A0A061IQR5_CRIGR Loading...

Endosome/lysosome-associated apoptosis and autophagy regulator 1

May protect cells from cell death by inducing cytosolic vacuolization and up-regulating the autophagy pathway. May play a role in apoptosis and cell proliferation through its interaction with HSPA5.

AlphaFold DB , UniProt , Accession A0A061IQR5, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Elapor1, Length 1,015 aa.

						>A0A061IQR5_CRIGR|A0A061IQR5|Elapor1
MVEPGLNPHPSARGGGRSERLTSSLMWLLLWAGTTFQVTLGTGPELHACKESEYHYEYTACDSTGSRWRVAVPHTPGLCTSLPDPVKGTECSFSCNAGEFLDMKDQSCKPCAEGRYSLGTGIRFDEWDELPHGFASLSANLEVDDSISESTENCTSSKWVPRGDYIASNTDECTATLMYAVNLKQSGTVNFEYYYPDSSIIFEFFVQNDQCQPNADDSRWMKTTEKGWEFHSVELNRGNNVLYWRTTAFSVWSKVSKPVLVRNIAITGVAYTSECFPCKPGTYAAKQGSSFCKLCPANSYSNKGETSCHPCDADKYSEKGSSTCKVRPACTDKDYFYTHTACDANGETQLMYKWAMPKICGEDLEGAVKLPASGVKTRCPPCNPGFFKTNNSTCEPCPYGSYSNGSDCTHCPAGTEPAVGFEYKWWNTLPSNMETTVLSGINFEYKGLTGWEVAGDHIYTAVGASDNDFMILTLVVPGFRPPQSVMADTENKEVARITFVFETICSVNCELYFMVGMNSRTNTPVETWKGTKGKQSYTYTIEENATVSFTWAFQRTTLHETGRKYTNDVAKIYSINVTNVMGGVASYCRPCALEASDLGSSCTSCPAGHYIDRDSGTCHLCPPNTILKAHQPYGAQACVPCGPGTKNNKIHSLCYNDCTFSLSRNTPTRIFNYNFSALSGTVSLAGAPSFTSKGLKYFHHFTLNLCGNQGKKMSVCTDNVTDLRIPEGEAGFSKSITAYVCQVVIIPSEVTGYKAGVSSQPVSLADRLIGVSTDMTLEGIISPAELFHPETSGIPDIVFFFRSNDVTQSCSSGRSTTIRLRCNPMKAAPGTLQLPSMCSDGTCDGCNFHFLWESVAACPLCSASDYHTFVSSCVAGIQKTTYMWREPKMCAGGISLPEQKVTICKTIDFWLKVGISAGTCTAILLTVLTCYFWKKNQKLEYKYSKLVMNATLKDCDLPAADSCAIMEGEDVEDDLIFTSKKSLFGKIKSFTSKRTPDGFDSVPLKTSSGGPDMDL
					

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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	35.9	Very low	31.8	Very low	233 Å²	233	138.5 Å²	138.5	100%	1.148	80%	0.798	S	S	*	*				0	93.7	0	-62.4	155	-179.8	0	0	104.9
2	V	27.6	Very low	31.5	Very low	131 Å²	131	134.3 Å²	134.3	79%	0.794	79%	0.792	S	S	*	*			cis	68.1	85.5	46.4	-171.3	0	0	0	0	111.2
3	E	29.3	Very low	31.2	Very low	174 Å²	174	143.9 Å²	143.9	81%	0.813	81%	0.807	S	S	*	*				40	161.6	110.7	-73	-160	130.2	0	0	121.5
4	P	52.4	Low	30.9	Very low	108 Å²	108	139.3 Å²	139.3	70%	0.701	81%	0.807	S	S	*	*			cis	-144	-172.2	-36.9	41	-23.4	0	0	0	113.8	L6	P4-L6 HydrophobicContact CG-CD1 4.43Å
5	G	26.3	Very low	30.5	Very low	63 Å²	63	135.9 Å²	135.9	65%	0.649	81%	0.814	S	S	*	*			trans	-176.5	117.6	159.7	0	0	0	0	0	110.4
6	L	28.4	Very low	30.3	Very low	146 Å²	146	132.1 Å²	132.1	76%	0.764	81%	0.811	S	S	*	*				62.2	133.8	65.2	-74	81.4	0	0	0	112.5	P4	P4-L6 HydrophobicContact CG-CD1 4.43Å
7	N	29.3	Very low	30.1	Very low	139 Å²	139	139.8 Å²	139.8	74%	0.743	82%	0.822	S	S	*	*			cis	-152.6	-169.7	14	-125.9	-0.6	0	0	0	112.1
8	P	35.3	Very low	29.8	Very low	106 Å²	106	137.2 Å²	137.2	69%	0.688	81%	0.813	S	S	*	*			trans	-126.3	-163.9	-142.8	43.3	-24.4	0	0	0	116.3
9	H	28.7	Very low	29.7	Very low	179 Å²	179	137.3 Å²	137.3	83%	0.829	80%	0.804	S	S	*	*			trans	-49.9	158.7	172	-71.9	-75.8	0	0	0	115.7
10	P	31.2	Very low	29.5	Very low	126 Å²	126	140.7 Å²	140.7	82%	0.818	80%	0.803	S	S	*	*				-117.1	166.3	127.2	36.3	-32.8	0	0	0	112.9
11	S	25.5	Very low	29.3	Very low	118 Å²	118	140.9 Å²	140.9	83%	0.825	80%	0.8	S	S	*	*			trans	-141.4	175.6	-177.1	-174.8	0	0	0	0	111.7
12	A	28	Very low	29	Very low	89 Å²	89	135.3 Å²	135.3	74%	0.736	78%	0.78	S	S	*	*			trans	78.3	104.5	160.4	0	0	0	0	0	120.4
13	R	28	Very low	29.1	Very low	259 Å²	259	134.7 Å²	134.7	98%	0.977	78%	0.781	S	S	*	*			trans	-164.2	130.5	138	-98.2	177.1	-173	-170.5	1.6	107.5
14	G	26.7	Very low	29	Very low	79 Å²	79	131.5 Å²	131.5	81%	0.814	78%	0.778	S	S	*	*			cis	171.4	132	-11.5	0	0	0	0	0	111.9
15	G	25.4	Very low	28	Very low	88 Å²	88	133.4 Å²	133.4	91%	0.907	78%	0.782	S	S	*	*			trans	83.3	155.5	178.2	0	0	0	0	0	115.4
16	G	26.2	Very low	28	Very low	75 Å²	75	137.8 Å²	137.8	77%	0.773	79%	0.787	S	S	*	*			cis	171	132.3	-10.8	0	0	0	0	0	116
17	R	26.6	Very low	28	Very low	263 Å²	263	141.3 Å²	141.3	99%	0.992	79%	0.79	S	S	*	*			trans	69.2	156.3	161.2	-109.9	-178.7	-177.9	167.9	0.8	120.7
18	S	25.2	Very low	28.1	Very low	94 Å²	94	140.8 Å²	140.8	66%	0.657	79%	0.787	S	S	*	*			trans	-94.3	156.6	-178.9	-170.4	0	0	0	0	112.8
19	E	28	Very low	27.9	Very low	139 Å²	139	142.5 Å²	142.5	65%	0.65	79%	0.79	S	S	*	*			trans	74	133.9	146.1	-100.1	177.4	-93.4	0	0	123.1
20	R	25.9	Very low	28.1	Very low	205 Å²	205	140.2 Å²	140.2	77%	0.774	78%	0.783	S	S	*	*			trans	96.4	152.5	138.7	-79.7	179.6	-156.7	-137.5	-3.2	122.9
21	L	26.1	Very low	28.1	Very low	144 Å²	144	145.5 Å²	145.5	75%	0.754	79%	0.786	S	S	*	*			trans	77.2	97	158.6	-70.2	150.9	0	0	0	116.4
22	T	28.1	Very low	28.2	Very low	116 Å²	116	144.2 Å²	144.2	71%	0.712	78%	0.783	S	S	*	*				79.6	120.6	88.2	51.7	0	0	0	0	113.9
23	S	31	Very low	28.9	Very low	119 Å²	119	143.6 Å²	143.6	83%	0.832	79%	0.785	S	S	*	*				93.6	121.1	64.2	-169.2	0	0	0	0	113.2
24	S	27.2	Very low	29.1	Very low	106 Å²	106	138.2 Å²	138.2	74%	0.741	78%	0.781	S	S	*	*			trans	-171.8	125.2	170	177.7	0	0	0	0	105.6
25	L	30.9	Very low	29.4	Very low	148 Å²	148	140.8 Å²	140.8	78%	0.775	78%	0.782	S	S	*	*			cis	-150	175.3	-2.7	-139.5	65.3	0	0	0	105.5
26	M	26.5	Very low	30.2	Very low	155 Å²	155	146.3 Å²	146.3	76%	0.764	78%	0.781	S	S	*	*			cis	-155.5	141.1	11.9	-176.6	158	63.5	0	0	111.9
27	W	28.8	Very low	30.4	Very low	221 Å²	221	151.8 Å²	151.8	84%	0.837	79%	0.786	S	S	*	*			trans	14.2	137.5	152.6	-86.4	16.1	0	0	0	124.8
28	L	31.7	Very low	31.1	Very low	127 Å²	127	145.3 Å²	145.3	67%	0.665	78%	0.776	S	S	*	*			trans	75.9	143.6	137.7	-65.3	175.4	0	0	0	118.5
29	L	31	Very low	31.5	Very low	143 Å²	143	147.1 Å²	147.1	75%	0.749	78%	0.783	S	S	*	*			cis	-145	167.9	11.2	-111.8	148.2	0	0	0	114.2
30	L	31.5	Very low	32.3	Very low	130 Å²	130	148.5 Å²	148.5	68%	0.681	79%	0.794	S	S	*	*			trans	-48.2	151	-174.6	-62.3	158.7	0	0	0	120.3
31	W	31.5	Very low	32.7	Very low	237 Å²	237	142 Å²	142	90%	0.898	79%	0.791	S	S	*	*			trans	48	141.4	130.9	-63.1	38.4	0	0	0	119.4
32	A	28.8	Very low	33.4	Very low	92 Å²	92	141.8 Å²	141.8	76%	0.76	80%	0.796	S	S	*	*			cis	-149.4	170.7	24.4	0	0	0	0	0	111.9
33	G	41.8	Very low	34.3	Very low	76 Å²	76	138.9 Å²	138.9	78%	0.784	79%	0.789	S	S	*	*			trans	-86.7	148.2	-176.7	0	0	0	0	0	115.2
34	T	33	Very low	35.3	Very low	145 Å²	145	138.7 Å²	138.7	89%	0.89	79%	0.785	S	S	*	*			trans	-133.5	154.7	166.4	43	0	0	0	0	111
35	T	32.4	Very low	36.5	Very low	134 Å²	134	142.8 Å²	142.8	82%	0.822	79%	0.792	S	S	*	*			trans	-77.2	156.3	-179.4	46.6	0	0	0	0	113.1
36	F	42	Very low	37.9	Very low	203 Å²	203	139.6 Å²	139.6	89%	0.89	78%	0.775	S	S	*	*			trans	-16.1	124.9	165.2	-92.3	-98.5	0	0	0	116.8
37	Q	30.4	Very low	40.4	Very low	190 Å²	190	135.8 Å²	135.8	89%	0.888	76%	0.756	S	S	*	*			trans	-141.7	144.3	141	-122.3	175	-3.5	0	0	109.7	T39	Q37-T39 PolarHBondContact O-N 3.4Å
38	V	40.9	Very low	42.7	Very low	127 Å²	127	128.4 Å²	128.4	77%	0.77	74%	0.742	S	S	*	*			trans	-76.4	118.6	-170.6	176.2	0	0	0	0	110.6
39	T	34	Very low	44.9	Very low	132 Å²	132	123.1 Å²	123.1	81%	0.81	72%	0.715	S	S	*	*			trans	-93.2	120.6	160.8	44.5	0	0	0	0	109.3	Q37 G41	Q37-T39 PolarHBondContact O-N 3.4Å; T39-G41 PolarHBondContact O-N 3.44Å
40	L	44.1	Very low	47.3	Very low	169 Å²	169	121.8 Å²	121.8	89%	0.885	70%	0.703	S	S	*	*			trans	-77.1	87.7	177.1	-156.7	79.1	0	0	0	109.1
41	G	35.4	Very low	49.3	Very low	69 Å²	69	121.7 Å²	121.7	71%	0.711	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-69.9	128.4	173	0	0	0	0	0	110.8	T39 G43	T39-G41 PolarHBondContact O-N 3.44Å; G41-G43 PolarHBondContact O-N 3Å
42	T	41.2	Very low	51.5	Low	139 Å²	139	114.7 Å²	114.7	85%	0.853	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-59	130.9	174.8	45.6	0	0	0	0	110.9
43	G	45.5	Very low	54	Low	55 Å²	55	111.6 Å²	111.6	57%	0.567	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-62.3	165.6	164.9	0	0	0	0	0	111.4	G41 E45	G41-G43 PolarHBondContact O-N 3Å; G43-E45 PolarHBondContact O-N 3.49Å
44	P	52.2	Low	55.9	Low	115 Å²	115	108.9 Å²	108.9	75%	0.747	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-59.3	131.3	177.6	26.1	-34.2	0	0	0	110.5	L46	P44-L46 PolarHBondContact O-N 3.47Å
45	E	53.3	Low	58.2	Low	192 Å²	192	105.1 Å²	105.1	90%	0.897	60%	0.595	S	S	*	*			trans	-65.8	104.4	172.4	-70.4	-172	130	0	0	109.2	G43 H47	G43-E45 PolarHBondContact O-N 3.49Å; E45-H47 PolarHBondContact O-N 3.34Å
46	L	60.9	Low	60.6	Low	80 Å²	80	100.7 Å²	100.7	42%	0.419	56%	0.563	S	S	.	*			trans	-65.9	114	173.9	-67.2	171.9	0	0	0	108.9	P44 G77 T80	P44-L46 PolarHBondContact O-N 3.47Å; L46-G77 WeakPolarHBondContact CD2-O 3.45Å; L46-T80 HydrophobicContact CB-CG2 3.54Å; L46-T80 HydrophobicContact CD1-CG2 3.65Å; L46-T80 HydrophobicContact CG-CG2 4.26Å; L46-T80 PolarHBondContact O-OG1 3.21Å
47	H	78.3	Confident	62.4	Low	75 Å²	75	95.5 Å²	95.5	35%	0.347	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-70	166.8	-173.1	63.6	-78	0	0	0	112.6	E45 C49 E53 C79 T80	E45-H47 PolarHBondContact O-N 3.34Å; H47-C49 PolarHBondContact O-N 3.02Å; H47-E53 IonicContact CD2-OE1 3.67Å; H47-E53 IonicContact CD2-OE2 3.93Å; H47-E53 PolarHBondContact CD2-OE2 3.27Å; H47-E53 IonicContact CE1-OE1 2.68Å; H47-E53 IonicContact CE1-OE2 2.66Å; H47-E53 IonicContact NE2-OE1 3.15Å; H47-E53 PolarHBondContact NE2-OE1 3.36Å; H47-E53 IonicContact NE2-OE2 3.76Å; H47-E53 PolarHBondContact NE2-OE2 2.83Å; H47-C79 WeakPolarHBondContact O-CA 3.45Å; H47-C79 VanDerWaalsContact O-CB 3.29Å; H47-C79 WeakPolarHBondContact O-CB 3.16Å; H47-T80 PolarHBondContact O-N 3.2Å
48	A	77.9	Confident	64.8	Low	67 Å²	67	87.6 Å²	87.6	55%	0.554	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-66.3	125.9	174.5	0	0	0	0	0	110.8	K50 S81	A48-K50 PolarHBondContact O-N 3.01Å; A48-S81 WeakPolarHBondContact CA-OG 3.34Å; A48-S81 WeakPolarHBondContact CB-OG 3.32Å
49	C	77.9	Confident	66.6	Low	15 Å²	15	84.2 Å²	84.2	10%	0.101	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-60.5	119.2	-175.3	-62.4	0	0	0	0	111.5	H47 Y54 C79 S81 L82	H47-C49 PolarHBondContact O-N 3.02Å; C49-Y54 HydrophobicContact CB-CD1 3.88Å; C49-Y54 HydrophobicContact CB-CE1 4.28Å; C49-C79 VanDerWaalsContact CA-SG 3.52Å; C49-C79 HydrophobicContact CB-CB 3.89Å; C49-C79 WeakPolarHBondContact CB-SG 3.43Å; C49-C79 WeakPolarHBondContact SG-CB 3.39Å; C49-C79 CovalentContact SG-SG 2.03Å; C49-C79 PolarHBondContact SG-SG 2.69Å; C49-S81 PolarHBondContact N-OG 2.82Å; C49-L82 HydrophobicContact CB-CD2 4.1Å
50	K	79.9	Confident	68.3	Low	115 Å²	115	81.8 Å²	81.8	50%	0.5	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-76.9	157.9	173.3	-57.8	174	-156.1	112.9	0	110	A48 S52 E53 Y54	A48-K50 PolarHBondContact O-N 3.01Å; K50-S52 PolarHBondContact O-N 3.35Å; K50-E53 HydrophobicContact CB-CG 4.2Å; K50-E53 PolarHBondContact N-OE2 2.94Å; K50-E53 IonicContact NZ-OE1 3.28Å; K50-E53 PolarHBondContact NZ-OE1 2.85Å; K50-E53 WeakPolarHBondContact O-CB 3.42Å; K50-E53 PolarHBondContact O-N 2.82Å; K50-Y54 WeakPolarHBondContact O-CD1 3.21Å; K50-Y54 WeakPolarHBondContact O-CE1 3.15Å
51	E	74.5	Confident	69.8	Low	128 Å²	128	76 Å²	76	60%	0.598	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-13.2	176.3	-61.9	-157.7	141.4	0	0	114.7	K104	E51-K104 IonicContact OE1-NZ 2.69Å; E51-K104 PolarHBondContact OE1-NZ 2.85Å; E51-K104 IonicContact OE2-NZ 2.91Å; E51-K104 PolarHBondContact OE2-NZ 3.03Å
52	S	77.5	Confident	71.8	Confident	90 Å²	90	76 Å²	76	63%	0.629	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	1	174.8	60.9	0	0	0	0	114.2	K50	K50-S52 PolarHBondContact O-N 3.35Å
53	E	80.6	Confident	73.4	Confident	27 Å²	27	75.6 Å²	75.6	13%	0.126	44%	0.437	C	S	.	.	S	Bend	trans	-114.9	-2.8	-172.4	-64	167.8	168.6	0	0	112.1	H47 K50 P73 H74	H47-E53 IonicContact CD2-OE1 3.67Å; H47-E53 IonicContact CD2-OE2 3.93Å; H47-E53 PolarHBondContact CD2-OE2 3.27Å; H47-E53 IonicContact CE1-OE1 2.68Å; H47-E53 IonicContact CE1-OE2 2.66Å; H47-E53 IonicContact NE2-OE1 3.15Å; H47-E53 PolarHBondContact NE2-OE1 3.36Å; H47-E53 IonicContact NE2-OE2 3.76Å; H47-E53 PolarHBondContact NE2-OE2 2.83Å; K50-E53 HydrophobicContact CB-CG 4.2Å; K50-E53 PolarHBondContact N-OE2 2.94Å; K50-E53 IonicContact NZ-OE1 3.28Å; K50-E53 PolarHBondContact NZ-OE1 2.85Å; K50-E53 WeakPolarHBondContact O-CB 3.42Å; K50-E53 PolarHBondContact O-N 2.82Å; E53-P73 WeakPolarHBondContact O-CA 3.41Å; E53-H74 PolarHBondContact O-N 3.01Å
54	Y	82.2	Confident	74.8	Confident	20 Å²	20	78.2 Å²	78.2	8%	0.078	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	153.6	175.2	66.8	-92.9	0	0	0	111.7	C49 K50 Y56 A71 V72 L82 P83	C49-Y54 HydrophobicContact CB-CD1 3.88Å; C49-Y54 HydrophobicContact CB-CE1 4.28Å; K50-Y54 WeakPolarHBondContact O-CD1 3.21Å; K50-Y54 WeakPolarHBondContact O-CE1 3.15Å; Y54-Y56 HydrophobicContact CE2-CE1 4.39Å; Y54-Y56 AromaticContact CE2-CE2 3.94Å; Y54-Y56 HydrophobicContact CE2-CE2 3.94Å; Y54-Y56 AromaticContact CE2-CZ 3.85Å; Y54-A71 HydrophobicContact CD2-CB 3.65Å; Y54-A71 HydrophobicContact CE2-CB 4.06Å; Y54-A71 HydrophobicContact CG-CB 4.3Å; Y54-V72 CarbonylContact C-O 3.54Å; Y54-V72 WeakPolarHBondContact CA-O 3.45Å; Y54-V72 VanDerWaalsContact CB-O 3.28Å; Y54-V72 WeakPolarHBondContact CB-O 3.04Å; Y54-L82 HydrophobicContact CD1-CD2 4Å; Y54-L82 HydrophobicContact CG-CD2 3.8Å; Y54-P83 HydrophobicContact CE1-CG 4.19Å; Y54-P83 HydrophobicContact CE2-CG 3.71Å; Y54-P83 VanDerWaalsContact CZ-CG 3.46Å; Y54-P83 VanDerWaalsContact OH-CG 3.24Å; Y54-P83 WeakPolarHBondContact OH-CG 3.46Å
55	H	81.4	Confident	75.7	Confident	65 Å²	65	74.1 Å²	74.1	30%	0.301	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	171.6	168.1	61.6	-71.9	0	0	0	111.2	E57 A71 V72 H74	H55-E57 IonicContact CD2-OE1 2.71Å; H55-E57 IonicContact CE1-OE1 2.69Å; H55-E57 IonicContact NE2-OE1 2.73Å; H55-E57 PolarHBondContact NE2-OE1 2.85Å; H55-A71 CarbonylContact O-C 3.59Å; H55-A71 WeakPolarHBondContact O-CA 3.05Å; H55-V72 PolarHBondContact N-O 2.67Å; H55-V72 PolarHBondContact ND1-O 2.84Å; H55-V72 PolarHBondContact O-N 2.93Å; H55-H74 AromaticContact CG-CE1 3.83Å; H55-H74 AromaticContact ND1-CE1 3.4Å; H55-H74 PolarHBondContact ND1-CE1 3.35Å; H55-H74 AromaticContact ND1-ND1 3.22Å; H55-H74 PolarHBondContact ND1-ND1 3.22Å
56	Y	83	Confident	77	Confident	41 Å²	41	65.8 Å²	65.8	16%	0.161	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.7	175.5	-74.6	-71.4	0	0	0	111	Y54 R69 V70 A71 P83 M103 K104	Y54-Y56 HydrophobicContact CE2-CE1 4.39Å; Y54-Y56 AromaticContact CE2-CE2 3.94Å; Y54-Y56 HydrophobicContact CE2-CE2 3.94Å; Y54-Y56 AromaticContact CE2-CZ 3.85Å; Y56-R69 HydrophobicContact CD1-CG 3.95Å; Y56-R69 VanDerWaalsContact CE1-CZ 3.46Å; Y56-R69 HydrophobicContact CG-CG 4.32Å; Y56-V70 WeakPolarHBondContact CA-O 3.1Å; Y56-A71 HydrophobicContact CD1-CB 4.17Å; Y56-A71 HydrophobicContact CE1-CB 3.95Å; Y56-P83 HydrophobicContact CE1-CB 4.38Å; Y56-P83 WeakPolarHBondContact OH-CG 3.31Å; Y56-M103 WeakPolarHBondContact O-CE 3.44Å; Y56-K104 HydrophobicContact CD2-CG 4.34Å; Y56-K104 HydrophobicContact CE2-CG 4.18Å
57	E	78.6	Confident	78	Confident	94 Å²	94	62.3 Å²	62.3	44%	0.439	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	163.4	170.5	-63.2	-170.2	166.2	0	0	110.2	H55 R69 V70 V72	H55-E57 IonicContact CD2-OE1 2.71Å; H55-E57 IonicContact CE1-OE1 2.69Å; H55-E57 IonicContact NE2-OE1 2.73Å; H55-E57 PolarHBondContact NE2-OE1 2.85Å; E57-R69 CarbonylContact O-C 3.6Å; E57-R69 WeakPolarHBondContact O-CA 3.4Å; E57-V70 PolarHBondContact N-O 3.1Å; E57-V70 PolarHBondContact O-N 3.04Å; E57-V72 HydrophobicContact CB-CG2 4.15Å; E57-V72 HydrophobicContact CG-CG2 4.06Å
58	Y	81.1	Confident	78.3	Confident	24 Å²	24	64.9 Å²	64.9	9%	0.094	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	143.2	161.7	-63.6	-65.1	0	0	0	110.8	R67 W68 R69 L101 M103 Q106 Y271	Y58-R67 HydrophobicContact CD1-CG 4.19Å; Y58-R67 VanDerWaalsContact CD2-CZ 3.44Å; Y58-R67 HydrophobicContact CG-CG 4.28Å; Y58-W68 CarbonylContact C-O 3.24Å; Y58-W68 VanDerWaalsContact CA-O 3.25Å; Y58-W68 WeakPolarHBondContact CA-O 3.41Å; Y58-R69 HydrophobicContact CD1-CB 3.81Å; Y58-R69 HydrophobicContact CD1-CG 4.26Å; Y58-R69 HydrophobicContact CE1-CB 3.75Å; Y58-R69 HydrophobicContact CE1-CG 4.11Å; Y58-L101 HydrophobicContact CE2-CD2 3.74Å; Y58-M103 HydrophobicContact CD1-CE 4.3Å; Y58-M103 HydrophobicContact CD2-CE 3.71Å; Y58-M103 HydrophobicContact CD2-SD 4.09Å; Y58-M103 HydrophobicContact CE1-CE 4.25Å; Y58-M103 HydrophobicContact CE2-CE 3.64Å; Y58-M103 HydrophobicContact CE2-SD 3.48Å; Y58-M103 WeakPolarHBondContact CE2-SD 3.14Å; Y58-M103 HydrophobicContact CG-CE 4.02Å; Y58-Q106 PolarHBondContact OH-OE1 2.91Å; Y58-Y271 AromaticContact CD2-CE1 3.64Å; Y58-Y271 HydrophobicContact CD2-CE1 3.64Å; Y58-Y271 AromaticContact CD2-CZ 3.7Å; Y58-Y271 VanDerWaalsContact CD2-OH 3.22Å; Y58-Y271 WeakPolarHBondContact CD2-OH 3.44Å; Y58-Y271 AromaticContact CE2-CE1 3.69Å; Y58-Y271 HydrophobicContact CE2-CE1 3.69Å; Y58-Y271 AromaticContact CE2-CZ 3.82Å
59	T	78.7	Confident	78.8	Confident	56 Å²	56	62.8 Å²	62.8	34%	0.344	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-59.3	166.9	166.3	65.3	0	0	0	0	111.6	W68 V70	T59-W68 HydrophobicContact CG2-CB 3.96Å; T59-W68 PolarHBondContact N-O 2.86Å; T59-W68 PolarHBondContact OG1-N 3.15Å; T59-V70 HydrophobicContact CG2-CG1 3.91Å; T59-V70 HydrophobicContact CG2-CG2 4.32Å
60	A	70.8	Confident	79.2	Confident	82 Å²	82	63.9 Å²	63.9	68%	0.678	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-51	152.6	159.1	0	0	0	0	0	111.4
61	C	74.4	Confident	79.5	Confident	47 Å²	47	59.1 Å²	59.1	32%	0.318	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-74.8	136.5	176	-59.2	0	0	0	0	110.2	S66 C91	C61-S66 WeakPolarHBondContact CA-O 3.19Å; C61-C91 HydrophobicContact CB-CB 3.98Å; C61-C91 WeakPolarHBondContact CB-SG 3.4Å; C61-C91 WeakPolarHBondContact SG-CB 3.03Å; C61-C91 CovalentContact SG-SG 2.02Å; C61-C91 PolarHBondContact SG-SG 2.96Å
62	D	77.9	Confident	79.9	Confident	68 Å²	68	55 Å²	55	36%	0.364	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-76.1	172.2	164.9	64.9	43.8	0	0	0	111.6	T64 G65 S66	D62-T64 PolarHBondContact O-N 3.2Å; D62-T64 VanDerWaalsContact O-N 3.12Å; D62-T64 VanDerWaalsContact OD1-CA 3.27Å; D62-T64 WeakPolarHBondContact OD1-CA 3.2Å; D62-T64 WeakPolarHBondContact OD1-CB 3.1Å; D62-T64 PolarHBondContact OD1-N 3.46Å; D62-T64 PolarHBondContact OD1-OG1 3.02Å; D62-G65 PolarHBondContact O-N 3.43Å; D62-G65 PolarHBondContact OD1-N 2.76Å; D62-S66 VanDerWaalsContact CG-O 3.3Å; D62-S66 PolarHBondContact N-O 3.18Å; D62-S66 PolarHBondContact OD1-N 3.22Å; D62-S66 VanDerWaalsContact OD2-CB 3.28Å; D62-S66 WeakPolarHBondContact OD2-CB 3.29Å
63	S	74.3	Confident	80.1	Confident	132 Å²	132	52.3 Å²	52.3	92%	0.923	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-7.5	179.2	51.6	0	0	0	0	114.5
64	T	75.2	Confident	79.9	Confident	110 Å²	110	56.3 Å²	56.3	68%	0.675	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-0.8	173.2	77.7	0	0	0	0	112.9	D62 S66	D62-T64 PolarHBondContact O-N 3.2Å; D62-T64 VanDerWaalsContact O-N 3.12Å; D62-T64 VanDerWaalsContact OD1-CA 3.27Å; D62-T64 WeakPolarHBondContact OD1-CA 3.2Å; D62-T64 WeakPolarHBondContact OD1-CB 3.1Å; D62-T64 PolarHBondContact OD1-N 3.46Å; D62-T64 PolarHBondContact OD1-OG1 3.02Å; T64-S66 VanDerWaalsContact C-N 3.28Å
65	G	72.1	Confident	79.7	Confident	28 Å²	28	59 Å²	59	29%	0.289	34%	0.339	S	S	.	.	S	Bend	trans	78.9	8.4	-176.9	0	0	0	0	0	114.3	D62 C91	D62-G65 PolarHBondContact O-N 3.43Å; D62-G65 PolarHBondContact OD1-N 2.76Å; G65-C91 PolarHBondContact O-N 2.9Å; G65-C91 PolarHBondContact O-SG 3.26Å; G65-C91 VanDerWaalsContact O-SG 3.41Å
66	S	79.3	Confident	79.4	Confident	18 Å²	18	61.5 Å²	61.5	13%	0.126	36%	0.361	C	S	.	.			trans	-86	157.8	170.7	-68.9	0	0	0	0	110.9	C61 D62 T64 K87	C61-S66 WeakPolarHBondContact CA-O 3.19Å; D62-S66 VanDerWaalsContact CG-O 3.3Å; D62-S66 PolarHBondContact N-O 3.18Å; D62-S66 PolarHBondContact OD1-N 3.22Å; D62-S66 VanDerWaalsContact OD2-CB 3.28Å; D62-S66 WeakPolarHBondContact OD2-CB 3.29Å; T64-S66 VanDerWaalsContact C-N 3.28Å; S66-K87 VanDerWaalsContact OG-CE 3.3Å; S66-K87 WeakPolarHBondContact OG-CE 3.47Å; S66-K87 PolarHBondContact OG-NZ 3.02Å
67	R	82.9	Confident	78.9	Confident	7 Å²	7	62.3 Å²	62.3	3%	0.026	38%	0.382	C	S	.	.			trans	-150.4	169.4	175.4	60.1	-172.5	175.4	175.7	-6.8	109.5	Y58 G88 T89 E90	Y58-R67 HydrophobicContact CD1-CG 4.19Å; Y58-R67 VanDerWaalsContact CD2-CZ 3.44Å; Y58-R67 HydrophobicContact CG-CG 4.28Å; R67-G88 WeakPolarHBondContact O-CA 3.22Å; R67-G88 PolarHBondContact O-N 2.04Å; R67-T89 WeakPolarHBondContact CG-O 3.44Å; R67-T89 PolarHBondContact NE-O 2.6Å; R67-T89 PolarHBondContact NH2-OG1 3.31Å; R67-E90 PolarHBondContact NH2-O 3.25Å
68	W	84.7	Confident	78.8	Confident	129 Å²	129	61.7 Å²	61.7	49%	0.489	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	140.5	177.6	-64.4	85.8	0	0	0	110.4	Y58 T59 P85 V86 K87	Y58-W68 CarbonylContact C-O 3.24Å; Y58-W68 VanDerWaalsContact CA-O 3.25Å; Y58-W68 WeakPolarHBondContact CA-O 3.41Å; T59-W68 HydrophobicContact CG2-CB 3.96Å; T59-W68 PolarHBondContact N-O 2.86Å; T59-W68 PolarHBondContact OG1-N 3.15Å; W68-P85 HydrophobicContact CE3-CB 4.22Å; W68-V86 CarbonylContact C-O 3.49Å; W68-K87 HydrophobicContact CZ3-CB 4.33Å
69	R	87.2	Confident	78.6	Confident	22 Å²	22	61 Å²	61	8%	0.083	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	118.9	167.2	-169	-161.2	65.4	171.9	2	108.6	Y56 E57 Y58 P85 V86 M103 K104	Y56-R69 HydrophobicContact CD1-CG 3.95Å; Y56-R69 VanDerWaalsContact CE1-CZ 3.46Å; Y56-R69 HydrophobicContact CG-CG 4.32Å; E57-R69 CarbonylContact O-C 3.6Å; E57-R69 WeakPolarHBondContact O-CA 3.4Å; Y58-R69 HydrophobicContact CD1-CB 3.81Å; Y58-R69 HydrophobicContact CD1-CG 4.26Å; Y58-R69 HydrophobicContact CE1-CB 3.75Å; Y58-R69 HydrophobicContact CE1-CG 4.11Å; R69-P85 WeakPolarHBondContact O-CA 3.47Å; R69-V86 PolarHBondContact N-O 2.04Å; R69-V86 PolarHBondContact O-N 3.49Å; R69-M103 WeakPolarHBondContact CD-O 3.21Å; R69-M103 HydrophobicContact CG-CE 4.22Å; R69-M103 PolarHBondContact NH1-O 2.72Å; R69-K104 PolarHBondContact NH1-O 2.95Å
70	V	87.6	Confident	78.4	Confident	39 Å²	39	62.8 Å²	62.8	24%	0.236	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	147	-178.9	-67.5	0	0	0	0	110.5	Y56 E57 T59 V72 P85	Y56-V70 WeakPolarHBondContact CA-O 3.1Å; E57-V70 PolarHBondContact N-O 3.1Å; E57-V70 PolarHBondContact O-N 3.04Å; T59-V70 HydrophobicContact CG2-CG1 3.91Å; T59-V70 HydrophobicContact CG2-CG2 4.32Å; V70-V72 HydrophobicContact CG2-CG2 4.15Å; V70-P85 HydrophobicContact CG1-CB 4.1Å; V70-P85 HydrophobicContact CG1-CG 4.2Å
71	A	84.8	Confident	78.8	Confident	14 Å²	14	61.8 Å²	61.8	12%	0.116	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	126.3	169.6	0	0	0	0	0	109.7	Y54 H55 Y56 L82 P83	Y54-A71 HydrophobicContact CD2-CB 3.65Å; Y54-A71 HydrophobicContact CE2-CB 4.06Å; Y54-A71 HydrophobicContact CG-CB 4.3Å; H55-A71 CarbonylContact O-C 3.59Å; H55-A71 WeakPolarHBondContact O-CA 3.05Å; Y56-A71 HydrophobicContact CD1-CB 4.17Å; Y56-A71 HydrophobicContact CE1-CB 3.95Å; A71-L82 HydrophobicContact CB-CB 4.18Å; A71-L82 HydrophobicContact CB-CD2 4.14Å; A71-P83 HydrophobicContact CB-CB 4.38Å; A71-P83 HydrophobicContact CB-CG 4.26Å
72	V	82.9	Confident	79.1	Confident	42 Å²	42	62.5 Å²	62.5	26%	0.255	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.8	-177.8	-177.6	0	0	0	0	108.3	Y54 H55 E57 V70	Y54-V72 CarbonylContact C-O 3.54Å; Y54-V72 WeakPolarHBondContact CA-O 3.45Å; Y54-V72 VanDerWaalsContact CB-O 3.28Å; Y54-V72 WeakPolarHBondContact CB-O 3.04Å; H55-V72 PolarHBondContact N-O 2.67Å; H55-V72 PolarHBondContact ND1-O 2.84Å; H55-V72 PolarHBondContact O-N 2.93Å; E57-V72 HydrophobicContact CB-CG2 4.15Å; E57-V72 HydrophobicContact CG-CG2 4.06Å; V70-V72 HydrophobicContact CG2-CG2 4.15Å
73	P	81.8	Confident	79.5	Confident	33 Å²	33	61.2 Å²	61.2	21%	0.214	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	137.9	-178.7	30.1	-32.3	0	0	0	110.3	E53 T75 L82	E53-P73 WeakPolarHBondContact O-CA 3.41Å; P73-T75 PolarHBondContact O-N 2.86Å; P73-L82 HydrophobicContact CB-CD1 4.44Å; P73-L82 HydrophobicContact CB-CD2 4.29Å; P73-L82 HydrophobicContact CG-CD1 4.09Å
74	H	77.8	Confident	79.9	Confident	112 Å²	112	61.5 Å²	61.5	52%	0.519	37%	0.365	S	S	.	.	S	Bend	trans	-63.4	-23.2	178.9	-69.6	-47.9	0	0	0	113.1	E53 H55	E53-H74 PolarHBondContact O-N 3.01Å; H55-H74 AromaticContact CG-CE1 3.83Å; H55-H74 AromaticContact ND1-CE1 3.4Å; H55-H74 PolarHBondContact ND1-CE1 3.35Å; H55-H74 AromaticContact ND1-ND1 3.22Å; H55-H74 PolarHBondContact ND1-ND1 3.22Å
75	T	77.1	Confident	80.5	Confident	76 Å²	76	59.8 Å²	59.8	47%	0.466	36%	0.356	S	S	.	.	S	Bend	trans	-135	115.3	174.2	-56.3	0	0	0	0	108.8	P73 G77 L78	P73-T75 PolarHBondContact O-N 2.86Å; T75-G77 PolarHBondContact O-N 2.69Å; T75-L78 HydrophobicContact CG2-CB 4.31Å; T75-L78 WeakPolarHBondContact O-CB 3.42Å; T75-L78 PolarHBondContact O-N 2.91Å
76	P	75.4	Confident	81.2	Confident	118 Å²	118	61.5 Å²	61.5	77%	0.766	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	128.5	179.3	-27.2	35.6	0	0	0	112.1
77	G	73.5	Confident	81.5	Confident	58 Å²	58	66.4 Å²	66.4	60%	0.598	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	11.9	177.6	0	0	0	0	0	116.2	L46 T75	L46-G77 WeakPolarHBondContact CD2-O 3.45Å; T75-G77 PolarHBondContact O-N 2.69Å
78	L	75.8	Confident	81.5	Confident	80 Å²	80	66.4 Å²	66.4	42%	0.419	38%	0.382	S	S	.	.	S	Bend	trans	-80.9	-29.1	177.4	-170.7	71	0	0	0	114	T75	T75-L78 HydrophobicContact CG2-CB 4.31Å; T75-L78 WeakPolarHBondContact O-CB 3.42Å; T75-L78 PolarHBondContact O-N 2.91Å
79	C	77.6	Confident	81.3	Confident	11 Å²	11	61.4 Å²	61.4	7%	0.074	37%	0.366	C	S	.	.			trans	-152.4	163.2	-176	67.6	0	0	0	0	110	H47 C49	H47-C79 WeakPolarHBondContact O-CA 3.45Å; H47-C79 VanDerWaalsContact O-CB 3.29Å; H47-C79 WeakPolarHBondContact O-CB 3.16Å; C49-C79 VanDerWaalsContact CA-SG 3.52Å; C49-C79 HydrophobicContact CB-CB 3.89Å; C49-C79 WeakPolarHBondContact CB-SG 3.43Å; C49-C79 WeakPolarHBondContact SG-CB 3.39Å; C49-C79 CovalentContact SG-SG 2.03Å; C49-C79 PolarHBondContact SG-SG 2.69Å
80	T	73.2	Confident	81	Confident	93 Å²	93	66.7 Å²	66.7	57%	0.571	39%	0.391	S	S	*	.	S	Bend	trans	-120.3	-22.8	-166.3	48.4	0	0	0	0	117	L46 H47	L46-T80 HydrophobicContact CB-CG2 3.54Å; L46-T80 HydrophobicContact CD1-CG2 3.65Å; L46-T80 HydrophobicContact CG-CG2 4.26Å; L46-T80 PolarHBondContact O-OG1 3.21Å; H47-T80 PolarHBondContact O-N 3.2Å
81	S	79.1	Confident	80.3	Confident	60 Å²	60	65.1 Å²	65.1	42%	0.42	38%	0.382	S	S	.	.			trans	-103.9	77.2	-176.1	71.4	0	0	0	0	112.6	A48 C49	A48-S81 WeakPolarHBondContact CA-OG 3.34Å; A48-S81 WeakPolarHBondContact CB-OG 3.32Å; C49-S81 PolarHBondContact N-OG 2.82Å
82	L	81.7	Confident	79.7	Confident	63 Å²	63	68.2 Å²	68.2	33%	0.33	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-78.8	146.8	173.5	-68.2	163.5	0	0	0	110.8	C49 Y54 A71 P73	C49-L82 HydrophobicContact CB-CD2 4.1Å; Y54-L82 HydrophobicContact CD1-CD2 4Å; Y54-L82 HydrophobicContact CG-CD2 3.8Å; A71-L82 HydrophobicContact CB-CB 4.18Å; A71-L82 HydrophobicContact CB-CD2 4.14Å; P73-L82 HydrophobicContact CB-CD1 4.44Å; P73-L82 HydrophobicContact CB-CD2 4.29Å; P73-L82 HydrophobicContact CG-CD1 4.09Å
83	P	85	Confident	79.5	Confident	41 Å²	41	69 Å²	69	27%	0.266	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-57.5	145.2	173.2	-26.2	33.1	0	0	0	114.2	Y54 Y56 A71	Y54-P83 HydrophobicContact CE1-CG 4.19Å; Y54-P83 HydrophobicContact CE2-CG 3.71Å; Y54-P83 VanDerWaalsContact CZ-CG 3.46Å; Y54-P83 VanDerWaalsContact OH-CG 3.24Å; Y54-P83 WeakPolarHBondContact OH-CG 3.46Å; Y56-P83 HydrophobicContact CE1-CB 4.38Å; Y56-P83 WeakPolarHBondContact OH-CG 3.31Å; A71-P83 HydrophobicContact CB-CB 4.38Å; A71-P83 HydrophobicContact CB-CG 4.26Å
84	D	84.3	Confident	79.3	Confident	137 Å²	137	69.8 Å²	69.8	73%	0.733	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-59.4	146.2	178.8	-70.4	-56.2	0	0	0	113.2	V86	D84-V86 PolarHBondContact O-N 3.16Å
85	P	85.9	Confident	79.6	Confident	74 Å²	74	64.6 Å²	64.6	48%	0.481	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-60.7	128.1	173.5	-23.7	34.4	0	0	0	112.8	W68 R69 V70	W68-P85 HydrophobicContact CE3-CB 4.22Å; R69-P85 WeakPolarHBondContact O-CA 3.47Å; V70-P85 HydrophobicContact CG1-CB 4.1Å; V70-P85 HydrophobicContact CG1-CG 4.2Å
86	V	88.4	Confident	79.9	Confident	64 Å²	64	66.2 Å²	66.2	39%	0.388	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	146.5	176.9	-176.5	0	0	0	0	109.1	W68 R69 D84 G88	W68-V86 CarbonylContact C-O 3.49Å; R69-V86 PolarHBondContact N-O 2.04Å; R69-V86 PolarHBondContact O-N 3.49Å; D84-V86 PolarHBondContact O-N 3.16Å; V86-G88 PolarHBondContact O-N 3.47Å
87	K	85.2	Confident	80.3	Confident	121 Å²	121	63.7 Å²	63.7	53%	0.526	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	131.1	174.4	-172.7	175.4	-178.5	177.9	0	109.9	S66 W68 Q106	S66-K87 VanDerWaalsContact OG-CE 3.3Å; S66-K87 WeakPolarHBondContact OG-CE 3.47Å; S66-K87 PolarHBondContact OG-NZ 3.02Å; W68-K87 HydrophobicContact CZ3-CB 4.33Å; K87-Q106 PolarHBondContact O-NE2 3.16Å; K87-Q106 PolarHBondContact O-OE1 3.07Å
88	G	81.6	Confident	80.8	Confident	8 Å²	8	61 Å²	61	8%	0.082	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-83.3	164	-179.8	0	0	0	0	0	113.7	R67 V86	R67-G88 WeakPolarHBondContact O-CA 3.22Å; R67-G88 PolarHBondContact O-N 2.04Å; V86-G88 PolarHBondContact O-N 3.47Å
89	T	82.4	Confident	81.4	Confident	23 Å²	23	59.4 Å²	59.4	14%	0.141	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-59.7	155	166.7	63.2	0	0	0	0	111.3	R67 F93 Q106	R67-T89 WeakPolarHBondContact CG-O 3.44Å; R67-T89 PolarHBondContact NE-O 2.6Å; R67-T89 PolarHBondContact NH2-OG1 3.31Å; T89-F93 HydrophobicContact CG2-CD1 4.46Å; T89-F93 HydrophobicContact CG2-CD2 4.17Å; T89-F93 HydrophobicContact CG2-CE2 4.29Å; T89-F93 HydrophobicContact CG2-CG 4.25Å; T89-F93 HydrophobicContact CG2-CZ 4.5Å; T89-Q106 HydrophobicContact CG2-CB 3.99Å; T89-Q106 WeakPolarHBondContact CG2-O 3.45Å
90	E	79.8	Confident	81.8	Confident	133 Å²	133	61 Å²	61	62%	0.621	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-58.6	153.4	-179.8	-63.9	-173.5	174.3	0	0	112.8	R67 S92 F93	R67-E90 PolarHBondContact NH2-O 3.25Å; E90-S92 WeakPolarHBondContact CB-OG 3.46Å; E90-S92 PolarHBondContact O-N 2.89Å; E90-S92 VanDerWaalsContact O-N 3.08Å; E90-S92 PolarHBondContact OE2-OG 3.31Å; E90-F93 WeakPolarHBondContact O-CB 3.39Å; E90-F93 PolarHBondContact O-N 3.18Å
91	C	72.6	Confident	82.4	Confident	6 Å²	6	56.5 Å²	56.5	4%	0.041	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	2.3	-179.7	-68.4	0	0	0	0	115.6	C61 G65	C61-C91 HydrophobicContact CB-CB 3.98Å; C61-C91 WeakPolarHBondContact CB-SG 3.4Å; C61-C91 WeakPolarHBondContact SG-CB 3.03Å; C61-C91 CovalentContact SG-SG 2.02Å; C61-C91 PolarHBondContact SG-SG 2.96Å; G65-C91 PolarHBondContact O-N 2.9Å; G65-C91 PolarHBondContact O-SG 3.26Å; G65-C91 VanDerWaalsContact O-SG 3.41Å
92	S	72.4	Confident	82.7	Confident	80 Å²	80	55 Å²	55	56%	0.559	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-13.3	167.6	47.2	0	0	0	0	113	E90	E90-S92 WeakPolarHBondContact CB-OG 3.46Å; E90-S92 PolarHBondContact O-N 2.89Å; E90-S92 VanDerWaalsContact O-N 3.08Å; E90-S92 PolarHBondContact OE2-OG 3.31Å
93	F	79.2	Confident	82.7	Confident	58 Å²	58	52.9 Å²	52.9	25%	0.254	30%	0.297	S	S	.	.			trans	-69.8	133.9	-172.6	-179.7	-83.7	0	0	0	112.4	T89 E90 L101 C108	T89-F93 HydrophobicContact CG2-CD1 4.46Å; T89-F93 HydrophobicContact CG2-CD2 4.17Å; T89-F93 HydrophobicContact CG2-CE2 4.29Å; T89-F93 HydrophobicContact CG2-CG 4.25Å; T89-F93 HydrophobicContact CG2-CZ 4.5Å; E90-F93 WeakPolarHBondContact O-CB 3.39Å; E90-F93 PolarHBondContact O-N 3.18Å; F93-L101 HydrophobicContact CD1-CD2 4.12Å; F93-L101 HydrophobicContact CE1-CD1 3.66Å; F93-L101 HydrophobicContact CE1-CD2 3.81Å; F93-L101 HydrophobicContact CE1-CG 4.27Å; F93-L101 HydrophobicContact CZ-CD1 4.05Å; F93-C108 WeakPolarHBondContact CZ-SG 3.36Å
94	S	77.4	Confident	82.5	Confident	50 Å²	50	55.9 Å²	55.9	35%	0.35	31%	0.306	S	S	.	.			trans	-146.3	151.4	179.6	52.8	0	0	0	0	113.3	T120 A270	S94-T120 VanDerWaalsContact CB-CG2 3.48Å; S94-A270 VanDerWaalsContact CA-O 3.25Å; S94-A270 WeakPolarHBondContact CA-O 3.46Å
95	C	83.3	Confident	82.4	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.02	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-101.8	152.4	174.6	-61	0	0	0	0	112.3	E99 C108 G119	C95-E99 HydrophobicContact CB-CB 4.01Å; C95-C108 WeakPolarHBondContact CA-SG 3.5Å; C95-C108 HydrophobicContact CB-CB 3.76Å; C95-C108 WeakPolarHBondContact CB-SG 3.29Å; C95-C108 VanDerWaalsContact SG-CA 3.57Å; C95-C108 WeakPolarHBondContact SG-CB 3Å; C95-C108 CovalentContact SG-SG 2.04Å; C95-C108 PolarHBondContact SG-SG 2.93Å; C95-G119 CarbonylContact O-C 3.46Å; C95-G119 WeakPolarHBondContact O-CA 3.25Å
96	N	84.1	Confident	82.4	Confident	110 Å²	110	52.5 Å²	52.5	59%	0.588	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-75.1	162	-178.3	-56.7	-81.9	0	0	0	111.7	G98 E99 G119	N96-G98 PolarHBondContact O-N 2.03Å; N96-E99 HydrophobicContact CB-CG 4.32Å; N96-E99 VanDerWaalsContact CB-OE2 3.29Å; N96-E99 WeakPolarHBondContact CB-OE2 3.4Å; N96-E99 PolarHBondContact N-OE2 3.21Å; N96-E99 PolarHBondContact ND2-OE2 2.81Å; N96-E99 WeakPolarHBondContact O-CB 3.45Å; N96-E99 PolarHBondContact O-N 2.94Å; N96-G119 WeakPolarHBondContact O-CA 3.07Å
97	A	83.2	Confident	82.4	Confident	64 Å²	64	51.8 Å²	51.8	53%	0.529	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	130.1	171.2	0	0	0	0	0	110.2
98	G	84.8	Confident	82.5	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.01	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	92	-3.9	-168.3	0	0	0	0	0	115.3	N96 C111 S117 G288	N96-G98 PolarHBondContact O-N 2.03Å; G98-C111 WeakPolarHBondContact O-CB 3.24Å; G98-C111 PolarHBondContact O-N 3.12Å; G98-C111 PolarHBondContact O-SG 2.93Å; G98-S117 PolarHBondContact N-O 2.94Å; G98-G288 WeakPolarHBondContact CA-O 3.25Å; G98-G288 WeakPolarHBondContact O-CA 3.5Å
99	E	87.9	Confident	82.9	Confident	48 Å²	48	50.6 Å²	50.6	22%	0.224	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	155.5	177.3	-57.7	178	148.3	0	0	112	C95 N96 C108 K109 S117	C95-E99 HydrophobicContact CB-CB 4.01Å; N96-E99 HydrophobicContact CB-CG 4.32Å; N96-E99 VanDerWaalsContact CB-OE2 3.29Å; N96-E99 WeakPolarHBondContact CB-OE2 3.4Å; N96-E99 PolarHBondContact N-OE2 3.21Å; N96-E99 PolarHBondContact ND2-OE2 2.81Å; N96-E99 WeakPolarHBondContact O-CB 3.45Å; N96-E99 PolarHBondContact O-N 2.94Å; E99-C108 HydrophobicContact CB-CB 4.31Å; E99-K109 CarbonylContact C-O 3.57Å; E99-K109 VanDerWaalsContact CA-O 3.27Å; E99-K109 WeakPolarHBondContact CA-O 3.32Å; E99-S117 VanDerWaalsContact O-CB 3.29Å; E99-S117 WeakPolarHBondContact O-CB 3.22Å; E99-S117 PolarHBondContact O-OG 2.84Å
100	F	86.9	Confident	83.3	Confident	43 Å²	43	52.2 Å²	52.2	19%	0.189	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	157.2	170.1	76.1	-74.8	0	0	0	110.1	D102 C108 K109 T272 S273 C275	F100-D102 HydrophobicContact CE2-CB 4.25Å; F100-D102 PolarHBondContact O-N 2.92Å; F100-C108 CarbonylContact O-C 3.49Å; F100-C108 WeakPolarHBondContact O-CA 3.26Å; F100-K109 HydrophobicContact CD1-CB 4.23Å; F100-K109 WeakPolarHBondContact CD1-O 3.23Å; F100-K109 HydrophobicContact CE1-CB 3.69Å; F100-K109 HydrophobicContact CZ-CB 4.1Å; F100-K109 PolarHBondContact N-O 2.83Å; F100-K109 PolarHBondContact O-N 2.81Å; F100-T272 HydrophobicContact CB-CG2 3.98Å; F100-S273 WeakPolarHBondContact CD2-O 3.21Å; F100-C275 WeakPolarHBondContact CD1-SG 3.13Å
101	L	85.8	Confident	83.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	112.1	174.9	-179.5	50.4	0	0	0	110.2	Y58 F93 M103 Q106 S107 Y271 T272	Y58-L101 HydrophobicContact CE2-CD2 3.74Å; F93-L101 HydrophobicContact CD1-CD2 4.12Å; F93-L101 HydrophobicContact CE1-CD1 3.66Å; F93-L101 HydrophobicContact CE1-CD2 3.81Å; F93-L101 HydrophobicContact CE1-CG 4.27Å; F93-L101 HydrophobicContact CZ-CD1 4.05Å; L101-M103 HydrophobicContact CD2-SD 4.17Å; L101-M103 HydrophobicContact CG-SD 4.21Å; L101-M103 PolarHBondContact O-N 3.3Å; L101-Q106 VanDerWaalsContact CD1-C 3.48Å; L101-S107 WeakPolarHBondContact CD1-O 3.03Å; L101-Y271 HydrophobicContact CB-CD2 3.6Å; L101-Y271 HydrophobicContact CB-CE2 4.45Å; L101-Y271 HydrophobicContact CB-CG 3.67Å; L101-Y271 HydrophobicContact CD2-CD1 3.51Å; L101-Y271 HydrophobicContact CD2-CD2 3.85Å; L101-Y271 HydrophobicContact CD2-CE1 3.92Å; L101-Y271 HydrophobicContact CD2-CE2 4.2Å; L101-Y271 HydrophobicContact CD2-CG 3.52Å; L101-Y271 HydrophobicContact CG-CD2 4.21Å; L101-Y271 HydrophobicContact CG-CG 4.21Å; L101-T272 PolarHBondContact N-O 2.62Å
102	D	85	Confident	84.6	Confident	29 Å²	29	48.1 Å²	48.1	16%	0.155	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	111.5	169.1	-171.3	-50.9	0	0	0	109.3	F100 K104 D105 Q106 S107 K109	F100-D102 HydrophobicContact CE2-CB 4.25Å; F100-D102 PolarHBondContact O-N 2.92Å; D102-K104 VanDerWaalsContact C-N 3.27Å; D102-K104 PolarHBondContact O-N 3.42Å; D102-K104 WeakPolarHBondContact OD1-CA 3.49Å; D102-K104 WeakPolarHBondContact OD1-CB 3.48Å; D102-K104 PolarHBondContact OD1-N 3.27Å; D102-D105 PolarHBondContact O-N 2.89Å; D102-D105 PolarHBondContact OD1-N 3.16Å; D102-Q106 VanDerWaalsContact O-CA 3.25Å; D102-Q106 WeakPolarHBondContact O-CA 3.45Å; D102-Q106 PolarHBondContact O-N 3.1Å; D102-S107 PolarHBondContact N-O 3.41Å; D102-K109 HydrophobicContact CB-CD 3.8Å; D102-K109 HydrophobicContact CB-CG 4.18Å; D102-K109 WeakPolarHBondContact OD2-CE 3.25Å; D102-K109 IonicContact OD2-NZ 3.8Å; D102-K109 PolarHBondContact OD2-NZ 2.71Å
103	M	81.1	Confident	85.5	Confident	18 Å²	18	49.2 Å²	49.2	9%	0.089	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-13.9	-178.2	-67.3	-67.3	-75.4	0	0	113.5	Y56 Y58 R69 L101 Y271	Y56-M103 WeakPolarHBondContact O-CE 3.44Å; Y58-M103 HydrophobicContact CD1-CE 4.3Å; Y58-M103 HydrophobicContact CD2-CE 3.71Å; Y58-M103 HydrophobicContact CD2-SD 4.09Å; Y58-M103 HydrophobicContact CE1-CE 4.25Å; Y58-M103 HydrophobicContact CE2-CE 3.64Å; Y58-M103 HydrophobicContact CE2-SD 3.48Å; Y58-M103 WeakPolarHBondContact CE2-SD 3.14Å; Y58-M103 HydrophobicContact CG-CE 4.02Å; R69-M103 WeakPolarHBondContact CD-O 3.21Å; R69-M103 HydrophobicContact CG-CE 4.22Å; R69-M103 PolarHBondContact NH1-O 2.72Å; L101-M103 HydrophobicContact CD2-SD 4.17Å; L101-M103 HydrophobicContact CG-SD 4.21Å; L101-M103 PolarHBondContact O-N 3.3Å; M103-Y271 HydrophobicContact SD-CE2 3.82Å
104	K	80.8	Confident	85.9	Confident	104 Å²	104	46.5 Å²	46.5	45%	0.452	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-49.5	170.9	-68.3	-165.8	176.9	-165.2	0	110.6	E51 Y56 R69 D102	E51-K104 IonicContact OE1-NZ 2.69Å; E51-K104 PolarHBondContact OE1-NZ 2.85Å; E51-K104 IonicContact OE2-NZ 2.91Å; E51-K104 PolarHBondContact OE2-NZ 3.03Å; Y56-K104 HydrophobicContact CD2-CG 4.34Å; Y56-K104 HydrophobicContact CE2-CG 4.18Å; R69-K104 PolarHBondContact NH1-O 2.95Å; D102-K104 VanDerWaalsContact C-N 3.27Å; D102-K104 PolarHBondContact O-N 3.42Å; D102-K104 WeakPolarHBondContact OD1-CA 3.49Å; D102-K104 WeakPolarHBondContact OD1-CB 3.48Å; D102-K104 PolarHBondContact OD1-N 3.27Å
105	D	83.4	Confident	86.5	Confident	103 Å²	103	48.4 Å²	48.4	55%	0.551	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-3.9	-174.3	-66.4	-17.6	0	0	0	114.4	D102 S107 K109	D102-D105 PolarHBondContact O-N 2.89Å; D102-D105 PolarHBondContact OD1-N 3.16Å; D105-S107 PolarHBondContact O-N 2.8Å; D105-S107 VanDerWaalsContact O-N 3.14Å; D105-S107 PolarHBondContact O-OG 2.64Å; D105-K109 WeakPolarHBondContact OD2-CE 3.35Å; D105-K109 IonicContact OD2-NZ 3.74Å; D105-K109 PolarHBondContact OD2-NZ 3.32Å
106	Q	84.5	Confident	86.7	Confident	37 Å²	37	48.8 Å²	48.8	17%	0.173	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	31.2	-178.1	-62	-160.4	64.6	0	0	114.8	Y58 K87 T89 L101 D102	Y58-Q106 PolarHBondContact OH-OE1 2.91Å; K87-Q106 PolarHBondContact O-NE2 3.16Å; K87-Q106 PolarHBondContact O-OE1 3.07Å; T89-Q106 HydrophobicContact CG2-CB 3.99Å; T89-Q106 WeakPolarHBondContact CG2-O 3.45Å; L101-Q106 VanDerWaalsContact CD1-C 3.48Å; D102-Q106 VanDerWaalsContact O-CA 3.25Å; D102-Q106 WeakPolarHBondContact O-CA 3.45Å; D102-Q106 PolarHBondContact O-N 3.1Å
107	S	88.4	Confident	86.8	Confident	48 Å²	48	43.5 Å²	43.5	34%	0.336	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	149.2	-176.7	46.1	0	0	0	0	112.2	L101 D102 D105 K109	L101-S107 WeakPolarHBondContact CD1-O 3.03Å; D102-S107 PolarHBondContact N-O 3.41Å; D105-S107 PolarHBondContact O-N 2.8Å; D105-S107 VanDerWaalsContact O-N 3.14Å; D105-S107 PolarHBondContact O-OG 2.64Å; S107-K109 PolarHBondContact O-N 2.89Å
108	C	88.1	Confident	86.7	Confident	38 Å²	38	42.6 Å²	42.6	26%	0.257	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	127.7	174.9	-58.6	0	0	0	0	109.9	F93 C95 E99 F100	F93-C108 WeakPolarHBondContact CZ-SG 3.36Å; C95-C108 WeakPolarHBondContact CA-SG 3.5Å; C95-C108 HydrophobicContact CB-CB 3.76Å; C95-C108 WeakPolarHBondContact CB-SG 3.29Å; C95-C108 VanDerWaalsContact SG-CA 3.57Å; C95-C108 WeakPolarHBondContact SG-CB 3Å; C95-C108 CovalentContact SG-SG 2.04Å; C95-C108 PolarHBondContact SG-SG 2.93Å; E99-C108 HydrophobicContact CB-CB 4.31Å; F100-C108 CarbonylContact O-C 3.49Å; F100-C108 WeakPolarHBondContact O-CA 3.26Å
109	K	89.9	Confident	86.6	Confident	66 Å²	66	42.6 Å²	42.6	29%	0.287	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	138.8	175.7	-65.7	-174.6	-175.3	172.7	0	109.7	E99 F100 D102 D105 S107	E99-K109 CarbonylContact C-O 3.57Å; E99-K109 VanDerWaalsContact CA-O 3.27Å; E99-K109 WeakPolarHBondContact CA-O 3.32Å; F100-K109 HydrophobicContact CD1-CB 4.23Å; F100-K109 WeakPolarHBondContact CD1-O 3.23Å; F100-K109 HydrophobicContact CE1-CB 3.69Å; F100-K109 HydrophobicContact CZ-CB 4.1Å; F100-K109 PolarHBondContact N-O 2.83Å; F100-K109 PolarHBondContact O-N 2.81Å; D102-K109 HydrophobicContact CB-CD 3.8Å; D102-K109 HydrophobicContact CB-CG 4.18Å; D102-K109 WeakPolarHBondContact OD2-CE 3.25Å; D102-K109 IonicContact OD2-NZ 3.8Å; D102-K109 PolarHBondContact OD2-NZ 2.71Å; D105-K109 WeakPolarHBondContact OD2-CE 3.35Å; D105-K109 IonicContact OD2-NZ 3.74Å; D105-K109 PolarHBondContact OD2-NZ 3.32Å; S107-K109 PolarHBondContact O-N 2.89Å
110	P	91.2	Very high	86	Confident	57 Å²	57	41.6 Å²	41.6	37%	0.37	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	137.7	177.7	29.2	-35	0	0	0	110.7	A112 Q287	P110-A112 PolarHBondContact O-N 2.89Å; P110-Q287 HydrophobicContact CB-CG 4.29Å; P110-Q287 HydrophobicContact CG-CG 4.41Å
111	C	89.8	Confident	85.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-56.5	134.5	178.7	-67.3	0	0	0	0	111.8	G98 S117 C275 Q287 G288	G98-C111 WeakPolarHBondContact O-CB 3.24Å; G98-C111 PolarHBondContact O-N 3.12Å; G98-C111 PolarHBondContact O-SG 2.93Å; C111-S117 WeakPolarHBondContact SG-CB 3.41Å; C111-C275 WeakPolarHBondContact CA-SG 3.33Å; C111-C275 HydrophobicContact CB-CB 3.74Å; C111-C275 WeakPolarHBondContact CB-SG 3.11Å; C111-C275 WeakPolarHBondContact SG-CB 3.26Å; C111-C275 CovalentContact SG-SG 2.03Å; C111-C275 PolarHBondContact SG-SG 3.1Å; C111-Q287 CarbonylContact O-C 3.55Å; C111-Q287 VanDerWaalsContact O-CA 3.26Å; C111-Q287 WeakPolarHBondContact O-CA 3.46Å; C111-Q287 WeakPolarHBondContact O-CG 3.38Å; C111-G288 PolarHBondContact O-N 2.9Å
112	A	90.5	Very high	85.3	Confident	53 Å²	53	41.3 Å²	41.3	44%	0.438	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-57.4	156.2	168.9	0	0	0	0	0	111.4	P110 R115	P110-A112 PolarHBondContact O-N 2.89Å; A112-R115 PolarHBondContact O-N 3.27Å; A112-R115 VanDerWaalsContact O-N 3.12Å
113	E	90.6	Very high	85.2	Confident	104 Å²	104	43.7 Å²	43.7	49%	0.486	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	148.3	172.2	-64	179.5	-174.7	0	0	111.2	R115 T306	E113-R115 PolarHBondContact O-N 3.1Å; E113-T306 HydrophobicContact CB-CG2 3.51Å
114	G	88.1	Confident	85.4	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	-0.6	-173	0	0	0	0	0	115.2	C278 A284 G304 E305	G114-C278 WeakPolarHBondContact O-CB 3.31Å; G114-C278 PolarHBondContact O-N 3.03Å; G114-C278 PolarHBondContact O-SG 3.33Å; G114-C278 VanDerWaalsContact O-SG 3.37Å; G114-A284 PolarHBondContact N-O 2.91Å; G114-G304 WeakPolarHBondContact CA-O 2.99Å; G114-G304 CarbonylContact O-C 3.58Å; G114-G304 VanDerWaalsContact O-CA 3.29Å; G114-G304 WeakPolarHBondContact O-CA 3.43Å; G114-E305 VanDerWaalsContact CA-O 3.27Å; G114-E305 WeakPolarHBondContact CA-O 3.02Å
115	R	89.3	Confident	85.1	Confident	90 Å²	90	40 Å²	40	34%	0.34	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	158.2	175	-46.8	-173.4	77.9	120.9	-10.6	111	A112 E113 E274 C275 F276	A112-R115 PolarHBondContact O-N 3.27Å; A112-R115 VanDerWaalsContact O-N 3.12Å; E113-R115 PolarHBondContact O-N 3.1Å; R115-E274 IonicContact NH2-OE2 3.51Å; R115-C275 HydrophobicContact CB-CB 3.7Å; R115-C275 VanDerWaalsContact CZ-O 3.29Å; R115-C275 PolarHBondContact NE-O 2.57Å; R115-C275 PolarHBondContact NH2-O 2.97Å; R115-F276 CarbonylContact C-O 3.48Å; R115-F276 VanDerWaalsContact CA-O 3.25Å; R115-F276 WeakPolarHBondContact CA-O 3.2Å; R115-F276 WeakPolarHBondContact CB-O 3.35Å
116	Y	87.8	Confident	84.8	Confident	11 Å²	11	38.2 Å²	38.2	4%	0.043	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	164.1	-179.4	81.5	-79.7	0	0	0	113.2	R123 D125 C275 F276 S289 C292	Y116-R123 VanDerWaalsContact OH-CD 3.29Å; Y116-R123 WeakPolarHBondContact OH-CD 3.29Å; Y116-R123 PolarHBondContact OH-NE 2.74Å; Y116-D125 PolarHBondContact OH-OD1 2.84Å; Y116-C275 CarbonylContact O-C 3.59Å; Y116-C275 WeakPolarHBondContact O-CA 3.44Å; Y116-F276 HydrophobicContact CD1-CB 4.11Å; Y116-F276 VanDerWaalsContact CD1-O 3.32Å; Y116-F276 WeakPolarHBondContact CD1-O 3.29Å; Y116-F276 HydrophobicContact CE1-CB 3.72Å; Y116-F276 PolarHBondContact N-O 2.66Å; Y116-F276 PolarHBondContact O-N 2.85Å; Y116-S289 WeakPolarHBondContact CA-O 3.29Å; Y116-S289 WeakPolarHBondContact CB-O 3.29Å; Y116-C292 WeakPolarHBondContact CD1-SG 3.32Å
117	S	86.8	Confident	84.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.189	C	C	.	.			trans	-152.8	143.2	176.8	170.2	0	0	0	0	111.8	G98 E99 C111 G119 T272 S289 S290	G98-S117 PolarHBondContact N-O 2.94Å; E99-S117 VanDerWaalsContact O-CB 3.29Å; E99-S117 WeakPolarHBondContact O-CB 3.22Å; E99-S117 PolarHBondContact O-OG 2.84Å; C111-S117 WeakPolarHBondContact SG-CB 3.41Å; S117-G119 VanDerWaalsContact C-N 3.29Å; S117-G119 PolarHBondContact OG-N 2.84Å; S117-T272 WeakPolarHBondContact OG-CG2 3.25Å; S117-S289 PolarHBondContact N-O 3.41Å; S117-S290 WeakPolarHBondContact O-CA 3.34Å
118	L	81	Confident	84.2	Confident	45 Å²	45	40.3 Å²	40.3	24%	0.236	21%	0.206	C	C	.	.			trans	-84.2	-2.3	168.5	-60	-178.8	0	0	0	113	T120 R123 A265	L118-T120 VanDerWaalsContact C-N 3.26Å; L118-T120 PolarHBondContact O-N 3.16Å; L118-R123 HydrophobicContact CD1-CB 4.1Å; L118-A265 HydrophobicContact CD1-CB 4.14Å
119	G	81.5	Confident	83.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	76.1	-72.7	-177.6	0	0	0	0	0	111.8	C95 N96 S117 Y271 T272	C95-G119 CarbonylContact O-C 3.46Å; C95-G119 WeakPolarHBondContact O-CA 3.25Å; N96-G119 WeakPolarHBondContact O-CA 3.07Å; S117-G119 VanDerWaalsContact C-N 3.29Å; S117-G119 PolarHBondContact OG-N 2.84Å; G119-Y271 CarbonylContact O-C 3.51Å; G119-Y271 VanDerWaalsContact O-CA 3.32Å; G119-Y271 WeakPolarHBondContact O-CA 3.11Å; G119-T272 PolarHBondContact O-N 2.85Å
120	T	75	Confident	83.6	Confident	27 Å²	27	46.1 Å²	46.1	17%	0.166	23%	0.232	C	C	.	.	S	Bend	trans	-105.5	27.2	179.8	56.3	0	0	0	0	112.6	S94 L118 T267 G268 V269	S94-T120 VanDerWaalsContact CB-CG2 3.48Å; L118-T120 VanDerWaalsContact C-N 3.26Å; L118-T120 PolarHBondContact O-N 3.16Å; T120-T267 CarbonylContact O-C 3.59Å; T120-T267 WeakPolarHBondContact O-CA 3.35Å; T120-G268 PolarHBondContact O-N 2.89Å; T120-V269 VanDerWaalsContact C-CG2 3.49Å; T120-V269 CarbonylContact C-O 3.51Å; T120-V269 VanDerWaalsContact CA-O 3.29Å; T120-V269 WeakPolarHBondContact CA-O 3.22Å; T120-V269 VanDerWaalsContact CB-O 3.26Å; T120-V269 WeakPolarHBondContact CB-O 3.37Å; T120-V269 VanDerWaalsContact O-CG2 3.29Å; T120-V269 WeakPolarHBondContact O-CG2 3.19Å; T120-V269 PolarHBondContact O-N 3.41Å
121	G	76.6	Confident	83.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	157.2	-173.4	0	0	0	0	0	116.2	I266	G121-I266 CarbonylContact C-O 3.54Å; G121-I266 WeakPolarHBondContact CA-O 3.3Å
122	I	81.8	Confident	82.7	Confident	38 Å²	38	53.7 Å²	53.7	20%	0.195	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	147.5	178.4	-51.8	176.7	0	0	0	107.9	F124 A265 I266 V269	I122-F124 HydrophobicContact CG2-CE1 4.15Å; I122-F124 HydrophobicContact CG2-CE2 3.72Å; I122-F124 HydrophobicContact CG2-CZ 3.48Å; I122-F124 VanDerWaalsContact CG2-CZ 3.48Å; I122-A265 WeakPolarHBondContact O-CA 3.26Å; I122-I266 PolarHBondContact N-O 3.09Å; I122-I266 PolarHBondContact O-N 3.46Å; I122-V269 HydrophobicContact CD1-CG1 4.09Å; I122-V269 HydrophobicContact CD1-CG2 4.45Å; I122-V269 HydrophobicContact CG1-CG1 4.44Å; I122-V269 HydrophobicContact CG1-CG2 4.02Å
123	R	82.8	Confident	82.1	Confident	78 Å²	78	53.9 Å²	53.9	29%	0.294	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	143.3	-179.7	179.6	167.9	160.4	112.5	6.4	112.2	Y116 L118 D125 I264 A265	Y116-R123 VanDerWaalsContact OH-CD 3.29Å; Y116-R123 WeakPolarHBondContact OH-CD 3.29Å; Y116-R123 PolarHBondContact OH-NE 2.74Å; L118-R123 HydrophobicContact CD1-CB 4.1Å; R123-D125 IonicContact CZ-OD2 2.91Å; R123-D125 IonicContact NE-OD1 2.63Å; R123-D125 IonicContact NE-OD2 3.28Å; R123-D125 PolarHBondContact NE-OD2 2.83Å; R123-D125 IonicContact NH2-OD2 3.87Å; R123-D125 PolarHBondContact NH2-OD2 3.3Å; R123-I264 CarbonylContact C-O 3.6Å; R123-I264 WeakPolarHBondContact CA-O 3.45Å; R123-A265 HydrophobicContact CG-CB 4.5Å
124	F	85.4	Confident	82	Confident	24 Å²	24	49.8 Å²	49.8	11%	0.105	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	95.7	-179.8	-54.4	-77.2	0	0	0	110.4	I122 W127 P131 F134 Y179 N263 I264 I266	I122-F124 HydrophobicContact CG2-CE1 4.15Å; I122-F124 HydrophobicContact CG2-CE2 3.72Å; I122-F124 HydrophobicContact CG2-CZ 3.48Å; I122-F124 VanDerWaalsContact CG2-CZ 3.48Å; F124-W127 HydrophobicContact CB-CH2 4.45Å; F124-W127 HydrophobicContact CB-CZ2 3.91Å; F124-W127 PolarHBondContact O-NE1 3.5Å; F124-P131 HydrophobicContact CD1-CB 3.74Å; F124-P131 HydrophobicContact CD1-CG 4.01Å; F124-P131 HydrophobicContact CE1-CB 3.93Å; F124-F134 HydrophobicContact CB-CE2 4.46Å; F124-F134 AromaticContact CD1-CE2 3.83Å; F124-F134 HydrophobicContact CD1-CE2 3.83Å; F124-F134 AromaticContact CD2-CE2 3.65Å; F124-F134 HydrophobicContact CD2-CE2 3.65Å; F124-F134 AromaticContact CD2-CZ 3.86Å; F124-F134 HydrophobicContact CD2-CZ 3.86Å; F124-F134 HydrophobicContact CE1-CD2 4.5Å; F124-F134 AromaticContact CE1-CE2 3.87Å; F124-F134 HydrophobicContact CE1-CE2 3.87Å; F124-F134 AromaticContact CE2-CE2 3.69Å; F124-F134 HydrophobicContact CE2-CE2 3.69Å; F124-F134 HydrophobicContact CE2-CZ 4.09Å; F124-F134 AromaticContact CG-CE2 3.71Å; F124-F134 HydrophobicContact CG-CE2 3.71Å; F124-F134 HydrophobicContact CG-CZ 4.2Å; F124-F134 AromaticContact CZ-CE2 3.79Å; F124-F134 HydrophobicContact CZ-CE2 3.79Å; F124-Y179 HydrophobicContact CE2-CE1 4.21Å; F124-Y179 HydrophobicContact CE2-CE2 4.11Å; F124-Y179 AromaticContact CE2-CZ 3.92Å; F124-Y179 HydrophobicContact CZ-CD2 4.45Å; F124-Y179 HydrophobicContact CZ-CE1 4.37Å; F124-Y179 AromaticContact CZ-CE2 3.66Å; F124-Y179 HydrophobicContact CZ-CE2 3.66Å; F124-Y179 AromaticContact CZ-CZ 3.63Å; F124-N263 WeakPolarHBondContact O-CA 3.15Å; F124-N263 PolarHBondContact O-N 3.02Å; F124-I264 HydrophobicContact CB-CB 4.37Å; F124-I264 HydrophobicContact CD2-CB 4.33Å; F124-I264 HydrophobicContact CD2-CG2 4.41Å; F124-I264 PolarHBondContact N-O 3.05Å; F124-I264 PolarHBondContact O-N 3.06Å; F124-I266 HydrophobicContact CE2-CD1 4.4Å
125	D	74.8	Confident	81.9	Confident	21 Å²	21	51.6 Å²	51.6	11%	0.112	27%	0.267	C	S	.	.			trans	-132.5	15.2	-178.9	61.6	-18.2	0	0	0	114.6	Y116 R123 N263 K279	Y116-D125 PolarHBondContact OH-OD1 2.84Å; R123-D125 IonicContact CZ-OD2 2.91Å; R123-D125 IonicContact NE-OD1 2.63Å; R123-D125 IonicContact NE-OD2 3.28Å; R123-D125 PolarHBondContact NE-OD2 2.83Å; R123-D125 IonicContact NH2-OD2 3.87Å; R123-D125 PolarHBondContact NH2-OD2 3.3Å; D125-N263 VanDerWaalsContact CB-OD1 3.25Å; D125-N263 WeakPolarHBondContact CB-OD1 3.47Å; D125-K279 PolarHBondContact O-NZ 2.68Å
126	E	77.6	Confident	81.8	Confident	66 Å²	66	48.1 Å²	48.1	31%	0.308	26%	0.256	S	S	.	.			trans	-123.3	128.3	162.8	-65.4	179.3	150.4	0	0	107.6	K279 K303	E126-K279 HydrophobicContact CG-CB 4.21Å; E126-K279 HydrophobicContact CG-CD 4.22Å; E126-K279 WeakPolarHBondContact OE1-CB 3.48Å; E126-K303 WeakPolarHBondContact OE1-CE 3.09Å; E126-K303 IonicContact OE1-NZ 2.84Å; E126-K303 PolarHBondContact OE1-NZ 3.47Å; E126-K303 IonicContact OE2-NZ 2.6Å; E126-K303 PolarHBondContact OE2-NZ 2.53Å
127	W	81.3	Confident	81.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-134.4	42	-174.1	-64.8	92.5	0	0	0	111.3	F124 L130 P131 F134 P161 R162 G163 Y165 I166 I264	F124-W127 HydrophobicContact CB-CH2 4.45Å; F124-W127 HydrophobicContact CB-CZ2 3.91Å; F124-W127 PolarHBondContact O-NE1 3.5Å; W127-L130 HydrophobicContact CZ3-CD1 4.29Å; W127-P131 HydrophobicContact CE3-CG 4.23Å; W127-P131 HydrophobicContact CZ3-CG 4.17Å; W127-F134 HydrophobicContact CH2-CE1 4.04Å; W127-F134 HydrophobicContact CH2-CE2 4.17Å; W127-F134 AromaticContact CH2-CZ 3.85Å; W127-F134 HydrophobicContact CH2-CZ 3.85Å; W127-P161 WeakPolarHBondContact O-CB 3.49Å; W127-R162 PolarHBondContact O-N 2.7Å; W127-G163 CarbonylContact C-O 3.57Å; W127-G163 WeakPolarHBondContact CA-O 3.49Å; W127-G163 WeakPolarHBondContact CB-O 3.36Å; W127-G163 PolarHBondContact N-O 2.94Å; W127-G163 WeakPolarHBondContact O-CA 3.24Å; W127-G163 PolarHBondContact O-N 3.36Å; W127-Y165 WeakPolarHBondContact CB-O 3.37Å; W127-I166 HydrophobicContact CD2-CB 4.05Å; W127-I166 HydrophobicContact CD2-CG2 4.37Å; W127-I166 HydrophobicContact CE3-CB 3.72Å; W127-I166 HydrophobicContact CE3-CD1 4.03Å; W127-I166 HydrophobicContact CE3-CG1 4.35Å; W127-I166 HydrophobicContact CE3-CG2 4.13Å; W127-I166 HydrophobicContact CH2-CG2 4.09Å; W127-I166 HydrophobicContact CZ2-CG2 4.35Å; W127-I166 HydrophobicContact CZ3-CB 4Å; W127-I166 HydrophobicContact CZ3-CD1 3.8Å; W127-I166 HydrophobicContact CZ3-CG1 4.48Å; W127-I166 HydrophobicContact CZ3-CG2 3.97Å; W127-I264 HydrophobicContact CH2-CD1 3.77Å; W127-I264 HydrophobicContact CZ2-CD1 3.65Å; W127-I264 HydrophobicContact CZ2-CG1 4.07Å
128	D	77.6	Confident	81.2	Confident	128 Å²	128	53.9 Å²	53.9	68%	0.684	29%	0.29	S	S	*	.	S	Bend	trans	-70.7	-41.5	172.6	-64.3	-52.6	0	0	0	111.2
129	E	82.2	Confident	80.6	Confident	163 Å²	163	54.1 Å²	54.1	76%	0.762	30%	0.299	S	S	*	.	S	Bend	trans	-123.8	171.9	168.8	-64.1	-170.7	171.3	0	0	109.7	P131	E129-P131 WeakPolarHBondContact O-CD 3.49Å
130	L	83.4	Confident	79.6	Confident	64 Å²	64	57.1 Å²	57.1	34%	0.335	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-78	118.2	177.1	-173.2	67.7	0	0	0	109.8	W127 F134 I166 L177	W127-L130 HydrophobicContact CZ3-CD1 4.29Å; L130-F134 HydrophobicContact CD1-CB 3.8Å; L130-F134 HydrophobicContact CD1-CG 4.46Å; L130-F134 HydrophobicContact CD2-CB 4.26Å; L130-F134 HydrophobicContact CG-CB 3.86Å; L130-I166 HydrophobicContact CD1-CD1 3.7Å; L130-L177 HydrophobicContact CD1-CD1 4.03Å
131	P	83.9	Confident	78.6	Confident	27 Å²	27	58.8 Å²	58.8	18%	0.175	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-64.6	147.9	-173	-22.2	33.6	0	0	0	113.5	F124 W127 E129 G133 F134	F124-P131 HydrophobicContact CD1-CB 3.74Å; F124-P131 HydrophobicContact CD1-CG 4.01Å; F124-P131 HydrophobicContact CE1-CB 3.93Å; W127-P131 HydrophobicContact CE3-CG 4.23Å; W127-P131 HydrophobicContact CZ3-CG 4.17Å; E129-P131 WeakPolarHBondContact O-CD 3.49Å; P131-G133 PolarHBondContact O-N 2.91Å; P131-F134 HydrophobicContact CB-CD2 4.02Å; P131-F134 HydrophobicContact CB-CE2 4.4Å; P131-F134 HydrophobicContact CG-CD2 4.33Å; P131-F134 WeakPolarHBondContact O-CB 3.38Å; P131-F134 PolarHBondContact O-N 3.49Å
132	H	77.9	Confident	77.1	Confident	189 Å²	189	67.9 Å²	67.9	88%	0.875	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	132.1	179.3	-69.4	-59.4	0	0	0	112.3
133	G	79.6	Confident	75.2	Confident	56 Å²	56	72.4 Å²	72.4	58%	0.577	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.8	-14.8	-175.8	0	0	0	0	0	114.5	P131 Y179	P131-G133 PolarHBondContact O-N 2.91Å; G133-Y179 WeakPolarHBondContact O-CD2 3.34Å
134	F	86.8	Confident	72.9	Confident	18 Å²	18	75.8 Å²	75.8	8%	0.079	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	144.3	166.1	-76.3	-92.2	0	0	0	111.4	F124 W127 L130 P131 L177 M178 Y179 W244 I264	F124-F134 HydrophobicContact CB-CE2 4.46Å; F124-F134 AromaticContact CD1-CE2 3.83Å; F124-F134 HydrophobicContact CD1-CE2 3.83Å; F124-F134 AromaticContact CD2-CE2 3.65Å; F124-F134 HydrophobicContact CD2-CE2 3.65Å; F124-F134 AromaticContact CD2-CZ 3.86Å; F124-F134 HydrophobicContact CD2-CZ 3.86Å; F124-F134 HydrophobicContact CE1-CD2 4.5Å; F124-F134 AromaticContact CE1-CE2 3.87Å; F124-F134 HydrophobicContact CE1-CE2 3.87Å; F124-F134 AromaticContact CE2-CE2 3.69Å; F124-F134 HydrophobicContact CE2-CE2 3.69Å; F124-F134 HydrophobicContact CE2-CZ 4.09Å; F124-F134 AromaticContact CG-CE2 3.71Å; F124-F134 HydrophobicContact CG-CE2 3.71Å; F124-F134 HydrophobicContact CG-CZ 4.2Å; F124-F134 AromaticContact CZ-CE2 3.79Å; F124-F134 HydrophobicContact CZ-CE2 3.79Å; W127-F134 HydrophobicContact CH2-CE1 4.04Å; W127-F134 HydrophobicContact CH2-CE2 4.17Å; W127-F134 AromaticContact CH2-CZ 3.85Å; W127-F134 HydrophobicContact CH2-CZ 3.85Å; L130-F134 HydrophobicContact CD1-CB 3.8Å; L130-F134 HydrophobicContact CD1-CG 4.46Å; L130-F134 HydrophobicContact CD2-CB 4.26Å; L130-F134 HydrophobicContact CG-CB 3.86Å; P131-F134 HydrophobicContact CB-CD2 4.02Å; P131-F134 HydrophobicContact CB-CE2 4.4Å; P131-F134 HydrophobicContact CG-CD2 4.33Å; P131-F134 WeakPolarHBondContact O-CB 3.38Å; P131-F134 PolarHBondContact O-N 3.49Å; F134-L177 HydrophobicContact CB-CD1 4.37Å; F134-L177 HydrophobicContact CD1-CD1 3.74Å; F134-L177 HydrophobicContact CD1-CD2 4.24Å; F134-L177 HydrophobicContact CD1-CG 3.92Å; F134-L177 HydrophobicContact CE1-CD2 4.27Å; F134-L177 HydrophobicContact CE1-CG 4.35Å; F134-L177 HydrophobicContact CG-CD1 4.46Å; F134-M178 WeakPolarHBondContact CA-O 3.03Å; F134-Y179 HydrophobicContact CD1-CD2 4.21Å; F134-Y179 HydrophobicContact CD1-CG 4.46Å; F134-Y179 AromaticContact CD2-CD2 3.55Å; F134-Y179 HydrophobicContact CD2-CD2 3.55Å; F134-Y179 HydrophobicContact CD2-CE2 4.09Å; F134-Y179 HydrophobicContact CD2-CG 4.44Å; F134-Y179 HydrophobicContact CE1-CD2 4.24Å; F134-Y179 HydrophobicContact CE1-CG 4.22Å; F134-Y179 AromaticContact CE2-CD2 3.56Å; F134-Y179 HydrophobicContact CE2-CD2 3.56Å; F134-Y179 HydrophobicContact CE2-CE2 4.02Å; F134-Y179 HydrophobicContact CE2-CG 4.17Å; F134-Y179 AromaticContact CG-CD2 3.89Å; F134-Y179 HydrophobicContact CG-CD2 3.89Å; F134-Y179 AromaticContact CZ-CD2 3.92Å; F134-Y179 HydrophobicContact CZ-CD2 3.92Å; F134-Y179 HydrophobicContact CZ-CG 4.06Å; F134-W244 HydrophobicContact CE1-CH2 4.3Å; F134-W244 AromaticContact CE1-CZ3 3.87Å; F134-W244 HydrophobicContact CE1-CZ3 3.87Å; F134-I264 HydrophobicContact CE1-CD1 4.01Å; F134-I264 HydrophobicContact CZ-CD1 3.9Å
135	A	86.8	Confident	70.7	Confident	39 Å²	39	82.2 Å²	82.2	32%	0.322	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	142.9	165.2	0	0	0	0	0	109.9	M178	A135-M178 HydrophobicContact CB-CG 3.93Å; A135-M178 HydrophobicContact CB-SD 4.44Å; A135-M178 PolarHBondContact N-O 3.31Å; A135-M178 PolarHBondContact O-N 3.19Å
136	S	86.8	Confident	69.2	Low	16 Å²	16	85.6 Å²	85.6	11%	0.112	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	117	167.2	-169.8	0	0	0	0	110	W159 T176	S136-W159 PolarHBondContact OG-N 3.27Å; S136-T176 WeakPolarHBondContact CA-O 3Å
137	L	84.4	Confident	67.4	Low	96 Å²	96	90.1 Å²	90.1	50%	0.503	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	155.1	178	-59.2	-176.2	0	0	0	110.1	T176 M178	L137-T176 PolarHBondContact N-O 2.02Å; L137-T176 PolarHBondContact O-N 2.75Å; L137-M178 HydrophobicContact CD1-CE 3.56Å; L137-M178 HydrophobicContact CD1-SD 4.22Å; L137-M178 HydrophobicContact CG-CE 4.16Å
138	S	78.6	Confident	65.2	Low	36 Å²	36	95 Å²	95	25%	0.252	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	138.6	173.1	51.4	0	0	0	0	110.1	C154 S157 T174	S138-C154 WeakPolarHBondContact CB-O 3.43Å; S138-C154 PolarHBondContact OG-O 3.3Å; S138-C154 VanDerWaalsContact OG-O 3.09Å; S138-S157 WeakPolarHBondContact CB-O 3.35Å; S138-T174 WeakPolarHBondContact CA-O 3.21Å
139	A	67.9	Low	63.4	Low	50 Å²	50	98.6 Å²	98.6	41%	0.413	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.5	173.2	0	0	0	0	0	109.8	T174	A139-T174 PolarHBondContact N-O 3.07Å; A139-T174 PolarHBondContact O-N 2.91Å
140	N	60.8	Low	61.4	Low	63 Å²	63	95.3 Å²	95.3	34%	0.337	55%	0.545	S	S	.	.			trans	-65.7	147.7	149.8	-69	-1.8	0	0	0	106.9	E142 E152 C154	N140-E142 PolarHBondContact O-N 2.8Å; N140-E152 PolarHBondContact ND2-O 3.06Å; N140-E152 PolarHBondContact OD1-O 3.14Å; N140-C154 WeakPolarHBondContact OD1-CB 3.5Å; N140-C154 PolarHBondContact OD1-SG 2.93Å
141	L	53.8	Low	59.6	Low	63 Å²	63	98.1 Å²	98.1	33%	0.33	57%	0.565	S	S	.	*			trans	-68.1	133.5	171.8	-87.8	156.3	0	0	0	109.5	V143 T247 L695 V750	L141-V143 VanDerWaalsContact C-N 3.33Å; L141-V143 PolarHBondContact O-N 2.73Å; L141-T247 HydrophobicContact CD1-CG2 4.17Å; L141-L695 HydrophobicContact CD1-CD2 3.61Å; L141-V750 HydrophobicContact CD1-CG1 3.87Å; L141-V750 WeakPolarHBondContact CD2-O 3.43Å
142	E	44.7	Very low	58.2	Low	191 Å²	191	101.8 Å²	101.8	89%	0.893	58%	0.58	S	S	*	*			trans	-71.9	85.6	-175.4	-66.5	178.4	150.7	0	0	110.1	N140	N140-E142 PolarHBondContact O-N 2.8Å
143	V	41.3	Very low	57.5	Low	132 Å²	132	98.6 Å²	98.6	80%	0.8	57%	0.569	S	S	*	*			trans	-73.7	123.8	162.7	-178.1	0	0	0	0	107.4	L141	L141-V143 VanDerWaalsContact C-N 3.33Å; L141-V143 PolarHBondContact O-N 2.73Å
144	D	35.9	Very low	57.1	Low	149 Å²	149	96.4 Å²	96.4	80%	0.797	55%	0.545	S	S	*	.			trans	-60.2	147.4	-175.4	-161.4	5.5	0	0	0	112	S146	D144-S146 PolarHBondContact O-N 2.88Å
145	D	39.7	Very low	56.3	Low	160 Å²	160	99.8 Å²	99.8	86%	0.856	57%	0.567	S	S	*	*	S	Bend	trans	-74.6	76.2	-153.9	-172.3	19.6	0	0	0	114
146	S	43	Very low	55.6	Low	92 Å²	92	102.7 Å²	102.7	64%	0.643	59%	0.585	S	S	*	*			trans	-155.4	126.7	162.4	57.1	0	0	0	0	114.3	D144	D144-S146 PolarHBondContact O-N 2.88Å
147	I	38.9	Very low	55.3	Low	160 Å²	160	102.1 Å²	102.1	82%	0.821	58%	0.581	S	S	*	*	S	Bend	trans	88	117.2	164.4	-50.2	170.8	0	0	0	117.5
148	S	36	Very low	55.4	Low	103 Å²	103	102.3 Å²	102.3	72%	0.72	58%	0.578	S	S	*	*			trans	79.2	118.7	158.9	59.4	0	0	0	0	120.9	S150	S148-S150 PolarHBondContact O-N 2.6Å
149	E	38.8	Very low	56	Low	203 Å²	203	101 Å²	101	95%	0.949	57%	0.567	S	S	*	*			trans	-67.1	76	-178.7	-58.9	166.6	118.9	0	0	114.1
150	S	40.1	Very low	56.9	Low	94 Å²	94	101.4 Å²	101.4	66%	0.657	57%	0.565	S	S	*	*			trans	-139.4	54.2	165.2	64.9	0	0	0	0	112.7	S148 E152	S148-S150 PolarHBondContact O-N 2.6Å; S150-E152 VanDerWaalsContact C-N 3.32Å; S150-E152 PolarHBondContact O-N 3.43Å
151	T	45.1	Very low	58.2	Low	123 Å²	123	100.2 Å²	100.2	76%	0.755	56%	0.561	S	S	*	*			trans	-69.4	85.3	173.5	-3.9	0	0	0	0	110.5
152	E	54.8	Low	59.4	Low	104 Å²	104	104.8 Å²	104.8	49%	0.486	57%	0.573	S	S	.	*			trans	-63.1	147.4	177.6	-64.1	-154.4	144.3	0	0	112	N140 S150 C154	N140-E152 PolarHBondContact ND2-O 3.06Å; N140-E152 PolarHBondContact OD1-O 3.14Å; S150-E152 VanDerWaalsContact C-N 3.32Å; S150-E152 PolarHBondContact O-N 3.43Å; E152-C154 PolarHBondContact O-N 3.22Å; E152-C154 VanDerWaalsContact O-N 3.16Å
153	N	62.7	Low	60.7	Low	123 Å²	123	96.7 Å²	96.7	66%	0.658	54%	0.541	S	S	*	.			trans	-85.8	85.4	-173.2	-94.7	-70.1	0	0	0	112.1	T155	N153-T155 PolarHBondContact O-N 3.4Å; N153-T155 VanDerWaalsContact O-N 3.12Å; N153-T155 PolarHBondContact OD1-OG1 2.64Å; N153-T155 VanDerWaalsContact OD1-OG1 3.14Å
154	C	71.4	Confident	62.2	Low	9 Å²	9	95 Å²	95	6%	0.061	53%	0.528	C	S	.	.	G	3₁₀ helix	trans	-67.1	0.1	167.3	-80.2	0	0	0	0	114.5	S138 N140 E152 S156 S157 C173	S138-C154 WeakPolarHBondContact CB-O 3.43Å; S138-C154 PolarHBondContact OG-O 3.3Å; S138-C154 VanDerWaalsContact OG-O 3.09Å; N140-C154 WeakPolarHBondContact OD1-CB 3.5Å; N140-C154 PolarHBondContact OD1-SG 2.93Å; E152-C154 PolarHBondContact O-N 3.22Å; E152-C154 VanDerWaalsContact O-N 3.16Å; C154-S156 PolarHBondContact O-N 2.91Å; C154-S157 WeakPolarHBondContact O-CB 3.29Å; C154-S157 PolarHBondContact O-N 2.89Å; C154-C173 VanDerWaalsContact CA-SG 3.52Å; C154-C173 HydrophobicContact CB-CB 3.74Å; C154-C173 WeakPolarHBondContact CB-SG 3.22Å; C154-C173 WeakPolarHBondContact SG-CB 3.32Å; C154-C173 CovalentContact SG-SG 2.03Å; C154-C173 PolarHBondContact SG-SG 2.86Å
155	T	69.9	Low	64.3	Low	89 Å²	89	90.2 Å²	90.2	55%	0.546	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-58.5	-17.6	-179	38.4	0	0	0	0	115.5	N153 K158	N153-T155 PolarHBondContact O-N 3.4Å; N153-T155 VanDerWaalsContact O-N 3.12Å; N153-T155 PolarHBondContact OD1-OG1 2.64Å; N153-T155 VanDerWaalsContact OD1-OG1 3.14Å; T155-K158 WeakPolarHBondContact O-CE 3.38Å
156	S	73	Confident	66.6	Low	100 Å²	100	82.6 Å²	82.6	70%	0.699	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-90.2	-18.1	173	57.8	0	0	0	0	114.3	C154 K158	C154-S156 PolarHBondContact O-N 2.91Å; S156-K158 PolarHBondContact O-N 3.48Å
157	S	80.8	Confident	68.8	Low	5 Å²	5	78.7 Å²	78.7	4%	0.035	43%	0.432	C	S	.	.			trans	-78.6	115.1	179.1	-176.2	0	0	0	0	109.7	S138 C154 N169 D171 C173	S138-S157 WeakPolarHBondContact CB-O 3.35Å; C154-S157 WeakPolarHBondContact O-CB 3.29Å; C154-S157 PolarHBondContact O-N 2.89Å; S157-N169 WeakPolarHBondContact OG-CB 3.36Å; S157-N169 PolarHBondContact OG-ND2 2.83Å; S157-D171 WeakPolarHBondContact CB-OD1 3.09Å; S157-D171 PolarHBondContact OG-OD1 2.61Å; S157-C173 WeakPolarHBondContact OG-CB 3.28Å
158	K	86.4	Confident	71.2	Confident	99 Å²	99	71.6 Å²	71.6	43%	0.43	40%	0.396	S	S	.	.			trans	-149.2	166.3	-177.2	-66.5	-170.6	-179.5	178.8	0	110.8	T155 S156	T155-K158 WeakPolarHBondContact O-CE 3.38Å; S156-K158 PolarHBondContact O-N 3.48Å
159	W	90.1	Very high	73.5	Confident	8 Å²	8	67.1 Å²	67.1	3%	0.03	36%	0.364	C	S	.	.			trans	-74.6	129.2	162.8	-73.4	74.4	0	0	0	109.6	S136 I166 A167 A175 L177 F202 W244 T246 V259 V261	S136-W159 PolarHBondContact OG-N 3.27Å; W159-I166 HydrophobicContact CB-CD1 3.84Å; W159-I166 HydrophobicContact CB-CG1 4.07Å; W159-I166 HydrophobicContact CE3-CG1 4.3Å; W159-I166 HydrophobicContact CE3-CG2 4.1Å; W159-I166 HydrophobicContact CZ3-CG2 4.43Å; W159-A167 CarbonylContact C-O 3.49Å; W159-A167 VanDerWaalsContact CA-O 3.23Å; W159-A167 WeakPolarHBondContact CA-O 3.5Å; W159-A175 PolarHBondContact NE1-O 2.88Å; W159-L177 HydrophobicContact CB-CB 4.25Å; W159-L177 HydrophobicContact CB-CD1 4.37Å; W159-L177 HydrophobicContact CD2-CB 3.89Å; W159-L177 HydrophobicContact CD2-CD2 4.41Å; W159-L177 HydrophobicContact CE3-CD2 4.33Å; W159-L177 HydrophobicContact CG-CB 3.72Å; W159-F202 HydrophobicContact CH2-CE2 4.25Å; W159-F202 HydrophobicContact CZ2-CE2 4.5Å; W159-W244 HydrophobicContact CH2-CB 4.34Å; W159-W244 HydrophobicContact CZ2-CB 4.1Å; W159-T246 HydrophobicContact CH2-CG2 4.2Å; W159-T246 HydrophobicContact CZ2-CG2 3.64Å; W159-T246 PolarHBondContact NE1-OG1 3.5Å; W159-V259 HydrophobicContact CH2-CB 4.32Å; W159-V259 HydrophobicContact CH2-CG1 4.03Å; W159-V261 HydrophobicContact CH2-CG2 3.9Å; W159-V261 HydrophobicContact CZ3-CB 4.24Å; W159-V261 HydrophobicContact CZ3-CG2 3.78Å
160	V	88.6	Confident	75.4	Confident	59 Å²	59	60.7 Å²	60.7	36%	0.358	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	122.6	-169	-178.9	0	0	0	0	111.2	A167	V160-A167 PolarHBondContact N-O 2.91Å; V160-A167 PolarHBondContact O-N 2.87Å
161	P	86.6	Confident	77.1	Confident	39 Å²	39	58.1 Å²	58.1	25%	0.253	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	143.5	173.9	20.1	-28.3	0	0	0	112.7	W127	W127-P161 WeakPolarHBondContact O-CB 3.49Å
162	R	79.7	Confident	78.3	Confident	158 Å²	158	53 Å²	53	60%	0.596	29%	0.285	S	S	*	.			trans	-140	28.6	-175.8	-63	-63.8	-175.8	-176.3	2.1	113.4	W127 D164 Y165 A167	W127-R162 PolarHBondContact O-N 2.7Å; R162-D164 PolarHBondContact O-N 3.43Å; R162-Y165 WeakPolarHBondContact CA-O 3.35Å; R162-Y165 HydrophobicContact CB-CD2 3.99Å; R162-Y165 HydrophobicContact CB-CE1 4.26Å; R162-Y165 HydrophobicContact CB-CE2 3.69Å; R162-Y165 HydrophobicContact CB-CG 4.4Å; R162-Y165 WeakPolarHBondContact CB-O 3.19Å; R162-Y165 HydrophobicContact CG-CD2 4.36Å; R162-Y165 HydrophobicContact CG-CE2 3.86Å; R162-Y165 PolarHBondContact N-O 2.95Å; R162-A167 HydrophobicContact CG-CB 4.34Å
163	G	72.8	Confident	79.5	Confident	21 Å²	21	48.1 Å²	48.1	22%	0.216	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	81.5	-71.4	178.9	0	0	0	0	0	113.2	W127	W127-G163 CarbonylContact C-O 3.57Å; W127-G163 WeakPolarHBondContact CA-O 3.49Å; W127-G163 WeakPolarHBondContact CB-O 3.36Å; W127-G163 PolarHBondContact N-O 2.94Å; W127-G163 WeakPolarHBondContact O-CA 3.24Å; W127-G163 PolarHBondContact O-N 3.36Å
164	D	71.2	Confident	80.3	Confident	97 Å²	97	42.6 Å²	42.6	52%	0.519	23%	0.234	S	C	.	.	S	Bend	trans	-89.9	-11	-179.7	-87.2	-51.1	0	0	0	114.2	R162 R262 K279	R162-D164 PolarHBondContact O-N 3.43Å; D164-R262 WeakPolarHBondContact O-CB 3.44Å; D164-K279 IonicContact OD1-NZ 3.77Å; D164-K279 PolarHBondContact OD1-NZ 3.43Å
165	Y	80.9	Confident	81.1	Confident	48 Å²	48	42.2 Å²	42.2	19%	0.188	23%	0.231	C	C	.	.			trans	-157.4	167.4	-177.2	58.7	-87.8	0	0	0	112	W127 R162 A167 W228 L260 V261	W127-Y165 WeakPolarHBondContact CB-O 3.37Å; R162-Y165 WeakPolarHBondContact CA-O 3.35Å; R162-Y165 HydrophobicContact CB-CD2 3.99Å; R162-Y165 HydrophobicContact CB-CE1 4.26Å; R162-Y165 HydrophobicContact CB-CE2 3.69Å; R162-Y165 HydrophobicContact CB-CG 4.4Å; R162-Y165 WeakPolarHBondContact CB-O 3.19Å; R162-Y165 HydrophobicContact CG-CD2 4.36Å; R162-Y165 HydrophobicContact CG-CE2 3.86Å; R162-Y165 PolarHBondContact N-O 2.95Å; Y165-A167 HydrophobicContact CD2-CB 4.42Å; Y165-A167 HydrophobicContact CE2-CB 4.24Å; Y165-W228 HydrophobicContact CG-CH2 4.1Å; Y165-W228 HydrophobicContact CG-CZ2 4.46Å; Y165-L260 HydrophobicContact CD2-CB 4.1Å; Y165-L260 HydrophobicContact CD2-CD1 4.07Å; Y165-L260 HydrophobicContact CD2-CD2 3.95Å; Y165-L260 HydrophobicContact CD2-CG 4.27Å; Y165-L260 HydrophobicContact CE2-CD1 3.87Å; Y165-L260 HydrophobicContact CE2-CD2 3.74Å; Y165-L260 HydrophobicContact CE2-CG 4.29Å; Y165-V261 WeakPolarHBondContact CB-O 3.33Å
166	I	88.3	Confident	81.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	137.3	166.1	-164.9	168.6	0	0	0	109.8	W127 L130 W159 L177 L260 V261	W127-I166 HydrophobicContact CD2-CB 4.05Å; W127-I166 HydrophobicContact CD2-CG2 4.37Å; W127-I166 HydrophobicContact CE3-CB 3.72Å; W127-I166 HydrophobicContact CE3-CD1 4.03Å; W127-I166 HydrophobicContact CE3-CG1 4.35Å; W127-I166 HydrophobicContact CE3-CG2 4.13Å; W127-I166 HydrophobicContact CH2-CG2 4.09Å; W127-I166 HydrophobicContact CZ2-CG2 4.35Å; W127-I166 HydrophobicContact CZ3-CB 4Å; W127-I166 HydrophobicContact CZ3-CD1 3.8Å; W127-I166 HydrophobicContact CZ3-CG1 4.48Å; W127-I166 HydrophobicContact CZ3-CG2 3.97Å; L130-I166 HydrophobicContact CD1-CD1 3.7Å; W159-I166 HydrophobicContact CB-CD1 3.84Å; W159-I166 HydrophobicContact CB-CG1 4.07Å; W159-I166 HydrophobicContact CE3-CG1 4.3Å; W159-I166 HydrophobicContact CE3-CG2 4.1Å; W159-I166 HydrophobicContact CZ3-CG2 4.43Å; I166-L177 HydrophobicContact CD1-CD1 3.91Å; I166-L177 HydrophobicContact CD1-CD2 4.07Å; I166-L177 HydrophobicContact CG2-CD2 4.03Å; I166-L260 WeakPolarHBondContact O-CA 3.38Å; I166-V261 HydrophobicContact CG2-CB 4.07Å; I166-V261 PolarHBondContact N-O 3.06Å; I166-V261 PolarHBondContact O-N 2.73Å
167	A	88.4	Confident	82.9	Confident	11 Å²	11	34.1 Å²	34.1	9%	0.091	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	140.7	-177.5	0	0	0	0	0	111.2	W159 V160 R162 Y165 L260	W159-A167 CarbonylContact C-O 3.49Å; W159-A167 VanDerWaalsContact CA-O 3.23Å; W159-A167 WeakPolarHBondContact CA-O 3.5Å; V160-A167 PolarHBondContact N-O 2.91Å; V160-A167 PolarHBondContact O-N 2.87Å; R162-A167 HydrophobicContact CG-CB 4.34Å; Y165-A167 HydrophobicContact CD2-CB 4.42Å; Y165-A167 HydrophobicContact CE2-CB 4.24Å; A167-L260 HydrophobicContact CB-CD2 3.6Å
168	S	89.4	Confident	83.3	Confident	10 Å²	10	35.9 Å²	35.9	7%	0.07	19%	0.185	C	C	.	.			trans	-71.1	173.9	173.7	78.5	0	0	0	0	112.3	V259	S168-V259 WeakPolarHBondContact CB-O 3.46Å; S168-V259 PolarHBondContact N-O 2.85Å; S168-V259 PolarHBondContact OG-N 3.39Å; S168-V259 PolarHBondContact OG-O 3.4Å
169	N	85.6	Confident	83.5	Confident	10 Å²	10	32.2 Å²	32.2	5%	0.053	17%	0.169	C	C	.	.			trans	-67.1	158.5	160.9	69.1	-46	0	0	0	111.9	S157 D171 C173 A175 T246	S157-N169 WeakPolarHBondContact OG-CB 3.36Å; S157-N169 PolarHBondContact OG-ND2 2.83Å; N169-D171 WeakPolarHBondContact CB-OD1 3.37Å; N169-D171 PolarHBondContact ND2-O 3.11Å; N169-D171 PolarHBondContact ND2-OD1 3.48Å; N169-C173 PolarHBondContact ND2-O 3.28Å; N169-A175 HydrophobicContact CB-CB 4.08Å; N169-A175 VanDerWaalsContact OD1-CB 3.24Å; N169-A175 WeakPolarHBondContact OD1-CB 3.4Å; N169-T246 PolarHBondContact OD1-OG1 2.86Å
170	T	78.4	Confident	83.4	Confident	67 Å²	67	35 Å²	35	41%	0.411	19%	0.193	S	C	.	.			trans	-115.9	8.3	171.2	60.7	0	0	0	0	112.2	S256 P258	T170-S256 WeakPolarHBondContact CB-O 3.47Å; T170-S256 WeakPolarHBondContact CG2-O 3.39Å; T170-P258 HydrophobicContact CG2-CB 3.6Å; T170-P258 HydrophobicContact CG2-CG 3.87Å
171	D	74.4	Confident	83.2	Confident	41 Å²	41	32.6 Å²	32.6	22%	0.219	18%	0.179	C	C	.	.	S	Bend	trans	-110.5	165.3	-174	74.7	-16.1	0	0	0	111.2	S157 N169 C173 A248 K693	S157-D171 WeakPolarHBondContact CB-OD1 3.09Å; S157-D171 PolarHBondContact OG-OD1 2.61Å; N169-D171 WeakPolarHBondContact CB-OD1 3.37Å; N169-D171 PolarHBondContact ND2-O 3.11Å; N169-D171 PolarHBondContact ND2-OD1 3.48Å; D171-C173 PolarHBondContact O-N 2.81Å; D171-A248 VanDerWaalsContact O-CB 3.31Å; D171-A248 WeakPolarHBondContact O-CB 3.27Å; D171-K693 IonicContact OD2-NZ 2.83Å; D171-K693 PolarHBondContact OD2-NZ 2.89Å
172	E	72.3	Confident	83	Confident	14 Å²	14	33.6 Å²	33.6	7%	0.065	18%	0.182	C	C	.	.	S	Bend	trans	-72.7	11.3	-167.5	-58.8	165.9	-159.9	0	0	114.8	A248 T691 S692 K693 L695	E172-A248 WeakPolarHBondContact CA-O 3.38Å; E172-T691 VanDerWaalsContact CD-CB 3.41Å; E172-T691 VanDerWaalsContact CD-OG1 3.29Å; E172-T691 WeakPolarHBondContact OE2-CB 3.31Å; E172-T691 PolarHBondContact OE2-OG1 2.87Å; E172-S692 VanDerWaalsContact CD-OG 3.26Å; E172-S692 WeakPolarHBondContact OE1-CB 3.38Å; E172-S692 PolarHBondContact OE1-N 2.98Å; E172-S692 VanDerWaalsContact OE1-N 3.1Å; E172-S692 PolarHBondContact OE1-OG 3.14Å; E172-S692 PolarHBondContact OE2-N 3.17Å; E172-S692 PolarHBondContact OE2-OG 3.04Å; E172-K693 HydrophobicContact CB-CB 4.06Å; E172-K693 HydrophobicContact CB-CD 4.13Å; E172-K693 HydrophobicContact CB-CG 4.05Å; E172-K693 WeakPolarHBondContact OE2-CB 3.41Å; E172-K693 PolarHBondContact OE2-N 2.78Å; E172-L695 HydrophobicContact CB-CD1 3.89Å; E172-L695 HydrophobicContact CB-CG 4.21Å; E172-L695 HydrophobicContact CG-CD1 4.41Å
173	C	78.1	Confident	83	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.014	15%	0.154	C	C	.	.	S	Bend	trans	-79.1	157.7	171.3	-60	0	0	0	0	111	C154 S157 N169 D171 K693	C154-C173 VanDerWaalsContact CA-SG 3.52Å; C154-C173 HydrophobicContact CB-CB 3.74Å; C154-C173 WeakPolarHBondContact CB-SG 3.22Å; C154-C173 WeakPolarHBondContact SG-CB 3.32Å; C154-C173 CovalentContact SG-SG 2.03Å; C154-C173 PolarHBondContact SG-SG 2.86Å; S157-C173 WeakPolarHBondContact OG-CB 3.28Å; N169-C173 PolarHBondContact ND2-O 3.28Å; D171-C173 PolarHBondContact O-N 2.81Å; C173-K693 PolarHBondContact SG-NZ 3.16Å
174	T	80.3	Confident	83.1	Confident	8 Å²	8	27.9 Å²	27.9	5%	0.049	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	111.3	165.2	-62.7	0	0	0	0	109.5	S138 A139 R245 T246 T247	S138-T174 WeakPolarHBondContact CA-O 3.21Å; A139-T174 PolarHBondContact N-O 3.07Å; A139-T174 PolarHBondContact O-N 2.91Å; T174-R245 HydrophobicContact CG2-CG 3.74Å; T174-T246 CarbonylContact C-O 3.51Å; T174-T246 WeakPolarHBondContact CA-O 3.32Å; T174-T247 WeakPolarHBondContact CG2-OG1 3.34Å; T174-T247 WeakPolarHBondContact OG1-CG2 3.37Å; T174-T247 PolarHBondContact OG1-OG1 2.62Å
175	A	87.7	Confident	83.3	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	128.3	174.1	0	0	0	0	0	110.7	W159 N169 T246	W159-A175 PolarHBondContact NE1-O 2.88Å; N169-A175 HydrophobicContact CB-CB 4.08Å; N169-A175 VanDerWaalsContact OD1-CB 3.24Å; N169-A175 WeakPolarHBondContact OD1-CB 3.4Å; A175-T246 PolarHBondContact N-O 3.12Å; A175-T246 PolarHBondContact O-N 3.45Å; A175-T246 PolarHBondContact O-OG1 2.87Å
176	T	88.2	Confident	83.3	Confident	19 Å²	19	28.7 Å²	28.7	12%	0.117	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	119.9	-178	-56.8	0	0	0	0	109.5	S136 L137 M178 Y243 W244	S136-T176 WeakPolarHBondContact CA-O 3Å; L137-T176 PolarHBondContact N-O 2.02Å; L137-T176 PolarHBondContact O-N 2.75Å; T176-M178 HydrophobicContact CG2-CE 4.14Å; T176-Y243 HydrophobicContact CG2-CD1 3.79Å; T176-W244 WeakPolarHBondContact CA-O 3.13Å
177	L	92.5	Very high	83.1	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	131.5	163.5	179.5	70.9	0	0	0	107.7	L130 F134 W159 I166 W244	L130-L177 HydrophobicContact CD1-CD1 4.03Å; F134-L177 HydrophobicContact CB-CD1 4.37Å; F134-L177 HydrophobicContact CD1-CD1 3.74Å; F134-L177 HydrophobicContact CD1-CD2 4.24Å; F134-L177 HydrophobicContact CD1-CG 3.92Å; F134-L177 HydrophobicContact CE1-CD2 4.27Å; F134-L177 HydrophobicContact CE1-CG 4.35Å; F134-L177 HydrophobicContact CG-CD1 4.46Å; W159-L177 HydrophobicContact CB-CB 4.25Å; W159-L177 HydrophobicContact CB-CD1 4.37Å; W159-L177 HydrophobicContact CD2-CB 3.89Å; W159-L177 HydrophobicContact CD2-CD2 4.41Å; W159-L177 HydrophobicContact CE3-CD2 4.33Å; W159-L177 HydrophobicContact CG-CB 3.72Å; I166-L177 HydrophobicContact CD1-CD1 3.91Å; I166-L177 HydrophobicContact CD1-CD2 4.07Å; I166-L177 HydrophobicContact CG2-CD2 4.03Å; L177-W244 HydrophobicContact CB-CB 4.29Å; L177-W244 HydrophobicContact CD2-CE3 4.17Å; L177-W244 HydrophobicContact CG-CE3 4.21Å; L177-W244 PolarHBondContact N-O 3.23Å; L177-W244 PolarHBondContact O-N 3Å
178	M	90.1	Very high	83	Confident	42 Å²	42	30.4 Å²	30.4	21%	0.207	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	149.4	179.3	62.2	177.2	64.7	0	0	112.8	F134 A135 L137 T176 L242 Y243	F134-M178 WeakPolarHBondContact CA-O 3.03Å; A135-M178 HydrophobicContact CB-CG 3.93Å; A135-M178 HydrophobicContact CB-SD 4.44Å; A135-M178 PolarHBondContact N-O 3.31Å; A135-M178 PolarHBondContact O-N 3.19Å; L137-M178 HydrophobicContact CD1-CE 3.56Å; L137-M178 HydrophobicContact CD1-SD 4.22Å; L137-M178 HydrophobicContact CG-CE 4.16Å; T176-M178 HydrophobicContact CG2-CE 4.14Å; M178-L242 WeakPolarHBondContact CA-O 3.45Å; M178-Y243 HydrophobicContact CB-CD1 4.17Å; M178-Y243 HydrophobicContact CB-CE1 4.34Å; M178-Y243 HydrophobicContact CE-CD1 4.22Å; M178-Y243 HydrophobicContact CE-CE1 3.79Å
179	Y	90.4	Very high	83.1	Confident	23 Å²	23	30 Å²	30	9%	0.09	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	131.2	173.9	-174.6	-101	0	0	0	110.2	F124 G133 F134 V181 L242 I266	F124-Y179 HydrophobicContact CE2-CE1 4.21Å; F124-Y179 HydrophobicContact CE2-CE2 4.11Å; F124-Y179 AromaticContact CE2-CZ 3.92Å; F124-Y179 HydrophobicContact CZ-CD2 4.45Å; F124-Y179 HydrophobicContact CZ-CE1 4.37Å; F124-Y179 AromaticContact CZ-CE2 3.66Å; F124-Y179 HydrophobicContact CZ-CE2 3.66Å; F124-Y179 AromaticContact CZ-CZ 3.63Å; G133-Y179 WeakPolarHBondContact O-CD2 3.34Å; F134-Y179 HydrophobicContact CD1-CD2 4.21Å; F134-Y179 HydrophobicContact CD1-CG 4.46Å; F134-Y179 AromaticContact CD2-CD2 3.55Å; F134-Y179 HydrophobicContact CD2-CD2 3.55Å; F134-Y179 HydrophobicContact CD2-CE2 4.09Å; F134-Y179 HydrophobicContact CD2-CG 4.44Å; F134-Y179 HydrophobicContact CE1-CD2 4.24Å; F134-Y179 HydrophobicContact CE1-CG 4.22Å; F134-Y179 AromaticContact CE2-CD2 3.56Å; F134-Y179 HydrophobicContact CE2-CD2 3.56Å; F134-Y179 HydrophobicContact CE2-CE2 4.02Å; F134-Y179 HydrophobicContact CE2-CG 4.17Å; F134-Y179 AromaticContact CG-CD2 3.89Å; F134-Y179 HydrophobicContact CG-CD2 3.89Å; F134-Y179 AromaticContact CZ-CD2 3.92Å; F134-Y179 HydrophobicContact CZ-CD2 3.92Å; F134-Y179 HydrophobicContact CZ-CG 4.06Å; Y179-V181 HydrophobicContact CD1-CB 4.19Å; Y179-V181 HydrophobicContact CE1-CB 3.84Å; Y179-V181 HydrophobicContact CE1-CG2 4.22Å; Y179-L242 HydrophobicContact CD1-CD1 4.27Å; Y179-L242 PolarHBondContact N-O 2.83Å; Y179-L242 PolarHBondContact O-N 2.83Å; Y179-I266 HydrophobicContact CD1-CD1 3.52Å; Y179-I266 HydrophobicContact CE1-CD1 3.53Å
180	A	87.1	Confident	83.2	Confident	66 Å²	66	31.3 Å²	31.3	55%	0.545	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.7	178.9	0	0	0	0	0	110.9	V241	A180-V241 HydrophobicContact CB-CG2 4.21Å
181	V	85.5	Confident	83.8	Confident	8 Å²	8	28.1 Å²	28.1	5%	0.048	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	136.1	-177.1	70.6	0	0	0	0	111.9	Y179 L183 N239 N240 I266 V269	Y179-V181 HydrophobicContact CD1-CB 4.19Å; Y179-V181 HydrophobicContact CE1-CB 3.84Å; Y179-V181 HydrophobicContact CE1-CG2 4.22Å; V181-L183 HydrophobicContact CG1-CD2 4.07Å; V181-L183 HydrophobicContact CG1-CG 4.4Å; V181-L183 HydrophobicContact CG2-CD2 3.76Å; V181-N239 WeakPolarHBondContact O-CA 3.25Å; V181-N240 HydrophobicContact CG1-CB 4.09Å; V181-N240 PolarHBondContact N-O 2.86Å; V181-N240 PolarHBondContact O-N 3.09Å; V181-I266 HydrophobicContact CG1-CG2 4.23Å; V181-I266 HydrophobicContact CG2-CG2 4.22Å; V181-V269 HydrophobicContact CG2-CG1 3.68Å
182	N	82.1	Confident	84.4	Confident	61 Å²	61	28.4 Å²	28.4	33%	0.326	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	109.2	175.3	-170.1	-73.6	0	0	0	110.4	K184 G238 N239	N182-K184 WeakPolarHBondContact OD1-CD 3.35Å; N182-K184 WeakPolarHBondContact OD1-CE 3.38Å; N182-K184 PolarHBondContact OD1-NZ 3.43Å; N182-G238 CarbonylContact C-O 3.6Å; N182-G238 WeakPolarHBondContact CA-O 3.3Å; N182-N239 WeakPolarHBondContact CB-OD1 3.43Å; N182-N239 PolarHBondContact ND2-OD1 2.92Å
183	L	80.4	Confident	85.1	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.9	-179.6	-53.7	-170.3	0	0	0	111.1	V181 Q185 L235 G238 I266 G268 V269	V181-L183 HydrophobicContact CG1-CD2 4.07Å; V181-L183 HydrophobicContact CG1-CG 4.4Å; V181-L183 HydrophobicContact CG2-CD2 3.76Å; L183-Q185 VanDerWaalsContact CB-O 3.32Å; L183-Q185 WeakPolarHBondContact CB-O 3.35Å; L183-L235 HydrophobicContact CD1-CB 3.28Å; L183-L235 HydrophobicContact CD1-CD1 3.81Å; L183-L235 HydrophobicContact CD1-CG 4.21Å; L183-G238 PolarHBondContact N-O 3.16Å; L183-G238 PolarHBondContact O-N 2.89Å; L183-G238 VanDerWaalsContact O-N 3.09Å; L183-I266 HydrophobicContact CD2-CG2 4.17Å; L183-G268 CarbonylContact C-O 3.52Å; L183-G268 WeakPolarHBondContact CA-O 3.33Å; L183-V269 HydrophobicContact CD2-CG1 3.71Å
184	K	74.8	Confident	85.3	Confident	57 Å²	57	30.8 Å²	30.8	25%	0.248	17%	0.173	C	C	.	.	S	Bend	trans	-95.4	-11.8	179.9	-57.4	-50.5	-173.4	-173.5	0	113.1	N182 R237 G268 A270	N182-K184 WeakPolarHBondContact OD1-CD 3.35Å; N182-K184 WeakPolarHBondContact OD1-CE 3.38Å; N182-K184 PolarHBondContact OD1-NZ 3.43Å; K184-R237 PolarHBondContact O-NE 3.35Å; K184-R237 PolarHBondContact O-NH2 2.91Å; K184-G268 PolarHBondContact N-O 3.45Å; K184-A270 HydrophobicContact CB-CB 3.96Å; K184-A270 HydrophobicContact CG-CB 3.75Å
185	Q	75.8	Confident	85.4	Confident	72 Å²	72	30.5 Å²	30.5	34%	0.336	17%	0.171	S	C	.	.	S	Bend	trans	-136.6	174.3	165.6	58.5	-175.7	15.3	0	0	108.7	L183 G268	L183-Q185 VanDerWaalsContact CB-O 3.32Å; L183-Q185 WeakPolarHBondContact CB-O 3.35Å; Q185-G268 PolarHBondContact N-O 2.93Å
186	S	80	Confident	84.4	Confident	90 Å²	90	32.2 Å²	32.2	63%	0.629	18%	0.182	S	C	*	.			trans	-65.6	152.5	167	43	0	0	0	0	110.5	L235	S186-L235 WeakPolarHBondContact CA-O 3.47Å
187	G	84	Confident	83.3	Confident	13 Å²	13	31.9 Å²	31.9	13%	0.134	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	-159.7	-178.4	0	0	0	0	0	111.5	L235	G187-L235 PolarHBondContact N-O 3.18Å; G187-L235 VanDerWaalsContact N-O 3.08Å; G187-L235 PolarHBondContact O-N 2.97Å
188	T	87.1	Confident	82.1	Confident	35 Å²	35	33.8 Å²	33.8	22%	0.215	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	153.3	-179.8	69.1	0	0	0	0	111.5	N190 V233 E234 I266 T267	T188-N190 VanDerWaalsContact CB-OD1 3.27Å; T188-N190 WeakPolarHBondContact CB-OD1 3.28Å; T188-N190 PolarHBondContact OG1-OD1 2.68Å; T188-V233 CarbonylContact C-O 3.58Å; T188-V233 WeakPolarHBondContact CA-O 3.01Å; T188-E234 HydrophobicContact CG2-CG 4.45Å; T188-I266 CarbonylContact O-C 3.39Å; T188-I266 WeakPolarHBondContact O-CA 3.28Å; T188-T267 PolarHBondContact N-OG1 2.89Å; T188-T267 PolarHBondContact O-N 2.87Å; T188-T267 PolarHBondContact O-OG1 2.95Å; T188-T267 PolarHBondContact OG1-OG1 3.35Å
189	V	89.7	Confident	81	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126	161	50.1	0	0	0	0	109	F191 F204 S232 V233 L235 L242 W244 I264 I266	V189-F191 HydrophobicContact CG2-CD1 4.18Å; V189-F204 HydrophobicContact CG1-CE1 3.96Å; V189-F204 HydrophobicContact CG1-CZ 3.74Å; V189-F204 HydrophobicContact CG2-CZ 4.25Å; V189-S232 WeakPolarHBondContact O-CA 3.44Å; V189-V233 HydrophobicContact CG1-CB 3.99Å; V189-V233 HydrophobicContact CG1-CG1 4.43Å; V189-V233 PolarHBondContact N-O 3.05Å; V189-V233 PolarHBondContact O-N 3.29Å; V189-L235 HydrophobicContact CB-CD1 3.87Å; V189-L235 HydrophobicContact CB-CG 4.34Å; V189-L235 HydrophobicContact CG1-CD1 3.98Å; V189-L235 HydrophobicContact CG1-CD2 3.84Å; V189-L235 HydrophobicContact CG1-CG 3.95Å; V189-L242 HydrophobicContact CB-CD1 4.27Å; V189-L242 HydrophobicContact CG1-CD2 4.18Å; V189-L242 HydrophobicContact CG2-CD1 3.95Å; V189-W244 HydrophobicContact CG2-CZ2 4.36Å; V189-I264 HydrophobicContact CG2-CG2 4.44Å; V189-I266 HydrophobicContact CB-CG1 4.34Å; V189-I266 HydrophobicContact CG2-CG1 4.15Å
190	N	89.2	Confident	80.4	Confident	39 Å²	39	30.9 Å²	30.9	21%	0.209	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.9	-177.2	-60.1	20.7	0	0	0	108.2	T188 F230 H231 S232 I264 A265	T188-N190 VanDerWaalsContact CB-OD1 3.27Å; T188-N190 WeakPolarHBondContact CB-OD1 3.28Å; T188-N190 PolarHBondContact OG1-OD1 2.68Å; N190-F230 HydrophobicContact CB-CE2 4.02Å; N190-F230 HydrophobicContact CB-CZ 3.71Å; N190-H231 CarbonylContact C-O 3.42Å; N190-H231 VanDerWaalsContact CA-O 3.28Å; N190-H231 WeakPolarHBondContact CA-O 3.38Å; N190-S232 PolarHBondContact OD1-OG 2.86Å; N190-I264 CarbonylContact O-C 3.28Å; N190-I264 WeakPolarHBondContact O-CA 3.36Å; N190-A265 PolarHBondContact N-O 3.35Å; N190-A265 PolarHBondContact O-N 2.94Å
191	F	90.8	Very high	79.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	157.9	175	60.6	-91	0	0	0	112.8	V189 Y193 F204 M221 F230 H231 W244 V261 I264	V189-F191 HydrophobicContact CG2-CD1 4.18Å; F191-Y193 HydrophobicContact CD2-CD1 4.28Å; F191-Y193 AromaticContact CE2-CD1 3.98Å; F191-Y193 HydrophobicContact CE2-CD1 3.98Å; F191-Y193 HydrophobicContact CE2-CG 4.32Å; F191-F204 AromaticContact CE1-CD1 3.9Å; F191-F204 HydrophobicContact CE1-CD1 3.9Å; F191-F204 AromaticContact CE1-CD2 3.81Å; F191-F204 HydrophobicContact CE1-CD2 3.81Å; F191-F204 AromaticContact CE1-CE1 3.91Å; F191-F204 HydrophobicContact CE1-CE1 3.91Å; F191-F204 AromaticContact CE1-CE2 3.82Å; F191-F204 HydrophobicContact CE1-CE2 3.82Å; F191-F204 AromaticContact CE1-CG 3.86Å; F191-F204 HydrophobicContact CE1-CG 3.86Å; F191-F204 AromaticContact CE1-CZ 3.87Å; F191-F204 HydrophobicContact CE1-CZ 3.87Å; F191-F204 HydrophobicContact CZ-CB 4.14Å; F191-F204 HydrophobicContact CZ-CD1 4.12Å; F191-F204 AromaticContact CZ-CD2 3.88Å; F191-F204 HydrophobicContact CZ-CD2 3.88Å; F191-F204 HydrophobicContact CZ-CE2 4.36Å; F191-F204 AromaticContact CZ-CG 3.75Å; F191-F204 HydrophobicContact CZ-CG 3.75Å; F191-M221 HydrophobicContact CE2-CE 3.7Å; F191-M221 HydrophobicContact CZ-CE 3.78Å; F191-M221 HydrophobicContact CZ-SD 4.31Å; F191-F230 WeakPolarHBondContact O-CA 3.49Å; F191-H231 HydrophobicContact CD1-CB 4.43Å; F191-H231 HydrophobicContact CD2-CB 4.34Å; F191-H231 HydrophobicContact CE1-CB 4.03Å; F191-H231 AromaticContact CE1-CD2 3.65Å; F191-H231 HydrophobicContact CE2-CB 3.92Å; F191-H231 HydrophobicContact CZ-CB 3.76Å; F191-H231 AromaticContact CZ-CD2 3.6Å; F191-H231 AromaticContact CZ-CG 3.95Å; F191-H231 PolarHBondContact N-O 2.92Å; F191-H231 PolarHBondContact O-N 3.2Å; F191-W244 HydrophobicContact CD1-CZ2 4.08Å; F191-W244 AromaticContact CD1-NE1 3.58Å; F191-W244 AromaticContact CD2-NE1 3.75Å; F191-W244 HydrophobicContact CE1-CZ2 4.31Å; F191-W244 AromaticContact CE1-NE1 3.28Å; F191-W244 VanDerWaalsContact CE1-NE1 3.28Å; F191-W244 AromaticContact CE2-CD1 3.9Å; F191-W244 AromaticContact CE2-NE1 3.48Å; F191-W244 AromaticContact CG-NE1 3.8Å; F191-W244 AromaticContact CZ-CD1 3.78Å; F191-W244 AromaticContact CZ-NE1 3.24Å; F191-V261 HydrophobicContact CB-CG1 4.41Å; F191-V261 HydrophobicContact CD2-CG1 4.05Å; F191-V261 HydrophobicContact CG-CG1 4.48Å; F191-I264 HydrophobicContact CB-CB 4.35Å; F191-I264 HydrophobicContact CB-CG1 3.89Å
192	E	86.7	Confident	79.9	Confident	47 Å²	47	28 Å²	28	22%	0.22	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	137.6	169.8	-73.3	170.9	-131.8	0	0	110.1	W228 E229 F230 V261 R262 N263	E192-W228 HydrophobicContact CB-CE3 4.15Å; E192-E229 CarbonylContact C-O 3.48Å; E192-E229 VanDerWaalsContact CA-O 3.26Å; E192-E229 WeakPolarHBondContact CA-O 3.23Å; E192-F230 HydrophobicContact CG-CD2 4.3Å; E192-V261 CarbonylContact O-C 3.49Å; E192-V261 WeakPolarHBondContact O-CA 3.39Å; E192-R262 HydrophobicContact CB-CG 3.84Å; E192-R262 PolarHBondContact N-O 3.24Å; E192-R262 PolarHBondContact O-N 2.88Å; E192-R262 IonicContact OE2-CZ 2.64Å; E192-R262 IonicContact OE2-NE 2.91Å; E192-R262 PolarHBondContact OE2-NE 3.38Å; E192-R262 IonicContact OE2-NH2 3.56Å; E192-R262 PolarHBondContact OE2-NH2 2.89Å; E192-N263 HydrophobicContact CG-CB 4.44Å; E192-N263 PolarHBondContact OE1-ND2 3.01Å
193	Y	87.7	Confident	80	Confident	10 Å²	10	25.3 Å²	25.3	4%	0.039	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	155.1	178.1	68.4	-82.5	0	0	0	112.5	F191 F202 M221 K222 T224 W228 E229 H231 L260	F191-Y193 HydrophobicContact CD2-CD1 4.28Å; F191-Y193 AromaticContact CE2-CD1 3.98Å; F191-Y193 HydrophobicContact CE2-CD1 3.98Å; F191-Y193 HydrophobicContact CE2-CG 4.32Å; Y193-F202 AromaticContact CD2-CE1 3.97Å; Y193-F202 HydrophobicContact CD2-CE1 3.97Å; Y193-F202 HydrophobicContact CG-CE1 4.17Å; Y193-M221 HydrophobicContact CD1-CE 3.47Å; Y193-M221 VanDerWaalsContact CD1-CE 3.47Å; Y193-M221 HydrophobicContact CD2-CE 3.96Å; Y193-M221 HydrophobicContact CE1-CE 3.45Å; Y193-M221 VanDerWaalsContact CE1-CE 3.45Å; Y193-M221 HydrophobicContact CE2-CE 3.94Å; Y193-M221 HydrophobicContact CG-CE 3.75Å; Y193-K222 WeakPolarHBondContact CE2-O 3.5Å; Y193-T224 HydrophobicContact CD2-CG2 3.62Å; Y193-T224 HydrophobicContact CE2-CG2 3.28Å; Y193-W228 CarbonylContact O-C 3.54Å; Y193-W228 WeakPolarHBondContact O-CA 3.38Å; Y193-E229 HydrophobicContact CD1-CB 4.41Å; Y193-E229 HydrophobicContact CE1-CB 3.74Å; Y193-E229 HydrophobicContact CE2-CB 4Å; Y193-E229 VanDerWaalsContact CZ-CB 3.5Å; Y193-E229 PolarHBondContact N-O 3.42Å; Y193-E229 PolarHBondContact O-N 3.16Å; Y193-E229 PolarHBondContact OH-OE2 2.59Å; Y193-H231 HydrophobicContact CD1-CB 4.02Å; Y193-H231 HydrophobicContact CE1-CB 3.82Å; Y193-L260 CarbonylContact C-O 3.56Å; Y193-L260 VanDerWaalsContact CA-O 3.22Å; Y193-L260 WeakPolarHBondContact CA-O 3.42Å
194	Y	80.9	Confident	80.3	Confident	55 Å²	55	25.5 Å²	25.5	22%	0.216	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	118.6	168.5	-177.8	-130.5	0	0	0	107.9	P196 T224 G227 V259 L260	Y194-P196 HydrophobicContact CD1-CG 4.12Å; Y194-P196 HydrophobicContact CD2-CB 4.49Å; Y194-P196 HydrophobicContact CE1-CB 3.89Å; Y194-P196 HydrophobicContact CE1-CG 3.75Å; Y194-P196 HydrophobicContact CE2-CB 3.86Å; Y194-P196 HydrophobicContact CE2-CG 4.47Å; Y194-T224 WeakPolarHBondContact CD2-OG1 3.46Å; Y194-G227 WeakPolarHBondContact CD2-O 3.46Å; Y194-V259 CarbonylContact O-C 3.58Å; Y194-V259 VanDerWaalsContact O-CA 3.27Å; Y194-V259 WeakPolarHBondContact O-CA 3.46Å; Y194-L260 HydrophobicContact CD1-CD1 3.92Å; Y194-L260 HydrophobicContact CD1-CG 4.19Å; Y194-L260 PolarHBondContact N-O 2.82Å; Y194-L260 PolarHBondContact O-N 2.62Å
195	Y	82.1	Confident	80.7	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.008	13%	0.134	C	C	.	.			trans	-131.9	80.1	-176	170.3	-153.1	0	0	0	109	D197 I200 F202 M221 K222 T223 T224 V259	Y195-D197 WeakPolarHBondContact CE2-O 3.41Å; Y195-I200 WeakPolarHBondContact CE2-O 3.45Å; Y195-I200 VanDerWaalsContact CZ-O 3.23Å; Y195-I200 PolarHBondContact OH-O 2.04Å; Y195-F202 HydrophobicContact CD1-CB 3.96Å; Y195-F202 AromaticContact CD1-CD1 3.81Å; Y195-F202 HydrophobicContact CD1-CD1 3.81Å; Y195-F202 HydrophobicContact CD1-CG 4.41Å; Y195-F202 HydrophobicContact CD2-CB 4.27Å; Y195-F202 HydrophobicContact CE1-CB 3.97Å; Y195-F202 HydrophobicContact CE2-CB 4.28Å; Y195-F202 HydrophobicContact CG-CB 4.15Å; Y195-F202 AromaticContact CG-CD1 3.89Å; Y195-F202 HydrophobicContact CG-CD1 3.89Å; Y195-M221 HydrophobicContact CD1-CB 4.21Å; Y195-M221 WeakPolarHBondContact CE1-O 3.39Å; Y195-K222 VanDerWaalsContact CD1-O 3.27Å; Y195-K222 WeakPolarHBondContact CD1-O 3.33Å; Y195-T223 HydrophobicContact CD1-CG2 4.12Å; Y195-T223 HydrophobicContact CD2-CG2 4.5Å; Y195-T223 HydrophobicContact CE1-CG2 3.57Å; Y195-T223 HydrophobicContact CE2-CG2 3.99Å; Y195-T223 VanDerWaalsContact CZ-CG2 3.47Å; Y195-T223 CarbonylContact O-C 3.42Å; Y195-T223 WeakPolarHBondContact O-CA 3.27Å; Y195-T224 VanDerWaalsContact C-OG1 3.27Å; Y195-T224 PolarHBondContact N-OG1 2.65Å; Y195-T224 PolarHBondContact O-N 2.8Å; Y195-T224 PolarHBondContact O-OG1 3.05Å; Y195-V259 HydrophobicContact CD2-CG2 3.84Å; Y195-V259 HydrophobicContact CG-CG2 4.27Å
196	P	67	Low	81.2	Confident	36 Å²	36	20.8 Å²	20.8	23%	0.234	12%	0.12	C	C	.	.			trans	-91	-0.9	-164	34.7	-38.8	0	0	0	116.5	Y194 K257	Y194-P196 HydrophobicContact CD1-CG 4.12Å; Y194-P196 HydrophobicContact CD2-CB 4.49Å; Y194-P196 HydrophobicContact CE1-CB 3.89Å; Y194-P196 HydrophobicContact CE1-CG 3.75Å; Y194-P196 HydrophobicContact CE2-CB 3.86Å; Y194-P196 HydrophobicContact CE2-CG 4.47Å; P196-K257 HydrophobicContact CB-CD 4.42Å; P196-K257 HydrophobicContact CG-CB 3.66Å; P196-K257 HydrophobicContact CG-CD 4.24Å
197	D	66.4	Low	81.2	Confident	12 Å²	12	18.8 Å²	18.8	6%	0.064	10%	0.101	C	C	.	.			trans	-148.5	111	-169.3	-164.1	-28.3	0	0	0	110.7	Y195 S199 I200 K254 K257	Y195-D197 WeakPolarHBondContact CE2-O 3.41Å; D197-S199 PolarHBondContact O-N 2.91Å; D197-S199 WeakPolarHBondContact OD1-CB 3.05Å; D197-S199 PolarHBondContact OD1-N 3.32Å; D197-S199 PolarHBondContact OD1-OG 2.92Å; D197-I200 PolarHBondContact O-N 3.44Å; D197-I200 VanDerWaalsContact O-N 3.1Å; D197-K254 IonicContact OD1-NZ 2.7Å; D197-K254 PolarHBondContact OD1-NZ 3.09Å; D197-K254 VanDerWaalsContact OD1-NZ 3.13Å; D197-K254 IonicContact OD2-NZ 2.92Å; D197-K254 PolarHBondContact OD2-NZ 3.09Å; D197-K254 VanDerWaalsContact OD2-NZ 3.16Å; D197-K257 HydrophobicContact CB-CB 4.06Å; D197-K257 PolarHBondContact OD2-N 2.95Å
198	S	66.7	Low	80.8	Confident	41 Å²	41	20.4 Å²	20.4	29%	0.287	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-4	-178.2	61.3	0	0	0	0	114.6	I200 F249	S198-I200 PolarHBondContact O-N 2.68Å; S198-F249 WeakPolarHBondContact O-CE1 3.49Å; S198-F249 WeakPolarHBondContact O-CZ 3.01Å
199	S	67.5	Low	79.8	Confident	3 Å²	3	23.6 Å²	23.6	2%	0.021	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	6	167.2	64.1	0	0	0	0	114.5	D197 A248 F249 S256	D197-S199 PolarHBondContact O-N 2.91Å; D197-S199 WeakPolarHBondContact OD1-CB 3.05Å; D197-S199 PolarHBondContact OD1-N 3.32Å; D197-S199 PolarHBondContact OD1-OG 2.92Å; S199-A248 CarbonylContact O-C 3.54Å; S199-A248 WeakPolarHBondContact O-CA 3.38Å; S199-F249 VanDerWaalsContact O-CD1 3.27Å; S199-F249 WeakPolarHBondContact O-CD1 3.33Å; S199-F249 PolarHBondContact O-N 3.47Å; S199-S256 WeakPolarHBondContact OG-CB 3.24Å; S199-S256 PolarHBondContact OG-OG 2.99Å
200	I	76.3	Confident	78.6	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117	165.2	-52.5	-168.2	0	0	0	109.2	Y195 D197 S198 F202 T246 A248 K257 V259	Y195-I200 WeakPolarHBondContact CE2-O 3.45Å; Y195-I200 VanDerWaalsContact CZ-O 3.23Å; Y195-I200 PolarHBondContact OH-O 2.04Å; D197-I200 PolarHBondContact O-N 3.44Å; D197-I200 VanDerWaalsContact O-N 3.1Å; S198-I200 PolarHBondContact O-N 2.68Å; I200-F202 PolarHBondContact O-N 3.27Å; I200-T246 HydrophobicContact CG2-CG2 3.93Å; I200-A248 HydrophobicContact CD1-CB 4.21Å; I200-A248 HydrophobicContact CG1-CB 3.84Å; I200-K257 WeakPolarHBondContact CD1-O 3.35Å; I200-V259 HydrophobicContact CG2-CG2 4.18Å
201	I	78	Confident	77.4	Confident	13 Å²	13	33 Å²	33	7%	0.067	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	118.2	165.8	-71.8	176.1	0	0	0	107.5	E203 W220 T246 T247 F249 I746	I201-E203 HydrophobicContact CG2-CG 4.17Å; I201-W220 HydrophobicContact CB-CZ3 4.24Å; I201-W220 HydrophobicContact CD1-CH2 4.29Å; I201-W220 HydrophobicContact CD1-CZ3 4.27Å; I201-W220 HydrophobicContact CG1-CZ3 4.04Å; I201-W220 HydrophobicContact CG2-CE3 4.26Å; I201-W220 HydrophobicContact CG2-CH2 3.91Å; I201-W220 HydrophobicContact CG2-CZ3 3.44Å; I201-W220 VanDerWaalsContact CG2-CZ3 3.44Å; I201-T246 VanDerWaalsContact O-CA 3.27Å; I201-T246 WeakPolarHBondContact O-CA 3.2Å; I201-T247 PolarHBondContact N-O 2.83Å; I201-T247 PolarHBondContact O-N 2.91Å; I201-F249 HydrophobicContact CG1-CD1 4.34Å; I201-F249 HydrophobicContact CG1-CE1 3.98Å; I201-I746 HydrophobicContact CD1-CD1 4.42Å
202	F	85.1	Confident	75.9	Confident	1 Å²	1	38 Å²	38	0%	0.004	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	116.4	173.9	-177.9	-150	0	0	0	110.5	W159 Y193 Y195 I200 M221 W244 T246 V259 V261	W159-F202 HydrophobicContact CH2-CE2 4.25Å; W159-F202 HydrophobicContact CZ2-CE2 4.5Å; Y193-F202 AromaticContact CD2-CE1 3.97Å; Y193-F202 HydrophobicContact CD2-CE1 3.97Å; Y193-F202 HydrophobicContact CG-CE1 4.17Å; Y195-F202 HydrophobicContact CD1-CB 3.96Å; Y195-F202 AromaticContact CD1-CD1 3.81Å; Y195-F202 HydrophobicContact CD1-CD1 3.81Å; Y195-F202 HydrophobicContact CD1-CG 4.41Å; Y195-F202 HydrophobicContact CD2-CB 4.27Å; Y195-F202 HydrophobicContact CE1-CB 3.97Å; Y195-F202 HydrophobicContact CE2-CB 4.28Å; Y195-F202 HydrophobicContact CG-CB 4.15Å; Y195-F202 AromaticContact CG-CD1 3.89Å; Y195-F202 HydrophobicContact CG-CD1 3.89Å; I200-F202 PolarHBondContact O-N 3.27Å; F202-M221 HydrophobicContact CB-CB 4.27Å; F202-M221 HydrophobicContact CD1-CB 3.37Å; F202-M221 HydrophobicContact CD1-CG 3.54Å; F202-M221 HydrophobicContact CD2-CG 4.27Å; F202-M221 HydrophobicContact CE1-CB 3.81Å; F202-M221 HydrophobicContact CE1-CE 3.83Å; F202-M221 HydrophobicContact CE1-CG 3.58Å; F202-M221 HydrophobicContact CE2-CG 4.3Å; F202-M221 HydrophobicContact CG-CB 3.9Å; F202-M221 HydrophobicContact CG-CG 3.9Å; F202-M221 HydrophobicContact CZ-CE 4.27Å; F202-M221 HydrophobicContact CZ-CG 3.97Å; F202-M221 WeakPolarHBondContact O-CB 3.46Å; F202-M221 PolarHBondContact O-N 3.21Å; F202-W244 HydrophobicContact CE2-CB 4.25Å; F202-T246 HydrophobicContact CB-CG2 4.39Å; F202-T246 HydrophobicContact CD2-CG2 3.8Å; F202-T246 HydrophobicContact CG-CG2 4.35Å; F202-V259 HydrophobicContact CB-CG2 4.01Å; F202-V259 HydrophobicContact CD1-CG1 3.6Å; F202-V259 HydrophobicContact CD1-CG2 4.18Å; F202-V259 HydrophobicContact CD2-CG1 4.09Å; F202-V259 HydrophobicContact CE1-CG1 3.49Å; F202-V259 VanDerWaalsContact CE1-CG1 3.49Å; F202-V259 HydrophobicContact CE2-CG1 4Å; F202-V259 HydrophobicContact CG-CG1 3.92Å; F202-V259 HydrophobicContact CG-CG2 3.99Å; F202-V259 HydrophobicContact CZ-CG1 3.71Å; F202-V261 HydrophobicContact CZ-CG2 4.14Å
203	E	82.9	Confident	74.6	Confident	5 Å²	5	40 Å²	40	2%	0.023	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.2	175.4	-65.4	176.6	118.3	0	0	111.1	I201 F205 R219 W220 R245	I201-E203 HydrophobicContact CG2-CG 4.17Å; E203-F205 HydrophobicContact CB-CD1 4.29Å; E203-R219 CarbonylContact C-O 3.39Å; E203-R219 WeakPolarHBondContact CA-O 3.14Å; E203-R219 HydrophobicContact CB-CG 4.13Å; E203-R219 WeakPolarHBondContact CB-O 3.18Å; E203-R219 HydrophobicContact CG-CG 4.13Å; E203-R219 VanDerWaalsContact OE1-CD 3.25Å; E203-R219 WeakPolarHBondContact OE1-CD 3.45Å; E203-R219 IonicContact OE1-CZ 3.15Å; E203-R219 IonicContact OE1-NE 2.75Å; E203-R219 PolarHBondContact OE1-NE 2.87Å; E203-R219 IonicContact OE1-NH1 2.7Å; E203-R219 PolarHBondContact OE1-NH1 2.86Å; E203-R219 IonicContact OE2-CZ 3.33Å; E203-R219 IonicContact OE2-NH1 3.91Å; E203-W220 HydrophobicContact CG-CD2 4.42Å; E203-W220 HydrophobicContact CG-CE3 4.39Å; E203-R245 HydrophobicContact CB-CB 4.44Å; E203-R245 PolarHBondContact N-O 2.99Å; E203-R245 PolarHBondContact O-N 3.38Å; E203-R245 IonicContact OE1-NH2 2.69Å; E203-R245 IonicContact OE2-CZ 3.87Å; E203-R245 IonicContact OE2-NE 3.3Å; E203-R245 PolarHBondContact OE2-NE 3.07Å; E203-R245 IonicContact OE2-NH2 3.21Å; E203-R245 PolarHBondContact OE2-NH2 3.26Å
204	F	87.1	Confident	73.2	Confident	5 Å²	5	41.2 Å²	41.2	2%	0.022	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.5	162.5	-179.6	-109.4	0	0	0	109.2	V189 F191 V206 R219 M221 H231 V233 L242 Y243 W244	V189-F204 HydrophobicContact CG1-CE1 3.96Å; V189-F204 HydrophobicContact CG1-CZ 3.74Å; V189-F204 HydrophobicContact CG2-CZ 4.25Å; F191-F204 AromaticContact CE1-CD1 3.9Å; F191-F204 HydrophobicContact CE1-CD1 3.9Å; F191-F204 AromaticContact CE1-CD2 3.81Å; F191-F204 HydrophobicContact CE1-CD2 3.81Å; F191-F204 AromaticContact CE1-CE1 3.91Å; F191-F204 HydrophobicContact CE1-CE1 3.91Å; F191-F204 AromaticContact CE1-CE2 3.82Å; F191-F204 HydrophobicContact CE1-CE2 3.82Å; F191-F204 AromaticContact CE1-CG 3.86Å; F191-F204 HydrophobicContact CE1-CG 3.86Å; F191-F204 AromaticContact CE1-CZ 3.87Å; F191-F204 HydrophobicContact CE1-CZ 3.87Å; F191-F204 HydrophobicContact CZ-CB 4.14Å; F191-F204 HydrophobicContact CZ-CD1 4.12Å; F191-F204 AromaticContact CZ-CD2 3.88Å; F191-F204 HydrophobicContact CZ-CD2 3.88Å; F191-F204 HydrophobicContact CZ-CE2 4.36Å; F191-F204 AromaticContact CZ-CG 3.75Å; F191-F204 HydrophobicContact CZ-CG 3.75Å; F204-V206 HydrophobicContact CE1-CG2 4.18Å; F204-V206 HydrophobicContact CZ-CG2 4.22Å; F204-R219 PolarHBondContact N-O 2.79Å; F204-R219 WeakPolarHBondContact O-CA 3.49Å; F204-M221 HydrophobicContact CB-CG 4.06Å; F204-M221 HydrophobicContact CB-SD 3.56Å; F204-M221 VanDerWaalsContact CB-SD 3.56Å; F204-H231 AromaticContact CD1-CD2 3.75Å; F204-H231 AromaticContact CD1-NE2 3.7Å; F204-V233 HydrophobicContact CD1-CG2 4.16Å; F204-V233 HydrophobicContact CE1-CB 4.09Å; F204-V233 HydrophobicContact CE1-CG1 4.43Å; F204-V233 HydrophobicContact CE1-CG2 3.95Å; F204-L242 HydrophobicContact CE2-CB 4.3Å; F204-L242 HydrophobicContact CZ-CB 4.5Å; F204-L242 HydrophobicContact CZ-CD2 4.41Å; F204-Y243 WeakPolarHBondContact CA-O 3.35Å; F204-Y243 VanDerWaalsContact CD2-O 3.23Å; F204-Y243 WeakPolarHBondContact CD2-O 3.36Å; F204-W244 AromaticContact CD2-CD1 3.53Å; F204-W244 HydrophobicContact CD2-CD2 4.02Å; F204-W244 AromaticContact CD2-CE2 3.73Å; F204-W244 AromaticContact CD2-CG 3.9Å; F204-W244 HydrophobicContact CD2-CG 3.9Å; F204-W244 HydrophobicContact CD2-CZ2 4.4Å; F204-W244 AromaticContact CD2-NE1 3.42Å; F204-W244 AromaticContact CE2-CD2 3.93Å; F204-W244 HydrophobicContact CE2-CD2 3.93Å; F204-W244 AromaticContact CE2-CE2 3.44Å; F204-W244 VanDerWaalsContact CE2-CE2 3.44Å; F204-W244 HydrophobicContact CE2-CG 4.32Å; F204-W244 HydrophobicContact CE2-CH2 4.3Å; F204-W244 AromaticContact CE2-CZ2 3.66Å; F204-W244 HydrophobicContact CE2-CZ2 3.66Å; F204-W244 AromaticContact CE2-NE1 3.56Å; F204-W244 HydrophobicContact CZ-CZ2 4.39Å
205	F	84.1	Confident	71.7	Confident	22 Å²	22	42 Å²	42	10%	0.096	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	159.9	173.6	58.2	-86.5	0	0	0	113.3	E203 Q207 R219 Y243 R245	E203-F205 HydrophobicContact CB-CD1 4.29Å; F205-Q207 HydrophobicContact CD2-CG 4.18Å; F205-Q207 HydrophobicContact CE2-CG 4.28Å; F205-R219 HydrophobicContact CB-CG 4.21Å; F205-R219 HydrophobicContact CD1-CG 4.17Å; F205-R219 VanDerWaalsContact CD1-NE 3.33Å; F205-R219 VanDerWaalsContact CE1-NH2 3.29Å; F205-Y243 AromaticContact CD2-CD2 3.76Å; F205-Y243 HydrophobicContact CD2-CD2 3.76Å; F205-Y243 HydrophobicContact CD2-CG 4.06Å; F205-Y243 HydrophobicContact CE2-CD1 4.15Å; F205-Y243 AromaticContact CE2-CD2 3.51Å; F205-Y243 HydrophobicContact CE2-CD2 3.51Å; F205-Y243 HydrophobicContact CE2-CE2 4.14Å; F205-Y243 AromaticContact CE2-CG 3.52Å; F205-Y243 HydrophobicContact CE2-CG 3.52Å; F205-Y243 HydrophobicContact CZ-CD1 4.2Å; F205-Y243 HydrophobicContact CZ-CD2 4.27Å; F205-Y243 AromaticContact CZ-CG 3.8Å; F205-Y243 HydrophobicContact CZ-CG 3.8Å; F205-Y243 PolarHBondContact N-O 2.83Å; F205-Y243 PolarHBondContact O-N 3.03Å; F205-R245 HydrophobicContact CE1-CB 4.22Å
206	V	85.1	Confident	70.1	Confident	7 Å²	7	49.1 Å²	49.1	4%	0.042	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	131.8	179.3	-175.1	0	0	0	0	108.8	F204 V233 L235 N240 V241 L242	F204-V206 HydrophobicContact CE1-CG2 4.18Å; F204-V206 HydrophobicContact CZ-CG2 4.22Å; V206-V233 HydrophobicContact CG2-CG1 4.11Å; V206-L235 HydrophobicContact CB-CD2 4.31Å; V206-L235 HydrophobicContact CG1-CD2 3.73Å; V206-L235 HydrophobicContact CG2-CD2 3.67Å; V206-N240 HydrophobicContact CG1-CB 3.89Å; V206-V241 WeakPolarHBondContact CA-O 3.45Å; V206-L242 HydrophobicContact CG1-CD2 4.18Å; V206-L242 HydrophobicContact CG2-CD2 3.86Å
207	Q	81.9	Confident	69.4	Low	48 Å²	48	51.3 Å²	51.3	22%	0.224	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	144.7	167.9	-62.8	-175.1	-20.2	0	0	110.6	F205 N240 V241 Y243	F205-Q207 HydrophobicContact CD2-CG 4.18Å; F205-Q207 HydrophobicContact CE2-CG 4.28Å; Q207-N240 WeakPolarHBondContact O-CA 3.12Å; Q207-V241 PolarHBondContact N-O 2.99Å; Q207-V241 PolarHBondContact O-N 2.8Å; Q207-Y243 HydrophobicContact CB-CE2 3.96Å; Q207-Y243 HydrophobicContact CG-CD2 4.29Å; Q207-Y243 HydrophobicContact CG-CE2 3.74Å; Q207-Y243 PolarHBondContact OE1-OH 2.82Å
208	N	73.8	Confident	68.8	Low	47 Å²	47	54.1 Å²	54.1	25%	0.251	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-179.9	175.7	64.6	35.6	0	0	0	112.3	Q210 C211 Q212	N208-Q210 PolarHBondContact O-N 3.34Å; N208-Q210 WeakPolarHBondContact OD1-CA 3.35Å; N208-Q210 PolarHBondContact OD1-N 3.37Å; N208-C211 PolarHBondContact O-N 2.86Å; N208-Q212 PolarHBondContact N-O 3.12Å; N208-Q212 PolarHBondContact ND2-O 2.82Å; N208-Q212 PolarHBondContact OD1-N 2.03Å
209	D	66.9	Low	68.8	Low	102 Å²	102	56.3 Å²	56.3	55%	0.545	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-15.9	176.4	-77.2	-71.6	0	0	0	116.2	N239	D209-N239 WeakPolarHBondContact OD1-CB 3.23Å; D209-N239 PolarHBondContact OD1-ND2 3.3Å; D209-N239 WeakPolarHBondContact OD2-CB 3.37Å; D209-N239 PolarHBondContact OD2-N 3.12Å
210	Q	64.4	Low	69	Low	141 Å²	141	58 Å²	58	66%	0.659	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	12.4	176.4	-58.8	-166.7	2.7	0	0	113.3	N208 Q212	N208-Q210 PolarHBondContact O-N 3.34Å; N208-Q210 WeakPolarHBondContact OD1-CA 3.35Å; N208-Q210 PolarHBondContact OD1-N 3.37Å; Q210-Q212 HydrophobicContact CB-CG 4.2Å; Q210-Q212 PolarHBondContact O-N 3.27Å; Q210-Q212 VanDerWaalsContact O-N 3.08Å
211	C	64.8	Low	69	Low	97 Å²	97	58.1 Å²	58.1	66%	0.655	32%	0.318	S	S	*	.	S	Bend	trans	56.7	16.3	-171.8	-58.1	0	0	0	0	114	N208	N208-C211 PolarHBondContact O-N 2.86Å
212	Q	58.8	Low	68.7	Low	103 Å²	103	62.8 Å²	62.8	48%	0.481	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-85.9	136.2	177.9	-68.8	171.4	27.8	0	0	109.3	N208 Q210	N208-Q212 PolarHBondContact N-O 3.12Å; N208-Q212 PolarHBondContact ND2-O 2.82Å; N208-Q212 PolarHBondContact OD1-N 2.03Å; Q210-Q212 HydrophobicContact CB-CG 4.2Å; Q210-Q212 PolarHBondContact O-N 3.27Å; Q210-Q212 VanDerWaalsContact O-N 3.08Å
213	P	59.4	Low	67.7	Low	89 Å²	89	65.3 Å²	65.3	58%	0.578	35%	0.353	S	S	*	.	B	Isolated β-bridge	trans	-69.9	142.4	168.8	30.5	-33.3	0	0	0	109.9
214	N	58.3	Low	66.8	Low	36 Å²	36	65.3 Å²	65.3	19%	0.193	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-59.9	138	166.5	-68.6	-16.5	0	0	0	109.1	N236	N214-N236 PolarHBondContact OD1-ND2 2.96Å
215	A	48.3	Very low	65.2	Low	72 Å²	72	68.8 Å²	68.8	60%	0.595	37%	0.37	S	S	*	.	S	Bend	trans	-81.3	-27.7	-159.3	0	0	0	0	0	115.8	R724	A215-R724 PolarHBondContact O-NH1 3.03Å
216	D	50.3	Low	63.6	Low	152 Å²	152	72.5 Å²	72.5	81%	0.813	39%	0.386	S	S	*	.	S	Bend	trans	-98	-25.8	-162.9	-76.4	-45.8	0	0	0	115.5
217	D	51.6	Low	62.2	Low	81 Å²	81	73.3 Å²	73.3	43%	0.433	40%	0.395	S	S	.	.	S	Bend	trans	-81.3	152.6	-172.3	-74.1	-58	0	0	0	115.1	R219	D217-R219 PolarHBondContact O-N 2.94Å
218	S	53.3	Low	61.5	Low	72 Å²	72	71.9 Å²	71.9	50%	0.503	39%	0.388	S	S	.	.			trans	-74	96.7	178.2	62.7	0	0	0	0	111.5	W220	S218-W220 PolarHBondContact O-N 2.92Å
219	R	68.1	Low	61.4	Low	86 Å²	86	72.8 Å²	72.8	33%	0.325	39%	0.391	S	S	.	.			trans	-50.6	-29.2	174	-175.9	172.1	-152.4	-139.5	12.7	114.4	E203 F204 F205 D217	E203-R219 CarbonylContact C-O 3.39Å; E203-R219 WeakPolarHBondContact CA-O 3.14Å; E203-R219 HydrophobicContact CB-CG 4.13Å; E203-R219 WeakPolarHBondContact CB-O 3.18Å; E203-R219 HydrophobicContact CG-CG 4.13Å; E203-R219 VanDerWaalsContact OE1-CD 3.25Å; E203-R219 WeakPolarHBondContact OE1-CD 3.45Å; E203-R219 IonicContact OE1-CZ 3.15Å; E203-R219 IonicContact OE1-NE 2.75Å; E203-R219 PolarHBondContact OE1-NE 2.87Å; E203-R219 IonicContact OE1-NH1 2.7Å; E203-R219 PolarHBondContact OE1-NH1 2.86Å; E203-R219 IonicContact OE2-CZ 3.33Å; E203-R219 IonicContact OE2-NH1 3.91Å; F204-R219 PolarHBondContact N-O 2.79Å; F204-R219 WeakPolarHBondContact O-CA 3.49Å; F205-R219 HydrophobicContact CB-CG 4.21Å; F205-R219 HydrophobicContact CD1-CG 4.17Å; F205-R219 VanDerWaalsContact CD1-NE 3.33Å; F205-R219 VanDerWaalsContact CE1-NH2 3.29Å; D217-R219 PolarHBondContact O-N 2.94Å
220	W	71.6	Confident	61.9	Low	38 Å²	38	74 Å²	74	14%	0.144	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-92.4	126.9	-176.5	-63.4	86.2	0	0	0	110.6	I201 E203 S218 V720 L723 V757	I201-W220 HydrophobicContact CB-CZ3 4.24Å; I201-W220 HydrophobicContact CD1-CH2 4.29Å; I201-W220 HydrophobicContact CD1-CZ3 4.27Å; I201-W220 HydrophobicContact CG1-CZ3 4.04Å; I201-W220 HydrophobicContact CG2-CE3 4.26Å; I201-W220 HydrophobicContact CG2-CH2 3.91Å; I201-W220 HydrophobicContact CG2-CZ3 3.44Å; I201-W220 VanDerWaalsContact CG2-CZ3 3.44Å; E203-W220 HydrophobicContact CG-CD2 4.42Å; E203-W220 HydrophobicContact CG-CE3 4.39Å; S218-W220 PolarHBondContact O-N 2.92Å; W220-V720 HydrophobicContact CE3-CG1 4.36Å; W220-V720 HydrophobicContact CZ3-CG1 4.28Å; W220-L723 HydrophobicContact CZ2-CD1 4.46Å; W220-V757 HydrophobicContact CH2-CG2 4.23Å
221	M	75.3	Confident	62.9	Low	4 Å²	4	68.7 Å²	68.7	2%	0.02	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-80	147.3	177.6	-63.4	-66.1	-68.4	0	0	110.4	F191 Y193 Y195 F202 F204 H231	F191-M221 HydrophobicContact CE2-CE 3.7Å; F191-M221 HydrophobicContact CZ-CE 3.78Å; F191-M221 HydrophobicContact CZ-SD 4.31Å; Y193-M221 HydrophobicContact CD1-CE 3.47Å; Y193-M221 VanDerWaalsContact CD1-CE 3.47Å; Y193-M221 HydrophobicContact CD2-CE 3.96Å; Y193-M221 HydrophobicContact CE1-CE 3.45Å; Y193-M221 VanDerWaalsContact CE1-CE 3.45Å; Y193-M221 HydrophobicContact CE2-CE 3.94Å; Y193-M221 HydrophobicContact CG-CE 3.75Å; Y195-M221 HydrophobicContact CD1-CB 4.21Å; Y195-M221 WeakPolarHBondContact CE1-O 3.39Å; F202-M221 HydrophobicContact CB-CB 4.27Å; F202-M221 HydrophobicContact CD1-CB 3.37Å; F202-M221 HydrophobicContact CD1-CG 3.54Å; F202-M221 HydrophobicContact CD2-CG 4.27Å; F202-M221 HydrophobicContact CE1-CB 3.81Å; F202-M221 HydrophobicContact CE1-CE 3.83Å; F202-M221 HydrophobicContact CE1-CG 3.58Å; F202-M221 HydrophobicContact CE2-CG 4.3Å; F202-M221 HydrophobicContact CG-CB 3.9Å; F202-M221 HydrophobicContact CG-CG 3.9Å; F202-M221 HydrophobicContact CZ-CE 4.27Å; F202-M221 HydrophobicContact CZ-CG 3.97Å; F202-M221 WeakPolarHBondContact O-CB 3.46Å; F202-M221 PolarHBondContact O-N 3.21Å; F204-M221 HydrophobicContact CB-CG 4.06Å; F204-M221 HydrophobicContact CB-SD 3.56Å; F204-M221 VanDerWaalsContact CB-SD 3.56Å; M221-H231 HydrophobicContact CE-CB 3.93Å
222	K	71.4	Confident	63.8	Low	110 Å²	110	67.1 Å²	67.1	48%	0.478	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-80.6	140.7	176.4	-63.6	-173	179.3	-173.6	0	110.2	Y193 Y195 T224	Y193-K222 WeakPolarHBondContact CE2-O 3.5Å; Y195-K222 VanDerWaalsContact CD1-O 3.27Å; Y195-K222 WeakPolarHBondContact CD1-O 3.33Å; K222-T224 PolarHBondContact O-N 3.43Å
223	T	65.6	Low	65.1	Low	54 Å²	54	62.5 Å²	62.5	33%	0.331	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-67.1	128.7	174.3	45.4	0	0	0	0	110.8	Y195 E225	Y195-T223 HydrophobicContact CD1-CG2 4.12Å; Y195-T223 HydrophobicContact CD2-CG2 4.5Å; Y195-T223 HydrophobicContact CE1-CG2 3.57Å; Y195-T223 HydrophobicContact CE2-CG2 3.99Å; Y195-T223 VanDerWaalsContact CZ-CG2 3.47Å; Y195-T223 CarbonylContact O-C 3.42Å; Y195-T223 WeakPolarHBondContact O-CA 3.27Å; T223-E225 PolarHBondContact O-N 3.19Å
224	T	62.8	Low	66.3	Low	6 Å²	6	65.5 Å²	65.5	4%	0.037	34%	0.342	C	S	.	.			trans	-84.7	110.1	-177.7	61.5	0	0	0	0	111.1	Y193 Y194 Y195 K222 G227 E229	Y193-T224 HydrophobicContact CD2-CG2 3.62Å; Y193-T224 HydrophobicContact CE2-CG2 3.28Å; Y194-T224 WeakPolarHBondContact CD2-OG1 3.46Å; Y195-T224 VanDerWaalsContact C-OG1 3.27Å; Y195-T224 PolarHBondContact N-OG1 2.65Å; Y195-T224 PolarHBondContact O-N 2.8Å; Y195-T224 PolarHBondContact O-OG1 3.05Å; K222-T224 PolarHBondContact O-N 3.43Å; T224-G227 WeakPolarHBondContact CB-O 3.46Å; T224-E229 HydrophobicContact CG2-CB 3.78Å; T224-E229 HydrophobicContact CG2-CG 3.7Å
225	E	53.3	Low	67.6	Low	78 Å²	78	63.9 Å²	63.9	36%	0.364	33%	0.333	S	S	.	.	S	Bend	trans	-77.8	-24.4	178.6	-61.2	-167.5	142.3	0	0	113.3	T223 T521	T223-E225 PolarHBondContact O-N 3.19Å; E225-T521 WeakPolarHBondContact OE2-CB 3.35Å; E225-T521 PolarHBondContact OE2-OG1 3.08Å
226	K	49.9	Very low	69.2	Low	100 Å²	100	65 Å²	65	44%	0.435	33%	0.329	S	S	.	.	S	Bend	trans	-142.2	88.8	-171.9	-67.6	-175	178.3	-177.3	0	112.8	N522	K226-N522 PolarHBondContact NZ-ND2 2.91Å
227	G	56.3	Low	70.5	Confident	23 Å²	23	65.8 Å²	65.8	24%	0.237	32%	0.32	C	S	.	.	S	Bend	trans	63.9	-151.5	175.1	0	0	0	0	0	112.8	Y194 T224	Y194-G227 WeakPolarHBondContact CD2-O 3.46Å; T224-G227 WeakPolarHBondContact CB-O 3.46Å
228	W	68.1	Low	71.8	Confident	19 Å²	19	62.9 Å²	62.9	7%	0.072	31%	0.31	C	S	.	.			trans	-80.3	131.2	-172.3	-62.6	78.2	0	0	0	111.8	Y165 E192 Y193 L260 R262 G440 N442	Y165-W228 HydrophobicContact CG-CH2 4.1Å; Y165-W228 HydrophobicContact CG-CZ2 4.46Å; E192-W228 HydrophobicContact CB-CE3 4.15Å; Y193-W228 CarbonylContact O-C 3.54Å; Y193-W228 WeakPolarHBondContact O-CA 3.38Å; W228-L260 HydrophobicContact CH2-CB 3.39Å; W228-L260 HydrophobicContact CH2-CD1 4.05Å; W228-L260 HydrophobicContact CH2-CG 4.39Å; W228-L260 HydrophobicContact CZ2-CB 4.11Å; W228-L260 HydrophobicContact CZ2-CD1 3.92Å; W228-L260 HydrophobicContact CZ3-CB 3.86Å; W228-R262 VanDerWaalsContact CD2-CZ 3.48Å; W228-R262 HydrophobicContact CE3-CG 3.92Å; W228-R262 VanDerWaalsContact CG-NH2 3.31Å; W228-R262 HydrophobicContact CH2-CB 4.37Å; W228-R262 HydrophobicContact CH2-CG 4.07Å; W228-R262 HydrophobicContact CZ3-CB 4.13Å; W228-R262 HydrophobicContact CZ3-CG 3.62Å; W228-R262 VanDerWaalsContact NE1-NH1 3.15Å; W228-G440 PolarHBondContact NE1-O 2.61Å; W228-G440 VanDerWaalsContact NE1-O 3.1Å; W228-N442 PolarHBondContact N-OD1 2.83Å; W228-N442 PolarHBondContact O-ND2 2.85Å
229	E	70.8	Confident	73.2	Confident	66 Å²	66	62.7 Å²	62.7	31%	0.308	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	165.8	170.3	-72.9	-178.6	-174.4	0	0	110.9	E192 Y193 T224	E192-E229 CarbonylContact C-O 3.48Å; E192-E229 VanDerWaalsContact CA-O 3.26Å; E192-E229 WeakPolarHBondContact CA-O 3.23Å; Y193-E229 HydrophobicContact CD1-CB 4.41Å; Y193-E229 HydrophobicContact CE1-CB 3.74Å; Y193-E229 HydrophobicContact CE2-CB 4Å; Y193-E229 VanDerWaalsContact CZ-CB 3.5Å; Y193-E229 PolarHBondContact N-O 3.42Å; Y193-E229 PolarHBondContact O-N 3.16Å; Y193-E229 PolarHBondContact OH-OE2 2.59Å; T224-E229 HydrophobicContact CG2-CB 3.78Å; T224-E229 HydrophobicContact CG2-CG 3.7Å
230	F	78.8	Confident	74	Confident	127 Å²	127	58.7 Å²	58.7	56%	0.557	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.4	-175.2	179.3	-94.8	0	0	0	110.4	N190 F191 E192	N190-F230 HydrophobicContact CB-CE2 4.02Å; N190-F230 HydrophobicContact CB-CZ 3.71Å; F191-F230 WeakPolarHBondContact O-CA 3.49Å; E192-F230 HydrophobicContact CG-CD2 4.3Å
231	H	83.7	Confident	74.7	Confident	30 Å²	30	58.6 Å²	58.6	14%	0.139	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	147.6	177	-161.7	70.2	0	0	0	110.6	N190 F191 Y193 F204 M221 V233	N190-H231 CarbonylContact C-O 3.42Å; N190-H231 VanDerWaalsContact CA-O 3.28Å; N190-H231 WeakPolarHBondContact CA-O 3.38Å; F191-H231 HydrophobicContact CD1-CB 4.43Å; F191-H231 HydrophobicContact CD2-CB 4.34Å; F191-H231 HydrophobicContact CE1-CB 4.03Å; F191-H231 AromaticContact CE1-CD2 3.65Å; F191-H231 HydrophobicContact CE2-CB 3.92Å; F191-H231 HydrophobicContact CZ-CB 3.76Å; F191-H231 AromaticContact CZ-CD2 3.6Å; F191-H231 AromaticContact CZ-CG 3.95Å; F191-H231 PolarHBondContact N-O 2.92Å; F191-H231 PolarHBondContact O-N 3.2Å; Y193-H231 HydrophobicContact CD1-CB 4.02Å; Y193-H231 HydrophobicContact CE1-CB 3.82Å; F204-H231 AromaticContact CD1-CD2 3.75Å; F204-H231 AromaticContact CD1-NE2 3.7Å; M221-H231 HydrophobicContact CE-CB 3.93Å; H231-V233 VanDerWaalsContact NE2-CG2 3.3Å; H231-V233 WeakPolarHBondContact NE2-CG2 3.47Å
232	S	84.8	Confident	75.4	Confident	63 Å²	63	58.4 Å²	58.4	44%	0.441	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	125.1	-177.9	179.9	0	0	0	0	109.1	V189 N190	V189-S232 WeakPolarHBondContact O-CA 3.44Å; N190-S232 PolarHBondContact OD1-OG 2.86Å
233	V	86.3	Confident	76.2	Confident	7 Å²	7	55 Å²	55	4%	0.042	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	139.6	-179.6	164.9	0	0	0	0	109.8	T188 V189 F204 V206 H231	T188-V233 CarbonylContact C-O 3.58Å; T188-V233 WeakPolarHBondContact CA-O 3.01Å; V189-V233 HydrophobicContact CG1-CB 3.99Å; V189-V233 HydrophobicContact CG1-CG1 4.43Å; V189-V233 PolarHBondContact N-O 3.05Å; V189-V233 PolarHBondContact O-N 3.29Å; F204-V233 HydrophobicContact CD1-CG2 4.16Å; F204-V233 HydrophobicContact CE1-CB 4.09Å; F204-V233 HydrophobicContact CE1-CG1 4.43Å; F204-V233 HydrophobicContact CE1-CG2 3.95Å; V206-V233 HydrophobicContact CG2-CG1 4.11Å; H231-V233 VanDerWaalsContact NE2-CG2 3.3Å; H231-V233 WeakPolarHBondContact NE2-CG2 3.47Å
234	E	84.2	Confident	77.4	Confident	152 Å²	152	52.5 Å²	52.5	71%	0.71	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	141.2	175.9	-64.3	-163.5	175.9	0	0	111.7	T188	T188-E234 HydrophobicContact CG2-CG 4.45Å
235	L	84.7	Confident	78.5	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	133.2	-176.8	-63.7	-177	0	0	0	111.1	L183 S186 G187 V189 V206 N240 L242 I266	L183-L235 HydrophobicContact CD1-CB 3.28Å; L183-L235 HydrophobicContact CD1-CD1 3.81Å; L183-L235 HydrophobicContact CD1-CG 4.21Å; S186-L235 WeakPolarHBondContact CA-O 3.47Å; G187-L235 PolarHBondContact N-O 3.18Å; G187-L235 VanDerWaalsContact N-O 3.08Å; G187-L235 PolarHBondContact O-N 2.97Å; V189-L235 HydrophobicContact CB-CD1 3.87Å; V189-L235 HydrophobicContact CB-CG 4.34Å; V189-L235 HydrophobicContact CG1-CD1 3.98Å; V189-L235 HydrophobicContact CG1-CD2 3.84Å; V189-L235 HydrophobicContact CG1-CG 3.95Å; V206-L235 HydrophobicContact CB-CD2 4.31Å; V206-L235 HydrophobicContact CG1-CD2 3.73Å; V206-L235 HydrophobicContact CG2-CD2 3.67Å; L235-N240 HydrophobicContact CD2-CB 4.35Å; L235-L242 HydrophobicContact CD1-CD2 4.17Å; L235-L242 HydrophobicContact CD2-CD2 3.8Å; L235-I266 HydrophobicContact CD1-CG2 3.97Å
236	N	81.8	Confident	80.1	Confident	94 Å²	94	51.4 Å²	51.4	50%	0.503	25%	0.252	S	S	.	.			trans	-78.2	153.9	-178.1	-79.2	-54.6	0	0	0	111.7	N214 G238 N240	N214-N236 PolarHBondContact OD1-ND2 2.96Å; N236-G238 PolarHBondContact O-N 3.06Å; N236-N240 PolarHBondContact N-OD1 3.06Å; N236-N240 PolarHBondContact O-ND2 2.67Å
237	R	79.4	Confident	81.4	Confident	169 Å²	169	47.5 Å²	47.5	64%	0.638	24%	0.236	S	C	*	.	S	Bend	trans	-66.3	121.5	171.7	-173.1	-172.1	-162.6	-147	4.3	109.8	K184	K184-R237 PolarHBondContact O-NE 3.35Å; K184-R237 PolarHBondContact O-NH2 2.91Å
238	G	77.8	Confident	82.2	Confident	21 Å²	21	46.4 Å²	46.4	22%	0.216	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	142.3	-166.4	-172.5	0	0	0	0	0	111.9	N182 L183 N236 N240	N182-G238 CarbonylContact C-O 3.6Å; N182-G238 WeakPolarHBondContact CA-O 3.3Å; L183-G238 PolarHBondContact N-O 3.16Å; L183-G238 PolarHBondContact O-N 2.89Å; L183-G238 VanDerWaalsContact O-N 3.09Å; N236-G238 PolarHBondContact O-N 3.06Å; G238-N240 PolarHBondContact O-ND2 2.69Å
239	N	82.6	Confident	82.1	Confident	68 Å²	68	45.9 Å²	45.9	36%	0.364	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	134.3	163.3	-64.4	-60.1	0	0	0	109.5	V181 N182 D209	V181-N239 WeakPolarHBondContact O-CA 3.25Å; N182-N239 WeakPolarHBondContact CB-OD1 3.43Å; N182-N239 PolarHBondContact ND2-OD1 2.92Å; D209-N239 WeakPolarHBondContact OD1-CB 3.23Å; D209-N239 PolarHBondContact OD1-ND2 3.3Å; D209-N239 WeakPolarHBondContact OD2-CB 3.37Å; D209-N239 PolarHBondContact OD2-N 3.12Å
240	N	84.8	Confident	81.5	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.7	169.6	-61.4	-103.6	0	0	0	106.8	V181 V206 Q207 L235 N236 G238	V181-N240 HydrophobicContact CG1-CB 4.09Å; V181-N240 PolarHBondContact N-O 2.86Å; V181-N240 PolarHBondContact O-N 3.09Å; V206-N240 HydrophobicContact CG1-CB 3.89Å; Q207-N240 WeakPolarHBondContact O-CA 3.12Å; L235-N240 HydrophobicContact CD2-CB 4.35Å; N236-N240 PolarHBondContact N-OD1 3.06Å; N236-N240 PolarHBondContact O-ND2 2.67Å; G238-N240 PolarHBondContact O-ND2 2.69Å
241	V	87.1	Confident	80.1	Confident	36 Å²	36	38.7 Å²	38.7	22%	0.218	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.2	168.7	-170.2	0	0	0	0	107.8	A180 V206 Q207 Y243	A180-V241 HydrophobicContact CB-CG2 4.21Å; V206-V241 WeakPolarHBondContact CA-O 3.45Å; Q207-V241 PolarHBondContact N-O 2.99Å; Q207-V241 PolarHBondContact O-N 2.8Å; V241-Y243 HydrophobicContact CB-CE2 3.66Å; V241-Y243 HydrophobicContact CG1-CD2 4.25Å; V241-Y243 HydrophobicContact CG1-CE1 4.28Å; V241-Y243 HydrophobicContact CG1-CE2 3.51Å; V241-Y243 WeakPolarHBondContact CG1-OH 3.33Å; V241-Y243 WeakPolarHBondContact O-CD2 3.13Å; V241-Y243 WeakPolarHBondContact O-CE2 3.47Å
242	L	89.6	Confident	78.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132.3	-177.8	-48.9	179.2	0	0	0	108.5	M178 Y179 V189 F204 V206 L235 W244 I266	M178-L242 WeakPolarHBondContact CA-O 3.45Å; Y179-L242 HydrophobicContact CD1-CD1 4.27Å; Y179-L242 PolarHBondContact N-O 2.83Å; Y179-L242 PolarHBondContact O-N 2.83Å; V189-L242 HydrophobicContact CB-CD1 4.27Å; V189-L242 HydrophobicContact CG1-CD2 4.18Å; V189-L242 HydrophobicContact CG2-CD1 3.95Å; F204-L242 HydrophobicContact CE2-CB 4.3Å; F204-L242 HydrophobicContact CZ-CB 4.5Å; F204-L242 HydrophobicContact CZ-CD2 4.41Å; V206-L242 HydrophobicContact CG1-CD2 4.18Å; V206-L242 HydrophobicContact CG2-CD2 3.86Å; L235-L242 HydrophobicContact CD1-CD2 4.17Å; L235-L242 HydrophobicContact CD2-CD2 3.8Å; L242-W244 HydrophobicContact CB-CH2 3.78Å; L242-W244 HydrophobicContact CB-CZ3 3.77Å; L242-W244 HydrophobicContact CD1-CH2 3.89Å; L242-I266 HydrophobicContact CD1-CD1 3.53Å; L242-I266 HydrophobicContact CD1-CG1 4.06Å
243	Y	88.1	Confident	76.4	Confident	40 Å²	40	46.1 Å²	46.1	16%	0.157	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120.6	-179.1	-63	-96.6	0	0	0	110.5	T176 M178 F204 F205 Q207 V241	T176-Y243 HydrophobicContact CG2-CD1 3.79Å; M178-Y243 HydrophobicContact CB-CD1 4.17Å; M178-Y243 HydrophobicContact CB-CE1 4.34Å; M178-Y243 HydrophobicContact CE-CD1 4.22Å; M178-Y243 HydrophobicContact CE-CE1 3.79Å; F204-Y243 WeakPolarHBondContact CA-O 3.35Å; F204-Y243 VanDerWaalsContact CD2-O 3.23Å; F204-Y243 WeakPolarHBondContact CD2-O 3.36Å; F205-Y243 AromaticContact CD2-CD2 3.76Å; F205-Y243 HydrophobicContact CD2-CD2 3.76Å; F205-Y243 HydrophobicContact CD2-CG 4.06Å; F205-Y243 HydrophobicContact CE2-CD1 4.15Å; F205-Y243 AromaticContact CE2-CD2 3.51Å; F205-Y243 HydrophobicContact CE2-CD2 3.51Å; F205-Y243 HydrophobicContact CE2-CE2 4.14Å; F205-Y243 AromaticContact CE2-CG 3.52Å; F205-Y243 HydrophobicContact CE2-CG 3.52Å; F205-Y243 HydrophobicContact CZ-CD1 4.2Å; F205-Y243 HydrophobicContact CZ-CD2 4.27Å; F205-Y243 AromaticContact CZ-CG 3.8Å; F205-Y243 HydrophobicContact CZ-CG 3.8Å; F205-Y243 PolarHBondContact N-O 2.83Å; F205-Y243 PolarHBondContact O-N 3.03Å; Q207-Y243 HydrophobicContact CB-CE2 3.96Å; Q207-Y243 HydrophobicContact CG-CD2 4.29Å; Q207-Y243 HydrophobicContact CG-CE2 3.74Å; Q207-Y243 PolarHBondContact OE1-OH 2.82Å; V241-Y243 HydrophobicContact CB-CE2 3.66Å; V241-Y243 HydrophobicContact CG1-CD2 4.25Å; V241-Y243 HydrophobicContact CG1-CE1 4.28Å; V241-Y243 HydrophobicContact CG1-CE2 3.51Å; V241-Y243 WeakPolarHBondContact CG1-OH 3.33Å; V241-Y243 WeakPolarHBondContact O-CD2 3.13Å; V241-Y243 WeakPolarHBondContact O-CE2 3.47Å
244	W	91.6	Very high	74.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	110.6	163.3	-60.7	-95.1	0	0	0	107.4	F134 W159 T176 L177 V189 F191 F202 F204 L242 I264	F134-W244 HydrophobicContact CE1-CH2 4.3Å; F134-W244 AromaticContact CE1-CZ3 3.87Å; F134-W244 HydrophobicContact CE1-CZ3 3.87Å; W159-W244 HydrophobicContact CH2-CB 4.34Å; W159-W244 HydrophobicContact CZ2-CB 4.1Å; T176-W244 WeakPolarHBondContact CA-O 3.13Å; L177-W244 HydrophobicContact CB-CB 4.29Å; L177-W244 HydrophobicContact CD2-CE3 4.17Å; L177-W244 HydrophobicContact CG-CE3 4.21Å; L177-W244 PolarHBondContact N-O 3.23Å; L177-W244 PolarHBondContact O-N 3Å; V189-W244 HydrophobicContact CG2-CZ2 4.36Å; F191-W244 HydrophobicContact CD1-CZ2 4.08Å; F191-W244 AromaticContact CD1-NE1 3.58Å; F191-W244 AromaticContact CD2-NE1 3.75Å; F191-W244 HydrophobicContact CE1-CZ2 4.31Å; F191-W244 AromaticContact CE1-NE1 3.28Å; F191-W244 VanDerWaalsContact CE1-NE1 3.28Å; F191-W244 AromaticContact CE2-CD1 3.9Å; F191-W244 AromaticContact CE2-NE1 3.48Å; F191-W244 AromaticContact CG-NE1 3.8Å; F191-W244 AromaticContact CZ-CD1 3.78Å; F191-W244 AromaticContact CZ-NE1 3.24Å; F202-W244 HydrophobicContact CE2-CB 4.25Å; F204-W244 AromaticContact CD2-CD1 3.53Å; F204-W244 HydrophobicContact CD2-CD2 4.02Å; F204-W244 AromaticContact CD2-CE2 3.73Å; F204-W244 AromaticContact CD2-CG 3.9Å; F204-W244 HydrophobicContact CD2-CG 3.9Å; F204-W244 HydrophobicContact CD2-CZ2 4.4Å; F204-W244 AromaticContact CD2-NE1 3.42Å; F204-W244 AromaticContact CE2-CD2 3.93Å; F204-W244 HydrophobicContact CE2-CD2 3.93Å; F204-W244 AromaticContact CE2-CE2 3.44Å; F204-W244 VanDerWaalsContact CE2-CE2 3.44Å; F204-W244 HydrophobicContact CE2-CG 4.32Å; F204-W244 HydrophobicContact CE2-CH2 4.3Å; F204-W244 AromaticContact CE2-CZ2 3.66Å; F204-W244 HydrophobicContact CE2-CZ2 3.66Å; F204-W244 AromaticContact CE2-NE1 3.56Å; F204-W244 HydrophobicContact CZ-CZ2 4.39Å; L242-W244 HydrophobicContact CB-CH2 3.78Å; L242-W244 HydrophobicContact CB-CZ3 3.77Å; L242-W244 HydrophobicContact CD1-CH2 3.89Å; W244-I264 HydrophobicContact CH2-CD1 3.96Å; W244-I264 HydrophobicContact CH2-CG2 4.09Å; W244-I264 HydrophobicContact CZ2-CD1 3.83Å; W244-I264 HydrophobicContact CZ2-CG1 4.38Å; W244-I264 HydrophobicContact CZ2-CG2 4.01Å
245	R	86	Confident	73.4	Confident	62 Å²	62	50.2 Å²	50.2	23%	0.234	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	128.5	-171.7	-174.6	164.3	79.6	150.1	9.6	110.8	T174 E203 F205	T174-R245 HydrophobicContact CG2-CG 3.74Å; E203-R245 HydrophobicContact CB-CB 4.44Å; E203-R245 PolarHBondContact N-O 2.99Å; E203-R245 PolarHBondContact O-N 3.38Å; E203-R245 IonicContact OE1-NH2 2.69Å; E203-R245 IonicContact OE2-CZ 3.87Å; E203-R245 IonicContact OE2-NE 3.3Å; E203-R245 PolarHBondContact OE2-NE 3.07Å; E203-R245 IonicContact OE2-NH2 3.21Å; E203-R245 PolarHBondContact OE2-NH2 3.26Å; F205-R245 HydrophobicContact CE1-CB 4.22Å
246	T	85.9	Confident	72.5	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	135.6	178.2	44.1	0	0	0	0	112.2	W159 N169 T174 A175 I200 I201 F202 V259	W159-T246 HydrophobicContact CH2-CG2 4.2Å; W159-T246 HydrophobicContact CZ2-CG2 3.64Å; W159-T246 PolarHBondContact NE1-OG1 3.5Å; N169-T246 PolarHBondContact OD1-OG1 2.86Å; T174-T246 CarbonylContact C-O 3.51Å; T174-T246 WeakPolarHBondContact CA-O 3.32Å; A175-T246 PolarHBondContact N-O 3.12Å; A175-T246 PolarHBondContact O-N 3.45Å; A175-T246 PolarHBondContact O-OG1 2.87Å; I200-T246 HydrophobicContact CG2-CG2 3.93Å; I201-T246 VanDerWaalsContact O-CA 3.27Å; I201-T246 WeakPolarHBondContact O-CA 3.2Å; F202-T246 HydrophobicContact CB-CG2 4.39Å; F202-T246 HydrophobicContact CD2-CG2 3.8Å; F202-T246 HydrophobicContact CG-CG2 4.35Å; T246-V259 HydrophobicContact CG2-CB 4Å; T246-V259 HydrophobicContact CG2-CG2 3.77Å
247	T	77.9	Confident	72.2	Confident	18 Å²	18	48.7 Å²	48.7	11%	0.11	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	110.7	174.1	-51.7	0	0	0	0	108.7	L141 T174 I201	L141-T247 HydrophobicContact CD1-CG2 4.17Å; T174-T247 WeakPolarHBondContact CG2-OG1 3.34Å; T174-T247 WeakPolarHBondContact OG1-CG2 3.37Å; T174-T247 PolarHBondContact OG1-OG1 2.62Å; I201-T247 PolarHBondContact N-O 2.83Å; I201-T247 PolarHBondContact O-N 2.91Å
248	A	71.5	Confident	72.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	150.7	178.8	0	0	0	0	0	112	D171 E172 S199 I200 L695	D171-A248 VanDerWaalsContact O-CB 3.31Å; D171-A248 WeakPolarHBondContact O-CB 3.27Å; E172-A248 WeakPolarHBondContact CA-O 3.38Å; S199-A248 CarbonylContact O-C 3.54Å; S199-A248 WeakPolarHBondContact O-CA 3.38Å; I200-A248 HydrophobicContact CD1-CB 4.21Å; I200-A248 HydrophobicContact CG1-CB 3.84Å; A248-L695 WeakPolarHBondContact O-CD1 3.16Å
249	F	66.9	Low	72.9	Confident	7 Å²	7	41.6 Å²	41.6	3%	0.031	22%	0.217	C	C	.	.			trans	-137.3	90.8	173.9	60.6	-81.6	0	0	0	110	S198 S199 I201 V251 L695 I746	S198-F249 WeakPolarHBondContact O-CE1 3.49Å; S198-F249 WeakPolarHBondContact O-CZ 3.01Å; S199-F249 VanDerWaalsContact O-CD1 3.27Å; S199-F249 WeakPolarHBondContact O-CD1 3.33Å; S199-F249 PolarHBondContact O-N 3.47Å; I201-F249 HydrophobicContact CG1-CD1 4.34Å; I201-F249 HydrophobicContact CG1-CE1 3.98Å; F249-V251 PolarHBondContact O-N 3.4Å; F249-L695 HydrophobicContact CB-CD1 4.44Å; F249-I746 HydrophobicContact CB-CD1 4.45Å; F249-I746 HydrophobicContact CD1-CD1 4.1Å; F249-I746 HydrophobicContact CD2-CD1 4.01Å; F249-I746 HydrophobicContact CE1-CD1 4.31Å; F249-I746 HydrophobicContact CE2-CD1 4.22Å; F249-I746 HydrophobicContact CG-CD1 3.95Å; F249-I746 HydrophobicContact CZ-CD1 4.35Å
250	S	57.1	Low	73.2	Confident	32 Å²	32	39.2 Å²	39.2	22%	0.224	20%	0.204	C	C	.	.			trans	-81.6	118.9	176.7	-169.2	0	0	0	0	110.4	K254	S250-K254 PolarHBondContact OG-O 2.97Å
251	V	49.7	Very low	73.5	Confident	11 Å²	11	39.2 Å²	39.2	7%	0.067	20%	0.204	C	C	.	.			trans	-115.8	137.5	170.4	-177.7	0	0	0	0	107.6	F249 S253 Y697	F249-V251 PolarHBondContact O-N 3.4Å; V251-S253 PolarHBondContact O-N 3.46Å; V251-Y697 HydrophobicContact CG1-CE2 4.28Å; V251-Y697 HydrophobicContact CG2-CE1 4.38Å; V251-Y697 HydrophobicContact CG2-CE2 4.36Å
252	W	44.8	Very low	73.5	Confident	130 Å²	130	38.8 Å²	38.8	49%	0.492	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	44.6	-179.4	-53.7	-21.2	0	0	0	115.4	K254 H699	W252-K254 PolarHBondContact O-N 3.08Å; W252-H699 AromaticContact CZ2-NE2 3.92Å
253	S	46.3	Very low	73.2	Confident	119 Å²	119	40.3 Å²	40.3	83%	0.832	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.4	12.8	168.5	-50.6	0	0	0	0	116.7	V251 V255	V251-S253 PolarHBondContact O-N 3.46Å; S253-V255 PolarHBondContact O-N 2.69Å
254	K	49.4	Very low	73.3	Confident	125 Å²	125	38.4 Å²	38.4	54%	0.543	20%	0.199	S	C	.	.			trans	-75.2	113.6	170.9	-171.3	-167.8	175.5	-144.1	0	108.7	D197 S250 W252 S256	D197-K254 IonicContact OD1-NZ 2.7Å; D197-K254 PolarHBondContact OD1-NZ 3.09Å; D197-K254 VanDerWaalsContact OD1-NZ 3.13Å; D197-K254 IonicContact OD2-NZ 2.92Å; D197-K254 PolarHBondContact OD2-NZ 3.09Å; D197-K254 VanDerWaalsContact OD2-NZ 3.16Å; S250-K254 PolarHBondContact OG-O 2.97Å; W252-K254 PolarHBondContact O-N 3.08Å; K254-S256 PolarHBondContact O-N 3.46Å
255	V	58	Low	73.1	Confident	119 Å²	119	39.1 Å²	39.1	72%	0.721	21%	0.205	S	C	*	.			trans	-66.9	114.2	175	-178.1	0	0	0	0	109.3	S253	S253-V255 PolarHBondContact O-N 2.69Å
256	S	66.9	Low	73.2	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.014	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-63.2	131.7	178.1	-57.7	0	0	0	0	111.3	T170 S199 K254	T170-S256 WeakPolarHBondContact CB-O 3.47Å; T170-S256 WeakPolarHBondContact CG2-O 3.39Å; S199-S256 WeakPolarHBondContact OG-CB 3.24Å; S199-S256 PolarHBondContact OG-OG 2.99Å; K254-S256 PolarHBondContact O-N 3.46Å
257	K	74.6	Confident	73.1	Confident	62 Å²	62	38.1 Å²	38.1	27%	0.27	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-74.1	133.1	172.7	-67.4	-176.2	175.9	-173.1	0	109.7	P196 D197 I200 E510 Y512	P196-K257 HydrophobicContact CB-CD 4.42Å; P196-K257 HydrophobicContact CG-CB 3.66Å; P196-K257 HydrophobicContact CG-CD 4.24Å; D197-K257 HydrophobicContact CB-CB 4.06Å; D197-K257 PolarHBondContact OD2-N 2.95Å; I200-K257 WeakPolarHBondContact CD1-O 3.35Å; K257-E510 IonicContact NZ-OE2 2.75Å; K257-E510 PolarHBondContact NZ-OE2 3.38Å; K257-Y512 PolarHBondContact NZ-OH 3.39Å
258	P	84.3	Confident	73.1	Confident	41 Å²	41	37.3 Å²	37.3	27%	0.266	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-68.6	155.3	-176.6	26.7	-32	0	0	0	112.4	T170 L260	T170-P258 HydrophobicContact CG2-CB 3.6Å; T170-P258 HydrophobicContact CG2-CG 3.87Å; P258-L260 HydrophobicContact CB-CD2 4.4Å; P258-L260 HydrophobicContact CG-CD2 4.15Å
259	V	87.3	Confident	73.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-76.7	136.1	165	179.5	0	0	0	0	108.8	W159 S168 Y194 Y195 I200 F202 T246 V261	W159-V259 HydrophobicContact CH2-CB 4.32Å; W159-V259 HydrophobicContact CH2-CG1 4.03Å; S168-V259 WeakPolarHBondContact CB-O 3.46Å; S168-V259 PolarHBondContact N-O 2.85Å; S168-V259 PolarHBondContact OG-N 3.39Å; S168-V259 PolarHBondContact OG-O 3.4Å; Y194-V259 CarbonylContact O-C 3.58Å; Y194-V259 VanDerWaalsContact O-CA 3.27Å; Y194-V259 WeakPolarHBondContact O-CA 3.46Å; Y195-V259 HydrophobicContact CD2-CG2 3.84Å; Y195-V259 HydrophobicContact CG-CG2 4.27Å; I200-V259 HydrophobicContact CG2-CG2 4.18Å; F202-V259 HydrophobicContact CB-CG2 4.01Å; F202-V259 HydrophobicContact CD1-CG1 3.6Å; F202-V259 HydrophobicContact CD1-CG2 4.18Å; F202-V259 HydrophobicContact CD2-CG1 4.09Å; F202-V259 HydrophobicContact CE1-CG1 3.49Å; F202-V259 VanDerWaalsContact CE1-CG1 3.49Å; F202-V259 HydrophobicContact CE2-CG1 4Å; F202-V259 HydrophobicContact CG-CG1 3.92Å; F202-V259 HydrophobicContact CG-CG2 3.99Å; F202-V259 HydrophobicContact CZ-CG1 3.71Å; T246-V259 HydrophobicContact CG2-CB 4Å; T246-V259 HydrophobicContact CG2-CG2 3.77Å; V259-V261 HydrophobicContact CG1-CG2 4.47Å
260	L	89.6	Confident	73.4	Confident	19 Å²	19	38 Å²	38	10%	0.099	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	144.6	174.2	-43.3	-179.1	0	0	0	109.7	Y165 I166 A167 Y193 Y194 W228 P258	Y165-L260 HydrophobicContact CD2-CB 4.1Å; Y165-L260 HydrophobicContact CD2-CD1 4.07Å; Y165-L260 HydrophobicContact CD2-CD2 3.95Å; Y165-L260 HydrophobicContact CD2-CG 4.27Å; Y165-L260 HydrophobicContact CE2-CD1 3.87Å; Y165-L260 HydrophobicContact CE2-CD2 3.74Å; Y165-L260 HydrophobicContact CE2-CG 4.29Å; I166-L260 WeakPolarHBondContact O-CA 3.38Å; A167-L260 HydrophobicContact CB-CD2 3.6Å; Y193-L260 CarbonylContact C-O 3.56Å; Y193-L260 VanDerWaalsContact CA-O 3.22Å; Y193-L260 WeakPolarHBondContact CA-O 3.42Å; Y194-L260 HydrophobicContact CD1-CD1 3.92Å; Y194-L260 HydrophobicContact CD1-CG 4.19Å; Y194-L260 PolarHBondContact N-O 2.82Å; Y194-L260 PolarHBondContact O-N 2.62Å; W228-L260 HydrophobicContact CH2-CB 3.39Å; W228-L260 HydrophobicContact CH2-CD1 4.05Å; W228-L260 HydrophobicContact CH2-CG 4.39Å; W228-L260 HydrophobicContact CZ2-CB 4.11Å; W228-L260 HydrophobicContact CZ2-CD1 3.92Å; W228-L260 HydrophobicContact CZ3-CB 3.86Å; P258-L260 HydrophobicContact CB-CD2 4.4Å; P258-L260 HydrophobicContact CG-CD2 4.15Å
261	V	90.1	Very high	74.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	142.5	175.8	177.2	0	0	0	0	109.9	W159 Y165 I166 F191 E192 F202 V259 I264	W159-V261 HydrophobicContact CH2-CG2 3.9Å; W159-V261 HydrophobicContact CZ3-CB 4.24Å; W159-V261 HydrophobicContact CZ3-CG2 3.78Å; Y165-V261 WeakPolarHBondContact CB-O 3.33Å; I166-V261 HydrophobicContact CG2-CB 4.07Å; I166-V261 PolarHBondContact N-O 3.06Å; I166-V261 PolarHBondContact O-N 2.73Å; F191-V261 HydrophobicContact CB-CG1 4.41Å; F191-V261 HydrophobicContact CD2-CG1 4.05Å; F191-V261 HydrophobicContact CG-CG1 4.48Å; E192-V261 CarbonylContact O-C 3.49Å; E192-V261 WeakPolarHBondContact O-CA 3.39Å; F202-V261 HydrophobicContact CZ-CG2 4.14Å; V259-V261 HydrophobicContact CG1-CG2 4.47Å; V261-I264 HydrophobicContact CG1-CD1 3.89Å; V261-I264 HydrophobicContact CG1-CG1 3.91Å
262	R	86.9	Confident	75.4	Confident	28 Å²	28	38.7 Å²	38.7	11%	0.106	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	176.9	174.6	73.5	-178.3	-173.5	-149.7	-9.2	112.4	D164 E192 W228 I264	D164-R262 WeakPolarHBondContact O-CB 3.44Å; E192-R262 HydrophobicContact CB-CG 3.84Å; E192-R262 PolarHBondContact N-O 3.24Å; E192-R262 PolarHBondContact O-N 2.88Å; E192-R262 IonicContact OE2-CZ 2.64Å; E192-R262 IonicContact OE2-NE 2.91Å; E192-R262 PolarHBondContact OE2-NE 3.38Å; E192-R262 IonicContact OE2-NH2 3.56Å; E192-R262 PolarHBondContact OE2-NH2 2.89Å; W228-R262 VanDerWaalsContact CD2-CZ 3.48Å; W228-R262 HydrophobicContact CE3-CG 3.92Å; W228-R262 VanDerWaalsContact CG-NH2 3.31Å; W228-R262 HydrophobicContact CH2-CB 4.37Å; W228-R262 HydrophobicContact CH2-CG 4.07Å; W228-R262 HydrophobicContact CZ3-CB 4.13Å; W228-R262 HydrophobicContact CZ3-CG 3.62Å; W228-R262 VanDerWaalsContact NE1-NH1 3.15Å; R262-I264 PolarHBondContact O-N 3.02Å
263	N	84.5	Confident	76.8	Confident	32 Å²	32	36 Å²	36	17%	0.171	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	51.4	39.2	173.2	-65.8	-16.4	0	0	0	113.8	F124 D125 E192 A265	F124-N263 WeakPolarHBondContact O-CA 3.15Å; F124-N263 PolarHBondContact O-N 3.02Å; D125-N263 VanDerWaalsContact CB-OD1 3.25Å; D125-N263 WeakPolarHBondContact CB-OD1 3.47Å; E192-N263 HydrophobicContact CG-CB 4.44Å; E192-N263 PolarHBondContact OE1-ND2 3.01Å; N263-A265 PolarHBondContact O-N 2.7Å
264	I	89.5	Confident	78.4	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	121.4	179.8	-53.9	176.3	0	0	0	108.1	R123 F124 W127 F134 V189 N190 F191 W244 V261 R262 I266	R123-I264 CarbonylContact C-O 3.6Å; R123-I264 WeakPolarHBondContact CA-O 3.45Å; F124-I264 HydrophobicContact CB-CB 4.37Å; F124-I264 HydrophobicContact CD2-CB 4.33Å; F124-I264 HydrophobicContact CD2-CG2 4.41Å; F124-I264 PolarHBondContact N-O 3.05Å; F124-I264 PolarHBondContact O-N 3.06Å; W127-I264 HydrophobicContact CH2-CD1 3.77Å; W127-I264 HydrophobicContact CZ2-CD1 3.65Å; W127-I264 HydrophobicContact CZ2-CG1 4.07Å; F134-I264 HydrophobicContact CE1-CD1 4.01Å; F134-I264 HydrophobicContact CZ-CD1 3.9Å; V189-I264 HydrophobicContact CG2-CG2 4.44Å; N190-I264 CarbonylContact O-C 3.28Å; N190-I264 WeakPolarHBondContact O-CA 3.36Å; F191-I264 HydrophobicContact CB-CB 4.35Å; F191-I264 HydrophobicContact CB-CG1 3.89Å; W244-I264 HydrophobicContact CH2-CD1 3.96Å; W244-I264 HydrophobicContact CH2-CG2 4.09Å; W244-I264 HydrophobicContact CZ2-CD1 3.83Å; W244-I264 HydrophobicContact CZ2-CG1 4.38Å; W244-I264 HydrophobicContact CZ2-CG2 4.01Å; V261-I264 HydrophobicContact CG1-CD1 3.89Å; V261-I264 HydrophobicContact CG1-CG1 3.91Å; R262-I264 PolarHBondContact O-N 3.02Å; I264-I266 HydrophobicContact CG2-CG1 4.35Å
265	A	86.8	Confident	80.2	Confident	15 Å²	15	29.4 Å²	29.4	12%	0.124	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	127.8	176.4	0	0	0	0	0	109.6	L118 I122 R123 N190 N263	L118-A265 HydrophobicContact CD1-CB 4.14Å; I122-A265 WeakPolarHBondContact O-CA 3.26Å; R123-A265 HydrophobicContact CG-CB 4.5Å; N190-A265 PolarHBondContact N-O 3.35Å; N190-A265 PolarHBondContact O-N 2.94Å; N263-A265 PolarHBondContact O-N 2.7Å
266	I	88.2	Confident	81.5	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131.2	-178.2	-57.4	165	0	0	0	107.9	G121 I122 F124 Y179 V181 L183 T188 V189 L235 L242 I264	G121-I266 CarbonylContact C-O 3.54Å; G121-I266 WeakPolarHBondContact CA-O 3.3Å; I122-I266 PolarHBondContact N-O 3.09Å; I122-I266 PolarHBondContact O-N 3.46Å; F124-I266 HydrophobicContact CE2-CD1 4.4Å; Y179-I266 HydrophobicContact CD1-CD1 3.52Å; Y179-I266 HydrophobicContact CE1-CD1 3.53Å; V181-I266 HydrophobicContact CG1-CG2 4.23Å; V181-I266 HydrophobicContact CG2-CG2 4.22Å; L183-I266 HydrophobicContact CD2-CG2 4.17Å; T188-I266 CarbonylContact O-C 3.39Å; T188-I266 WeakPolarHBondContact O-CA 3.28Å; V189-I266 HydrophobicContact CB-CG1 4.34Å; V189-I266 HydrophobicContact CG2-CG1 4.15Å; L235-I266 HydrophobicContact CD1-CG2 3.97Å; L242-I266 HydrophobicContact CD1-CD1 3.53Å; L242-I266 HydrophobicContact CD1-CG1 4.06Å; I264-I266 HydrophobicContact CG2-CG1 4.35Å
267	T	84.6	Confident	82.4	Confident	40 Å²	40	28 Å²	28	25%	0.245	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	164.1	175.8	66.4	0	0	0	0	111.2	T120 T188	T120-T267 CarbonylContact O-C 3.59Å; T120-T267 WeakPolarHBondContact O-CA 3.35Å; T188-T267 PolarHBondContact N-OG1 2.89Å; T188-T267 PolarHBondContact O-N 2.87Å; T188-T267 PolarHBondContact O-OG1 2.95Å; T188-T267 PolarHBondContact OG1-OG1 3.35Å
268	G	77.9	Confident	83	Confident	1 Å²	1	25 Å²	25	1%	0.01	14%	0.139	C	C	.	.			trans	98.1	-2.4	-179.6	0	0	0	0	0	115.1	T120 L183 K184 Q185	T120-G268 PolarHBondContact O-N 2.89Å; L183-G268 CarbonylContact C-O 3.52Å; L183-G268 WeakPolarHBondContact CA-O 3.33Å; K184-G268 PolarHBondContact N-O 3.45Å; Q185-G268 PolarHBondContact N-O 2.93Å
269	V	78.6	Confident	83	Confident	13 Å²	13	25.3 Å²	25.3	8%	0.079	14%	0.136	C	C	.	.	S	Bend	trans	-69.4	150.7	163.9	-61.7	0	0	0	0	109	T120 I122 V181 L183 Y271	T120-V269 VanDerWaalsContact C-CG2 3.49Å; T120-V269 CarbonylContact C-O 3.51Å; T120-V269 VanDerWaalsContact CA-O 3.29Å; T120-V269 WeakPolarHBondContact CA-O 3.22Å; T120-V269 VanDerWaalsContact CB-O 3.26Å; T120-V269 WeakPolarHBondContact CB-O 3.37Å; T120-V269 VanDerWaalsContact O-CG2 3.29Å; T120-V269 WeakPolarHBondContact O-CG2 3.19Å; T120-V269 PolarHBondContact O-N 3.41Å; I122-V269 HydrophobicContact CD1-CG1 4.09Å; I122-V269 HydrophobicContact CD1-CG2 4.45Å; I122-V269 HydrophobicContact CG1-CG1 4.44Å; I122-V269 HydrophobicContact CG1-CG2 4.02Å; V181-V269 HydrophobicContact CG2-CG1 3.68Å; L183-V269 HydrophobicContact CD2-CG1 3.71Å; V269-Y271 VanDerWaalsContact C-N 3.32Å; V269-Y271 PolarHBondContact O-N 2.83Å
270	A	66.9	Low	82.9	Confident	10 Å²	10	27.6 Å²	27.6	8%	0.083	15%	0.151	C	C	.	.	S	Bend	trans	-60.7	-41	-173.8	0	0	0	0	0	113	S94 K184	S94-A270 VanDerWaalsContact CA-O 3.25Å; S94-A270 WeakPolarHBondContact CA-O 3.46Å; K184-A270 HydrophobicContact CB-CB 3.96Å; K184-A270 HydrophobicContact CG-CB 3.75Å
271	Y	72.6	Confident	82.8	Confident	48 Å²	48	26.7 Å²	26.7	19%	0.188	15%	0.146	C	C	.	.			trans	-161.9	158.2	-178.4	56.4	-85.1	0	0	0	109.4	Y58 L101 M103 G119 V269	Y58-Y271 AromaticContact CD2-CE1 3.64Å; Y58-Y271 HydrophobicContact CD2-CE1 3.64Å; Y58-Y271 AromaticContact CD2-CZ 3.7Å; Y58-Y271 VanDerWaalsContact CD2-OH 3.22Å; Y58-Y271 WeakPolarHBondContact CD2-OH 3.44Å; Y58-Y271 AromaticContact CE2-CE1 3.69Å; Y58-Y271 HydrophobicContact CE2-CE1 3.69Å; Y58-Y271 AromaticContact CE2-CZ 3.82Å; L101-Y271 HydrophobicContact CB-CD2 3.6Å; L101-Y271 HydrophobicContact CB-CE2 4.45Å; L101-Y271 HydrophobicContact CB-CG 3.67Å; L101-Y271 HydrophobicContact CD2-CD1 3.51Å; L101-Y271 HydrophobicContact CD2-CD2 3.85Å; L101-Y271 HydrophobicContact CD2-CE1 3.92Å; L101-Y271 HydrophobicContact CD2-CE2 4.2Å; L101-Y271 HydrophobicContact CD2-CG 3.52Å; L101-Y271 HydrophobicContact CG-CD2 4.21Å; L101-Y271 HydrophobicContact CG-CG 4.21Å; M103-Y271 HydrophobicContact SD-CE2 3.82Å; G119-Y271 CarbonylContact O-C 3.51Å; G119-Y271 VanDerWaalsContact O-CA 3.32Å; G119-Y271 WeakPolarHBondContact O-CA 3.11Å; V269-Y271 VanDerWaalsContact C-N 3.32Å; V269-Y271 PolarHBondContact O-N 2.83Å
272	T	75.4	Confident	82.6	Confident	8 Å²	8	27.3 Å²	27.3	5%	0.049	15%	0.15	C	C	.	.			trans	-85.8	138.5	151.4	-176.6	0	0	0	0	110.2	F100 L101 S117 G119 E274	F100-T272 HydrophobicContact CB-CG2 3.98Å; L101-T272 PolarHBondContact N-O 2.62Å; S117-T272 WeakPolarHBondContact OG-CG2 3.25Å; G119-T272 PolarHBondContact O-N 2.85Å; T272-E274 VanDerWaalsContact C-N 3.31Å; T272-E274 WeakPolarHBondContact CG2-O 3.4Å; T272-E274 PolarHBondContact OG1-N 2.65Å; T272-E274 PolarHBondContact OG1-O 3.5Å
273	S	73.7	Confident	82.8	Confident	74 Å²	74	28.7 Å²	28.7	52%	0.517	16%	0.156	S	C	.	.	S	Bend	trans	-77.4	-15.8	178.7	47	0	0	0	0	113.5	F100	F100-S273 WeakPolarHBondContact CD2-O 3.21Å
274	E	81.4	Confident	83.2	Confident	100 Å²	100	27.3 Å²	27.3	47%	0.467	15%	0.149	S	C	.	.	S	Bend	trans	-150.2	168.2	175.5	65.7	169.5	151.5	0	0	111.7	R115 T272	R115-E274 IonicContact NH2-OE2 3.51Å; T272-E274 VanDerWaalsContact C-N 3.31Å; T272-E274 WeakPolarHBondContact CG2-O 3.4Å; T272-E274 PolarHBondContact OG1-N 2.65Å; T272-E274 PolarHBondContact OG1-O 3.5Å
275	C	86.6	Confident	83.2	Confident	6 Å²	6	30 Å²	30	4%	0.041	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-92	129.1	169.9	-60.6	0	0	0	0	110.6	F100 C111 R115 Y116	F100-C275 WeakPolarHBondContact CD1-SG 3.13Å; C111-C275 WeakPolarHBondContact CA-SG 3.33Å; C111-C275 HydrophobicContact CB-CB 3.74Å; C111-C275 WeakPolarHBondContact CB-SG 3.11Å; C111-C275 WeakPolarHBondContact SG-CB 3.26Å; C111-C275 CovalentContact SG-SG 2.03Å; C111-C275 PolarHBondContact SG-SG 3.1Å; R115-C275 HydrophobicContact CB-CB 3.7Å; R115-C275 VanDerWaalsContact CZ-O 3.29Å; R115-C275 PolarHBondContact NE-O 2.57Å; R115-C275 PolarHBondContact NH2-O 2.97Å; Y116-C275 CarbonylContact O-C 3.59Å; Y116-C275 WeakPolarHBondContact O-CA 3.44Å
276	F	84.4	Confident	83.3	Confident	56 Å²	56	36.8 Å²	36.8	25%	0.246	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	132	176.8	-57.4	-77.4	0	0	0	109.6	R115 Y116	R115-F276 CarbonylContact C-O 3.48Å; R115-F276 VanDerWaalsContact CA-O 3.25Å; R115-F276 WeakPolarHBondContact CA-O 3.2Å; R115-F276 WeakPolarHBondContact CB-O 3.35Å; Y116-F276 HydrophobicContact CD1-CB 4.11Å; Y116-F276 VanDerWaalsContact CD1-O 3.32Å; Y116-F276 WeakPolarHBondContact CD1-O 3.29Å; Y116-F276 HydrophobicContact CE1-CB 3.72Å; Y116-F276 PolarHBondContact N-O 2.66Å; Y116-F276 PolarHBondContact O-N 2.85Å
277	P	87	Confident	83.4	Confident	34 Å²	34	42.9 Å²	42.9	22%	0.221	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	145.7	173.2	29.8	-34.4	0	0	0	109.9	K279 K303	P277-K279 PolarHBondContact O-N 2.85Å; P277-K303 HydrophobicContact CB-CG 4.09Å; P277-K303 HydrophobicContact CG-CD 4.43Å; P277-K303 HydrophobicContact CG-CG 4.04Å
278	C	87.6	Confident	83.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-57.7	131.3	172.2	-70.7	0	0	0	0	110.6	G114 T282 A284 C292 K303 G304	G114-C278 WeakPolarHBondContact O-CB 3.31Å; G114-C278 PolarHBondContact O-N 3.03Å; G114-C278 PolarHBondContact O-SG 3.33Å; G114-C278 VanDerWaalsContact O-SG 3.37Å; C278-T282 WeakPolarHBondContact CB-OG1 3.35Å; C278-A284 WeakPolarHBondContact SG-CB 3.43Å; C278-C292 WeakPolarHBondContact CA-SG 3.33Å; C278-C292 HydrophobicContact CB-CB 3.74Å; C278-C292 WeakPolarHBondContact CB-SG 3.29Å; C278-C292 WeakPolarHBondContact SG-CB 3.29Å; C278-C292 CovalentContact SG-SG 2.03Å; C278-C292 PolarHBondContact SG-SG 2.78Å; C278-K303 WeakPolarHBondContact O-CA 3.47Å; C278-G304 PolarHBondContact O-N 2.03Å
279	K	83.8	Confident	84	Confident	47 Å²	47	43.4 Å²	43.4	20%	0.204	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-64.2	147.9	178.2	81.3	170.5	-171.2	165.6	0	110.5	D125 E126 D164 P277 G281 T282	D125-K279 PolarHBondContact O-NZ 2.68Å; E126-K279 HydrophobicContact CG-CB 4.21Å; E126-K279 HydrophobicContact CG-CD 4.22Å; E126-K279 WeakPolarHBondContact OE1-CB 3.48Å; D164-K279 IonicContact OD1-NZ 3.77Å; D164-K279 PolarHBondContact OD1-NZ 3.43Å; P277-K279 PolarHBondContact O-N 2.85Å; K279-G281 PolarHBondContact O-N 3.2Å; K279-T282 HydrophobicContact CG-CG2 4.2Å; K279-T282 PolarHBondContact N-OG1 2.78Å; K279-T282 WeakPolarHBondContact O-CA 3.04Å; K279-T282 WeakPolarHBondContact O-CB 3.4Å; K279-T282 PolarHBondContact O-N 3.4Å; K279-T282 PolarHBondContact O-OG1 2.9Å
280	P	85.5	Confident	84.3	Confident	49 Å²	49	44.9 Å²	44.9	32%	0.318	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	140.5	-179.5	-28.7	35.6	0	0	0	112.9	T282 S301 K303 S322	P280-T282 PolarHBondContact O-N 2.78Å; P280-S301 WeakPolarHBondContact CA-O 3.09Å; P280-K303 HydrophobicContact CG-CB 4Å; P280-S322 VanDerWaalsContact CB-CB 3.42Å
281	G	86	Confident	85	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	0.9	-170.8	0	0	0	0	0	115.3	K279 C295 S301 G320 S321	K279-G281 PolarHBondContact O-N 3.2Å; G281-C295 WeakPolarHBondContact O-CB 3.06Å; G281-C295 PolarHBondContact O-N 3.45Å; G281-S301 WeakPolarHBondContact CA-OG 3.31Å; G281-S301 PolarHBondContact N-O 3.31Å; G281-S301 PolarHBondContact N-OG 3.19Å; G281-G320 WeakPolarHBondContact CA-O 3.34Å; G281-G320 WeakPolarHBondContact O-CA 3.25Å; G281-S321 WeakPolarHBondContact CA-O 3.34Å
282	T	87.3	Confident	85.7	Confident	13 Å²	13	49.6 Å²	49.6	8%	0.08	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	161	166.6	73.7	0	0	0	0	112.1	C278 K279 P280 C292 K293 L294 S301	C278-T282 WeakPolarHBondContact CB-OG1 3.35Å; K279-T282 HydrophobicContact CG-CG2 4.2Å; K279-T282 PolarHBondContact N-OG1 2.78Å; K279-T282 WeakPolarHBondContact O-CA 3.04Å; K279-T282 WeakPolarHBondContact O-CB 3.4Å; K279-T282 PolarHBondContact O-N 3.4Å; K279-T282 PolarHBondContact O-OG1 2.9Å; P280-T282 PolarHBondContact O-N 2.78Å; T282-C292 WeakPolarHBondContact OG1-CB 3.38Å; T282-K293 CarbonylContact C-O 3.59Å; T282-K293 WeakPolarHBondContact CA-O 3.42Å; T282-K293 VanDerWaalsContact CB-O 3.29Å; T282-K293 WeakPolarHBondContact CB-O 3.2Å; T282-L294 HydrophobicContact CG2-CD2 4.01Å; T282-L294 HydrophobicContact CG2-CG 4.42Å; T282-S301 PolarHBondContact N-OG 2.8Å; T282-S301 PolarHBondContact O-OG 2.03Å
283	Y	91	Very high	86.2	Confident	57 Å²	57	54.8 Å²	54.8	22%	0.224	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	156.9	-176.6	77	-76.2	0	0	0	112.8	A285 K293 E305 T306 S307 C308	Y283-A285 HydrophobicContact CD2-CB 3.97Å; Y283-A285 HydrophobicContact CE2-CB 3.84Å; Y283-K293 HydrophobicContact CD1-CB 3.91Å; Y283-K293 WeakPolarHBondContact CD1-O 3.5Å; Y283-K293 HydrophobicContact CE1-CB 3.51Å; Y283-K293 PolarHBondContact N-O 3.49Å; Y283-K293 PolarHBondContact O-N 2.81Å; Y283-E305 WeakPolarHBondContact CA-O 3.17Å; Y283-T306 WeakPolarHBondContact CD2-O 3.44Å; Y283-S307 WeakPolarHBondContact CB-O 3.33Å; Y283-C308 WeakPolarHBondContact CD1-SG 3.34Å; Y283-C308 VanDerWaalsContact CE1-SG 3.56Å
284	A	92.2	Very high	86.7	Confident	3 Å²	3	55.2 Å²	55.2	3%	0.025	29%	0.288	C	S	.	.			trans	-133.1	87.8	174.5	0	0	0	0	0	112	G114 C278 K286 E305	G114-A284 PolarHBondContact N-O 2.91Å; C278-A284 WeakPolarHBondContact SG-CB 3.43Å; A284-K286 PolarHBondContact O-N 2.86Å; A284-E305 PolarHBondContact N-O 2.88Å
285	A	88.9	Confident	87	Confident	57 Å²	57	50.5 Å²	50.5	47%	0.471	27%	0.266	S	S	.	.			trans	-74.1	21.5	-178.2	0	0	0	0	0	115.6	Y283 T306	Y283-A285 HydrophobicContact CD2-CB 3.97Å; Y283-A285 HydrophobicContact CE2-CB 3.84Å; A285-T306 WeakPolarHBondContact CA-O 3.19Å; A285-T306 WeakPolarHBondContact CB-O 3.46Å; A285-T306 PolarHBondContact N-O 3.24Å
286	K	88.8	Confident	87	Confident	156 Å²	156	53.9 Å²	53.9	68%	0.678	29%	0.288	S	S	*	.	S	Bend	trans	-148.2	135.5	177.9	-70.7	-166.2	174.7	-168.4	0	110.9	A284 S289	A284-K286 PolarHBondContact O-N 2.86Å; K286-S289 PolarHBondContact O-N 2.92Å; K286-S289 PolarHBondContact O-OG 2.72Å
287	Q	90.4	Very high	86.8	Confident	129 Å²	129	53.8 Å²	53.8	60%	0.603	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	142.3	163	-158.5	-179.2	7.6	0	0	109.7	P110 C111	P110-Q287 HydrophobicContact CB-CG 4.29Å; P110-Q287 HydrophobicContact CG-CG 4.41Å; C111-Q287 CarbonylContact O-C 3.55Å; C111-Q287 VanDerWaalsContact O-CA 3.26Å; C111-Q287 WeakPolarHBondContact O-CA 3.46Å; C111-Q287 WeakPolarHBondContact O-CG 3.38Å
288	G	87.8	Confident	86.7	Confident	31 Å²	31	56 Å²	56	32%	0.32	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	23.8	-176.8	0	0	0	0	0	114.9	G98 C111	G98-G288 WeakPolarHBondContact CA-O 3.25Å; G98-G288 WeakPolarHBondContact O-CA 3.5Å; C111-G288 PolarHBondContact O-N 2.9Å
289	S	88.1	Confident	86.8	Confident	20 Å²	20	56.4 Å²	56.4	14%	0.14	31%	0.31	C	S	.	.			trans	-70.3	129.8	178	-70.7	0	0	0	0	112	Y116 S117 K286	Y116-S289 WeakPolarHBondContact CA-O 3.29Å; Y116-S289 WeakPolarHBondContact CB-O 3.29Å; S117-S289 PolarHBondContact N-O 3.41Å; K286-S289 PolarHBondContact O-N 2.92Å; K286-S289 PolarHBondContact O-OG 2.72Å
290	S	84.6	Confident	87.1	Confident	45 Å²	45	57.5 Å²	57.5	32%	0.315	31%	0.313	S	S	.	.	S	Bend	trans	-90	-12.1	175.3	54.5	0	0	0	0	114.3	S117	S117-S290 WeakPolarHBondContact O-CA 3.34Å
291	F	82.8	Confident	87.5	Confident	130 Å²	130	55.1 Å²	55.1	57%	0.57	30%	0.298	S	S	*	.	S	Bend	trans	-154	157.7	175.7	67.1	-83.6	0	0	0	110.8	K293	F291-K293 HydrophobicContact CE2-CG 4.04Å
292	C	86.8	Confident	87.6	Confident	27 Å²	27	58.9 Å²	58.9	18%	0.182	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-95.2	146.8	175.2	-57	0	0	0	0	111.5	Y116 C278 T282	Y116-C292 WeakPolarHBondContact CD1-SG 3.32Å; C278-C292 WeakPolarHBondContact CA-SG 3.33Å; C278-C292 HydrophobicContact CB-CB 3.74Å; C278-C292 WeakPolarHBondContact CB-SG 3.29Å; C278-C292 WeakPolarHBondContact SG-CB 3.29Å; C278-C292 CovalentContact SG-SG 2.03Å; C278-C292 PolarHBondContact SG-SG 2.78Å; T282-C292 WeakPolarHBondContact OG1-CB 3.38Å
293	K	86.3	Confident	87.7	Confident	117 Å²	117	63.6 Å²	63.6	51%	0.509	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	141.5	178.5	-68	-179.9	178.7	-176.3	0	110.6	T282 Y283 F291	T282-K293 CarbonylContact C-O 3.59Å; T282-K293 WeakPolarHBondContact CA-O 3.42Å; T282-K293 VanDerWaalsContact CB-O 3.29Å; T282-K293 WeakPolarHBondContact CB-O 3.2Å; Y283-K293 HydrophobicContact CD1-CB 3.91Å; Y283-K293 WeakPolarHBondContact CD1-O 3.5Å; Y283-K293 HydrophobicContact CE1-CB 3.51Å; Y283-K293 PolarHBondContact N-O 3.49Å; Y283-K293 PolarHBondContact O-N 2.81Å; F291-K293 HydrophobicContact CE2-CG 4.04Å
294	L	83.8	Confident	87.5	Confident	83 Å²	83	62.1 Å²	62.1	44%	0.435	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	138.3	173.8	-76	157.7	0	0	0	111.5	T282 F443	T282-L294 HydrophobicContact CG2-CD2 4.01Å; T282-L294 HydrophobicContact CG2-CG 4.42Å; L294-F443 HydrophobicContact CD1-CE2 4.3Å; L294-F443 HydrophobicContact CD1-CZ 4.07Å
295	C	87.7	Confident	87.4	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.007	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-70.8	141.4	172.1	-72.9	0	0	0	0	112.4	G281 S301 C308 K319 G320	G281-C295 WeakPolarHBondContact O-CB 3.06Å; G281-C295 PolarHBondContact O-N 3.45Å; C295-S301 PolarHBondContact SG-OG 3.3Å; C295-S301 VanDerWaalsContact SG-OG 3.41Å; C295-C308 WeakPolarHBondContact CA-SG 3.26Å; C295-C308 HydrophobicContact CB-CB 3.79Å; C295-C308 WeakPolarHBondContact CB-SG 3.46Å; C295-C308 WeakPolarHBondContact SG-CB 3.24Å; C295-C308 CovalentContact SG-SG 2.04Å; C295-C308 PolarHBondContact SG-SG 3.45Å; C295-K319 CarbonylContact O-C 3.59Å; C295-K319 WeakPolarHBondContact O-CG 3.31Å; C295-G320 PolarHBondContact O-N 2.81Å
296	P	86.4	Confident	87.5	Confident	76 Å²	76	63.8 Å²	63.8	49%	0.494	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-67.8	161.1	173.8	28.2	-33.5	0	0	0	112.1	S299	P296-S299 VanDerWaalsContact CD-OG 3.23Å; P296-S299 WeakPolarHBondContact CD-OG 2.99Å; P296-S299 WeakPolarHBondContact CG-OG 3.27Å; P296-S299 PolarHBondContact O-N 3.04Å; P296-S299 VanDerWaalsContact O-N 3.16Å; P296-S299 PolarHBondContact O-OG 2.88Å
297	A	80.6	Confident	87.7	Confident	54 Å²	54	58.6 Å²	58.6	45%	0.446	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	148.5	177	0	0	0	0	0	112.1	S299	A297-S299 PolarHBondContact O-N 2.85Å
298	N	84.4	Confident	87.9	Confident	80 Å²	80	53.9 Å²	53.9	43%	0.428	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	22.6	-166.3	-46.4	-69.4	0	0	0	114.5	C311 S317	N298-C311 PolarHBondContact O-N 3.1Å; N298-S317 WeakPolarHBondContact CA-OG 3.4Å; N298-S317 PolarHBondContact N-O 2.62Å; N298-S317 PolarHBondContact N-OG 3.5Å; N298-S317 VanDerWaalsContact N-OG 3.12Å
299	S	89.9	Confident	88.1	Confident	9 Å²	9	55.5 Å²	55.5	6%	0.063	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	160.4	161.5	73.2	0	0	0	0	111.3	P296 A297 C308 H309 S317	P296-S299 VanDerWaalsContact CD-OG 3.23Å; P296-S299 WeakPolarHBondContact CD-OG 2.99Å; P296-S299 WeakPolarHBondContact CG-OG 3.27Å; P296-S299 PolarHBondContact O-N 3.04Å; P296-S299 VanDerWaalsContact O-N 3.16Å; P296-S299 PolarHBondContact O-OG 2.88Å; A297-S299 PolarHBondContact O-N 2.85Å; S299-C308 WeakPolarHBondContact OG-CB 3.29Å; S299-H309 CarbonylContact C-O 3.56Å; S299-H309 WeakPolarHBondContact CA-O 3.1Å; S299-H309 VanDerWaalsContact CB-O 3.25Å; S299-H309 WeakPolarHBondContact CB-O 3.32Å; S299-S317 VanDerWaalsContact C-OG 3.3Å; S299-S317 PolarHBondContact N-OG 3.48Å; S299-S317 PolarHBondContact O-OG 3Å
300	Y	90.4	Very high	88.3	Confident	70 Å²	70	59.4 Å²	59.4	28%	0.275	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	164.3	179.8	74	-74.7	0	0	0	111	C308 H309 S321 S322 C324	Y300-C308 CarbonylContact O-C 3.58Å; Y300-C308 WeakPolarHBondContact O-CA 3.02Å; Y300-H309 HydrophobicContact CD1-CB 4Å; Y300-H309 WeakPolarHBondContact CD1-O 3.39Å; Y300-H309 HydrophobicContact CE1-CB 3.56Å; Y300-H309 PolarHBondContact N-O 2.87Å; Y300-H309 PolarHBondContact O-N 2.89Å; Y300-S321 WeakPolarHBondContact CA-O 3.31Å; Y300-S322 WeakPolarHBondContact CD2-O 3.4Å; Y300-C324 WeakPolarHBondContact CD1-SG 3.46Å
301	S	92.8	Very high	88.6	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.321	C	S	.	.			trans	-145.3	145.8	168.9	64.7	0	0	0	0	112	P280 G281 T282 C295	P280-S301 WeakPolarHBondContact CA-O 3.09Å; G281-S301 WeakPolarHBondContact CA-OG 3.31Å; G281-S301 PolarHBondContact N-O 3.31Å; G281-S301 PolarHBondContact N-OG 3.19Å; T282-S301 PolarHBondContact N-OG 2.8Å; T282-S301 PolarHBondContact O-OG 2.03Å; C295-S301 PolarHBondContact SG-OG 3.3Å; C295-S301 VanDerWaalsContact SG-OG 3.41Å
302	N	89.1	Confident	88.9	Confident	79 Å²	79	56.5 Å²	56.5	42%	0.422	32%	0.318	S	S	.	.			trans	-81.1	176.6	174	-53.6	-71.6	0	0	0	110.7	G304 E305	N302-G304 PolarHBondContact O-N 2.98Å; N302-E305 PolarHBondContact N-OE2 2.84Å; N302-E305 PolarHBondContact ND2-OE2 2.74Å; N302-E305 WeakPolarHBondContact O-CB 3.29Å; N302-E305 PolarHBondContact O-N 3.12Å
303	K	88	Confident	88.6	Confident	111 Å²	111	60 Å²	60	48%	0.483	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	123	173.8	-166.2	158	-172.8	149.3	0	109.9	E126 P277 C278 P280	E126-K303 WeakPolarHBondContact OE1-CE 3.09Å; E126-K303 IonicContact OE1-NZ 2.84Å; E126-K303 PolarHBondContact OE1-NZ 3.47Å; E126-K303 IonicContact OE2-NZ 2.6Å; E126-K303 PolarHBondContact OE2-NZ 2.53Å; P277-K303 HydrophobicContact CB-CG 4.09Å; P277-K303 HydrophobicContact CG-CD 4.43Å; P277-K303 HydrophobicContact CG-CG 4.04Å; C278-K303 WeakPolarHBondContact O-CA 3.47Å; P280-K303 HydrophobicContact CG-CB 4Å
304	G	87.7	Confident	88.5	Confident	26 Å²	26	58.4 Å²	58.4	27%	0.268	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	19	178.5	0	0	0	0	0	116.1	G114 C278 N302	G114-G304 WeakPolarHBondContact CA-O 2.99Å; G114-G304 CarbonylContact O-C 3.58Å; G114-G304 VanDerWaalsContact O-CA 3.29Å; G114-G304 WeakPolarHBondContact O-CA 3.43Å; C278-G304 PolarHBondContact O-N 2.03Å; N302-G304 PolarHBondContact O-N 2.98Å
305	E	89.9	Confident	88.7	Confident	41 Å²	41	57.3 Å²	57.3	19%	0.192	34%	0.337	C	S	.	.			trans	-78.7	144.3	-173.3	-160.5	75.1	-123.7	0	0	114	G114 Y283 A284 N302 S307 H309	G114-E305 VanDerWaalsContact CA-O 3.27Å; G114-E305 WeakPolarHBondContact CA-O 3.02Å; Y283-E305 WeakPolarHBondContact CA-O 3.17Å; A284-E305 PolarHBondContact N-O 2.88Å; N302-E305 PolarHBondContact N-OE2 2.84Å; N302-E305 PolarHBondContact ND2-OE2 2.74Å; N302-E305 WeakPolarHBondContact O-CB 3.29Å; N302-E305 PolarHBondContact O-N 3.12Å; E305-S307 WeakPolarHBondContact CG-O 3.42Å; E305-H309 IonicContact OE1-CD2 3.91Å; E305-H309 IonicContact OE1-CE1 3.46Å; E305-H309 IonicContact OE1-NE2 3.91Å; E305-H309 PolarHBondContact OE1-NE2 2.91Å; E305-H309 IonicContact OE2-CD2 2.76Å; E305-H309 IonicContact OE2-NE2 3.02Å
306	T	92.1	Very high	88.6	Confident	54 Å²	54	58.6 Å²	58.6	33%	0.331	34%	0.342	S	S	.	.	S	Bend	trans	-86.7	-15.3	179.5	70.9	0	0	0	0	113.7	E113 Y283 A285	E113-T306 HydrophobicContact CB-CG2 3.51Å; Y283-T306 WeakPolarHBondContact CD2-O 3.44Å; A285-T306 WeakPolarHBondContact CA-O 3.19Å; A285-T306 WeakPolarHBondContact CB-O 3.46Å; A285-T306 PolarHBondContact N-O 3.24Å
307	S	92.8	Very high	88.5	Confident	48 Å²	48	55.2 Å²	55.2	34%	0.336	32%	0.32	S	S	.	.	S	Bend	trans	-149.2	-172.8	-178.8	64.9	0	0	0	0	111	Y283 E305	Y283-S307 WeakPolarHBondContact CB-O 3.33Å; E305-S307 WeakPolarHBondContact CG-O 3.42Å
308	C	93.6	Very high	88.3	Confident	30 Å²	30	55.8 Å²	55.8	20%	0.203	31%	0.314	C	S	.	.			trans	-116.1	126.1	173.6	-56.2	0	0	0	0	109.3	Y283 C295 S299 Y300	Y283-C308 WeakPolarHBondContact CD1-SG 3.34Å; Y283-C308 VanDerWaalsContact CE1-SG 3.56Å; C295-C308 WeakPolarHBondContact CA-SG 3.26Å; C295-C308 HydrophobicContact CB-CB 3.79Å; C295-C308 WeakPolarHBondContact CB-SG 3.46Å; C295-C308 WeakPolarHBondContact SG-CB 3.24Å; C295-C308 CovalentContact SG-SG 2.04Å; C295-C308 PolarHBondContact SG-SG 3.45Å; S299-C308 WeakPolarHBondContact OG-CB 3.29Å; Y300-C308 CarbonylContact O-C 3.58Å; Y300-C308 WeakPolarHBondContact O-CA 3.02Å
309	H	92.4	Very high	87.9	Confident	65 Å²	65	57.2 Å²	57.2	30%	0.301	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	131	179.7	-63	-65.7	0	0	0	109.5	S299 Y300 E305	S299-H309 CarbonylContact C-O 3.56Å; S299-H309 WeakPolarHBondContact CA-O 3.1Å; S299-H309 VanDerWaalsContact CB-O 3.25Å; S299-H309 WeakPolarHBondContact CB-O 3.32Å; Y300-H309 HydrophobicContact CD1-CB 4Å; Y300-H309 WeakPolarHBondContact CD1-O 3.39Å; Y300-H309 HydrophobicContact CE1-CB 3.56Å; Y300-H309 PolarHBondContact N-O 2.87Å; Y300-H309 PolarHBondContact O-N 2.89Å; E305-H309 IonicContact OE1-CD2 3.91Å; E305-H309 IonicContact OE1-CE1 3.46Å; E305-H309 IonicContact OE1-NE2 3.91Å; E305-H309 PolarHBondContact OE1-NE2 2.91Å; E305-H309 IonicContact OE2-CD2 2.76Å; E305-H309 IonicContact OE2-NE2 3.02Å
310	P	92.6	Very high	87.5	Confident	102 Å²	102	57.9 Å²	57.9	66%	0.662	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	147.7	177	29.2	-34.6	0	0	0	110.8
311	C	89.6	Confident	87.1	Confident	21 Å²	21	55.5 Å²	55.5	14%	0.142	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-74.4	148.6	168	-64.4	0	0	0	0	111.3	N298 K315 S317 C324	N298-C311 PolarHBondContact O-N 3.1Å; C311-K315 HydrophobicContact CB-CB 4.21Å; C311-S317 VanDerWaalsContact SG-CB 3.57Å; C311-S317 PolarHBondContact SG-OG 2.89Å; C311-C324 WeakPolarHBondContact CA-SG 3.37Å; C311-C324 HydrophobicContact CB-CB 3.86Å; C311-C324 WeakPolarHBondContact CB-SG 3.36Å; C311-C324 WeakPolarHBondContact SG-CB 3.48Å; C311-C324 CovalentContact SG-SG 2.04Å; C311-C324 PolarHBondContact SG-SG 3.11Å
312	D	89.1	Confident	86.6	Confident	93 Å²	93	57.9 Å²	57.9	50%	0.497	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-59.8	157.2	167.9	-53.5	-67.6	0	0	0	111.7	D314 K315	D312-D314 VanDerWaalsContact C-N 3.27Å; D312-D314 WeakPolarHBondContact CB-OD1 3.32Å; D312-D314 PolarHBondContact O-N 3.17Å; D312-K315 HydrophobicContact CB-CD 4.01Å; D312-K315 HydrophobicContact CB-CG 4.41Å; D312-K315 WeakPolarHBondContact O-CA 3.41Å; D312-K315 WeakPolarHBondContact O-CB 3.25Å; D312-K315 PolarHBondContact O-N 2.88Å; D312-K315 WeakPolarHBondContact OD2-CE 3.49Å; D312-K315 IonicContact OD2-NZ 2.67Å; D312-K315 PolarHBondContact OD2-NZ 2.73Å
313	A	82	Confident	86.5	Confident	100 Å²	100	57.9 Å²	57.9	83%	0.826	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-26.4	-174.6	0	0	0	0	0	114.1	K315	A313-K315 PolarHBondContact O-N 2.81Å
314	D	83.5	Confident	86.6	Confident	84 Å²	84	54.3 Å²	54.3	45%	0.449	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	5.2	172.3	67.4	-56.5	0	0	0	113.1	D312 R327	D312-D314 VanDerWaalsContact C-N 3.27Å; D312-D314 WeakPolarHBondContact CB-OD1 3.32Å; D312-D314 PolarHBondContact O-N 3.17Å; D314-R327 WeakPolarHBondContact O-CB 3.01Å; D314-R327 PolarHBondContact O-N 3.18Å
315	K	87.3	Confident	86.5	Confident	60 Å²	60	56.1 Å²	56.1	26%	0.261	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	177	-174.2	-61.8	170.1	-158.5	164.2	0	111.4	C311 D312 A313 C324 K325 R327	C311-K315 HydrophobicContact CB-CB 4.21Å; D312-K315 HydrophobicContact CB-CD 4.01Å; D312-K315 HydrophobicContact CB-CG 4.41Å; D312-K315 WeakPolarHBondContact O-CA 3.41Å; D312-K315 WeakPolarHBondContact O-CB 3.25Å; D312-K315 PolarHBondContact O-N 2.88Å; D312-K315 WeakPolarHBondContact OD2-CE 3.49Å; D312-K315 IonicContact OD2-NZ 2.67Å; D312-K315 PolarHBondContact OD2-NZ 2.73Å; A313-K315 PolarHBondContact O-N 2.81Å; K315-C324 HydrophobicContact CB-CB 4.02Å; K315-C324 HydrophobicContact CD-CB 4.25Å; K315-K325 CarbonylContact C-O 3.5Å; K315-K325 VanDerWaalsContact CA-O 3.22Å; K315-K325 WeakPolarHBondContact CA-O 3.48Å; K315-K325 VanDerWaalsContact CB-O 3.31Å; K315-K325 WeakPolarHBondContact CB-O 3.05Å; K315-R327 PolarHBondContact O-NE 3.39Å; K315-R327 PolarHBondContact O-NH2 3.48Å; K315-R327 VanDerWaalsContact O-NH2 3.1Å
316	Y	85.6	Confident	86.4	Confident	28 Å²	28	59.2 Å²	59.2	11%	0.11	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	164.6	171.9	77.4	-80.8	0	0	0	110.3	C324 K325 V326 I359	Y316-C324 CarbonylContact O-C 3.56Å; Y316-C324 WeakPolarHBondContact O-CA 3.43Å; Y316-K325 HydrophobicContact CD1-CB 4.06Å; Y316-K325 WeakPolarHBondContact CD1-O 3.22Å; Y316-K325 HydrophobicContact CE1-CB 3.54Å; Y316-K325 HydrophobicContact CE1-CD 4.43Å; Y316-K325 HydrophobicContact CE2-CB 4.42Å; Y316-K325 HydrophobicContact CE2-CD 4.16Å; Y316-K325 PolarHBondContact N-O 2.89Å; Y316-K325 PolarHBondContact O-N 2.97Å; Y316-K325 WeakPolarHBondContact OH-CD 3.48Å; Y316-V326 WeakPolarHBondContact CE1-O 3.22Å; Y316-I359 HydrophobicContact CD1-CG2 4.02Å; Y316-I359 HydrophobicContact CD2-CG1 4.21Å; Y316-I359 HydrophobicContact CD2-CG2 4.07Å; Y316-I359 HydrophobicContact CE1-CG2 3.62Å; Y316-I359 HydrophobicContact CE2-CB 4.49Å; Y316-I359 HydrophobicContact CE2-CD1 4.31Å; Y316-I359 HydrophobicContact CE2-CG1 4.09Å; Y316-I359 HydrophobicContact CE2-CG2 3.69Å; Y316-I359 HydrophobicContact CG-CG2 4.22Å; Y316-I359 VanDerWaalsContact CZ-CG2 3.43Å
317	S	84.7	Confident	86.1	Confident	5 Å²	5	59 Å²	59	4%	0.035	34%	0.341	C	S	.	.			trans	-145.1	150.8	166.5	66.4	0	0	0	0	110.8	N298 S299 C311	N298-S317 WeakPolarHBondContact CA-OG 3.4Å; N298-S317 PolarHBondContact N-O 2.62Å; N298-S317 PolarHBondContact N-OG 3.5Å; N298-S317 VanDerWaalsContact N-OG 3.12Å; S299-S317 VanDerWaalsContact C-OG 3.3Å; S299-S317 PolarHBondContact N-OG 3.48Å; S299-S317 PolarHBondContact O-OG 3Å; C311-S317 VanDerWaalsContact SG-CB 3.57Å; C311-S317 PolarHBondContact SG-OG 2.89Å
318	E	76.1	Confident	85.9	Confident	66 Å²	66	59.5 Å²	59.5	31%	0.308	34%	0.343	S	S	.	.			trans	-76.8	158.9	171	-69.9	149.1	-116.4	0	0	110.3	G320 S321 K325	E318-G320 PolarHBondContact O-N 2.91Å; E318-S321 VanDerWaalsContact O-CB 3.25Å; E318-S321 WeakPolarHBondContact O-CB 3.02Å; E318-S321 PolarHBondContact O-N 3.49Å; E318-S321 VanDerWaalsContact O-N 3.1Å; E318-K325 IonicContact OE1-NZ 3.99Å; E318-K325 PolarHBondContact OE1-NZ 2.9Å
319	K	77.6	Confident	85.7	Confident	110 Å²	110	59.6 Å²	59.6	48%	0.478	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	125.3	176.9	179.3	-165.7	173.2	-166.5	0	109.2	C295 F443	C295-K319 CarbonylContact O-C 3.59Å; C295-K319 WeakPolarHBondContact O-CG 3.31Å; K319-F443 VanDerWaalsContact NZ-CZ 3.33Å
320	G	79.8	Confident	85.6	Confident	22 Å²	22	56.5 Å²	56.5	23%	0.227	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	20	-176.9	0	0	0	0	0	114.8	G281 C295 E318	G281-G320 WeakPolarHBondContact CA-O 3.34Å; G281-G320 WeakPolarHBondContact O-CA 3.25Å; C295-G320 PolarHBondContact O-N 2.81Å; E318-G320 PolarHBondContact O-N 2.91Å
321	S	82	Confident	85.4	Confident	20 Å²	20	54.3 Å²	54.3	14%	0.14	32%	0.317	C	S	.	.			trans	-81.8	145.4	179	-161.2	0	0	0	0	113.5	G281 Y300 E318 T323	G281-S321 WeakPolarHBondContact CA-O 3.34Å; Y300-S321 WeakPolarHBondContact CA-O 3.31Å; E318-S321 VanDerWaalsContact O-CB 3.25Å; E318-S321 WeakPolarHBondContact O-CB 3.02Å; E318-S321 PolarHBondContact O-N 3.49Å; E318-S321 VanDerWaalsContact O-N 3.1Å; S321-T323 PolarHBondContact OG-O 2.85Å
322	S	84	Confident	85.1	Confident	50 Å²	50	58.2 Å²	58.2	35%	0.35	34%	0.336	S	S	.	.	S	Bend	trans	-75.9	-20.1	174.6	59.1	0	0	0	0	114.3	P280 Y300	P280-S322 VanDerWaalsContact CB-CB 3.42Å; Y300-S322 WeakPolarHBondContact CD2-O 3.4Å
323	T	87.1	Confident	84.8	Confident	79 Å²	79	57.8 Å²	57.8	49%	0.485	33%	0.33	S	S	.	.	S	Bend	trans	-150	158.6	-169.4	49.2	0	0	0	0	111.8	S321	S321-T323 PolarHBondContact OG-O 2.85Å
324	C	89.8	Confident	84.9	Confident	36 Å²	36	53.9 Å²	53.9	24%	0.243	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-92.4	129.1	170.9	-58.2	0	0	0	0	110.8	Y300 C311 K315 Y316	Y300-C324 WeakPolarHBondContact CD1-SG 3.46Å; C311-C324 WeakPolarHBondContact CA-SG 3.37Å; C311-C324 HydrophobicContact CB-CB 3.86Å; C311-C324 WeakPolarHBondContact CB-SG 3.36Å; C311-C324 WeakPolarHBondContact SG-CB 3.48Å; C311-C324 CovalentContact SG-SG 2.04Å; C311-C324 PolarHBondContact SG-SG 3.11Å; K315-C324 HydrophobicContact CB-CB 4.02Å; K315-C324 HydrophobicContact CD-CB 4.25Å; Y316-C324 CarbonylContact O-C 3.56Å; Y316-C324 WeakPolarHBondContact O-CA 3.43Å
325	K	85.7	Confident	85.1	Confident	64 Å²	64	52 Å²	52	28%	0.278	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	148.6	171.2	-63.7	172.2	-178	174.2	0	109.2	K315 Y316 E318 T561	K315-K325 CarbonylContact C-O 3.5Å; K315-K325 VanDerWaalsContact CA-O 3.22Å; K315-K325 WeakPolarHBondContact CA-O 3.48Å; K315-K325 VanDerWaalsContact CB-O 3.31Å; K315-K325 WeakPolarHBondContact CB-O 3.05Å; Y316-K325 HydrophobicContact CD1-CB 4.06Å; Y316-K325 WeakPolarHBondContact CD1-O 3.22Å; Y316-K325 HydrophobicContact CE1-CB 3.54Å; Y316-K325 HydrophobicContact CE1-CD 4.43Å; Y316-K325 HydrophobicContact CE2-CB 4.42Å; Y316-K325 HydrophobicContact CE2-CD 4.16Å; Y316-K325 PolarHBondContact N-O 2.89Å; Y316-K325 PolarHBondContact O-N 2.97Å; Y316-K325 WeakPolarHBondContact OH-CD 3.48Å; E318-K325 IonicContact OE1-NZ 3.99Å; E318-K325 PolarHBondContact OE1-NZ 2.9Å; K325-T561 PolarHBondContact NZ-OG1 3Å
326	V	86.9	Confident	85.2	Confident	107 Å²	107	50 Å²	50	65%	0.648	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.6	138.6	174.5	-179.9	0	0	0	0	110	Y316 P328	Y316-V326 WeakPolarHBondContact CE1-O 3.22Å; V326-P328 WeakPolarHBondContact O-CD 3.3Å
327	R	87	Confident	85.3	Confident	49 Å²	49	52.3 Å²	52.3	19%	0.185	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-73.1	117.2	179.3	-179.7	162.2	-63.1	-93.2	-2.1	110.1	D314 K315 K358 I359 C360 L364	D314-R327 WeakPolarHBondContact O-CB 3.01Å; D314-R327 PolarHBondContact O-N 3.18Å; K315-R327 PolarHBondContact O-NE 3.39Å; K315-R327 PolarHBondContact O-NH2 3.48Å; K315-R327 VanDerWaalsContact O-NH2 3.1Å; R327-K358 PolarHBondContact NH1-O 2.79Å; R327-I359 WeakPolarHBondContact CG-O 3.36Å; R327-I359 PolarHBondContact NH1-O 3.01Å; R327-C360 PolarHBondContact NH1-O 2.92Å; R327-L364 WeakPolarHBondContact O-CD1 3.27Å
328	P	87.9	Confident	85.6	Confident	59 Å²	59	52.1 Å²	52.1	38%	0.383	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-73.8	157	177.3	31	-34.8	0	0	0	111.6	V326 I359 C360 G361	V326-P328 WeakPolarHBondContact O-CD 3.3Å; P328-I359 HydrophobicContact CG-CG2 4.26Å; P328-C360 HydrophobicContact CG-CB 4.4Å; P328-C360 CarbonylContact O-C 3.46Å; P328-C360 WeakPolarHBondContact O-CA 3.03Å; P328-C360 WeakPolarHBondContact O-CB 3.41Å; P328-G361 PolarHBondContact O-N 2.98Å
329	A	89.1	Confident	86.1	Confident	31 Å²	31	50.9 Å²	50.9	26%	0.256	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-62	139.6	166.4	0	0	0	0	0	110.3	L364 A367	A329-L364 HydrophobicContact CB-CB 3.93Å; A329-L364 HydrophobicContact CB-CD1 4.41Å; A329-A367 HydrophobicContact CB-CB 3.96Å
330	C	89.9	Confident	86.6	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.007	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-65.2	139.4	179.7	-67.8	0	0	0	0	112.4	W354 C360 G361 V368	C330-W354 HydrophobicContact CB-CH2 3.6Å; C330-W354 HydrophobicContact CB-CZ2 4.45Å; C330-W354 HydrophobicContact CB-CZ3 3.84Å; C330-C360 VanDerWaalsContact CA-CB 3.49Å; C330-C360 WeakPolarHBondContact CA-SG 3.39Å; C330-C360 HydrophobicContact CB-CB 3.78Å; C330-C360 WeakPolarHBondContact CB-SG 3.44Å; C330-C360 VanDerWaalsContact SG-C 3.55Å; C330-C360 WeakPolarHBondContact SG-CB 3.33Å; C330-C360 CovalentContact SG-SG 2.04Å; C330-C360 PolarHBondContact SG-SG 3.13Å; C330-G361 PolarHBondContact N-O 3.38Å; C330-G361 PolarHBondContact SG-N 2.87Å; C330-G361 PolarHBondContact SG-O 3.18Å; C330-G361 VanDerWaalsContact SG-O 3.36Å; C330-V368 WeakPolarHBondContact CB-O 3.38Å; C330-V368 PolarHBondContact O-N 3.17Å
331	T	88.7	Confident	86.9	Confident	55 Å²	55	49 Å²	49	34%	0.337	28%	0.275	S	S	.	.			trans	-118.9	174.2	-179.5	65	0	0	0	0	112	K333 D334	T331-K333 PolarHBondContact O-N 2.91Å; T331-K333 PolarHBondContact OG1-N 2.91Å; T331-D334 PolarHBondContact N-OD2 2.84Å; T331-D334 PolarHBondContact O-N 3.03Å; T331-D334 VanDerWaalsContact O-N 3.15Å; T331-D334 PolarHBondContact OG1-OD2 2.76Å
332	D	84.6	Confident	87	Confident	104 Å²	104	49.2 Å²	49.2	56%	0.556	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.5	169.6	62.9	-28.7	0	0	0	113.6
333	K	81.8	Confident	87	Confident	83 Å²	83	49 Å²	49	36%	0.361	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-16.4	174.5	-58.9	-175.6	178.9	-172.3	0	114.2	T331 T566	T331-K333 PolarHBondContact O-N 2.91Å; T331-K333 PolarHBondContact OG1-N 2.91Å; K333-T566 HydrophobicContact CB-CG2 4.23Å; K333-T566 WeakPolarHBondContact CB-OG1 3.14Å
334	D	85.3	Confident	86.8	Confident	18 Å²	18	48.5 Å²	48.5	10%	0.096	28%	0.275	C	S	.	.	S	Bend	trans	-85.1	-10.4	-176.7	-72.5	-73.6	0	0	0	113.3	T331 W354 A355	T331-D334 PolarHBondContact N-OD2 2.84Å; T331-D334 PolarHBondContact O-N 3.03Å; T331-D334 VanDerWaalsContact O-N 3.15Å; T331-D334 PolarHBondContact OG1-OD2 2.76Å; D334-W354 HydrophobicContact CB-CE3 4.04Å; D334-W354 HydrophobicContact CB-CZ3 3.79Å; D334-A355 VanDerWaalsContact O-CB 3.25Å; D334-A355 WeakPolarHBondContact O-CB 3.49Å; D334-A355 PolarHBondContact O-N 3.12Å
335	Y	87.6	Confident	86.4	Confident	45 Å²	45	52.7 Å²	52.7	18%	0.176	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	162.9	172.7	63.4	-108.5	0	0	0	111.9	Y352 K353 W354 V368 L370 P371	Y335-Y352 AromaticContact CD2-CD1 3.63Å; Y335-Y352 HydrophobicContact CD2-CD1 3.63Å; Y335-Y352 HydrophobicContact CD2-CE1 4.3Å; Y335-Y352 HydrophobicContact CD2-CG 4.46Å; Y335-Y352 AromaticContact CE2-CD1 3.69Å; Y335-Y352 HydrophobicContact CE2-CD1 3.69Å; Y335-Y352 AromaticContact CE2-CE1 3.92Å; Y335-Y352 HydrophobicContact CE2-CE1 3.92Å; Y335-K353 CarbonylContact C-O 3.52Å; Y335-K353 VanDerWaalsContact CA-O 3.23Å; Y335-K353 WeakPolarHBondContact CA-O 3.41Å; Y335-K353 VanDerWaalsContact CB-O 3.29Å; Y335-K353 WeakPolarHBondContact CB-O 3.22Å; Y335-W354 HydrophobicContact CD1-CE3 4.49Å; Y335-W354 HydrophobicContact CD1-CH2 4.16Å; Y335-W354 AromaticContact CD1-CZ3 3.81Å; Y335-W354 HydrophobicContact CD1-CZ3 3.81Å; Y335-W354 HydrophobicContact CG-CZ3 4.44Å; Y335-V368 HydrophobicContact CE1-CG1 3.97Å; Y335-L370 HydrophobicContact CD1-CD1 4.41Å; Y335-L370 HydrophobicContact CG-CD1 4.18Å; Y335-P371 HydrophobicContact CE1-CG 3.86Å; Y335-P371 HydrophobicContact CE2-CG 3.99Å
336	F	87.8	Confident	86.3	Confident	19 Å²	19	50 Å²	50	8%	0.083	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	165.6	170.4	65.2	-89.1	0	0	0	109.9	Y352 K353 A355 E452 V462	F336-Y352 CarbonylContact O-C 3.55Å; F336-Y352 WeakPolarHBondContact O-CA 3.37Å; F336-K353 HydrophobicContact CD1-CB 4.38Å; F336-K353 HydrophobicContact CD2-CB 4.44Å; F336-K353 HydrophobicContact CE1-CB 3.85Å; F336-K353 HydrophobicContact CE2-CB 3.91Å; F336-K353 HydrophobicContact CE2-CD 3.55Å; F336-K353 HydrophobicContact CE2-CG 4.31Å; F336-K353 HydrophobicContact CZ-CB 3.61Å; F336-K353 HydrophobicContact CZ-CD 3.51Å; F336-K353 HydrophobicContact CZ-CG 4.23Å; F336-K353 PolarHBondContact N-O 2.88Å; F336-K353 PolarHBondContact O-N 2.94Å; F336-A355 HydrophobicContact CD1-CB 4.33Å; F336-E452 HydrophobicContact CD2-CG 4.21Å; F336-E452 HydrophobicContact CE2-CB 4.33Å; F336-E452 HydrophobicContact CE2-CG 3.54Å; F336-E452 HydrophobicContact CZ-CG 4.25Å; F336-V462 HydrophobicContact CB-CG2 4.29Å
337	Y	88.6	Confident	86.3	Confident	75 Å²	75	47.8 Å²	47.8	29%	0.294	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	152.7	178.6	69.8	-83.9	0	0	0	111.5	L350 M351 A454 Y459	Y337-L350 HydrophobicContact CD2-CD1 3.86Å; Y337-L350 HydrophobicContact CD2-CG 4.24Å; Y337-L350 HydrophobicContact CG-CD1 4.41Å; Y337-M351 CarbonylContact C-O 3.5Å; Y337-M351 WeakPolarHBondContact CA-O 3.21Å; Y337-A454 HydrophobicContact CE2-CB 4.04Å; Y337-Y459 HydrophobicContact CE1-CE1 4.4Å; Y337-Y459 HydrophobicContact CE1-CE2 4.49Å; Y337-Y459 AromaticContact CE1-CZ 3.95Å; Y337-Y459 HydrophobicContact CE2-CE1 4.21Å; Y337-Y459 PolarHBondContact N-OH 2.95Å; Y337-Y459 WeakPolarHBondContact O-CE1 3.21Å; Y337-Y459 PolarHBondContact O-OH 2.84Å
338	T	89.7	Confident	86.3	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.012	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	156.8	177.1	-170.5	0	0	0	0	109.2	M351 K353 E452 V453	T338-M351 HydrophobicContact CG2-CG 3.67Å; T338-M351 HydrophobicContact CG2-SD 4.19Å; T338-M351 PolarHBondContact N-O 3.02Å; T338-M351 WeakPolarHBondContact O-CG 3.48Å; T338-M351 PolarHBondContact O-N 2.99Å; T338-M351 VanDerWaalsContact O-O 3.09Å; T338-K353 HydrophobicContact CG2-CD 3.77Å; T338-K353 HydrophobicContact CG2-CG 4.24Å; T338-E452 WeakPolarHBondContact CB-OE2 3.42Å; T338-E452 PolarHBondContact OG1-OE2 3.17Å; T338-V453 WeakPolarHBondContact CA-O 3.49Å; T338-V453 WeakPolarHBondContact OG1-CG2 3.28Å; T338-V453 PolarHBondContact OG1-O 2.99Å
339	H	87.7	Confident	86.4	Confident	39 Å²	39	45.5 Å²	45.5	18%	0.181	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	141.7	175.6	-72	77	0	0	0	110.8	V453 A454	H339-V453 PolarHBondContact N-O 3.44Å; H339-V453 PolarHBondContact ND1-O 3.17Å; H339-A454 WeakPolarHBondContact ND1-CA 3.39Å
340	T	87.6	Confident	86.4	Confident	33 Å²	33	46.3 Å²	46.3	20%	0.202	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-66.9	148.9	167.2	62.6	0	0	0	0	109.9	T348 Q349 M351	T340-T348 WeakPolarHBondContact O-CB 3.44Å; T340-T348 PolarHBondContact O-OG1 2.82Å; T340-T348 PolarHBondContact OG1-OG1 2.91Å; T340-Q349 HydrophobicContact CG2-CG 3.59Å; T340-Q349 PolarHBondContact N-O 2.72Å; T340-Q349 PolarHBondContact OG1-N 3.04Å; T340-Q349 VanDerWaalsContact OG1-N 3.08Å; T340-M351 HydrophobicContact CG2-CB 4.42Å; T340-M351 HydrophobicContact CG2-CG 4.09Å; T340-M351 HydrophobicContact CG2-SD 3.83Å
341	A	85.4	Confident	86.4	Confident	60 Å²	60	48.9 Å²	48.9	50%	0.496	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-52.6	151.1	161.7	0	0	0	0	0	110.5	D343 T428	A341-D343 PolarHBondContact O-N 2.65Å; A341-T428 HydrophobicContact CB-CG2 3.69Å
342	C	85.8	Confident	86.5	Confident	25 Å²	25	49.5 Å²	49.5	17%	0.169	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-64.4	128	179.2	-59.5	0	0	0	0	110.7	E347 C379	C342-E347 WeakPolarHBondContact CA-O 3.29Å; C342-C379 VanDerWaalsContact CA-SG 3.58Å; C342-C379 HydrophobicContact CB-CB 4.16Å; C342-C379 WeakPolarHBondContact CB-SG 3.03Å; C342-C379 WeakPolarHBondContact SG-CB 3.41Å; C342-C379 CovalentContact SG-SG 2.03Å; C342-C379 PolarHBondContact SG-SG 3.41Å
343	D	84.3	Confident	86.7	Confident	45 Å²	45	47.9 Å²	47.9	24%	0.241	25%	0.251	C	S	.	.			trans	-78.9	178.7	176	73.7	10.6	0	0	0	112.7	A341 N345 G346 E347 K376 S392	A341-D343 PolarHBondContact O-N 2.65Å; D343-N345 PolarHBondContact O-N 2.03Å; D343-N345 VanDerWaalsContact O-N 3.12Å; D343-N345 WeakPolarHBondContact OD1-CA 3.49Å; D343-N345 VanDerWaalsContact OD1-CB 3.31Å; D343-N345 WeakPolarHBondContact OD1-CB 3.41Å; D343-N345 PolarHBondContact OD1-N 2.86Å; D343-G346 WeakPolarHBondContact O-CA 3.48Å; D343-G346 PolarHBondContact O-N 3.45Å; D343-G346 PolarHBondContact OD1-N 2.86Å; D343-G346 VanDerWaalsContact OD1-N 3.17Å; D343-E347 PolarHBondContact N-O 3.12Å; D343-E347 PolarHBondContact OD1-N 2.95Å; D343-K376 IonicContact OD2-NZ 2.73Å; D343-K376 PolarHBondContact OD2-NZ 3.37Å; D343-S392 WeakPolarHBondContact O-CB 3.34Å; D343-S392 PolarHBondContact O-OG 3.4Å
344	A	81.7	Confident	86.9	Confident	69 Å²	69	45.6 Å²	45.6	57%	0.57	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-21.5	179.8	0	0	0	0	0	114.3	G346	A344-G346 VanDerWaalsContact C-N 3.29Å
345	N	81.8	Confident	86.9	Confident	124 Å²	124	44.7 Å²	44.7	66%	0.663	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-13.1	173.7	-59	-22.5	0	0	0	112.1	D343 E347	D343-N345 PolarHBondContact O-N 2.03Å; D343-N345 VanDerWaalsContact O-N 3.12Å; D343-N345 WeakPolarHBondContact OD1-CA 3.49Å; D343-N345 VanDerWaalsContact OD1-CB 3.31Å; D343-N345 WeakPolarHBondContact OD1-CB 3.41Å; D343-N345 PolarHBondContact OD1-N 2.86Å; N345-E347 HydrophobicContact CB-CG 3.99Å
346	G	82.6	Confident	86.3	Confident	7 Å²	7	48.4 Å²	48.4	7%	0.072	26%	0.256	C	S	.	.	S	Bend	trans	83.2	27.3	-171.1	0	0	0	0	0	112.8	D343 A344 C379 S392	D343-G346 WeakPolarHBondContact O-CA 3.48Å; D343-G346 PolarHBondContact O-N 3.45Å; D343-G346 PolarHBondContact OD1-N 2.86Å; D343-G346 VanDerWaalsContact OD1-N 3.17Å; A344-G346 VanDerWaalsContact C-N 3.29Å; G346-C379 WeakPolarHBondContact O-CB 3.45Å; G346-C379 PolarHBondContact O-N 3.06Å; G346-S392 WeakPolarHBondContact CA-OG 3.49Å; G346-S392 PolarHBondContact N-OG 2.95Å
347	E	87.8	Confident	85.7	Confident	60 Å²	60	50.8 Å²	50.8	28%	0.28	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	144.4	-179.8	-58.9	-179.1	134.3	0	0	111.4	C342 D343 N345 K376 T377	C342-E347 WeakPolarHBondContact CA-O 3.29Å; D343-E347 PolarHBondContact N-O 3.12Å; D343-E347 PolarHBondContact OD1-N 2.95Å; N345-E347 HydrophobicContact CB-CG 3.99Å; E347-K376 HydrophobicContact CB-CB 4.22Å; E347-K376 HydrophobicContact CB-CD 3.89Å; E347-K376 HydrophobicContact CB-CG 4.47Å; E347-K376 HydrophobicContact CG-CD 4.49Å; E347-K376 WeakPolarHBondContact OE2-CD 3.08Å; E347-K376 IonicContact OE2-NZ 3.43Å; E347-K376 PolarHBondContact OE2-NZ 2.97Å; E347-T377 CarbonylContact C-O 3.54Å; E347-T377 VanDerWaalsContact CA-O 3.24Å; E347-T377 WeakPolarHBondContact CA-O 3.42Å
348	T	87.8	Confident	85.4	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.031	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	156.4	169.4	179.4	0	0	0	0	109.4	T340 K376 T377 C379	T340-T348 WeakPolarHBondContact O-CB 3.44Å; T340-T348 PolarHBondContact O-OG1 2.82Å; T340-T348 PolarHBondContact OG1-OG1 2.91Å; T348-K376 CarbonylContact O-C 3.58Å; T348-K376 WeakPolarHBondContact O-CA 3.48Å; T348-T377 PolarHBondContact N-O 2.76Å; T348-T377 PolarHBondContact O-N 2.9Å; T348-T377 PolarHBondContact O-OG1 3.47Å; T348-C379 VanDerWaalsContact CB-SG 3.6Å
349	Q	89.4	Confident	85	Confident	56 Å²	56	51.8 Å²	51.8	26%	0.262	28%	0.28	S	S	.	.			trans	-133.3	143.6	171.9	61	-171.2	12.4	0	0	109.6	T340 M351 K376	T340-Q349 HydrophobicContact CG2-CG 3.59Å; T340-Q349 PolarHBondContact N-O 2.72Å; T340-Q349 PolarHBondContact OG1-N 3.04Å; T340-Q349 VanDerWaalsContact OG1-N 3.08Å; Q349-M351 PolarHBondContact O-N 2.94Å; Q349-K376 HydrophobicContact CB-CG 4.23Å
350	L	89	Confident	84.9	Confident	47 Å²	47	50 Å²	50	25%	0.246	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	123	168.1	-175.1	155.8	0	0	0	108.1	Y337 Y352 S373 G374	Y337-L350 HydrophobicContact CD2-CD1 3.86Å; Y337-L350 HydrophobicContact CD2-CG 4.24Å; Y337-L350 HydrophobicContact CG-CD1 4.41Å; L350-Y352 HydrophobicContact CD2-CD2 4.05Å; L350-Y352 HydrophobicContact CD2-CE1 4.08Å; L350-Y352 HydrophobicContact CD2-CE2 3.41Å; L350-Y352 VanDerWaalsContact CD2-CE2 3.41Å; L350-Y352 VanDerWaalsContact CD2-CZ 3.44Å; L350-S373 CarbonylContact O-C 3.6Å; L350-S373 WeakPolarHBondContact O-CA 3.37Å; L350-G374 PolarHBondContact O-N 3.23Å
351	M	89.9	Confident	84.9	Confident	56 Å²	56	49 Å²	49	28%	0.276	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	153.9	176	65.3	168.8	-63.8	0	0	110.6	Y337 T338 T340 Q349 K353	Y337-M351 CarbonylContact C-O 3.5Å; Y337-M351 WeakPolarHBondContact CA-O 3.21Å; T338-M351 HydrophobicContact CG2-CG 3.67Å; T338-M351 HydrophobicContact CG2-SD 4.19Å; T338-M351 PolarHBondContact N-O 3.02Å; T338-M351 WeakPolarHBondContact O-CG 3.48Å; T338-M351 PolarHBondContact O-N 2.99Å; T338-M351 VanDerWaalsContact O-O 3.09Å; T340-M351 HydrophobicContact CG2-CB 4.42Å; T340-M351 HydrophobicContact CG2-CG 4.09Å; T340-M351 HydrophobicContact CG2-SD 3.83Å; Q349-M351 PolarHBondContact O-N 2.94Å; M351-K353 HydrophobicContact CE-CG 3.98Å
352	Y	89.7	Confident	85.1	Confident	68 Å²	68	48.4 Å²	48.4	27%	0.267	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	146.2	175.5	-63.1	-88.8	0	0	0	110.7	Y335 F336 L350 P371	Y335-Y352 AromaticContact CD2-CD1 3.63Å; Y335-Y352 HydrophobicContact CD2-CD1 3.63Å; Y335-Y352 HydrophobicContact CD2-CE1 4.3Å; Y335-Y352 HydrophobicContact CD2-CG 4.46Å; Y335-Y352 AromaticContact CE2-CD1 3.69Å; Y335-Y352 HydrophobicContact CE2-CD1 3.69Å; Y335-Y352 AromaticContact CE2-CE1 3.92Å; Y335-Y352 HydrophobicContact CE2-CE1 3.92Å; F336-Y352 CarbonylContact O-C 3.55Å; F336-Y352 WeakPolarHBondContact O-CA 3.37Å; L350-Y352 HydrophobicContact CD2-CD2 4.05Å; L350-Y352 HydrophobicContact CD2-CE1 4.08Å; L350-Y352 HydrophobicContact CD2-CE2 3.41Å; L350-Y352 VanDerWaalsContact CD2-CE2 3.41Å; L350-Y352 VanDerWaalsContact CD2-CZ 3.44Å; Y352-P371 HydrophobicContact CD1-CG 4.25Å; Y352-P371 HydrophobicContact CD2-CB 3.64Å; Y352-P371 HydrophobicContact CD2-CG 4.14Å; Y352-P371 WeakPolarHBondContact CD2-O 3.15Å; Y352-P371 HydrophobicContact CE1-CG 4.43Å; Y352-P371 HydrophobicContact CE2-CB 3.74Å; Y352-P371 HydrophobicContact CE2-CG 4.34Å; Y352-P371 HydrophobicContact CG-CB 4.1Å; Y352-P371 HydrophobicContact CG-CG 4.08Å
353	K	88.9	Confident	85.1	Confident	69 Å²	69	54.6 Å²	54.6	30%	0.3	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136.1	177.1	-70.6	172.2	173.3	168	0	109.4	Y335 F336 T338 M351 E452	Y335-K353 CarbonylContact C-O 3.52Å; Y335-K353 VanDerWaalsContact CA-O 3.23Å; Y335-K353 WeakPolarHBondContact CA-O 3.41Å; Y335-K353 VanDerWaalsContact CB-O 3.29Å; Y335-K353 WeakPolarHBondContact CB-O 3.22Å; F336-K353 HydrophobicContact CD1-CB 4.38Å; F336-K353 HydrophobicContact CD2-CB 4.44Å; F336-K353 HydrophobicContact CE1-CB 3.85Å; F336-K353 HydrophobicContact CE2-CB 3.91Å; F336-K353 HydrophobicContact CE2-CD 3.55Å; F336-K353 HydrophobicContact CE2-CG 4.31Å; F336-K353 HydrophobicContact CZ-CB 3.61Å; F336-K353 HydrophobicContact CZ-CD 3.51Å; F336-K353 HydrophobicContact CZ-CG 4.23Å; F336-K353 PolarHBondContact N-O 2.88Å; F336-K353 PolarHBondContact O-N 2.94Å; T338-K353 HydrophobicContact CG2-CD 3.77Å; T338-K353 HydrophobicContact CG2-CG 4.24Å; M351-K353 HydrophobicContact CE-CG 3.98Å; K353-E452 IonicContact NZ-OE1 2.6Å; K353-E452 PolarHBondContact NZ-OE1 3.02Å; K353-E452 IonicContact NZ-OE2 3.83Å; K353-E452 PolarHBondContact NZ-OE2 2.85Å
354	W	87.4	Confident	85.2	Confident	35 Å²	35	56.1 Å²	56.1	13%	0.133	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	134.3	168.1	-72.9	123.1	0	0	0	110.6	C330 D334 Y335 M356 K358 E362 V368 L370	C330-W354 HydrophobicContact CB-CH2 3.6Å; C330-W354 HydrophobicContact CB-CZ2 4.45Å; C330-W354 HydrophobicContact CB-CZ3 3.84Å; D334-W354 HydrophobicContact CB-CE3 4.04Å; D334-W354 HydrophobicContact CB-CZ3 3.79Å; Y335-W354 HydrophobicContact CD1-CE3 4.49Å; Y335-W354 HydrophobicContact CD1-CH2 4.16Å; Y335-W354 AromaticContact CD1-CZ3 3.81Å; Y335-W354 HydrophobicContact CD1-CZ3 3.81Å; Y335-W354 HydrophobicContact CG-CZ3 4.44Å; W354-M356 PolarHBondContact O-N 2.82Å; W354-K358 HydrophobicContact CB-CD 4.47Å; W354-K358 HydrophobicContact CB-CG 4.43Å; W354-K358 HydrophobicContact CG-CD 4.14Å; W354-K358 HydrophobicContact CG-CG 4.45Å; W354-E362 HydrophobicContact CH2-CG 4.32Å; W354-E362 HydrophobicContact CZ2-CG 3.62Å; W354-E362 WeakPolarHBondContact CZ2-OE2 3.2Å; W354-E362 PolarHBondContact NE1-OE1 2.99Å; W354-V368 WeakPolarHBondContact CH2-O 3.26Å; W354-L370 HydrophobicContact CD2-CD1 4.02Å; W354-L370 HydrophobicContact CE3-CD1 4.46Å; W354-L370 HydrophobicContact CG-CD1 4.28Å; W354-L370 HydrophobicContact CZ2-CB 3.74Å; W354-L370 HydrophobicContact CZ2-CD1 4.32Å
355	A	83.7	Confident	85.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-69.2	119.4	176.3	0	0	0	0	0	110.7	D334 F336 P357 V462 R563	D334-A355 VanDerWaalsContact O-CB 3.25Å; D334-A355 WeakPolarHBondContact O-CB 3.49Å; D334-A355 PolarHBondContact O-N 3.12Å; F336-A355 HydrophobicContact CD1-CB 4.33Å; A355-P357 CarbonylContact O-C 3.44Å; A355-P357 VanDerWaalsContact O-C 3.24Å; A355-V462 HydrophobicContact CB-CB 3.66Å; A355-V462 HydrophobicContact CB-CG1 3.55Å; A355-R563 PolarHBondContact O-NH1 2.89Å; A355-R563 VanDerWaalsContact O-NH1 3.16Å; A355-R563 PolarHBondContact O-NH2 3.34Å; A355-R563 VanDerWaalsContact O-NH2 3.12Å
356	M	75.5	Confident	85.6	Confident	123 Å²	123	59.9 Å²	59.9	61%	0.606	32%	0.316	S	S	*	.	S	Bend	trans	-88.1	140.6	-176	-68.1	-168.4	-174.9	0	0	112.1	W354 L448 R563	W354-M356 PolarHBondContact O-N 2.82Å; M356-L448 HydrophobicContact CB-CD2 3.51Å; M356-R563 VanDerWaalsContact C-NH2 3.26Å; M356-R563 PolarHBondContact O-NH2 3Å
357	P	75.9	Confident	85.9	Confident	68 Å²	68	60.5 Å²	60.5	44%	0.442	32%	0.32	S	S	.	.	S	Bend	cis	-66.4	146.3	-6.5	30.2	-35.6	0	0	0	112	A355 I359 R563	A355-P357 CarbonylContact O-C 3.44Å; A355-P357 VanDerWaalsContact O-C 3.24Å; P357-I359 HydrophobicContact CG-CG1 4.42Å; P357-I359 PolarHBondContact O-N 2.87Å; P357-R563 PolarHBondContact O-NH1 2.9Å; P357-R563 PolarHBondContact O-NH2 3Å; P357-R563 VanDerWaalsContact O-NH2 3.16Å
358	K	82.4	Confident	86	Confident	78 Å²	78	60.4 Å²	60.4	34%	0.339	32%	0.323	S	S	.	.			trans	-76.2	94.2	178.7	-171.5	-172.5	180	-172.5	0	110.1	R327 W354 E362	R327-K358 PolarHBondContact NH1-O 2.79Å; W354-K358 HydrophobicContact CB-CD 4.47Å; W354-K358 HydrophobicContact CB-CG 4.43Å; W354-K358 HydrophobicContact CG-CD 4.14Å; W354-K358 HydrophobicContact CG-CG 4.45Å; K358-E362 IonicContact NZ-OE1 3.89Å; K358-E362 PolarHBondContact NZ-OE1 3.37Å
359	I	81.3	Confident	86.1	Confident	20 Å²	20	66.9 Å²	66.9	10%	0.103	35%	0.351	C	S	.	.			trans	-77.6	-31.9	-177.1	-72.2	167.9	0	0	0	112.3	Y316 R327 P328 P357	Y316-I359 HydrophobicContact CD1-CG2 4.02Å; Y316-I359 HydrophobicContact CD2-CG1 4.21Å; Y316-I359 HydrophobicContact CD2-CG2 4.07Å; Y316-I359 HydrophobicContact CE1-CG2 3.62Å; Y316-I359 HydrophobicContact CE2-CB 4.49Å; Y316-I359 HydrophobicContact CE2-CD1 4.31Å; Y316-I359 HydrophobicContact CE2-CG1 4.09Å; Y316-I359 HydrophobicContact CE2-CG2 3.69Å; Y316-I359 HydrophobicContact CG-CG2 4.22Å; Y316-I359 VanDerWaalsContact CZ-CG2 3.43Å; R327-I359 WeakPolarHBondContact CG-O 3.36Å; R327-I359 PolarHBondContact NH1-O 3.01Å; P328-I359 HydrophobicContact CG-CG2 4.26Å; P357-I359 HydrophobicContact CG-CG1 4.42Å; P357-I359 PolarHBondContact O-N 2.87Å
360	C	85.3	Confident	86.1	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.014	35%	0.354	C	S	.	.	S	Bend	trans	-84.5	172.2	-175.5	70.4	0	0	0	0	114.7	R327 P328 C330	R327-C360 PolarHBondContact NH1-O 2.92Å; P328-C360 HydrophobicContact CG-CB 4.4Å; P328-C360 CarbonylContact O-C 3.46Å; P328-C360 WeakPolarHBondContact O-CA 3.03Å; P328-C360 WeakPolarHBondContact O-CB 3.41Å; C330-C360 VanDerWaalsContact CA-CB 3.49Å; C330-C360 WeakPolarHBondContact CA-SG 3.39Å; C330-C360 HydrophobicContact CB-CB 3.78Å; C330-C360 WeakPolarHBondContact CB-SG 3.44Å; C330-C360 VanDerWaalsContact SG-C 3.55Å; C330-C360 WeakPolarHBondContact SG-CB 3.33Å; C330-C360 CovalentContact SG-SG 2.04Å; C330-C360 PolarHBondContact SG-SG 3.13Å
361	G	87.5	Confident	86.2	Confident	11 Å²	11	67 Å²	67	11%	0.113	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-119.8	140.2	171.7	0	0	0	0	0	112.8	P328 C330 A367	P328-G361 PolarHBondContact O-N 2.98Å; C330-G361 PolarHBondContact N-O 3.38Å; C330-G361 PolarHBondContact SG-N 2.87Å; C330-G361 PolarHBondContact SG-O 3.18Å; C330-G361 VanDerWaalsContact SG-O 3.36Å; G361-A367 WeakPolarHBondContact O-CB 3.22Å
362	E	89.1	Confident	86.1	Confident	49 Å²	49	68.6 Å²	68.6	23%	0.229	38%	0.378	C	S	.	.	S	Bend	trans	-90.7	-16.8	-177.5	-73.2	-175.2	-107.4	0	0	114.1	W354 K358	W354-E362 HydrophobicContact CH2-CG 4.32Å; W354-E362 HydrophobicContact CZ2-CG 3.62Å; W354-E362 WeakPolarHBondContact CZ2-OE2 3.2Å; W354-E362 PolarHBondContact NE1-OE1 2.99Å; K358-E362 IonicContact NZ-OE1 3.89Å; K358-E362 PolarHBondContact NZ-OE1 3.37Å
363	D	86.9	Confident	86.1	Confident	155 Å²	155	68.4 Å²	68.4	83%	0.829	39%	0.386	S	S	*	.	S	Bend	trans	-97.2	6.7	-176.4	-52.2	-73.8	0	0	0	113.1
364	L	86.6	Confident	86	Confident	77 Å²	77	66.7 Å²	66.7	40%	0.403	39%	0.388	S	S	.	.	S	Bend	trans	-84.6	150.6	177.9	-66.6	170.3	0	0	0	111.1	R327 A329 G366 A367	R327-L364 WeakPolarHBondContact O-CD1 3.27Å; A329-L364 HydrophobicContact CB-CB 3.93Å; A329-L364 HydrophobicContact CB-CD1 4.41Å; L364-G366 PolarHBondContact O-N 3.19Å; L364-A367 HydrophobicContact CB-CB 4.36Å; L364-A367 WeakPolarHBondContact O-CB 3.33Å; L364-A367 PolarHBondContact O-N 3.44Å
365	E	86	Confident	86.1	Confident	199 Å²	199	71.3 Å²	71.3	93%	0.93	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	129.9	178.5	-169.9	171.2	-171.2	0	0	110.9	A367	E365-A367 VanDerWaalsContact C-N 3.3Å; E365-A367 PolarHBondContact O-N 2.94Å
366	G	84.9	Confident	86.3	Confident	73 Å²	73	75.5 Å²	75.5	75%	0.753	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	0.2	-174	0	0	0	0	0	115.7	L364 V368	L364-G366 PolarHBondContact O-N 3.19Å; G366-V368 PolarHBondContact O-N 3.41Å
367	A	89	Confident	86.9	Confident	20 Å²	20	73.4 Å²	73.4	17%	0.165	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-66.9	131.7	177.7	0	0	0	0	0	112.6	A329 G361 L364 E365	A329-A367 HydrophobicContact CB-CB 3.96Å; G361-A367 WeakPolarHBondContact O-CB 3.22Å; L364-A367 HydrophobicContact CB-CB 4.36Å; L364-A367 WeakPolarHBondContact O-CB 3.33Å; L364-A367 PolarHBondContact O-N 3.44Å; E365-A367 VanDerWaalsContact C-N 3.3Å; E365-A367 PolarHBondContact O-N 2.94Å
368	V	90.7	Very high	87.4	Confident	57 Å²	57	80.9 Å²	80.9	35%	0.345	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-75.7	133.2	170.2	-176.7	0	0	0	0	108.9	C330 Y335 W354 G366	C330-V368 WeakPolarHBondContact CB-O 3.38Å; C330-V368 PolarHBondContact O-N 3.17Å; Y335-V368 HydrophobicContact CE1-CG1 3.97Å; W354-V368 WeakPolarHBondContact CH2-O 3.26Å; G366-V368 PolarHBondContact O-N 3.41Å
369	K	89.3	Confident	87.5	Confident	142 Å²	142	78.5 Å²	78.5	62%	0.617	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-88.5	151.7	171.4	-60.7	-165.2	176.4	-163.4	0	110.3	P371	K369-P371 WeakPolarHBondContact O-CD 3.49Å
370	L	89.6	Confident	87.6	Confident	63 Å²	63	79.4 Å²	79.4	33%	0.33	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-56	123.6	-179.9	-168.4	66.7	0	0	0	109.9	Y335 W354	Y335-L370 HydrophobicContact CD1-CD1 4.41Å; Y335-L370 HydrophobicContact CG-CD1 4.18Å; W354-L370 HydrophobicContact CD2-CD1 4.02Å; W354-L370 HydrophobicContact CE3-CD1 4.46Å; W354-L370 HydrophobicContact CG-CD1 4.28Å; W354-L370 HydrophobicContact CZ2-CB 3.74Å; W354-L370 HydrophobicContact CZ2-CD1 4.32Å
371	P	90.4	Very high	87.7	Confident	41 Å²	41	82.5 Å²	82.5	27%	0.266	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-65	146.5	-175.8	-18.9	29.8	0	0	0	111.7	Y335 Y352 K369	Y335-P371 HydrophobicContact CE1-CG 3.86Å; Y335-P371 HydrophobicContact CE2-CG 3.99Å; Y352-P371 HydrophobicContact CD1-CG 4.25Å; Y352-P371 HydrophobicContact CD2-CB 3.64Å; Y352-P371 HydrophobicContact CD2-CG 4.14Å; Y352-P371 WeakPolarHBondContact CD2-O 3.15Å; Y352-P371 HydrophobicContact CE1-CG 4.43Å; Y352-P371 HydrophobicContact CE2-CB 3.74Å; Y352-P371 HydrophobicContact CE2-CG 4.34Å; Y352-P371 HydrophobicContact CG-CB 4.1Å; Y352-P371 HydrophobicContact CG-CG 4.08Å; K369-P371 WeakPolarHBondContact O-CD 3.49Å
372	A	89.2	Confident	87.8	Confident	91 Å²	91	82.2 Å²	82.2	75%	0.752	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-62	146.9	175.4	0	0	0	0	0	111.1
373	S	89.1	Confident	87.9	Confident	64 Å²	64	80.8 Å²	80.8	45%	0.448	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-56.1	142	174.1	-56.1	0	0	0	0	111.3	L350	L350-S373 CarbonylContact O-C 3.6Å; L350-S373 WeakPolarHBondContact O-CA 3.37Å
374	G	86.1	Confident	88.2	Confident	32 Å²	32	74 Å²	74	33%	0.33	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-65.7	169.2	176.2	0	0	0	0	0	113.1	L350	L350-G374 PolarHBondContact O-N 3.23Å
375	V	89.2	Confident	88.4	Confident	132 Å²	132	70.3 Å²	70.3	80%	0.8	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-61.4	139.7	174.6	-173.7	0	0	0	0	109.6	T377	V375-T377 PolarHBondContact O-N 2.75Å
376	K	87.4	Confident	88.6	Confident	89 Å²	89	62.3 Å²	62.3	39%	0.387	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-59.3	134.6	172.5	-74.5	-165.9	179.3	-169.4	0	111.7	D343 E347 T348 Q349	D343-K376 IonicContact OD2-NZ 2.73Å; D343-K376 PolarHBondContact OD2-NZ 3.37Å; E347-K376 HydrophobicContact CB-CB 4.22Å; E347-K376 HydrophobicContact CB-CD 3.89Å; E347-K376 HydrophobicContact CB-CG 4.47Å; E347-K376 HydrophobicContact CG-CD 4.49Å; E347-K376 WeakPolarHBondContact OE2-CD 3.08Å; E347-K376 IonicContact OE2-NZ 3.43Å; E347-K376 PolarHBondContact OE2-NZ 2.97Å; T348-K376 CarbonylContact O-C 3.58Å; T348-K376 WeakPolarHBondContact O-CA 3.48Å; Q349-K376 HydrophobicContact CB-CG 4.23Å
377	T	88.3	Confident	88.8	Confident	78 Å²	78	61.5 Å²	61.5	48%	0.479	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	155.9	174.5	58.5	0	0	0	0	109.7	E347 T348 V375 C379	E347-T377 CarbonylContact C-O 3.54Å; E347-T377 VanDerWaalsContact CA-O 3.24Å; E347-T377 WeakPolarHBondContact CA-O 3.42Å; T348-T377 PolarHBondContact N-O 2.76Å; T348-T377 PolarHBondContact O-N 2.9Å; T348-T377 PolarHBondContact O-OG1 3.47Å; V375-T377 PolarHBondContact O-N 2.75Å; T377-C379 PolarHBondContact O-N 2.04Å
378	R	87.3	Confident	88.6	Confident	225 Å²	225	65 Å²	65	85%	0.849	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	133.9	174.3	-71.4	-176.1	174.6	-170.3	-2.5	109.9
379	C	84.6	Confident	88.2	Confident	28 Å²	28	63.5 Å²	63.5	19%	0.189	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-61.3	146.5	174.1	-76.8	0	0	0	0	112.1	C342 G346 T348 T377	C342-C379 VanDerWaalsContact CA-SG 3.58Å; C342-C379 HydrophobicContact CB-CB 4.16Å; C342-C379 WeakPolarHBondContact CB-SG 3.03Å; C342-C379 WeakPolarHBondContact SG-CB 3.41Å; C342-C379 CovalentContact SG-SG 2.03Å; C342-C379 PolarHBondContact SG-SG 3.41Å; G346-C379 WeakPolarHBondContact O-CB 3.45Å; G346-C379 PolarHBondContact O-N 3.06Å; T348-C379 VanDerWaalsContact CB-SG 3.6Å; T377-C379 PolarHBondContact O-N 2.04Å
380	P	83.8	Confident	87.5	Confident	39 Å²	39	65 Å²	65	25%	0.253	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-62.5	162.7	162.3	29.5	-34	0	0	0	110.7	W425 N427	P380-W425 HydrophobicContact CB-CD2 3.77Å; P380-W425 HydrophobicContact CB-CE3 3.71Å; P380-W425 HydrophobicContact CB-CG 4.13Å; P380-W425 HydrophobicContact CB-CZ3 4.18Å; P380-W425 HydrophobicContact CG-CB 4.24Å; P380-W425 HydrophobicContact CG-CD2 4.3Å; P380-W425 HydrophobicContact CG-CE3 4.09Å; P380-W425 HydrophobicContact CG-CG 4.39Å; P380-N427 VanDerWaalsContact CD-OD1 3.3Å; P380-N427 WeakPolarHBondContact CD-OD1 3.4Å; P380-N427 VanDerWaalsContact CG-OD1 3.22Å; P380-N427 WeakPolarHBondContact CG-OD1 3.41Å
381	P	87.3	Confident	86.7	Confident	67 Å²	67	67.2 Å²	67.2	44%	0.435	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-61	168.6	176.3	27.5	-35.5	0	0	0	112	G405 W425	P381-G405 WeakPolarHBondContact CB-O 3.31Å; P381-W425 VanDerWaalsContact O-CD1 3.22Å
382	C	89.1	Confident	85.9	Confident	5 Å²	5	65.8 Å²	65.8	3%	0.034	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-61.8	160.4	173.9	-71.1	0	0	0	0	111.3	F386 C394 G405	C382-F386 HydrophobicContact CB-CB 4Å; C382-C394 WeakPolarHBondContact CA-SG 3.4Å; C382-C394 HydrophobicContact CB-CB 3.75Å; C382-C394 WeakPolarHBondContact CB-SG 3.16Å; C382-C394 VanDerWaalsContact SG-CA 3.52Å; C382-C394 WeakPolarHBondContact SG-CB 3.38Å; C382-C394 CovalentContact SG-SG 2.04Å; C382-C394 PolarHBondContact SG-SG 2.85Å; C382-G405 PolarHBondContact N-O 2.84Å; C382-G405 WeakPolarHBondContact O-CA 3.02Å
383	N	91.7	Very high	85.5	Confident	20 Å²	20	64.4 Å²	64.4	11%	0.107	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-59.4	142.8	171.8	-79	-58.8	0	0	0	110.1	G385 F386 Y423 K424 W425	N383-G385 PolarHBondContact O-N 3.01Å; N383-F386 HydrophobicContact CB-CD2 4.07Å; N383-F386 VanDerWaalsContact O-CB 3.31Å; N383-F386 WeakPolarHBondContact O-CB 3.43Å; N383-F386 WeakPolarHBondContact O-CD2 3.43Å; N383-F386 PolarHBondContact O-N 3.21Å; N383-Y423 HydrophobicContact CB-CD1 4.43Å; N383-K424 PolarHBondContact OD1-N 3.13Å; N383-W425 PolarHBondContact ND2-O 3.44Å; N383-W425 PolarHBondContact OD1-N 3.21Å; N383-W425 PolarHBondContact OD1-O 3.16Å
384	P	92.6	Very high	85.4	Confident	12 Å²	12	64 Å²	64	8%	0.078	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	138	177.9	-29.8	35.8	0	0	0	113.2	F386 E422	P384-F386 VanDerWaalsContact C-N 3.32Å; P384-E422 HydrophobicContact CB-CB 4.43Å; P384-E422 WeakPolarHBondContact CD-O 3.3Å
385	G	90.7	Very high	85.5	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	-6.3	-169.8	0	0	0	0	0	115.9	N383 C397 S403 V584 A585	N383-G385 PolarHBondContact O-N 3.01Å; G385-C397 WeakPolarHBondContact O-CB 3.45Å; G385-C397 PolarHBondContact O-N 3Å; G385-S403 PolarHBondContact N-O 3.26Å; G385-V584 WeakPolarHBondContact O-CB 3.47Å; G385-V584 WeakPolarHBondContact O-CG1 3.27Å; G385-A585 WeakPolarHBondContact CA-O 3.11Å
386	F	90.9	Very high	85.6	Confident	31 Å²	31	64.3 Å²	64.3	14%	0.136	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	157.7	170.2	-61.9	-105.4	0	0	0	110.8	C382 N383 P384 C394 E395 P396 S403 Y423 V584	C382-F386 HydrophobicContact CB-CB 4Å; N383-F386 HydrophobicContact CB-CD2 4.07Å; N383-F386 VanDerWaalsContact O-CB 3.31Å; N383-F386 WeakPolarHBondContact O-CB 3.43Å; N383-F386 WeakPolarHBondContact O-CD2 3.43Å; N383-F386 PolarHBondContact O-N 3.21Å; P384-F386 VanDerWaalsContact C-N 3.32Å; F386-C394 HydrophobicContact CB-CB 4.22Å; F386-E395 CarbonylContact C-O 3.56Å; F386-E395 WeakPolarHBondContact CA-O 3.48Å; F386-E395 WeakPolarHBondContact CB-O 3.37Å; F386-P396 HydrophobicContact CD1-CB 4.2Å; F386-P396 HydrophobicContact CE1-CB 4.04Å; F386-S403 WeakPolarHBondContact O-CB 3.32Å; F386-S403 PolarHBondContact O-OG 3.45Å; F386-Y423 HydrophobicContact CE2-CE1 4.32Å; F386-Y423 HydrophobicContact CZ-CE1 4.49Å; F386-V584 HydrophobicContact CD2-CG2 3.99Å; F386-V584 HydrophobicContact CE2-CG1 4.26Å; F386-V584 HydrophobicContact CE2-CG2 3.6Å; F386-V584 HydrophobicContact CZ-CG1 4.28Å; F386-V584 HydrophobicContact CZ-CG2 4.31Å
387	F	89.1	Confident	85.8	Confident	55 Å²	55	60.8 Å²	60.8	24%	0.241	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	157.1	173.1	72.3	-77.5	0	0	0	111.1	T389 C394 E395 S406 C408	F387-T389 HydrophobicContact CE2-CG2 4.23Å; F387-C394 WeakPolarHBondContact O-CA 3.07Å; F387-E395 HydrophobicContact CD1-CB 4.24Å; F387-E395 WeakPolarHBondContact CD1-O 3.48Å; F387-E395 HydrophobicContact CE1-CB 3.56Å; F387-E395 HydrophobicContact CZ-CB 3.73Å; F387-E395 PolarHBondContact N-O 2.88Å; F387-E395 PolarHBondContact O-N 2.67Å; F387-S406 VanDerWaalsContact CA-O 3.23Å; F387-S406 WeakPolarHBondContact CA-O 3.42Å; F387-S406 VanDerWaalsContact CB-O 3.31Å; F387-S406 WeakPolarHBondContact CB-O 3.06Å; F387-C408 VanDerWaalsContact CB-SG 3.59Å; F387-C408 WeakPolarHBondContact CD1-SG 3.14Å; F387-C408 VanDerWaalsContact CG-SG 3.59Å
388	K	84.3	Confident	85.9	Confident	95 Å²	95	60.7 Å²	60.7	41%	0.413	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	127	179.7	-169.1	-170.9	174.9	-172.5	0	110.8	S392 S406	K388-S392 VanDerWaalsContact CE-CA 3.42Å; K388-S392 WeakPolarHBondContact CE-OG 3.38Å; K388-S392 PolarHBondContact NZ-OG 2.96Å; K388-S406 PolarHBondContact N-O 2.93Å; K388-S406 VanDerWaalsContact N-O 3.14Å
389	T	81.4	Confident	85.8	Confident	24 Å²	24	57.6 Å²	57.6	15%	0.147	31%	0.311	C	S	.	.			trans	-83.6	168.8	172.6	77.8	0	0	0	0	112.7	F387 N391 S392 T393 E395	F387-T389 HydrophobicContact CE2-CG2 4.23Å; T389-N391 PolarHBondContact O-N 2.85Å; T389-N391 PolarHBondContact OG1-N 2.72Å; T389-N391 VanDerWaalsContact OG1-N 3.17Å; T389-S392 PolarHBondContact O-N 3.3Å; T389-T393 WeakPolarHBondContact CG2-OG1 3.27Å; T389-T393 PolarHBondContact N-O 3.42Å; T389-T393 PolarHBondContact OG1-N 2.74Å; T389-T393 PolarHBondContact OG1-O 3.48Å; T389-T393 PolarHBondContact OG1-OG1 2.8Å; T389-E395 HydrophobicContact CG2-CB 4.06Å; T389-E395 VanDerWaalsContact CG2-CD 3.42Å; T389-E395 HydrophobicContact CG2-CG 3.74Å
390	N	76.4	Confident	85.8	Confident	174 Å²	174	57.2 Å²	57.2	93%	0.93	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-18.9	171.9	-67	-19.1	0	0	0	114.3
391	N	72.6	Confident	86.1	Confident	110 Å²	110	55.6 Å²	55.6	59%	0.588	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	17.1	178.8	-162.1	43.2	0	0	0	112.6	T389 T393	T389-N391 PolarHBondContact O-N 2.85Å; T389-N391 PolarHBondContact OG1-N 2.72Å; T389-N391 VanDerWaalsContact OG1-N 3.17Å; N391-T393 PolarHBondContact O-N 3.1Å; N391-T393 VanDerWaalsContact O-N 3.08Å
392	S	72.2	Confident	86.3	Confident	11 Å²	11	56 Å²	56	8%	0.077	30%	0.296	C	S	.	.	S	Bend	trans	57.3	13.7	-173.3	-63.1	0	0	0	0	116.5	D343 G346 K388 T389	D343-S392 WeakPolarHBondContact O-CB 3.34Å; D343-S392 PolarHBondContact O-OG 3.4Å; G346-S392 WeakPolarHBondContact CA-OG 3.49Å; G346-S392 PolarHBondContact N-OG 2.95Å; K388-S392 VanDerWaalsContact CE-CA 3.42Å; K388-S392 WeakPolarHBondContact CE-OG 3.38Å; K388-S392 PolarHBondContact NZ-OG 2.96Å; T389-S392 PolarHBondContact O-N 3.3Å
393	T	81.2	Confident	86.4	Confident	61 Å²	61	55.9 Å²	55.9	37%	0.374	30%	0.295	S	S	.	.			trans	-75	152.7	166.7	58.8	0	0	0	0	110.2	T389 N391	T389-T393 WeakPolarHBondContact CG2-OG1 3.27Å; T389-T393 PolarHBondContact N-O 3.42Å; T389-T393 PolarHBondContact OG1-N 2.74Å; T389-T393 PolarHBondContact OG1-O 3.48Å; T389-T393 PolarHBondContact OG1-OG1 2.8Å; N391-T393 PolarHBondContact O-N 3.1Å; N391-T393 VanDerWaalsContact O-N 3.08Å
394	C	87	Confident	86.3	Confident	55 Å²	55	60.4 Å²	60.4	37%	0.372	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117.4	173.5	-65.6	0	0	0	0	109.4	C382 F386 F387	C382-C394 WeakPolarHBondContact CA-SG 3.4Å; C382-C394 HydrophobicContact CB-CB 3.75Å; C382-C394 WeakPolarHBondContact CB-SG 3.16Å; C382-C394 VanDerWaalsContact SG-CA 3.52Å; C382-C394 WeakPolarHBondContact SG-CB 3.38Å; C382-C394 CovalentContact SG-SG 2.04Å; C382-C394 PolarHBondContact SG-SG 2.85Å; F386-C394 HydrophobicContact CB-CB 4.22Å; F387-C394 WeakPolarHBondContact O-CA 3.07Å
395	E	89.1	Confident	85.8	Confident	95 Å²	95	59.9 Å²	59.9	44%	0.444	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	148.4	180	-78.3	177.9	-163.1	0	0	111	F386 F387 T389	F386-E395 CarbonylContact C-O 3.56Å; F386-E395 WeakPolarHBondContact CA-O 3.48Å; F386-E395 WeakPolarHBondContact CB-O 3.37Å; F387-E395 HydrophobicContact CD1-CB 4.24Å; F387-E395 WeakPolarHBondContact CD1-O 3.48Å; F387-E395 HydrophobicContact CE1-CB 3.56Å; F387-E395 HydrophobicContact CZ-CB 3.73Å; F387-E395 PolarHBondContact N-O 2.88Å; F387-E395 PolarHBondContact O-N 2.67Å; T389-E395 HydrophobicContact CG2-CB 4.06Å; T389-E395 VanDerWaalsContact CG2-CD 3.42Å; T389-E395 HydrophobicContact CG2-CG 3.74Å
396	P	91	Very high	85.6	Confident	77 Å²	77	62.7 Å²	62.7	50%	0.5	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	138.2	-177.1	28.9	-34.7	0	0	0	111	F386 V584	F386-P396 HydrophobicContact CD1-CB 4.2Å; F386-P396 HydrophobicContact CE1-CB 4.04Å; P396-V584 HydrophobicContact CB-CG1 3.46Å; P396-V584 VanDerWaalsContact CB-CG1 3.46Å
397	C	91.1	Very high	85.5	Confident	14 Å²	14	66.6 Å²	66.6	10%	0.095	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-65.1	145.7	175.8	-77	0	0	0	0	112.5	G385 S403 C408	G385-C397 WeakPolarHBondContact O-CB 3.45Å; G385-C397 PolarHBondContact O-N 3Å; C397-S403 WeakPolarHBondContact SG-CB 3.36Å; C397-C408 WeakPolarHBondContact CA-SG 3.19Å; C397-C408 HydrophobicContact CB-CB 3.9Å; C397-C408 WeakPolarHBondContact CB-SG 3.48Å; C397-C408 VanDerWaalsContact SG-CA 3.53Å; C397-C408 WeakPolarHBondContact SG-CB 3.33Å; C397-C408 CovalentContact SG-SG 2.04Å; C397-C408 PolarHBondContact SG-SG 3.27Å
398	P	90.6	Very high	85.6	Confident	76 Å²	76	66 Å²	66	49%	0.494	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-65.8	148.2	177.5	27.9	-33.8	0	0	0	111.3	S401	P398-S401 WeakPolarHBondContact O-CB 3.35Å; P398-S401 PolarHBondContact O-N 3.32Å; P398-S401 VanDerWaalsContact O-N 3.11Å; P398-S401 PolarHBondContact O-OG 2.82Å; P398-S401 VanDerWaalsContact O-OG 3.04Å
399	Y	85.1	Confident	86	Confident	160 Å²	160	64.4 Å²	64.4	63%	0.627	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	139.6	-179	-174.3	-91.8	0	0	0	112.1	P417 R480	Y399-P417 HydrophobicContact CE2-CG 4.45Å; Y399-R480 PolarHBondContact OH-NH1 3.18Å; Y399-R480 VanDerWaalsContact OH-NH1 3.09Å
400	G	84	Confident	86.5	Confident	21 Å²	21	70.3 Å²	70.3	22%	0.216	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	13.8	-171.1	0	0	0	0	0	114.2	H410 C411	G400-H410 WeakPolarHBondContact O-CA 3.17Å; G400-H410 PolarHBondContact O-ND1 2.98Å; G400-C411 PolarHBondContact O-N 2.9Å
401	S	90.3	Very high	87	Confident	5 Å²	5	63.1 Å²	63.1	4%	0.035	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	160.8	175.2	-41.5	0	0	0	0	111.6	P398 T409 H410	P398-S401 WeakPolarHBondContact O-CB 3.35Å; P398-S401 PolarHBondContact O-N 3.32Å; P398-S401 VanDerWaalsContact O-N 3.11Å; P398-S401 PolarHBondContact O-OG 2.82Å; P398-S401 VanDerWaalsContact O-OG 3.04Å; S401-T409 CarbonylContact C-O 3.26Å; S401-T409 WeakPolarHBondContact CA-O 3.43Å; S401-T409 WeakPolarHBondContact CB-O 3.5Å; S401-H410 PolarHBondContact OG-CE1 2.92Å; S401-H410 PolarHBondContact OG-ND1 2.86Å
402	Y	91.4	Very high	87.6	Confident	76 Å²	76	61.5 Å²	61.5	30%	0.298	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	160	172.7	75.1	-70.7	0	0	0	111.1	T409 A585 C588	Y402-T409 VanDerWaalsContact CD1-O 3.23Å; Y402-T409 WeakPolarHBondContact CD1-O 3.35Å; Y402-T409 WeakPolarHBondContact CD1-OG1 3.42Å; Y402-T409 WeakPolarHBondContact CE1-OG1 3.03Å; Y402-T409 VanDerWaalsContact CZ-OG1 3.29Å; Y402-T409 PolarHBondContact N-O 3.2Å; Y402-T409 PolarHBondContact O-N 2.87Å; Y402-T409 PolarHBondContact O-OG1 3.42Å; Y402-A585 VanDerWaalsContact CA-O 3.23Å; Y402-A585 WeakPolarHBondContact CA-O 3.49Å; Y402-A585 WeakPolarHBondContact CB-O 2.92Å; Y402-C588 WeakPolarHBondContact CD1-SG 3.48Å
403	S	92.3	Very high	88	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.014	38%	0.378	C	S	.	.			trans	-147.8	143.5	176.1	167	0	0	0	0	110.5	G385 F386 C397 G405 S406 A585	G385-S403 PolarHBondContact N-O 3.26Å; F386-S403 WeakPolarHBondContact O-CB 3.32Å; F386-S403 PolarHBondContact O-OG 3.45Å; C397-S403 WeakPolarHBondContact SG-CB 3.36Å; S403-G405 VanDerWaalsContact C-N 3.3Å; S403-G405 PolarHBondContact OG-N 2.6Å; S403-S406 PolarHBondContact OG-N 3.33Å; S403-A585 PolarHBondContact N-O 2.86Å
404	N	88.2	Confident	87.6	Confident	114 Å²	114	63.7 Å²	63.7	61%	0.61	37%	0.369	S	S	*	.	S	Bend	trans	-88	3	170	65.4	0.6	0	0	0	113.2	S406	N404-S406 PolarHBondContact OD1-N 2.8Å; N404-S406 PolarHBondContact OD1-OG 2.85Å
405	G	83.7	Confident	87.2	Confident	2 Å²	2	62.7 Å²	62.7	2%	0.021	36%	0.361	C	S	.	.	S	Bend	trans	117.2	1.9	-175.6	0	0	0	0	0	115.2	P381 C382 S403	P381-G405 WeakPolarHBondContact CB-O 3.31Å; C382-G405 PolarHBondContact N-O 2.84Å; C382-G405 WeakPolarHBondContact O-CA 3.02Å; S403-G405 VanDerWaalsContact C-N 3.3Å; S403-G405 PolarHBondContact OG-N 2.6Å
406	S	85.3	Confident	86.8	Confident	58 Å²	58	60.1 Å²	60.1	41%	0.406	35%	0.349	S	S	.	.	S	Bend	trans	-104.5	-87.9	174.2	65	0	0	0	0	113.2	F387 K388 S403 N404	F387-S406 VanDerWaalsContact CA-O 3.23Å; F387-S406 WeakPolarHBondContact CA-O 3.42Å; F387-S406 VanDerWaalsContact CB-O 3.31Å; F387-S406 WeakPolarHBondContact CB-O 3.06Å; K388-S406 PolarHBondContact N-O 2.93Å; K388-S406 VanDerWaalsContact N-O 3.14Å; S403-S406 PolarHBondContact OG-N 3.33Å; N404-S406 PolarHBondContact OD1-N 2.8Å; N404-S406 PolarHBondContact OD1-OG 2.85Å
407	D	89.5	Confident	86.6	Confident	113 Å²	113	57.1 Å²	57.1	60%	0.604	33%	0.33	S	S	*	.			trans	-120.5	148.2	-174	-62.9	-66.1	0	0	0	110.1	T409	D407-T409 PolarHBondContact O-N 3.01Å
408	C	92	Very high	86.3	Confident	43 Å²	43	57 Å²	57	29%	0.291	33%	0.33	S	S	.	.			trans	-74.9	126.5	175.7	-55.8	0	0	0	0	111.1	F387 C397	F387-C408 VanDerWaalsContact CB-SG 3.59Å; F387-C408 WeakPolarHBondContact CD1-SG 3.14Å; F387-C408 VanDerWaalsContact CG-SG 3.59Å; C397-C408 WeakPolarHBondContact CA-SG 3.19Å; C397-C408 HydrophobicContact CB-CB 3.9Å; C397-C408 WeakPolarHBondContact CB-SG 3.48Å; C397-C408 VanDerWaalsContact SG-CA 3.53Å; C397-C408 WeakPolarHBondContact SG-CB 3.33Å; C397-C408 CovalentContact SG-SG 2.04Å; C397-C408 PolarHBondContact SG-SG 3.27Å
409	T	92.4	Very high	86.2	Confident	62 Å²	62	54.5 Å²	54.5	38%	0.38	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136.3	172.1	55.2	0	0	0	0	109.9	S401 Y402 D407	S401-T409 CarbonylContact C-O 3.26Å; S401-T409 WeakPolarHBondContact CA-O 3.43Å; S401-T409 WeakPolarHBondContact CB-O 3.5Å; Y402-T409 VanDerWaalsContact CD1-O 3.23Å; Y402-T409 WeakPolarHBondContact CD1-O 3.35Å; Y402-T409 WeakPolarHBondContact CD1-OG1 3.42Å; Y402-T409 WeakPolarHBondContact CE1-OG1 3.03Å; Y402-T409 VanDerWaalsContact CZ-OG1 3.29Å; Y402-T409 PolarHBondContact N-O 3.2Å; Y402-T409 PolarHBondContact O-N 2.87Å; Y402-T409 PolarHBondContact O-OG1 3.42Å; D407-T409 PolarHBondContact O-N 3.01Å
410	H	90.7	Very high	86.4	Confident	147 Å²	147	47.2 Å²	47.2	68%	0.681	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	146.9	177.6	-82.7	-63	0	0	0	111.6	G400 S401	G400-H410 WeakPolarHBondContact O-CA 3.17Å; G400-H410 PolarHBondContact O-ND1 2.98Å; S401-H410 PolarHBondContact OG-CE1 2.92Å; S401-H410 PolarHBondContact OG-ND1 2.86Å
411	C	86.6	Confident	86.8	Confident	24 Å²	24	47.2 Å²	47.2	16%	0.162	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-63	134.7	173.1	-71.4	0	0	0	0	111	G400 P417 C588	G400-C411 PolarHBondContact O-N 2.9Å; C411-P417 VanDerWaalsContact SG-N 3.44Å; C411-C588 WeakPolarHBondContact CA-SG 3.11Å; C411-C588 HydrophobicContact CB-CB 3.79Å; C411-C588 WeakPolarHBondContact CB-SG 3.48Å; C411-C588 WeakPolarHBondContact SG-CB 3.18Å; C411-C588 CovalentContact SG-SG 2.04Å; C411-C588 PolarHBondContact SG-SG 3.28Å
412	P	86.3	Confident	86.9	Confident	75 Å²	75	48.8 Å²	48.8	49%	0.487	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-55.3	149.5	169.5	-26.5	34.9	0	0	0	112.6	G414 T415	P412-G414 PolarHBondContact O-N 2.89Å; P412-T415 WeakPolarHBondContact CD-OG1 3.48Å; P412-T415 PolarHBondContact O-N 2.87Å; P412-T415 PolarHBondContact O-OG1 3.05Å
413	A	79.5	Confident	87	Confident	99 Å²	99	45.3 Å²	45.3	82%	0.818	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	137.6	171.4	0	0	0	0	0	110.6
414	G	73.2	Confident	87	Confident	19 Å²	19	49.6 Å²	49.6	20%	0.196	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	2	-169.9	0	0	0	0	0	115.2	P412 C591	P412-G414 PolarHBondContact O-N 2.89Å; G414-C591 PolarHBondContact O-N 2.88Å
415	T	79.7	Confident	87	Confident	34 Å²	34	48.9 Å²	48.9	21%	0.209	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	148.1	179.6	72.2	0	0	0	0	113.1	P412 C588 R589	P412-T415 WeakPolarHBondContact CD-OG1 3.48Å; P412-T415 PolarHBondContact O-N 2.87Å; P412-T415 PolarHBondContact O-OG1 3.05Å; T415-C588 WeakPolarHBondContact OG1-CB 3.39Å; T415-R589 CarbonylContact C-O 3.56Å; T415-R589 VanDerWaalsContact CA-O 3.22Å; T415-R589 WeakPolarHBondContact CA-O 3.31Å; T415-R589 VanDerWaalsContact CB-O 3.31Å; T415-R589 WeakPolarHBondContact CB-O 3.13Å
416	E	80.8	Confident	87.3	Confident	42 Å²	42	48.8 Å²	48.8	20%	0.196	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	153.3	174.1	67	173.3	-173.1	0	0	111.4	A418 C588 R589 C591 C602	E416-A418 PolarHBondContact O-N 3.5Å; E416-C588 CarbonylContact O-C 3.6Å; E416-C588 WeakPolarHBondContact O-CA 3.29Å; E416-C588 WeakPolarHBondContact O-CB 3.48Å; E416-R589 HydrophobicContact CG-CG 3.75Å; E416-R589 PolarHBondContact N-O 2.79Å; E416-R589 PolarHBondContact O-N 3.06Å; E416-R589 IonicContact OE1-CZ 3.45Å; E416-R589 IonicContact OE1-NE 3.74Å; E416-R589 PolarHBondContact OE1-NE 3.08Å; E416-R589 IonicContact OE1-NH2 3.88Å; E416-R589 PolarHBondContact OE1-NH2 3.22Å; E416-C591 HydrophobicContact CB-CB 4.1Å; E416-C591 HydrophobicContact CG-CB 3.99Å; E416-C602 HydrophobicContact CB-CB 4.29Å
417	P	85.4	Confident	87.1	Confident	13 Å²	13	46.7 Å²	46.7	8%	0.084	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	128.8	174.7	26.9	-35.1	0	0	0	111.3	Y399 C411 V419 A585	Y399-P417 HydrophobicContact CE2-CG 4.45Å; C411-P417 VanDerWaalsContact SG-N 3.44Å; P417-V419 VanDerWaalsContact C-N 3.33Å; P417-V419 HydrophobicContact CB-CG1 4.4Å; P417-V419 HydrophobicContact CG-CG1 4.4Å; P417-V419 PolarHBondContact O-N 2.04Å; P417-A585 HydrophobicContact CB-CB 3.5Å; P417-A585 VanDerWaalsContact CB-CB 3.5Å
418	A	85.8	Confident	87	Confident	12 Å²	12	44.9 Å²	44.9	10%	0.099	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	81.5	175.1	0	0	0	0	0	110.8	E416 Y587 R589	E416-A418 PolarHBondContact O-N 3.5Å; A418-Y587 HydrophobicContact CB-CD1 4.37Å; A418-Y587 HydrophobicContact CB-CD2 4.1Å; A418-Y587 HydrophobicContact CB-CE1 3.99Å; A418-Y587 HydrophobicContact CB-CE2 3.72Å; A418-Y587 HydrophobicContact CB-CG 4.4Å; A418-Y587 WeakPolarHBondContact CB-O 3.18Å; A418-Y587 PolarHBondContact N-O 2.68Å; A418-R589 HydrophobicContact CB-CG 4.34Å
419	V	87.1	Confident	86.8	Confident	23 Å²	23	45.3 Å²	45.3	14%	0.139	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	134.3	-171.5	-65.7	0	0	0	0	114.3	P417 N579 V580 V584	P417-V419 VanDerWaalsContact C-N 3.33Å; P417-V419 HydrophobicContact CB-CG1 4.4Å; P417-V419 HydrophobicContact CG-CG1 4.4Å; P417-V419 PolarHBondContact O-N 2.04Å; V419-N579 WeakPolarHBondContact O-CA 3.45Å; V419-N579 PolarHBondContact O-N 3.06Å; V419-V580 PolarHBondContact O-N 2.85Å; V419-V584 CarbonylContact C-O 3.56Å; V419-V584 WeakPolarHBondContact CA-O 3.36Å
420	G	90.5	Very high	86.6	Confident	8 Å²	8	43.2 Å²	43.2	8%	0.082	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.4	-158.6	-178.7	0	0	0	0	0	112.2	V577 G583 V584	G420-V577 CarbonylContact C-O 3.47Å; G420-V577 WeakPolarHBondContact CA-O 3.21Å; G420-G583 WeakPolarHBondContact O-CA 3.34Å; G420-V584 PolarHBondContact N-O 3.07Å; G420-V584 PolarHBondContact O-N 2.9Å; G420-V584 VanDerWaalsContact O-O 3.07Å
421	F	92.3	Very high	86.5	Confident	20 Å²	20	42.5 Å²	42.5	9%	0.088	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	128.2	166.1	-67	-49	0	0	0	109.9	Y423 N432 N576 V577 V580 V584	F421-Y423 HydrophobicContact CB-CD2 4.24Å; F421-Y423 HydrophobicContact CB-CE1 4.44Å; F421-Y423 HydrophobicContact CB-CE2 3.59Å; F421-Y423 WeakPolarHBondContact CD1-OH 3.5Å; F421-Y423 HydrophobicContact CD2-CE2 4.37Å; F421-Y423 HydrophobicContact CG-CE2 4.02Å; F421-Y423 AromaticContact CG-CZ 3.79Å; F421-Y423 VanDerWaalsContact CG-OH 3.31Å; F421-Y423 WeakPolarHBondContact CG-OH 3.08Å; F421-N432 WeakPolarHBondContact CE2-ND2 3.17Å; F421-N576 CarbonylContact O-C 3.5Å; F421-N576 VanDerWaalsContact O-CA 3.29Å; F421-N576 WeakPolarHBondContact O-CA 3.45Å; F421-N576 PolarHBondContact O-OD1 2.74Å; F421-V577 PolarHBondContact N-O 3.32Å; F421-V577 PolarHBondContact O-N 3.14Å; F421-V580 HydrophobicContact CD2-CG1 4.16Å; F421-V580 HydrophobicContact CD2-CG2 4.07Å; F421-V580 HydrophobicContact CE2-CB 4.46Å; F421-V580 HydrophobicContact CE2-CG1 3.65Å; F421-V580 HydrophobicContact CE2-CG2 4.39Å; F421-V580 HydrophobicContact CZ-CG1 4.01Å; F421-V584 HydrophobicContact CD1-CG2 4.34Å
422	E	92.9	Very high	86.6	Confident	39 Å²	39	43.1 Å²	43.1	18%	0.182	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	81.4	-179	-168.9	-178.8	162.5	0	0	109.8	P384 K424 S586	P384-E422 HydrophobicContact CB-CB 4.43Å; P384-E422 WeakPolarHBondContact CD-O 3.3Å; E422-K424 HydrophobicContact CG-CD 4.35Å; E422-K424 WeakPolarHBondContact OE1-CE 3.32Å; E422-K424 IonicContact OE1-NZ 2.65Å; E422-K424 PolarHBondContact OE1-NZ 2.85Å; E422-S586 WeakPolarHBondContact OE2-CB 2.75Å; E422-S586 PolarHBondContact OE2-OG 2.88Å
423	Y	93.4	Very high	86.8	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.008	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	123.8	-179.4	-54.2	-59.2	0	0	0	110.9	N383 F386 F421 W426 P430 N432 M433 L474 S574 I575	N383-Y423 HydrophobicContact CB-CD1 4.43Å; F386-Y423 HydrophobicContact CE2-CE1 4.32Å; F386-Y423 HydrophobicContact CZ-CE1 4.49Å; F421-Y423 HydrophobicContact CB-CD2 4.24Å; F421-Y423 HydrophobicContact CB-CE1 4.44Å; F421-Y423 HydrophobicContact CB-CE2 3.59Å; F421-Y423 WeakPolarHBondContact CD1-OH 3.5Å; F421-Y423 HydrophobicContact CD2-CE2 4.37Å; F421-Y423 HydrophobicContact CG-CE2 4.02Å; F421-Y423 AromaticContact CG-CZ 3.79Å; F421-Y423 VanDerWaalsContact CG-OH 3.31Å; F421-Y423 WeakPolarHBondContact CG-OH 3.08Å; Y423-W426 HydrophobicContact CG-CH2 4.35Å; Y423-P430 HydrophobicContact CD1-CB 4.42Å; Y423-P430 HydrophobicContact CD1-CG 3.6Å; Y423-P430 HydrophobicContact CD2-CG 4.38Å; Y423-P430 HydrophobicContact CE1-CB 3.74Å; Y423-P430 HydrophobicContact CE1-CG 3.43Å; Y423-P430 VanDerWaalsContact CE1-CG 3.43Å; Y423-P430 HydrophobicContact CE2-CG 4.23Å; Y423-P430 HydrophobicContact CG-CG 4.09Å; Y423-N432 PolarHBondContact OH-ND2 3.18Å; Y423-N432 PolarHBondContact OH-OD1 3.29Å; Y423-M433 HydrophobicContact CD2-CE 3.47Å; Y423-M433 VanDerWaalsContact CD2-CE 3.47Å; Y423-M433 HydrophobicContact CE2-CE 3.62Å; Y423-M433 HydrophobicContact CG-CE 4.28Å; Y423-L474 HydrophobicContact CE2-CD1 4.23Å; Y423-S574 CarbonylContact O-C 3.54Å; Y423-S574 WeakPolarHBondContact O-CA 3.37Å; Y423-S574 VanDerWaalsContact O-CB 3.31Å; Y423-S574 WeakPolarHBondContact O-CB 3.3Å; Y423-I575 HydrophobicContact CD2-CB 4.34Å; Y423-I575 PolarHBondContact N-O 2.93Å; Y423-I575 PolarHBondContact O-N 3.47Å
424	K	90.8	Very high	87.2	Confident	93 Å²	93	41.9 Å²	41.9	40%	0.404	23%	0.229	S	C	.	.			trans	-140.3	-32.4	-176.8	-75.3	175.1	166.4	172.3	0	113.1	N383 E422 W426	N383-K424 PolarHBondContact OD1-N 3.13Å; E422-K424 HydrophobicContact CG-CD 4.35Å; E422-K424 WeakPolarHBondContact OE1-CE 3.32Å; E422-K424 IonicContact OE1-NZ 2.65Å; E422-K424 PolarHBondContact OE1-NZ 2.85Å; K424-W426 PolarHBondContact O-NE1 3.41Å
425	W	89.7	Confident	87.8	Confident	98 Å²	98	42 Å²	42	37%	0.371	23%	0.226	S	C	.	.			trans	-106.9	126.6	179.5	-54.1	121.9	0	0	0	110	P380 P381 N383	P380-W425 HydrophobicContact CB-CD2 3.77Å; P380-W425 HydrophobicContact CB-CE3 3.71Å; P380-W425 HydrophobicContact CB-CG 4.13Å; P380-W425 HydrophobicContact CB-CZ3 4.18Å; P380-W425 HydrophobicContact CG-CB 4.24Å; P380-W425 HydrophobicContact CG-CD2 4.3Å; P380-W425 HydrophobicContact CG-CE3 4.09Å; P380-W425 HydrophobicContact CG-CG 4.39Å; P381-W425 VanDerWaalsContact O-CD1 3.22Å; N383-W425 PolarHBondContact ND2-O 3.44Å; N383-W425 PolarHBondContact OD1-N 3.21Å; N383-W425 PolarHBondContact OD1-O 3.16Å
426	W	89.6	Confident	87.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-119.8	65.9	-169.4	-55.9	96.2	0	0	0	110.2	Y423 K424 M433 V453 G455 H457 I458 Y573 I575	Y423-W426 HydrophobicContact CG-CH2 4.35Å; K424-W426 PolarHBondContact O-NE1 3.41Å; W426-M433 HydrophobicContact CH2-CE 4.09Å; W426-M433 HydrophobicContact CH2-SD 4.37Å; W426-M433 HydrophobicContact CZ3-CE 4.22Å; W426-M433 HydrophobicContact CZ3-SD 3.97Å; W426-V453 HydrophobicContact CB-CG1 4.42Å; W426-V453 WeakPolarHBondContact O-CB 3.1Å; W426-G455 PolarHBondContact N-O 3.13Å; W426-G455 WeakPolarHBondContact O-CA 3.07Å; W426-G455 PolarHBondContact O-N 3.07Å; W426-G455 VanDerWaalsContact O-N 3.09Å; W426-H457 WeakPolarHBondContact CB-O 3.02Å; W426-H457 VanDerWaalsContact CD1-CA 3.4Å; W426-I458 HydrophobicContact CB-CG2 4.04Å; W426-I458 HydrophobicContact CD2-CB 4.46Å; W426-I458 HydrophobicContact CD2-CG1 4.19Å; W426-I458 HydrophobicContact CD2-CG2 3.73Å; W426-I458 HydrophobicContact CE3-CB 4.4Å; W426-I458 HydrophobicContact CE3-CD1 4.25Å; W426-I458 HydrophobicContact CE3-CG1 4.16Å; W426-I458 HydrophobicContact CE3-CG2 3.45Å; W426-I458 VanDerWaalsContact CE3-CG2 3.45Å; W426-I458 HydrophobicContact CG-CG2 4.01Å; W426-I458 HydrophobicContact CH2-CD1 4.05Å; W426-I458 HydrophobicContact CH2-CG1 4.35Å; W426-I458 HydrophobicContact CZ2-CG1 4.39Å; W426-I458 HydrophobicContact CZ3-CD1 3.9Å; W426-I458 HydrophobicContact CZ3-CG1 4.24Å; W426-I458 HydrophobicContact CZ3-CG2 4.16Å; W426-Y573 PolarHBondContact NE1-O 2.8Å; W426-I575 HydrophobicContact CH2-CD1 4.07Å; W426-I575 HydrophobicContact CH2-CG1 4.36Å
427	N	81.9	Confident	87.7	Confident	14 Å²	14	39.6 Å²	39.6	8%	0.075	21%	0.214	C	C	.	.	S	Bend	trans	-83.7	-31.6	170.8	-57.8	-26.2	0	0	0	111.4	P380	P380-N427 VanDerWaalsContact CD-OD1 3.3Å; P380-N427 WeakPolarHBondContact CD-OD1 3.4Å; P380-N427 VanDerWaalsContact CG-OD1 3.22Å; P380-N427 WeakPolarHBondContact CG-OD1 3.41Å
428	T	86.3	Confident	86.9	Confident	76 Å²	76	41.4 Å²	41.4	47%	0.466	22%	0.223	S	C	.	.	S	Bend	trans	-150.9	148.1	-179.7	51.6	0	0	0	0	108.1	A341	A341-T428 HydrophobicContact CB-CG2 3.69Å
429	L	88.1	Confident	85.8	Confident	51 Å²	51	41.8 Å²	41.8	27%	0.267	22%	0.224	S	C	.	.			trans	-65.6	139.3	170.6	-72.8	172.6	0	0	0	110.4	M433 T435 V453 I458 L472	L429-M433 HydrophobicContact CD2-SD 4.47Å; L429-T435 HydrophobicContact CD1-CG2 4.11Å; L429-V453 HydrophobicContact CD2-CG1 4.42Å; L429-V453 HydrophobicContact CG-CG1 4.24Å; L429-I458 HydrophobicContact CD2-CG2 3.95Å; L429-L472 HydrophobicContact CD2-CD1 4.29Å
430	P	88.9	Confident	84.1	Confident	18 Å²	18	41.3 Å²	41.3	12%	0.117	23%	0.225	C	C	.	.			trans	-57.2	149.4	170.5	-25.4	34.9	0	0	0	112.7	Y423 N432 M433	Y423-P430 HydrophobicContact CD1-CB 4.42Å; Y423-P430 HydrophobicContact CD1-CG 3.6Å; Y423-P430 HydrophobicContact CD2-CG 4.38Å; Y423-P430 HydrophobicContact CE1-CB 3.74Å; Y423-P430 HydrophobicContact CE1-CG 3.43Å; Y423-P430 VanDerWaalsContact CE1-CG 3.43Å; Y423-P430 HydrophobicContact CE2-CG 4.23Å; Y423-P430 HydrophobicContact CG-CG 4.09Å; P430-N432 VanDerWaalsContact CB-OD1 3.3Å; P430-N432 WeakPolarHBondContact CB-OD1 3.35Å; P430-N432 PolarHBondContact O-N 2.79Å; P430-N432 VanDerWaalsContact O-N 3.12Å; P430-M433 HydrophobicContact CB-CG 4.26Å; P430-M433 HydrophobicContact CG-CE 4.19Å; P430-M433 HydrophobicContact CG-CG 4.3Å; P430-M433 HydrophobicContact CG-SD 3.96Å; P430-M433 PolarHBondContact O-N 2.77Å
431	S	87.1	Confident	81.9	Confident	133 Å²	133	44.8 Å²	44.8	93%	0.93	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-11.1	-177.4	52.5	0	0	0	0	115.3
432	N	88.9	Confident	79.6	Confident	37 Å²	37	47.9 Å²	47.9	20%	0.198	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	12.2	171.5	63.7	-36	0	0	0	113.2	F421 Y423 P430 L474 V475	F421-N432 WeakPolarHBondContact CE2-ND2 3.17Å; Y423-N432 PolarHBondContact OH-ND2 3.18Å; Y423-N432 PolarHBondContact OH-OD1 3.29Å; P430-N432 VanDerWaalsContact CB-OD1 3.3Å; P430-N432 WeakPolarHBondContact CB-OD1 3.35Å; P430-N432 PolarHBondContact O-N 2.79Å; P430-N432 VanDerWaalsContact O-N 3.12Å; N432-L474 VanDerWaalsContact ND2-CD1 3.29Å; N432-L474 WeakPolarHBondContact ND2-CD1 3.29Å; N432-V475 PolarHBondContact ND2-O 3Å; N432-V475 PolarHBondContact O-N 2.81Å
433	M	90.4	Very high	77.4	Confident	17 Å²	17	50.1 Å²	50.1	8%	0.084	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	135.4	167.6	-68.7	-172.7	-176.3	0	0	111	Y423 W426 L429 P430 L472 T473 L474 I575	Y423-M433 HydrophobicContact CD2-CE 3.47Å; Y423-M433 VanDerWaalsContact CD2-CE 3.47Å; Y423-M433 HydrophobicContact CE2-CE 3.62Å; Y423-M433 HydrophobicContact CG-CE 4.28Å; W426-M433 HydrophobicContact CH2-CE 4.09Å; W426-M433 HydrophobicContact CH2-SD 4.37Å; W426-M433 HydrophobicContact CZ3-CE 4.22Å; W426-M433 HydrophobicContact CZ3-SD 3.97Å; L429-M433 HydrophobicContact CD2-SD 4.47Å; P430-M433 HydrophobicContact CB-CG 4.26Å; P430-M433 HydrophobicContact CG-CE 4.19Å; P430-M433 HydrophobicContact CG-CG 4.3Å; P430-M433 HydrophobicContact CG-SD 3.96Å; P430-M433 PolarHBondContact O-N 2.77Å; M433-L472 HydrophobicContact CB-CD1 4.33Å; M433-L472 HydrophobicContact SD-CD1 4.33Å; M433-T473 CarbonylContact C-O 3.6Å; M433-T473 VanDerWaalsContact CA-O 3.28Å; M433-T473 WeakPolarHBondContact CA-O 3.07Å; M433-L474 HydrophobicContact CE-CB 4.26Å; M433-L474 HydrophobicContact CE-CD1 3.87Å; M433-L474 HydrophobicContact CE-CD2 4.05Å; M433-L474 HydrophobicContact CE-CG 4.28Å; M433-L474 HydrophobicContact CG-CB 4.16Å; M433-L474 HydrophobicContact CG-CD1 3.85Å; M433-I575 HydrophobicContact CE-CD1 3.8Å
434	E	88.1	Confident	75.4	Confident	130 Å²	130	54.5 Å²	54.5	61%	0.607	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.7	148.6	171.8	-175.7	168.9	-149.4	0	0	109.6	T436 T473	E434-T436 HydrophobicContact CG-CG2 4.32Å; E434-T473 PolarHBondContact N-O 2.98Å; E434-T473 PolarHBondContact O-N 3.45Å
435	T	86.9	Confident	73.9	Confident	22 Å²	22	54 Å²	54	14%	0.135	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.4	172	-178.1	0	0	0	0	110.7	L429 T449 G450 W451 I471	L429-T435 HydrophobicContact CD1-CG2 4.11Å; T435-T449 HydrophobicContact CG2-CG2 3.98Å; T435-G450 VanDerWaalsContact OG1-CA 3.28Å; T435-G450 WeakPolarHBondContact OG1-CA 3.11Å; T435-G450 PolarHBondContact OG1-N 2.91Å; T435-W451 PolarHBondContact OG1-N 2.83Å; T435-I471 WeakPolarHBondContact CA-O 3.35Å; T435-I471 WeakPolarHBondContact CB-O 3.23Å; T435-I471 PolarHBondContact OG1-O 3.15Å
436	T	80	Confident	72	Confident	24 Å²	24	58 Å²	58	15%	0.147	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	162.1	-179.7	56.6	0	0	0	0	110.3	E434 I471	E434-T436 HydrophobicContact CG-CG2 4.32Å; T436-I471 PolarHBondContact N-O 2.95Å; T436-I471 WeakPolarHBondContact O-CB 3.16Å; T436-I471 PolarHBondContact O-N 3.03Å
437	V	77.2	Confident	70.4	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.006	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	121.5	173.8	-175.7	0	0	0	0	108.4	Y445 L448 D468 F469 M470	V437-Y445 HydrophobicContact CB-CD2 4.3Å; V437-Y445 HydrophobicContact CG1-CD2 3.97Å; V437-Y445 PolarHBondContact O-N 2.97Å; V437-L448 HydrophobicContact CB-CB 4.27Å; V437-L448 HydrophobicContact CG2-CB 3.86Å; V437-D468 HydrophobicContact CG1-CB 3.83Å; V437-F469 WeakPolarHBondContact CA-O 3.41Å; V437-M470 HydrophobicContact CB-SD 4.44Å; V437-M470 HydrophobicContact CG1-SD 3.8Å; V437-M470 HydrophobicContact CG2-CE 4.2Å; V437-M470 HydrophobicContact CG2-SD 3.85Å
438	L	68.9	Low	69.9	Low	52 Å²	52	62.8 Å²	62.8	27%	0.272	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	116.2	175.3	-65.7	-177.6	0	0	0	109.6	E444 F469 I471	L438-E444 HydrophobicContact CD2-CB 4.02Å; L438-F469 HydrophobicContact CB-CB 4.44Å; L438-F469 PolarHBondContact N-O 3.14Å; L438-F469 VanDerWaalsContact N-O 3.13Å; L438-F469 PolarHBondContact O-N 2.84Å; L438-I471 HydrophobicContact CB-CD1 4.3Å; L438-I471 HydrophobicContact CD1-CD1 3.63Å; L438-I471 HydrophobicContact CG-CD1 3.87Å
439	S	63.5	Low	69.4	Low	19 Å²	19	61.9 Å²	61.9	13%	0.133	34%	0.342	C	S	.	.			trans	-80.7	158.9	167.6	-155.3	0	0	0	0	111	I441 N442 D468	S439-I441 PolarHBondContact O-N 3.03Å; S439-N442 PolarHBondContact O-N 3.08Å; S439-D468 WeakPolarHBondContact CA-OD1 3.48Å; S439-D468 WeakPolarHBondContact CB-OD1 3.03Å; S439-D468 PolarHBondContact OG-OD1 3.23Å
440	G	50.5	Low	69.2	Low	14 Å²	14	59.4 Å²	59.4	14%	0.144	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	16.7	-178.8	0	0	0	0	0	116.7	W228	W228-G440 PolarHBondContact NE1-O 2.61Å; W228-G440 VanDerWaalsContact NE1-O 3.1Å
441	I	43.9	Very low	69.3	Low	81 Å²	81	58.6 Å²	58.6	42%	0.415	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129	27.7	-179.6	52.4	170	0	0	0	111.6	S439 F443	S439-I441 PolarHBondContact O-N 3.03Å; I441-F443 HydrophobicContact CB-CD2 4.41Å; I441-F443 HydrophobicContact CD1-CD2 3.86Å; I441-F443 HydrophobicContact CD1-CE2 4.49Å; I441-F443 HydrophobicContact CG1-CD2 3.98Å; I441-F443 VanDerWaalsContact O-CD2 3.31Å; I441-F443 WeakPolarHBondContact O-CD2 3.44Å; I441-F443 PolarHBondContact O-N 3.46Å
442	N	44.1	Very low	69.5	Low	84 Å²	84	52.8 Å²	52.8	45%	0.449	28%	0.282	S	S	.	.	S	Bend	trans	55.8	8.9	175.6	-65.3	15.2	0	0	0	116.6	W228 S439 E444	W228-N442 PolarHBondContact N-OD1 2.83Å; W228-N442 PolarHBondContact O-ND2 2.85Å; S439-N442 PolarHBondContact O-N 3.08Å; N442-E444 PolarHBondContact O-N 2.9Å
443	F	48.1	Very low	69.7	Low	87 Å²	87	51.7 Å²	51.7	38%	0.382	28%	0.277	S	S	.	.			trans	-82.1	109.7	173.3	-75.8	-71.1	0	0	0	110.5	L294 K319 I441 Y445	L294-F443 HydrophobicContact CD1-CE2 4.3Å; L294-F443 HydrophobicContact CD1-CZ 4.07Å; K319-F443 VanDerWaalsContact NZ-CZ 3.33Å; I441-F443 HydrophobicContact CB-CD2 4.41Å; I441-F443 HydrophobicContact CD1-CD2 3.86Å; I441-F443 HydrophobicContact CD1-CE2 4.49Å; I441-F443 HydrophobicContact CG1-CD2 3.98Å; I441-F443 VanDerWaalsContact O-CD2 3.31Å; I441-F443 WeakPolarHBondContact O-CD2 3.44Å; I441-F443 PolarHBondContact O-N 3.46Å; F443-Y445 PolarHBondContact O-N 2.97Å
444	E	51.4	Low	69.6	Low	94 Å²	94	51.2 Å²	51.2	44%	0.439	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-66.7	116.1	163	178.9	-177.6	-119.3	0	0	109.9	L438 N442 K446	L438-E444 HydrophobicContact CD2-CB 4.02Å; N442-E444 PolarHBondContact O-N 2.9Å; E444-K446 VanDerWaalsContact C-N 3.32Å; E444-K446 HydrophobicContact CG-CG 4.19Å; E444-K446 PolarHBondContact O-N 2.99Å; E444-K446 WeakPolarHBondContact OE2-CE 3.25Å; E444-K446 IonicContact OE2-NZ 2.67Å
445	Y	58.1	Low	69.4	Low	82 Å²	82	45.6 Å²	45.6	32%	0.322	25%	0.253	S	S	.	.			trans	-79.3	80.1	175.3	-71.4	-64.7	0	0	0	111.1	V437 F443 G447 L448 A464	V437-Y445 HydrophobicContact CB-CD2 4.3Å; V437-Y445 HydrophobicContact CG1-CD2 3.97Å; V437-Y445 PolarHBondContact O-N 2.97Å; F443-Y445 PolarHBondContact O-N 2.97Å; Y445-G447 PolarHBondContact O-N 2.94Å; Y445-L448 HydrophobicContact CD1-CD1 4.24Å; Y445-L448 HydrophobicContact CD2-CD1 3.85Å; Y445-L448 HydrophobicContact CG-CD1 3.66Å; Y445-L448 HydrophobicContact CG-CG 4.39Å; Y445-L448 PolarHBondContact O-N 2.95Å; Y445-A464 HydrophobicContact CE2-CB 3.91Å
446	K	50.1	Low	69.5	Low	182 Å²	182	48.6 Å²	48.6	79%	0.791	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	112.6	175.5	-65.4	-164.5	171	-169.6	0	111	E444	E444-K446 VanDerWaalsContact C-N 3.32Å; E444-K446 HydrophobicContact CG-CG 4.19Å; E444-K446 PolarHBondContact O-N 2.99Å; E444-K446 WeakPolarHBondContact OE2-CE 3.25Å; E444-K446 IonicContact OE2-NZ 2.67Å
447	G	57	Low	70.1	Confident	79 Å²	79	48 Å²	48	81%	0.814	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.3	-1.3	-179.2	0	0	0	0	0	116.2	Y445	Y445-G447 PolarHBondContact O-N 2.94Å
448	L	70.6	Confident	70.9	Confident	35 Å²	35	48 Å²	48	18%	0.183	26%	0.263	C	S	.	.			trans	-90.5	129.9	167	-67.5	-172.8	0	0	0	111.1	M356 V437 Y445	M356-L448 HydrophobicContact CB-CD2 3.51Å; V437-L448 HydrophobicContact CB-CB 4.27Å; V437-L448 HydrophobicContact CG2-CB 3.86Å; Y445-L448 HydrophobicContact CD1-CD1 4.24Å; Y445-L448 HydrophobicContact CD2-CD1 3.85Å; Y445-L448 HydrophobicContact CG-CD1 3.66Å; Y445-L448 HydrophobicContact CG-CG 4.39Å; Y445-L448 PolarHBondContact O-N 2.95Å
449	T	75.9	Confident	72.2	Confident	57 Å²	57	46.2 Å²	46.2	35%	0.35	25%	0.253	S	S	.	.			trans	-82.7	117.7	170.7	38.8	0	0	0	0	110.3	T435 E452 A461	T435-T449 HydrophobicContact CG2-CG2 3.98Å; T449-E452 WeakPolarHBondContact CB-OE1 3.35Å; T449-E452 PolarHBondContact OG1-OE1 2.89Å; T449-A461 WeakPolarHBondContact O-CB 3.49Å
450	G	83.5	Confident	73.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-77.5	-31	174.9	0	0	0	0	0	112.8	T435 T460 A461	T435-G450 VanDerWaalsContact OG1-CA 3.28Å; T435-G450 WeakPolarHBondContact OG1-CA 3.11Å; T435-G450 PolarHBondContact OG1-N 2.91Å; G450-T460 CarbonylContact O-C 3.58Å; G450-T460 WeakPolarHBondContact O-CA 3.27Å; G450-A461 PolarHBondContact O-N 2.76Å
451	W	91.5	Very high	75.3	Confident	1 Å²	1	44.7 Å²	44.7	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	139.5	179.3	-69.5	70.8	0	0	0	110.5	T435 I458 Y459 T460 M470 L472 L511 W551 F553 A570 I572	T435-W451 PolarHBondContact OG1-N 2.83Å; W451-I458 HydrophobicContact CE3-CB 4.42Å; W451-I458 HydrophobicContact CE3-CD1 4.24Å; W451-I458 HydrophobicContact CE3-CG1 4.35Å; W451-Y459 CarbonylContact C-O 3.58Å; W451-Y459 VanDerWaalsContact CA-O 3.28Å; W451-Y459 WeakPolarHBondContact CA-O 3.13Å; W451-T460 HydrophobicContact CD2-CG2 3.85Å; W451-T460 VanDerWaalsContact CE2-CG2 3.44Å; W451-T460 HydrophobicContact CE3-CG2 4.14Å; W451-T460 HydrophobicContact CH2-CG2 3.75Å; W451-T460 HydrophobicContact CZ2-CG2 3.41Å; W451-T460 VanDerWaalsContact CZ2-CG2 3.41Å; W451-T460 HydrophobicContact CZ3-CG2 4.09Å; W451-M470 PolarHBondContact NE1-O 2.88Å; W451-L472 HydrophobicContact CD2-CB 4.05Å; W451-L472 HydrophobicContact CG-CB 3.86Å; W451-L511 HydrophobicContact CZ2-CD1 4.46Å; W451-W551 HydrophobicContact CZ2-CB 4.07Å; W451-F553 HydrophobicContact CZ2-CB 4.48Å; W451-A570 HydrophobicContact CH2-CB 3.85Å; W451-A570 HydrophobicContact CZ2-CB 4.41Å; W451-I572 HydrophobicContact CH2-CD1 3.65Å; W451-I572 HydrophobicContact CH2-CG1 3.89Å; W451-I572 HydrophobicContact CZ2-CD1 4.44Å; W451-I572 HydrophobicContact CZ3-CB 4.46Å; W451-I572 HydrophobicContact CZ3-CD1 3.75Å; W451-I572 HydrophobicContact CZ3-CG1 3.8Å
452	E	91.8	Very high	77	Confident	11 Å²	11	41.6 Å²	41.6	5%	0.051	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	163.2	-176.8	-75.9	-92.6	175.1	0	0	111.6	F336 T338 K353 T449 I458 Y459 A461	F336-E452 HydrophobicContact CD2-CG 4.21Å; F336-E452 HydrophobicContact CE2-CB 4.33Å; F336-E452 HydrophobicContact CE2-CG 3.54Å; F336-E452 HydrophobicContact CZ-CG 4.25Å; T338-E452 WeakPolarHBondContact CB-OE2 3.42Å; T338-E452 PolarHBondContact OG1-OE2 3.17Å; K353-E452 IonicContact NZ-OE1 2.6Å; K353-E452 PolarHBondContact NZ-OE1 3.02Å; K353-E452 IonicContact NZ-OE2 3.83Å; K353-E452 PolarHBondContact NZ-OE2 2.85Å; T449-E452 WeakPolarHBondContact CB-OE1 3.35Å; T449-E452 PolarHBondContact OG1-OE1 2.89Å; E452-I458 WeakPolarHBondContact O-CA 3.15Å; E452-Y459 HydrophobicContact CB-CE1 4.38Å; E452-Y459 PolarHBondContact N-O 2.84Å; E452-Y459 PolarHBondContact O-N 2.77Å; E452-A461 HydrophobicContact CG-CB 3.96Å
453	V	91.3	Very high	78.3	Confident	13 Å²	13	37.8 Å²	37.8	8%	0.079	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	125.1	-167.9	-77.1	0	0	0	0	113	T338 H339 W426 L429 I458	T338-V453 WeakPolarHBondContact CA-O 3.49Å; T338-V453 WeakPolarHBondContact OG1-CG2 3.28Å; T338-V453 PolarHBondContact OG1-O 2.99Å; H339-V453 PolarHBondContact N-O 3.44Å; H339-V453 PolarHBondContact ND1-O 3.17Å; W426-V453 HydrophobicContact CB-CG1 4.42Å; W426-V453 WeakPolarHBondContact O-CB 3.1Å; L429-V453 HydrophobicContact CD2-CG1 4.42Å; L429-V453 HydrophobicContact CG-CG1 4.24Å; V453-I458 HydrophobicContact CG1-CG2 3.84Å
454	A	88.9	Confident	79.4	Confident	7 Å²	7	34.3 Å²	34.3	6%	0.058	19%	0.193	C	C	.	.			trans	-119	17.4	-176.3	0	0	0	0	0	113.8	Y337 H339 D456 H457 Y459	Y337-A454 HydrophobicContact CE2-CB 4.04Å; H339-A454 WeakPolarHBondContact ND1-CA 3.39Å; A454-D456 PolarHBondContact O-N 3.28Å; A454-D456 VanDerWaalsContact O-N 3.09Å; A454-H457 CarbonylContact C-O 3.45Å; A454-H457 WeakPolarHBondContact CA-O 3.35Å; A454-H457 WeakPolarHBondContact CB-CE1 3.4Å; A454-H457 WeakPolarHBondContact CB-O 3.46Å; A454-H457 PolarHBondContact N-O 3.07Å; A454-Y459 HydrophobicContact CB-CD1 3.92Å; A454-Y459 HydrophobicContact CB-CE1 4.19Å
455	G	84.9	Confident	80.5	Confident	13 Å²	13	30.8 Å²	30.8	13%	0.134	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	84.8	-69.3	174.3	0	0	0	0	0	113.5	W426	W426-G455 PolarHBondContact N-O 3.13Å; W426-G455 WeakPolarHBondContact O-CA 3.07Å; W426-G455 PolarHBondContact O-N 3.07Å; W426-G455 VanDerWaalsContact O-N 3.09Å
456	D	88.1	Confident	81.3	Confident	85 Å²	85	27.3 Å²	27.3	46%	0.455	17%	0.165	S	C	.	.	S	Bend	trans	-90.4	-7.8	175.6	82.4	-49.5	0	0	0	113.3	A454 Y573	A454-D456 PolarHBondContact O-N 3.28Å; A454-D456 VanDerWaalsContact O-N 3.09Å; D456-Y573 WeakPolarHBondContact O-CD1 3.49Å; D456-Y573 WeakPolarHBondContact OD2-CE1 3.21Å
457	H	93.2	Very high	82.5	Confident	11 Å²	11	19 Å²	19	5%	0.051	13%	0.13	C	C	.	.			trans	-152.6	168.7	175.6	64.8	-75.5	0	0	0	112.1	W426 A454 I572 Y573	W426-H457 WeakPolarHBondContact CB-O 3.02Å; W426-H457 VanDerWaalsContact CD1-CA 3.4Å; A454-H457 CarbonylContact C-O 3.45Å; A454-H457 WeakPolarHBondContact CA-O 3.35Å; A454-H457 WeakPolarHBondContact CB-CE1 3.4Å; A454-H457 WeakPolarHBondContact CB-O 3.46Å; A454-H457 PolarHBondContact N-O 3.07Å; H457-I572 WeakPolarHBondContact CA-O 3.27Å; H457-I572 WeakPolarHBondContact CB-O 3.36Å; H457-Y573 HydrophobicContact CB-CD1 3.64Å; H457-Y573 HydrophobicContact CB-CE1 3.74Å; H457-Y573 HydrophobicContact CB-CG 4.18Å
458	I	94.6	Very high	83.5	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	150.5	157.1	45.2	168	0	0	0	109.5	W426 L429 W451 E452 V453 L472 K571 I572	W426-I458 HydrophobicContact CB-CG2 4.04Å; W426-I458 HydrophobicContact CD2-CB 4.46Å; W426-I458 HydrophobicContact CD2-CG1 4.19Å; W426-I458 HydrophobicContact CD2-CG2 3.73Å; W426-I458 HydrophobicContact CE3-CB 4.4Å; W426-I458 HydrophobicContact CE3-CD1 4.25Å; W426-I458 HydrophobicContact CE3-CG1 4.16Å; W426-I458 HydrophobicContact CE3-CG2 3.45Å; W426-I458 VanDerWaalsContact CE3-CG2 3.45Å; W426-I458 HydrophobicContact CG-CG2 4.01Å; W426-I458 HydrophobicContact CH2-CD1 4.05Å; W426-I458 HydrophobicContact CH2-CG1 4.35Å; W426-I458 HydrophobicContact CZ2-CG1 4.39Å; W426-I458 HydrophobicContact CZ3-CD1 3.9Å; W426-I458 HydrophobicContact CZ3-CG1 4.24Å; W426-I458 HydrophobicContact CZ3-CG2 4.16Å; L429-I458 HydrophobicContact CD2-CG2 3.95Å; W451-I458 HydrophobicContact CE3-CB 4.42Å; W451-I458 HydrophobicContact CE3-CD1 4.24Å; W451-I458 HydrophobicContact CE3-CG1 4.35Å; E452-I458 WeakPolarHBondContact O-CA 3.15Å; V453-I458 HydrophobicContact CG1-CG2 3.84Å; I458-L472 HydrophobicContact CD1-CD2 3.39Å; I458-K571 CarbonylContact O-C 3.58Å; I458-K571 VanDerWaalsContact O-CA 3.26Å; I458-K571 WeakPolarHBondContact O-CA 3.49Å; I458-I572 HydrophobicContact CD1-CB 4.26Å; I458-I572 HydrophobicContact CG1-CB 3.99Å; I458-I572 WeakPolarHBondContact CG1-O 3.38Å; I458-I572 PolarHBondContact N-O 3.37Å; I458-I572 PolarHBondContact O-N 2.9Å
459	Y	94.3	Very high	84	Confident	15 Å²	15	16.1 Å²	16.1	6%	0.059	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	159.5	178.4	78.8	-73.2	0	0	0	113	Y337 W451 E452 A454 A461 V569 A570	Y337-Y459 HydrophobicContact CE1-CE1 4.4Å; Y337-Y459 HydrophobicContact CE1-CE2 4.49Å; Y337-Y459 AromaticContact CE1-CZ 3.95Å; Y337-Y459 HydrophobicContact CE2-CE1 4.21Å; Y337-Y459 PolarHBondContact N-OH 2.95Å; Y337-Y459 WeakPolarHBondContact O-CE1 3.21Å; Y337-Y459 PolarHBondContact O-OH 2.84Å; W451-Y459 CarbonylContact C-O 3.58Å; W451-Y459 VanDerWaalsContact CA-O 3.28Å; W451-Y459 WeakPolarHBondContact CA-O 3.13Å; E452-Y459 HydrophobicContact CB-CE1 4.38Å; E452-Y459 PolarHBondContact N-O 2.84Å; E452-Y459 PolarHBondContact O-N 2.77Å; A454-Y459 HydrophobicContact CB-CD1 3.92Å; A454-Y459 HydrophobicContact CB-CE1 4.19Å; Y459-A461 PolarHBondContact O-N 3.12Å; Y459-V569 HydrophobicContact CD2-CG1 4.18Å; Y459-A570 VanDerWaalsContact CA-O 3.3Å; Y459-A570 WeakPolarHBondContact CA-O 3.49Å
460	T	92.3	Very high	84.5	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	119.1	177.5	53.6	0	0	0	0	111.2	G450 W451 M470 F553 R555 V569 A570	G450-T460 CarbonylContact O-C 3.58Å; G450-T460 WeakPolarHBondContact O-CA 3.27Å; W451-T460 HydrophobicContact CD2-CG2 3.85Å; W451-T460 VanDerWaalsContact CE2-CG2 3.44Å; W451-T460 HydrophobicContact CE3-CG2 4.14Å; W451-T460 HydrophobicContact CH2-CG2 3.75Å; W451-T460 HydrophobicContact CZ2-CG2 3.41Å; W451-T460 VanDerWaalsContact CZ2-CG2 3.41Å; W451-T460 HydrophobicContact CZ3-CG2 4.09Å; T460-M470 HydrophobicContact CG2-CB 4.2Å; T460-F553 HydrophobicContact CG2-CB 3.54Å; T460-F553 HydrophobicContact CG2-CD1 3.64Å; T460-F553 HydrophobicContact CG2-CG 3.85Å; T460-R555 PolarHBondContact O-NH2 2.85Å; T460-V569 VanDerWaalsContact OG1-CA 3.32Å; T460-V569 WeakPolarHBondContact OG1-CA 3.27Å; T460-A570 HydrophobicContact CG2-CB 3.9Å; T460-A570 PolarHBondContact N-O 2.87Å; T460-A570 PolarHBondContact OG1-N 3.47Å; T460-A570 VanDerWaalsContact OG1-N 3.09Å; T460-A570 PolarHBondContact OG1-O 2.7Å
461	A	86.8	Confident	84.6	Confident	1 Å²	1	14.2 Å²	14.2	1%	0.008	8%	0.081	C	C	.	.			trans	-68.3	-176.1	178.1	0	0	0	0	0	112.2	T449 G450 E452 Y459 M470 R555	T449-A461 WeakPolarHBondContact O-CB 3.49Å; G450-A461 PolarHBondContact O-N 2.76Å; E452-A461 HydrophobicContact CG-CB 3.96Å; Y459-A461 PolarHBondContact O-N 3.12Å; A461-M470 HydrophobicContact CB-CE 4.1Å; A461-M470 WeakPolarHBondContact O-CE 3.28Å; A461-R555 VanDerWaalsContact O-CZ 3.32Å; A461-R555 PolarHBondContact O-NH1 2.86Å; A461-R555 PolarHBondContact O-NH2 2.97Å
462	V	80.6	Confident	84.5	Confident	17 Å²	17	14.2 Å²	14.2	10%	0.103	8%	0.081	C	C	.	.			trans	-90	121.4	175.3	-180	0	0	0	0	109.6	F336 A355 R563 T566	F336-V462 HydrophobicContact CB-CG2 4.29Å; A355-V462 HydrophobicContact CB-CB 3.66Å; A355-V462 HydrophobicContact CB-CG1 3.55Å; V462-R563 HydrophobicContact CG1-CG 4.49Å; V462-T566 HydrophobicContact CG1-CG2 3.93Å; V462-T566 HydrophobicContact CG2-CG2 4.48Å
463	G	71.4	Confident	84.4	Confident	3 Å²	3	14.8 Å²	14.8	3%	0.031	9%	0.086	C	C	.	.			trans	-80	-168.1	-176.5	0	0	0	0	0	114	R563	G463-R563 VanDerWaalsContact O-CZ 3.29Å; G463-R563 PolarHBondContact O-NE 3.13Å; G463-R563 PolarHBondContact O-NH2 2.79Å
464	A	70.2	Confident	84.4	Confident	14 Å²	14	14.2 Å²	14.2	12%	0.116	8%	0.082	C	C	.	.	S	Bend	trans	-78.5	-37.8	166.9	0	0	0	0	0	110.6	Y445 D468	Y445-A464 HydrophobicContact CE2-CB 3.91Å; A464-D468 WeakPolarHBondContact CA-OD2 3.27Å; A464-D468 WeakPolarHBondContact CB-OD2 3.33Å; A464-D468 PolarHBondContact N-OD2 3.46Å
465	S	74.4	Confident	84.4	Confident	20 Å²	20	17 Å²	17	14%	0.14	10%	0.098	C	C	.	.	S	Bend	trans	-132	155.7	174.9	-178.3	0	0	0	0	111.5	N467 D468	S465-N467 PolarHBondContact O-N 2.72Å; S465-N467 PolarHBondContact OG-N 2.85Å; S465-D468 PolarHBondContact N-OD2 2.04Å; S465-D468 WeakPolarHBondContact O-CB 3.29Å; S465-D468 PolarHBondContact O-N 3.46Å
466	D	76.9	Confident	84.7	Confident	9 Å²	9	16.4 Å²	16.4	5%	0.048	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-17	172	-69.2	-27.6	0	0	0	113.2	R555 T556 G562 K564 Y565	D466-R555 HydrophobicContact CB-CB 4.11Å; D466-R555 WeakPolarHBondContact O-CB 3.47Å; D466-R555 PolarHBondContact O-N 3.13Å; D466-T556 HydrophobicContact CB-CG2 3.84Å; D466-T556 PolarHBondContact O-N 3Å; D466-G562 PolarHBondContact N-O 3.12Å; D466-K564 WeakPolarHBondContact OD2-CA 3.38Å; D466-K564 PolarHBondContact OD2-N 3.24Å; D466-Y565 HydrophobicContact CB-CD2 4.28Å; D466-Y565 VanDerWaalsContact OD2-CD2 3.29Å; D466-Y565 WeakPolarHBondContact OD2-CD2 3.48Å; D466-Y565 PolarHBondContact OD2-N 2.93Å
467	N	74.3	Confident	84.7	Confident	8 Å²	8	15.9 Å²	15.9	4%	0.043	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	3.4	175.2	-173	47.2	0	0	0	113.2	S465 Q554 T556 H559	S465-N467 PolarHBondContact O-N 2.72Å; S465-N467 PolarHBondContact OG-N 2.85Å; N467-Q554 PolarHBondContact OD1-NE2 2.9Å; N467-T556 PolarHBondContact OD1-O 3.47Å; N467-T556 VanDerWaalsContact OD1-O 3.05Å; N467-H559 PolarHBondContact ND2-CD2 2.97Å; N467-H559 PolarHBondContact ND2-CE1 2.88Å; N467-H559 PolarHBondContact ND2-ND1 3.25Å; N467-H559 PolarHBondContact ND2-NE2 3.48Å
468	D	77.3	Confident	84.4	Confident	3 Å²	3	15.4 Å²	15.4	2%	0.016	9%	0.091	C	C	.	.	S	Bend	trans	-73.1	140.2	172	-64.9	-22.7	0	0	0	110.7	V437 S439 A464 S465 M470	V437-D468 HydrophobicContact CG1-CB 3.83Å; S439-D468 WeakPolarHBondContact CA-OD1 3.48Å; S439-D468 WeakPolarHBondContact CB-OD1 3.03Å; S439-D468 PolarHBondContact OG-OD1 3.23Å; A464-D468 WeakPolarHBondContact CA-OD2 3.27Å; A464-D468 WeakPolarHBondContact CB-OD2 3.33Å; A464-D468 PolarHBondContact N-OD2 3.46Å; S465-D468 PolarHBondContact N-OD2 2.04Å; S465-D468 WeakPolarHBondContact O-CB 3.29Å; S465-D468 PolarHBondContact O-N 3.46Å; D468-M470 HydrophobicContact CB-SD 4.47Å; D468-M470 PolarHBondContact O-N 3.33Å
469	F	81.4	Confident	84	Confident	50 Å²	50	15.4 Å²	15.4	22%	0.219	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	115.5	168.4	-70.3	-85.8	0	0	0	109.8	V437 L438 I471 Y512 A552 Q554	V437-F469 WeakPolarHBondContact CA-O 3.41Å; L438-F469 HydrophobicContact CB-CB 4.44Å; L438-F469 PolarHBondContact N-O 3.14Å; L438-F469 VanDerWaalsContact N-O 3.13Å; L438-F469 PolarHBondContact O-N 2.84Å; F469-I471 HydrophobicContact CB-CD1 4.13Å; F469-I471 HydrophobicContact CB-CG1 4.04Å; F469-Y512 HydrophobicContact CE1-CD2 4.39Å; F469-Y512 HydrophobicContact CE1-CE2 4.14Å; F469-A552 HydrophobicContact CD1-CB 4.25Å; F469-Q554 HydrophobicContact CD1-CB 4.04Å; F469-Q554 HydrophobicContact CE1-CB 3.92Å; F469-Q554 HydrophobicContact CE1-CG 4.23Å; F469-Q554 VanDerWaalsContact CE1-OE1 3.28Å; F469-Q554 HydrophobicContact CZ-CG 4.41Å; F469-Q554 VanDerWaalsContact CZ-OE1 3.23Å
470	M	86.6	Confident	83.1	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.005	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	106	174.3	-56.5	-55.4	-95.3	0	0	108.6	V437 W451 T460 A461 D468 A552 F553	V437-M470 HydrophobicContact CB-SD 4.44Å; V437-M470 HydrophobicContact CG1-SD 3.8Å; V437-M470 HydrophobicContact CG2-CE 4.2Å; V437-M470 HydrophobicContact CG2-SD 3.85Å; W451-M470 PolarHBondContact NE1-O 2.88Å; T460-M470 HydrophobicContact CG2-CB 4.2Å; A461-M470 HydrophobicContact CB-CE 4.1Å; A461-M470 WeakPolarHBondContact O-CE 3.28Å; D468-M470 HydrophobicContact CB-SD 4.47Å; D468-M470 PolarHBondContact O-N 3.33Å; M470-A552 WeakPolarHBondContact O-CA 3.41Å; M470-F553 PolarHBondContact N-O 2.86Å; M470-F553 PolarHBondContact O-N 2.95Å
471	I	85.7	Confident	81.8	Confident	17 Å²	17	22.6 Å²	22.6	9%	0.087	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	136.9	-166.1	-60.3	-179.9	0	0	0	111.5	T435 T436 L438 F469 T550 W551 A552	T435-I471 WeakPolarHBondContact CA-O 3.35Å; T435-I471 WeakPolarHBondContact CB-O 3.23Å; T435-I471 PolarHBondContact OG1-O 3.15Å; T436-I471 PolarHBondContact N-O 2.95Å; T436-I471 WeakPolarHBondContact O-CB 3.16Å; T436-I471 PolarHBondContact O-N 3.03Å; L438-I471 HydrophobicContact CB-CD1 4.3Å; L438-I471 HydrophobicContact CD1-CD1 3.63Å; L438-I471 HydrophobicContact CG-CD1 3.87Å; F469-I471 HydrophobicContact CB-CD1 4.13Å; F469-I471 HydrophobicContact CB-CG1 4.04Å; I471-T550 HydrophobicContact CG2-CG2 3.59Å; I471-W551 WeakPolarHBondContact CA-O 3.41Å; I471-A552 HydrophobicContact CG1-CB 3.89Å
472	L	90.5	Very high	80.5	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126.4	166.7	177	73.7	0	0	0	108.1	L429 M433 W451 I458 T550 W551 I572	L429-L472 HydrophobicContact CD2-CD1 4.29Å; M433-L472 HydrophobicContact CB-CD1 4.33Å; M433-L472 HydrophobicContact SD-CD1 4.33Å; W451-L472 HydrophobicContact CD2-CB 4.05Å; W451-L472 HydrophobicContact CG-CB 3.86Å; I458-L472 HydrophobicContact CD1-CD2 3.39Å; L472-T550 CarbonylContact O-C 3.56Å; L472-T550 VanDerWaalsContact O-CA 3.3Å; L472-T550 WeakPolarHBondContact O-CA 3.36Å; L472-W551 HydrophobicContact CB-CE3 4.4Å; L472-W551 HydrophobicContact CD2-CD2 4.46Å; L472-W551 HydrophobicContact CD2-CE3 3.78Å; L472-W551 HydrophobicContact CD2-CZ3 4.26Å; L472-W551 HydrophobicContact CG-CE3 4.1Å; L472-W551 PolarHBondContact N-O 3.16Å; L472-W551 PolarHBondContact O-N 3.12Å; L472-I572 HydrophobicContact CD2-CD1 4.17Å
473	T	87.8	Confident	79.4	Confident	24 Å²	24	29.1 Å²	29.1	15%	0.147	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	123.7	176	-50.8	0	0	0	0	109.5	M433 E434 V475 F549	M433-T473 CarbonylContact C-O 3.6Å; M433-T473 VanDerWaalsContact CA-O 3.28Å; M433-T473 WeakPolarHBondContact CA-O 3.07Å; E434-T473 PolarHBondContact N-O 2.98Å; E434-T473 PolarHBondContact O-N 3.45Å; T473-V475 HydrophobicContact CG2-CG2 4.22Å; T473-F549 CarbonylContact C-O 3.52Å; T473-F549 WeakPolarHBondContact CA-O 3.38Å
474	L	91.9	Very high	78.4	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.2	168.3	167.5	62.6	0	0	0	108.6	Y423 N432 M433 V476 I497 F549 W551 I575 V577	Y423-L474 HydrophobicContact CE2-CD1 4.23Å; N432-L474 VanDerWaalsContact ND2-CD1 3.29Å; N432-L474 WeakPolarHBondContact ND2-CD1 3.29Å; M433-L474 HydrophobicContact CE-CB 4.26Å; M433-L474 HydrophobicContact CE-CD1 3.87Å; M433-L474 HydrophobicContact CE-CD2 4.05Å; M433-L474 HydrophobicContact CE-CG 4.28Å; M433-L474 HydrophobicContact CG-CB 4.16Å; M433-L474 HydrophobicContact CG-CD1 3.85Å; L474-V476 HydrophobicContact CG-CG2 4.25Å; L474-I497 HydrophobicContact CD2-CD1 4.38Å; L474-F549 HydrophobicContact CB-CB 4.35Å; L474-F549 HydrophobicContact CD2-CD2 4.23Å; L474-F549 HydrophobicContact CG-CD2 4.37Å; L474-F549 PolarHBondContact N-O 3.12Å; L474-F549 PolarHBondContact O-N 2.92Å; L474-W551 HydrophobicContact CB-CH2 4.21Å; L474-W551 HydrophobicContact CB-CZ3 3.81Å; L474-W551 HydrophobicContact CD2-CH2 4.23Å; L474-I575 HydrophobicContact CD2-CG2 3.98Å; L474-V577 HydrophobicContact CD2-CG2 4.01Å
475	V	90.1	Very high	77.7	Confident	66 Å²	66	30 Å²	30	40%	0.4	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.9	176.4	-176.1	0	0	0	0	110.1	N432 T473 T546	N432-V475 PolarHBondContact ND2-O 3Å; N432-V475 PolarHBondContact O-N 2.81Å; T473-V475 HydrophobicContact CG2-CG2 4.22Å; V475-T546 HydrophobicContact CG1-CG2 4.46Å
476	V	91.1	Very high	76.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	121	174.7	-179.5	0	0	0	0	108.3	L474 G478 F479 T546 V547 F549 V580	L474-V476 HydrophobicContact CG-CG2 4.25Å; V476-G478 PolarHBondContact O-N 3.17Å; V476-F479 HydrophobicContact CB-CZ 4.21Å; V476-F479 HydrophobicContact CG1-CD1 4.39Å; V476-F479 HydrophobicContact CG1-CE1 3.74Å; V476-F479 HydrophobicContact CG1-CE2 4.28Å; V476-F479 HydrophobicContact CG1-CZ 3.67Å; V476-T546 WeakPolarHBondContact O-CA 3.26Å; V476-V547 PolarHBondContact N-O 2.84Å; V476-V547 PolarHBondContact O-N 2.89Å; V476-F549 HydrophobicContact CB-CE2 4.3Å; V476-F549 HydrophobicContact CG2-CD2 4.05Å; V476-F549 HydrophobicContact CG2-CE2 3.79Å; V476-V580 HydrophobicContact CG1-CB 4.46Å; V476-V580 HydrophobicContact CG1-CG1 3.77Å; V476-V580 HydrophobicContact CG1-CG2 4.01Å
477	P	87.1	Confident	75.6	Confident	75 Å²	75	37.3 Å²	37.3	49%	0.487	20%	0.198	S	C	.	.			trans	-71.3	-11.1	-172.3	30	-36.9	0	0	0	113.9	T546	P477-T546 PolarHBondContact O-OG1 3.48Å
478	G	86.5	Confident	74.8	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.199	C	C	.	.			trans	145.9	-173.1	176.1	0	0	0	0	0	111.8	V476 A545 M581	V476-G478 PolarHBondContact O-N 3.17Å; G478-A545 WeakPolarHBondContact CA-O 3.46Å; G478-M581 PolarHBondContact O-N 3.04Å
479	F	86.6	Confident	73.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-133.2	149.2	-167.3	-58.1	-82.7	0	0	0	112.4	V476 P481 V494 A495 I541 N544 V547 F549 V577 N579 V580	V476-F479 HydrophobicContact CB-CZ 4.21Å; V476-F479 HydrophobicContact CG1-CD1 4.39Å; V476-F479 HydrophobicContact CG1-CE1 3.74Å; V476-F479 HydrophobicContact CG1-CE2 4.28Å; V476-F479 HydrophobicContact CG1-CZ 3.67Å; F479-P481 VanDerWaalsContact C-CD 3.46Å; F479-P481 WeakPolarHBondContact O-CD 3.46Å; F479-V494 HydrophobicContact CB-CG1 3.33Å; F479-V494 HydrophobicContact CD2-CG1 4.33Å; F479-V494 HydrophobicContact CG-CG1 3.99Å; F479-A495 HydrophobicContact CB-CB 4.35Å; F479-A495 HydrophobicContact CD1-CB 3.23Å; F479-A495 HydrophobicContact CE1-CB 3.53Å; F479-A495 HydrophobicContact CG-CB 3.81Å; F479-A495 HydrophobicContact CZ-CB 4.34Å; F479-I541 HydrophobicContact CD2-CG2 4.13Å; F479-I541 HydrophobicContact CE2-CG1 4.41Å; F479-I541 HydrophobicContact CE2-CG2 3.85Å; F479-I541 HydrophobicContact CZ-CG1 4.19Å; F479-I541 HydrophobicContact CZ-CG2 4.42Å; F479-N544 PolarHBondContact N-OD1 3.24Å; F479-N544 PolarHBondContact O-ND2 2.89Å; F479-N544 VanDerWaalsContact O-ND2 3.08Å; F479-N544 PolarHBondContact O-OD1 2.91Å; F479-V547 HydrophobicContact CE2-CB 4.11Å; F479-V547 HydrophobicContact CE2-CG2 3.79Å; F479-V547 HydrophobicContact CZ-CB 4.42Å; F479-F549 HydrophobicContact CZ-CE2 4.25Å; F479-F549 HydrophobicContact CZ-CZ 4.13Å; F479-V577 HydrophobicContact CE1-CG1 3.82Å; F479-N579 CarbonylContact C-O 3.5Å; F479-N579 WeakPolarHBondContact CA-O 3.5Å; F479-V580 HydrophobicContact CD1-CG2 4.4Å; F479-V580 HydrophobicContact CE1-CG2 4.23Å
480	R	74.9	Confident	72.4	Confident	150 Å²	150	42 Å²	42	57%	0.566	23%	0.228	S	C	*	.			trans	-113.2	79.1	178	-167.5	175.2	-177.1	-171	-2.5	109.4	Y399 N579 M581	Y399-R480 PolarHBondContact OH-NH1 3.18Å; Y399-R480 VanDerWaalsContact OH-NH1 3.09Å; R480-N579 PolarHBondContact N-O 2.86Å; R480-M581 HydrophobicContact CB-CG 4.08Å
481	P	65.2	Low	71	Confident	17 Å²	17	46.3 Å²	46.3	11%	0.11	25%	0.251	C	S	.	.			trans	-63.9	150.4	176	28.1	-35.1	0	0	0	111	F479 V485 M486 V494	F479-P481 VanDerWaalsContact C-CD 3.46Å; F479-P481 WeakPolarHBondContact O-CD 3.46Å; P481-V485 HydrophobicContact CB-CB 4.25Å; P481-V485 HydrophobicContact CB-CG1 4.1Å; P481-M486 HydrophobicContact CB-CG 4.34Å; P481-M486 HydrophobicContact CG-CG 3.75Å; P481-M486 HydrophobicContact CG-SD 3.49Å; P481-M486 WeakPolarHBondContact CG-SD 3.29Å; P481-V494 HydrophobicContact CB-CB 4.4Å; P481-V494 HydrophobicContact CB-CG1 4.17Å; P481-V494 HydrophobicContact CB-CG2 4.22Å; P481-V494 HydrophobicContact CG-CG1 4.16Å; P481-V494 HydrophobicContact CG-CG2 4.22Å
482	P	59.9	Low	69.8	Low	27 Å²	27	49.2 Å²	49.2	18%	0.175	26%	0.263	C	S	.	.			trans	-57.2	150.2	168.5	-23.1	33.7	0	0	0	111.9	S484 V485 M486	P482-S484 PolarHBondContact O-N 3.2Å; P482-V485 HydrophobicContact CB-CG2 4.3Å; P482-V485 HydrophobicContact CG-CG2 4.21Å; P482-V485 WeakPolarHBondContact O-CB 3.4Å; P482-V485 PolarHBondContact O-N 3Å; P482-M486 PolarHBondContact O-N 3Å
483	Q	56.7	Low	68.9	Low	128 Å²	128	50.9 Å²	50.9	60%	0.598	27%	0.27	S	S	*	.	H	α-helix	trans	-61.3	-29	177.8	-69.3	-176.5	-22.4	0	0	113	V485 M486 A487	Q483-V485 VanDerWaalsContact C-N 3.26Å; Q483-V485 PolarHBondContact O-N 2.92Å; Q483-M486 PolarHBondContact O-N 2.98Å; Q483-A487 PolarHBondContact O-N 3.39Å; Q483-A487 VanDerWaalsContact O-N 3.11Å
484	S	52.1	Low	68.5	Low	24 Å²	24	50.2 Å²	50.2	17%	0.168	27%	0.267	C	S	.	.	H	α-helix	trans	-64	-28	173.1	51.9	0	0	0	0	113.6	P482	P482-S484 PolarHBondContact O-N 3.2Å
485	V	55.7	Low	68.1	Low	12 Å²	12	50.2 Å²	50.2	7%	0.073	27%	0.267	C	S	.	.	H	α-helix	trans	-82.6	-39.6	173	174.8	0	0	0	0	110.7	P481 P482 Q483 A487 D488 E493 A629	P481-V485 HydrophobicContact CB-CB 4.25Å; P481-V485 HydrophobicContact CB-CG1 4.1Å; P482-V485 HydrophobicContact CB-CG2 4.3Å; P482-V485 HydrophobicContact CG-CG2 4.21Å; P482-V485 WeakPolarHBondContact O-CB 3.4Å; P482-V485 PolarHBondContact O-N 3Å; Q483-V485 VanDerWaalsContact C-N 3.26Å; Q483-V485 PolarHBondContact O-N 2.92Å; V485-A487 PolarHBondContact O-N 2.73Å; V485-A487 VanDerWaalsContact O-N 3.15Å; V485-D488 PolarHBondContact O-N 3.06Å; V485-E493 VanDerWaalsContact CG1-O 3.3Å; V485-E493 WeakPolarHBondContact CG1-O 3.4Å; V485-A629 HydrophobicContact CG2-CB 3.99Å
486	M	54.1	Low	68	Low	131 Å²	131	50.9 Å²	50.9	65%	0.645	26%	0.262	S	S	*	.	H	α-helix	trans	-60.8	-21.9	174.4	-69.2	-78.7	-71.6	0	0	113.5	P481 P482 Q483	P481-M486 HydrophobicContact CB-CG 4.34Å; P481-M486 HydrophobicContact CG-CG 3.75Å; P481-M486 HydrophobicContact CG-SD 3.49Å; P481-M486 WeakPolarHBondContact CG-SD 3.29Å; P482-M486 PolarHBondContact O-N 3Å; Q483-M486 PolarHBondContact O-N 2.98Å
487	A	51.2	Low	68	Low	51 Å²	51	50.9 Å²	50.9	42%	0.421	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-14.2	173.7	0	0	0	0	0	113.7	Q483 V485 A607	Q483-A487 PolarHBondContact O-N 3.39Å; Q483-A487 VanDerWaalsContact O-N 3.11Å; V485-A487 PolarHBondContact O-N 2.73Å; V485-A487 VanDerWaalsContact O-N 3.15Å; A487-A607 HydrophobicContact CB-CB 4Å
488	D	57.5	Low	68.3	Low	12 Å²	12	49.1 Å²	49.1	6%	0.064	25%	0.25	C	C	.	.			trans	-91	118.9	174.7	-165.1	-22.8	0	0	0	110.3	V485 E490 N491 I650 S652	V485-D488 PolarHBondContact O-N 3.06Å; D488-E490 WeakPolarHBondContact OD1-CA 3.33Å; D488-E490 PolarHBondContact OD1-N 2.83Å; D488-N491 PolarHBondContact OD1-N 3.14Å; D488-N491 VanDerWaalsContact OD2-CB 3.23Å; D488-N491 WeakPolarHBondContact OD2-CB 3.43Å; D488-I650 HydrophobicContact CB-CD1 3.83Å; D488-S652 WeakPolarHBondContact OD2-CB 3.35Å; D488-S652 PolarHBondContact OD2-OG 2.96Å
489	T	55	Low	68.8	Low	100 Å²	100	49.1 Å²	49.1	61%	0.613	25%	0.25	S	C	*	.	S	Bend	trans	-98.2	1.4	179.1	46.6	0	0	0	0	113.3
490	E	53.5	Low	69.2	Low	48 Å²	48	50.8 Å²	50.8	22%	0.224	26%	0.26	C	S	.	.	S	Bend	trans	-122.1	-38.1	-169.3	-61.4	175.8	-144.9	0	0	112.1	D488 L653 G710 K711	D488-E490 WeakPolarHBondContact OD1-CA 3.33Å; D488-E490 PolarHBondContact OD1-N 2.83Å; E490-L653 HydrophobicContact CB-CD2 3.96Å; E490-L653 WeakPolarHBondContact OE2-CD2 3.34Å; E490-G710 WeakPolarHBondContact OE2-CA 3.38Å; E490-K711 HydrophobicContact CG-CG 3.8Å; E490-K711 WeakPolarHBondContact OE1-CE 3.32Å; E490-K711 VanDerWaalsContact OE1-CG 3.26Å; E490-K711 WeakPolarHBondContact OE1-CG 3.4Å; E490-K711 WeakPolarHBondContact OE2-CA 3.41Å; E490-K711 WeakPolarHBondContact OE2-CG 3.25Å; E490-K711 PolarHBondContact OE2-N 2.92Å
491	N	57.4	Low	70.2	Confident	91 Å²	91	43.7 Å²	43.7	49%	0.487	23%	0.233	S	C	.	.	S	Bend	trans	-112.8	59.6	178.4	-152.2	14	0	0	0	109.9	D488 E493	D488-N491 PolarHBondContact OD1-N 3.14Å; D488-N491 VanDerWaalsContact OD2-CB 3.23Å; D488-N491 WeakPolarHBondContact OD2-CB 3.43Å; N491-E493 PolarHBondContact O-N 2.87Å
492	K	61.9	Low	71.7	Confident	77 Å²	77	44.3 Å²	44.3	34%	0.335	23%	0.234	S	C	.	.			trans	-66.2	28.2	-166.9	-54.2	178.2	174	173.1	0	116.1	V494 E542 E543	K492-V494 PolarHBondContact O-N 2.67Å; K492-E542 HydrophobicContact CB-CB 4.16Å; K492-E542 VanDerWaalsContact CB-O 3.22Å; K492-E542 WeakPolarHBondContact CB-O 3.5Å; K492-E542 HydrophobicContact CD-CB 4.42Å; K492-E542 WeakPolarHBondContact CD-O 3.28Å; K492-E542 CarbonylContact O-C 3.44Å; K492-E542 VanDerWaalsContact O-CA 3.27Å; K492-E542 WeakPolarHBondContact O-CA 3.29Å; K492-E542 VanDerWaalsContact O-O 3.08Å; K492-E543 IonicContact NZ-OE1 2.65Å; K492-E543 PolarHBondContact NZ-OE1 3.07Å
493	E	71.3	Confident	73.3	Confident	35 Å²	35	43 Å²	43	16%	0.164	23%	0.226	C	C	.	.			trans	-64.1	95.1	-177.8	178.9	171.8	-157.2	0	0	111.9	V485 N491 R496 T540 H630	V485-E493 VanDerWaalsContact CG1-O 3.3Å; V485-E493 WeakPolarHBondContact CG1-O 3.4Å; N491-E493 PolarHBondContact O-N 2.87Å; E493-R496 IonicContact OE1-CZ 2.82Å; E493-R496 IonicContact OE1-NE 3.5Å; E493-R496 PolarHBondContact OE1-NE 2.89Å; E493-R496 IonicContact OE1-NH2 2.65Å; E493-R496 PolarHBondContact OE1-NH2 3.42Å; E493-R496 IonicContact OE2-CZ 2.62Å; E493-R496 IonicContact OE2-NH2 2.73Å; E493-R496 PolarHBondContact OE2-NH2 2.88Å; E493-T540 HydrophobicContact CB-CG2 3.97Å; E493-T540 HydrophobicContact CG-CG2 3.6Å; E493-H630 IonicContact OE1-CE1 2.61Å; E493-H630 PolarHBondContact OE1-CE1 2.94Å; E493-H630 IonicContact OE1-ND1 3.16Å; E493-H630 IonicContact OE1-NE2 2.72Å; E493-H630 IonicContact OE2-CE1 3.64Å; E493-H630 PolarHBondContact OE2-CE1 2.95Å; E493-H630 VanDerWaalsContact OE2-CE1 3.3Å; E493-H630 IonicContact OE2-ND1 3.13Å; E493-H630 PolarHBondContact OE2-ND1 3.01Å
494	V	78.9	Confident	75.1	Confident	11 Å²	11	40.5 Å²	40.5	7%	0.067	22%	0.216	C	C	.	.			trans	-79.2	-41.2	-179.3	162.4	0	0	0	0	110.7	F479 P481 K492 I541 N579	F479-V494 HydrophobicContact CB-CG1 3.33Å; F479-V494 HydrophobicContact CD2-CG1 4.33Å; F479-V494 HydrophobicContact CG-CG1 3.99Å; P481-V494 HydrophobicContact CB-CB 4.4Å; P481-V494 HydrophobicContact CB-CG1 4.17Å; P481-V494 HydrophobicContact CB-CG2 4.22Å; P481-V494 HydrophobicContact CG-CG1 4.16Å; P481-V494 HydrophobicContact CG-CG2 4.22Å; K492-V494 PolarHBondContact O-N 2.67Å; V494-I541 PolarHBondContact N-O 2.77Å; V494-N579 PolarHBondContact O-ND2 3.38Å
495	A	83.6	Confident	76.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	172.2	179.8	0	0	0	0	0	111	F479 I541 T578 N579	F479-A495 HydrophobicContact CB-CB 4.35Å; F479-A495 HydrophobicContact CD1-CB 3.23Å; F479-A495 HydrophobicContact CE1-CB 3.53Å; F479-A495 HydrophobicContact CG-CB 3.81Å; F479-A495 HydrophobicContact CZ-CB 4.34Å; A495-I541 HydrophobicContact CB-CB 4.29Å; A495-I541 HydrophobicContact CB-CD1 4.36Å; A495-I541 PolarHBondContact N-O 3.06Å; A495-I541 PolarHBondContact O-N 2.93Å; A495-T578 WeakPolarHBondContact CB-O 3.42Å; A495-N579 HydrophobicContact CB-CB 4.34Å
496	R	87.5	Confident	78.5	Confident	80 Å²	80	44 Å²	44	30%	0.302	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	149.8	168.2	59.2	178.4	64.9	-179	0.1	111.4	E493 T538 Y539 V577 T578 H630	E493-R496 IonicContact OE1-CZ 2.82Å; E493-R496 IonicContact OE1-NE 3.5Å; E493-R496 PolarHBondContact OE1-NE 2.89Å; E493-R496 IonicContact OE1-NH2 2.65Å; E493-R496 PolarHBondContact OE1-NH2 3.42Å; E493-R496 IonicContact OE2-CZ 2.62Å; E493-R496 IonicContact OE2-NH2 2.73Å; E493-R496 PolarHBondContact OE2-NH2 2.88Å; R496-T538 HydrophobicContact CB-CG2 4.24Å; R496-Y539 VanDerWaalsContact CA-O 3.31Å; R496-Y539 WeakPolarHBondContact CA-O 3.35Å; R496-Y539 WeakPolarHBondContact CB-O 3.5Å; R496-V577 WeakPolarHBondContact O-CA 3.3Å; R496-T578 HydrophobicContact CG-CG2 3.96Å; R496-T578 PolarHBondContact N-OG1 2.82Å; R496-T578 PolarHBondContact O-N 2.9Å; R496-T578 PolarHBondContact O-OG1 2.89Å; R496-H630 PolarHBondContact NE-NE2 2.79Å
497	I	92.5	Very high	79.8	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.4	165.5	-178.7	166.5	0	0	0	108.9	L474 F499 F513 T538 Y539 I541 F549 W551 I575 N576 V577	L474-I497 HydrophobicContact CD2-CD1 4.38Å; I497-F499 HydrophobicContact CG1-CD1 4.49Å; I497-F513 HydrophobicContact CG2-CZ 4.01Å; I497-T538 CarbonylContact O-C 3.58Å; I497-T538 VanDerWaalsContact O-CA 3.27Å; I497-T538 WeakPolarHBondContact O-CA 3.4Å; I497-Y539 HydrophobicContact CG2-CD1 4.09Å; I497-Y539 HydrophobicContact CG2-CG 4.5Å; I497-Y539 PolarHBondContact N-O 3.17Å; I497-Y539 PolarHBondContact O-N 2.7Å; I497-I541 HydrophobicContact CG2-CD1 4.24Å; I497-F549 HydrophobicContact CB-CD1 4.49Å; I497-F549 HydrophobicContact CB-CE1 4.16Å; I497-F549 HydrophobicContact CB-CZ 4.22Å; I497-F549 HydrophobicContact CD1-CB 3.93Å; I497-F549 HydrophobicContact CD1-CD1 3.87Å; I497-F549 HydrophobicContact CD1-CD2 3.78Å; I497-F549 HydrophobicContact CD1-CE1 4.32Å; I497-F549 HydrophobicContact CD1-CE2 4.23Å; I497-F549 HydrophobicContact CD1-CG 3.57Å; I497-F549 HydrophobicContact CD1-CZ 4.48Å; I497-F549 HydrophobicContact CG2-CD1 3.86Å; I497-F549 HydrophobicContact CG2-CE1 3.55Å; I497-F549 HydrophobicContact CG2-CZ 4.09Å; I497-W551 HydrophobicContact CD1-CH2 3.81Å; I497-W551 HydrophobicContact CD1-CZ2 3.88Å; I497-I575 HydrophobicContact CD1-CG2 3.97Å; I497-I575 HydrophobicContact CG1-CG2 4.22Å; I497-N576 CarbonylContact C-O 3.51Å; I497-N576 WeakPolarHBondContact CA-O 3.21Å; I497-V577 HydrophobicContact CB-CG2 4.31Å; I497-V577 HydrophobicContact CD1-CG2 3.98Å; I497-V577 HydrophobicContact CG1-CG2 3.95Å
498	T	93.4	Very high	81.2	Confident	38 Å²	38	42.1 Å²	42.1	23%	0.233	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	129.2	172.6	-60.6	0	0	0	0	108.7	Y537 T538 N576	T498-Y537 CarbonylContact C-O 3.58Å; T498-Y537 VanDerWaalsContact CA-O 3.29Å; T498-Y537 WeakPolarHBondContact CA-O 3.46Å; T498-T538 WeakPolarHBondContact CG2-OG1 3.19Å; T498-T538 WeakPolarHBondContact OG1-CG2 3.41Å; T498-T538 PolarHBondContact OG1-OG1 2.81Å; T498-N576 PolarHBondContact N-O 3.02Å; T498-N576 PolarHBondContact O-N 2.87Å
499	F	95.7	Very high	82.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	149.7	175.2	62.1	-91.9	0	0	0	112.7	I497 F501 F513 W528 S536 Y537 W551 I572 S574 I575	I497-F499 HydrophobicContact CG1-CD1 4.49Å; F499-F501 HydrophobicContact CD2-CB 4.25Å; F499-F501 AromaticContact CD2-CD1 3.73Å; F499-F501 HydrophobicContact CD2-CD1 3.73Å; F499-F501 HydrophobicContact CD2-CG 4.3Å; F499-F501 HydrophobicContact CE2-CB 4.5Å; F499-F501 AromaticContact CE2-CD1 3.53Å; F499-F501 HydrophobicContact CE2-CD1 3.53Å; F499-F501 AromaticContact CE2-CE1 3.95Å; F499-F501 HydrophobicContact CE2-CE1 3.95Å; F499-F501 HydrophobicContact CE2-CG 4.15Å; F499-F513 HydrophobicContact CD1-CE2 4.33Å; F499-F513 HydrophobicContact CE1-CD1 4.23Å; F499-F513 AromaticContact CE1-CD2 3.58Å; F499-F513 HydrophobicContact CE1-CD2 3.58Å; F499-F513 HydrophobicContact CE1-CE1 4.23Å; F499-F513 AromaticContact CE1-CE2 3.56Å; F499-F513 HydrophobicContact CE1-CE2 3.56Å; F499-F513 AromaticContact CE1-CG 3.92Å; F499-F513 HydrophobicContact CE1-CG 3.92Å; F499-F513 AromaticContact CE1-CZ 3.9Å; F499-F513 HydrophobicContact CE1-CZ 3.9Å; F499-F513 HydrophobicContact CZ-CB 4.16Å; F499-F513 HydrophobicContact CZ-CD1 4.43Å; F499-F513 AromaticContact CZ-CD2 3.77Å; F499-F513 HydrophobicContact CZ-CD2 3.77Å; F499-F513 HydrophobicContact CZ-CE2 4.24Å; F499-F513 AromaticContact CZ-CG 3.87Å; F499-F513 HydrophobicContact CZ-CG 3.87Å; F499-W528 HydrophobicContact CE2-CH2 4.21Å; F499-W528 AromaticContact CZ-CH2 3.75Å; F499-W528 HydrophobicContact CZ-CH2 3.75Å; F499-W528 HydrophobicContact CZ-CZ3 4.27Å; F499-S536 WeakPolarHBondContact O-CA 3.12Å; F499-Y537 AromaticContact CE1-CD1 3.71Å; F499-Y537 HydrophobicContact CE1-CD1 3.71Å; F499-Y537 AromaticContact CZ-CD1 3.77Å; F499-Y537 HydrophobicContact CZ-CD1 3.77Å; F499-Y537 HydrophobicContact CZ-CG 4.35Å; F499-Y537 PolarHBondContact N-O 2.84Å; F499-Y537 PolarHBondContact O-N 3.17Å; F499-W551 HydrophobicContact CB-CZ2 4.48Å; F499-W551 AromaticContact CD1-CZ2 3.78Å; F499-W551 HydrophobicContact CD1-CZ2 3.78Å; F499-W551 AromaticContact CD1-NE1 3.63Å; F499-W551 AromaticContact CD2-NE1 3.53Å; F499-W551 HydrophobicContact CE1-CZ2 4.14Å; F499-W551 AromaticContact CE1-NE1 3.38Å; F499-W551 AromaticContact CE2-CD1 3.89Å; F499-W551 AromaticContact CE2-NE1 3.29Å; F499-W551 VanDerWaalsContact CE2-NE1 3.29Å; F499-W551 HydrophobicContact CG-CZ2 4.12Å; F499-W551 AromaticContact CG-NE1 3.7Å; F499-W551 AromaticContact CZ-CD1 3.92Å; F499-W551 AromaticContact CZ-NE1 3.21Å; F499-I572 HydrophobicContact CB-CG2 4.39Å; F499-S574 WeakPolarHBondContact CA-O 3.24Å; F499-S574 WeakPolarHBondContact CB-O 3.25Å; F499-I575 HydrophobicContact CB-CG1 3.94Å
500	V	96.1	Very high	84.1	Confident	34 Å²	34	37 Å²	37	21%	0.206	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	124	178.7	179.5	0	0	0	0	108.7	K534 Q535 I572 Y573 S574	V500-K534 HydrophobicContact CG1-CG 3.91Å; V500-Q535 WeakPolarHBondContact CA-O 3.42Å; V500-I572 WeakPolarHBondContact O-CA 3.42Å; V500-Y573 HydrophobicContact CG1-CD2 4.47Å; V500-Y573 PolarHBondContact O-N 3.22Å; V500-S574 WeakPolarHBondContact CG2-OG 3.36Å; V500-S574 PolarHBondContact N-O 2.86Å
501	F	95.8	Very high	85.8	Confident	1 Å²	1	34.7 Å²	34.7	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	164	-173.4	76.2	-80.9	0	0	0	112.5	F499 L511 W528 K534 Q535 K571 I572	F499-F501 HydrophobicContact CD2-CB 4.25Å; F499-F501 AromaticContact CD2-CD1 3.73Å; F499-F501 HydrophobicContact CD2-CD1 3.73Å; F499-F501 HydrophobicContact CD2-CG 4.3Å; F499-F501 HydrophobicContact CE2-CB 4.5Å; F499-F501 AromaticContact CE2-CD1 3.53Å; F499-F501 HydrophobicContact CE2-CD1 3.53Å; F499-F501 AromaticContact CE2-CE1 3.95Å; F499-F501 HydrophobicContact CE2-CE1 3.95Å; F499-F501 HydrophobicContact CE2-CG 4.15Å; F501-L511 HydrophobicContact CD2-CD2 3.56Å; F501-L511 HydrophobicContact CE2-CD2 3.76Å; F501-L511 HydrophobicContact CG-CD2 4.37Å; F501-W528 HydrophobicContact CE1-CD2 4.33Å; F501-W528 HydrophobicContact CE1-CH2 4.44Å; F501-W528 HydrophobicContact CE1-CZ2 4.07Å; F501-W528 HydrophobicContact CE2-CB 4.45Å; F501-W528 AromaticContact CE2-CD2 3.84Å; F501-W528 HydrophobicContact CE2-CD2 3.84Å; F501-W528 HydrophobicContact CE2-CE3 4.06Å; F501-W528 AromaticContact CE2-CG 4Å; F501-W528 HydrophobicContact CE2-CG 4Å; F501-W528 AromaticContact CZ-CD1 3.93Å; F501-W528 AromaticContact CZ-CD2 3.4Å; F501-W528 HydrophobicContact CZ-CD2 3.4Å; F501-W528 AromaticContact CZ-CE2 3.43Å; F501-W528 VanDerWaalsContact CZ-CE2 3.43Å; F501-W528 AromaticContact CZ-CE3 3.86Å; F501-W528 HydrophobicContact CZ-CE3 3.86Å; F501-W528 AromaticContact CZ-CG 3.74Å; F501-W528 HydrophobicContact CZ-CG 3.74Å; F501-W528 HydrophobicContact CZ-CH2 4.37Å; F501-W528 AromaticContact CZ-CZ2 3.92Å; F501-W528 HydrophobicContact CZ-CZ2 3.92Å; F501-W528 HydrophobicContact CZ-CZ3 4.33Å; F501-W528 AromaticContact CZ-NE1 3.74Å; F501-K534 WeakPolarHBondContact O-CA 3.31Å; F501-Q535 HydrophobicContact CD1-CG 4.29Å; F501-Q535 HydrophobicContact CE1-CG 3.76Å; F501-Q535 HydrophobicContact CE2-CG 4.4Å; F501-Q535 HydrophobicContact CZ-CG 3.83Å; F501-Q535 PolarHBondContact N-O 3.34Å; F501-Q535 PolarHBondContact O-N 3.14Å; F501-K571 CarbonylContact C-O 3.49Å; F501-K571 WeakPolarHBondContact CA-O 2.97Å; F501-K571 WeakPolarHBondContact CB-O 3.32Å; F501-I572 HydrophobicContact CB-CG1 4.19Å
502	E	95.9	Very high	87.2	Confident	30 Å²	30	32 Å²	32	14%	0.14	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	155.7	164.1	69.4	-173.6	-146	0	0	110	K534 K571 Y573	E502-K534 HydrophobicContact CB-CB 4.37Å; E502-K571 HydrophobicContact CG-CB 4.08Å; E502-K571 HydrophobicContact CG-CD 3.94Å; E502-K571 HydrophobicContact CG-CG 4.28Å; E502-K571 PolarHBondContact N-O 2.79Å; E502-K571 PolarHBondContact O-N 2.91Å; E502-K571 WeakPolarHBondContact OE1-CD 2.99Å; E502-K571 WeakPolarHBondContact OE1-CE 3.43Å; E502-K571 IonicContact OE1-NZ 2.75Å; E502-K571 PolarHBondContact OE1-NZ 2.66Å; E502-Y573 HydrophobicContact CG-CE2 3.91Å; E502-Y573 PolarHBondContact OE1-OH 3.38Å; E502-Y573 PolarHBondContact OE2-OH 3.08Å
503	T	94.3	Very high	88.4	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.4	168.3	52	0	0	0	0	108.7	L511 G530 T531 K532 F553 A570	T503-L511 HydrophobicContact CG2-CB 3.88Å; T503-L511 HydrophobicContact CG2-CD2 3.79Å; T503-L511 HydrophobicContact CG2-CG 4.46Å; T503-G530 PolarHBondContact OG1-O 2.95Å; T503-T531 CarbonylContact O-C 3.56Å; T503-T531 VanDerWaalsContact O-CA 3.27Å; T503-T531 WeakPolarHBondContact O-CA 3.28Å; T503-K532 PolarHBondContact N-O 3Å; T503-K532 PolarHBondContact O-N 3.2Å; T503-K532 WeakPolarHBondContact OG1-CB 3.3Å; T503-K532 PolarHBondContact OG1-N 3.36Å; T503-F553 HydrophobicContact CG2-CE2 4.41Å; T503-A570 HydrophobicContact CG2-CB 4.08Å
504	I	93.9	Very high	88.9	Confident	74 Å²	74	27.7 Å²	27.7	38%	0.379	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.6	173.9	-58.5	176.7	0	0	0	106.2	D568 V569	I504-D568 CarbonylContact O-C 3.48Å; I504-D568 VanDerWaalsContact O-CA 3.22Å; I504-D568 WeakPolarHBondContact O-CA 3.36Å; I504-V569 HydrophobicContact CB-CG2 4.24Å; I504-V569 PolarHBondContact N-O 3.28Å; I504-V569 PolarHBondContact O-N 2.86Å
505	C	90.8	Very high	88.9	Confident	18 Å²	18	27.4 Å²	27.4	12%	0.122	15%	0.149	C	C	.	.			trans	-143.3	133.3	-174.6	-53.6	0	0	0	0	112.8	V507 C509 T531 D568	C505-V507 VanDerWaalsContact CB-O 3.29Å; C505-V507 WeakPolarHBondContact CB-O 3.27Å; C505-C509 HydrophobicContact CB-CB 3.72Å; C505-C509 WeakPolarHBondContact CB-SG 3.23Å; C505-C509 WeakPolarHBondContact SG-CB 3.46Å; C505-C509 CovalentContact SG-SG 2.02Å; C505-C509 PolarHBondContact SG-SG 2.96Å; C505-T531 PolarHBondContact N-OG1 3.36Å; C505-T531 PolarHBondContact O-OG1 2.93Å; C505-D568 VanDerWaalsContact CA-OD2 3.24Å; C505-D568 WeakPolarHBondContact CA-OD2 3.16Å; C505-D568 HydrophobicContact CB-CB 4.37Å; C505-D568 WeakPolarHBondContact CB-OD2 3.48Å
506	S	87.4	Confident	88.6	Confident	93 Å²	93	27.5 Å²	27.5	65%	0.65	15%	0.15	S	C	*	.	S	Bend	trans	-82.3	-27.4	172.1	-37.3	0	0	0	0	111.6	D568	S506-D568 WeakPolarHBondContact CB-OD1 3.39Å; S506-D568 PolarHBondContact N-OD1 2.98Å; S506-D568 PolarHBondContact N-OD2 2.86Å; S506-D568 PolarHBondContact OG-OD1 2.91Å
507	V	82.4	Confident	88	Confident	45 Å²	45	26.2 Å²	26.2	27%	0.273	15%	0.148	S	C	.	.	S	Bend	trans	-121.1	-177.5	175.5	-69.5	0	0	0	0	111.3	C505 C509 R555 Y565 D568	C505-V507 VanDerWaalsContact CB-O 3.29Å; C505-V507 WeakPolarHBondContact CB-O 3.27Å; V507-C509 PolarHBondContact O-N 2.9Å; V507-R555 WeakPolarHBondContact CG2-O 3.33Å; V507-Y565 HydrophobicContact CB-CD1 4.46Å; V507-Y565 HydrophobicContact CB-CE1 4.43Å; V507-Y565 HydrophobicContact CG1-CD1 3.76Å; V507-Y565 HydrophobicContact CG1-CE1 3.36Å; V507-Y565 HydrophobicContact CG1-CE2 4.49Å; V507-Y565 HydrophobicContact CG1-CG 4.49Å; V507-Y565 HydrophobicContact CG2-CD1 3.84Å; V507-Y565 HydrophobicContact CG2-CD2 4.14Å; V507-Y565 HydrophobicContact CG2-CE1 4.2Å; V507-Y565 HydrophobicContact CG2-CE2 4.47Å; V507-Y565 HydrophobicContact CG2-CG 3.81Å; V507-D568 WeakPolarHBondContact CG2-OD2 3.23Å; V507-D568 PolarHBondContact N-OD2 2.92Å
508	N	79.7	Confident	86.5	Confident	96 Å²	96	30.6 Å²	30.6	51%	0.513	17%	0.171	S	C	.	.			trans	-78.7	66.1	-179.8	-170.3	48.5	0	0	0	111.9
509	C	86.8	Confident	84.3	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.204	C	C	.	.			trans	-59.8	160.3	171.7	71.2	0	0	0	0	112.1	C505 V507 K529 G530 F553 Q554 R555	C505-C509 HydrophobicContact CB-CB 3.72Å; C505-C509 WeakPolarHBondContact CB-SG 3.23Å; C505-C509 WeakPolarHBondContact SG-CB 3.46Å; C505-C509 CovalentContact SG-SG 2.02Å; C505-C509 PolarHBondContact SG-SG 2.96Å; V507-C509 PolarHBondContact O-N 2.9Å; C509-K529 WeakPolarHBondContact O-CA 3.31Å; C509-G530 PolarHBondContact O-N 2.6Å; C509-G530 VanDerWaalsContact SG-CA 3.59Å; C509-F553 HydrophobicContact CB-CE2 3.76Å; C509-F553 HydrophobicContact CB-CZ 3.8Å; C509-Q554 WeakPolarHBondContact CA-O 3.3Å; C509-R555 WeakPolarHBondContact CA-O 3.37Å
510	E	88.4	Confident	82.2	Confident	5 Å²	5	43 Å²	43	2%	0.023	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	122.7	176.9	-57.4	-169.1	143.8	0	0	110.4	K257 Y512 T527 K529 Q554 T557	K257-E510 IonicContact NZ-OE2 2.75Å; K257-E510 PolarHBondContact NZ-OE2 3.38Å; E510-Y512 HydrophobicContact CB-CD2 4.24Å; E510-Y512 HydrophobicContact CB-CE2 3.54Å; E510-Y512 PolarHBondContact OE2-OH 3.25Å; E510-T527 HydrophobicContact CB-CG2 4.47Å; E510-K529 HydrophobicContact CG-CD 4.38Å; E510-K529 HydrophobicContact CG-CG 4.26Å; E510-K529 WeakPolarHBondContact OE1-CD 3.46Å; E510-K529 WeakPolarHBondContact OE1-CE 3.29Å; E510-K529 IonicContact OE1-NZ 3.92Å; E510-K529 PolarHBondContact OE1-NZ 2.83Å; E510-Q554 PolarHBondContact N-O 2.8Å; E510-Q554 PolarHBondContact O-N 2.78Å; E510-T557 HydrophobicContact CG-CG2 4.35Å; E510-T557 WeakPolarHBondContact OE2-CG2 3.47Å
511	L	89	Confident	80.2	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	120.2	168.8	178	65.6	0	0	0	109	W451 F501 T503 T527 W528 F553 A570	W451-L511 HydrophobicContact CZ2-CD1 4.46Å; F501-L511 HydrophobicContact CD2-CD2 3.56Å; F501-L511 HydrophobicContact CE2-CD2 3.76Å; F501-L511 HydrophobicContact CG-CD2 4.37Å; T503-L511 HydrophobicContact CG2-CB 3.88Å; T503-L511 HydrophobicContact CG2-CD2 3.79Å; T503-L511 HydrophobicContact CG2-CG 4.46Å; L511-T527 CarbonylContact O-C 3.54Å; L511-T527 WeakPolarHBondContact O-CA 3.15Å; L511-W528 HydrophobicContact CB-CE3 4.24Å; L511-W528 HydrophobicContact CD2-CE3 3.91Å; L511-W528 HydrophobicContact CD2-CZ3 4.36Å; L511-W528 HydrophobicContact CG-CE3 3.93Å; L511-W528 HydrophobicContact CG-CZ3 4.35Å; L511-W528 PolarHBondContact N-O 2.91Å; L511-W528 PolarHBondContact O-N 2.88Å; L511-F553 HydrophobicContact CB-CD2 4.02Å; L511-F553 HydrophobicContact CD1-CB 4.02Å; L511-F553 HydrophobicContact CD1-CD2 4.27Å; L511-A570 HydrophobicContact CD1-CB 3.92Å; L511-A570 HydrophobicContact CD2-CB 4.19Å
512	Y	86.6	Confident	78.5	Confident	33 Å²	33	45.8 Å²	45.8	13%	0.129	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.8	178.5	-65.7	-97.8	0	0	0	110.3	K257 F469 E510 T527 W551 A552	K257-Y512 PolarHBondContact NZ-OH 3.39Å; F469-Y512 HydrophobicContact CE1-CD2 4.39Å; F469-Y512 HydrophobicContact CE1-CE2 4.14Å; E510-Y512 HydrophobicContact CB-CD2 4.24Å; E510-Y512 HydrophobicContact CB-CE2 3.54Å; E510-Y512 PolarHBondContact OE2-OH 3.25Å; Y512-T527 HydrophobicContact CD1-CG2 3.81Å; Y512-T527 VanDerWaalsContact CD1-OG1 3.29Å; Y512-T527 WeakPolarHBondContact CD1-OG1 3.48Å; Y512-T527 HydrophobicContact CD2-CG2 4.47Å; Y512-T527 HydrophobicContact CE1-CG2 3.72Å; Y512-T527 HydrophobicContact CE2-CG2 4.38Å; Y512-T527 HydrophobicContact CG-CG2 4.2Å; Y512-W551 WeakPolarHBondContact O-CA 3.02Å; Y512-A552 PolarHBondContact N-O 2.83Å; Y512-A552 PolarHBondContact O-N 2.84Å
513	F	86.8	Confident	76.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.6	163.1	176.6	-111.2	0	0	0	109.3	I497 F499 V515 V525 E526 W528 Y537 Y539 F549 W551	I497-F513 HydrophobicContact CG2-CZ 4.01Å; F499-F513 HydrophobicContact CD1-CE2 4.33Å; F499-F513 HydrophobicContact CE1-CD1 4.23Å; F499-F513 AromaticContact CE1-CD2 3.58Å; F499-F513 HydrophobicContact CE1-CD2 3.58Å; F499-F513 HydrophobicContact CE1-CE1 4.23Å; F499-F513 AromaticContact CE1-CE2 3.56Å; F499-F513 HydrophobicContact CE1-CE2 3.56Å; F499-F513 AromaticContact CE1-CG 3.92Å; F499-F513 HydrophobicContact CE1-CG 3.92Å; F499-F513 AromaticContact CE1-CZ 3.9Å; F499-F513 HydrophobicContact CE1-CZ 3.9Å; F499-F513 HydrophobicContact CZ-CB 4.16Å; F499-F513 HydrophobicContact CZ-CD1 4.43Å; F499-F513 AromaticContact CZ-CD2 3.77Å; F499-F513 HydrophobicContact CZ-CD2 3.77Å; F499-F513 HydrophobicContact CZ-CE2 4.24Å; F499-F513 AromaticContact CZ-CG 3.87Å; F499-F513 HydrophobicContact CZ-CG 3.87Å; F513-V515 HydrophobicContact CE1-CG2 3.75Å; F513-V515 HydrophobicContact CZ-CG2 3.87Å; F513-V525 HydrophobicContact CD1-CB 4.17Å; F513-V525 HydrophobicContact CD1-CG1 4.48Å; F513-V525 PolarHBondContact O-N 2.88Å; F513-E526 PolarHBondContact N-O 2.75Å; F513-E526 PolarHBondContact O-N 3.17Å; F513-W528 HydrophobicContact CB-CH2 3.64Å; F513-W528 HydrophobicContact CB-CZ3 3.61Å; F513-W528 HydrophobicContact CG-CH2 4.47Å; F513-Y537 HydrophobicContact CD1-CD1 4.38Å; F513-Y537 AromaticContact CD1-CE1 3.81Å; F513-Y537 HydrophobicContact CD1-CE1 3.81Å; F513-Y537 HydrophobicContact CE1-CE1 4.02Å; F513-Y539 HydrophobicContact CE1-CD1 4.39Å; F513-Y539 HydrophobicContact CE1-CG 4.05Å; F513-F549 HydrophobicContact CE2-CB 4.2Å; F513-F549 HydrophobicContact CE2-CD1 4.33Å; F513-F549 AromaticContact CZ-CD1 3.9Å; F513-F549 HydrophobicContact CZ-CD1 3.9Å; F513-W551 AromaticContact CD2-CD1 3.88Å; F513-W551 HydrophobicContact CD2-CD2 4.33Å; F513-W551 AromaticContact CD2-CE2 3.8Å; F513-W551 HydrophobicContact CD2-CG 4.37Å; F513-W551 HydrophobicContact CD2-CZ2 4.26Å; F513-W551 AromaticContact CD2-NE1 3.5Å; F513-W551 AromaticContact CE2-CE2 3.84Å; F513-W551 AromaticContact CE2-CZ2 3.82Å; F513-W551 HydrophobicContact CE2-CZ2 3.82Å; F513-W551 AromaticContact CE2-NE1 3.94Å
514	M	81.3	Confident	75.3	Confident	22 Å²	22	50.4 Å²	50.4	11%	0.108	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149.6	-175.9	-56.9	166.9	-79.2	0	0	111.1	N522 T523 P524 T550 A552	M514-N522 HydrophobicContact CB-CB 3.77Å; M514-N522 HydrophobicContact SD-CB 4.47Å; M514-T523 CarbonylContact C-O 3.51Å; M514-T523 WeakPolarHBondContact CA-O 3.46Å; M514-T523 WeakPolarHBondContact CB-O 3.03Å; M514-P524 HydrophobicContact CG-CB 4.12Å; M514-T550 HydrophobicContact CE-CG2 3.69Å; M514-T550 PolarHBondContact N-O 2.86Å; M514-T550 PolarHBondContact O-N 2.89Å; M514-A552 HydrophobicContact CE-CB 3.43Å; M514-A552 VanDerWaalsContact CE-CB 3.43Å
515	V	80.1	Confident	74.3	Confident	6 Å²	6	49.3 Å²	49.3	4%	0.036	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	126.3	179.6	-176.8	0	0	0	0	109.7	F513 T523 V525 Y539 V547 S548 F549	F513-V515 HydrophobicContact CE1-CG2 3.75Å; F513-V515 HydrophobicContact CZ-CG2 3.87Å; V515-T523 PolarHBondContact N-O 2.02Å; V515-T523 PolarHBondContact O-N 2.86Å; V515-T523 PolarHBondContact O-OG1 3.04Å; V515-T523 VanDerWaalsContact O-OG1 3.13Å; V515-V525 HydrophobicContact CB-CG2 4Å; V515-V525 HydrophobicContact CG2-CG2 3.7Å; V515-Y539 HydrophobicContact CB-CE1 4.37Å; V515-Y539 HydrophobicContact CG1-CE1 4.04Å; V515-Y539 HydrophobicContact CG2-CD1 4.05Å; V515-Y539 HydrophobicContact CG2-CE1 3.8Å; V515-V547 HydrophobicContact CG1-CG1 3.75Å; V515-S548 WeakPolarHBondContact CA-O 3.36Å; V515-F549 HydrophobicContact CG1-CD1 4.46Å; V515-F549 HydrophobicContact CG1-CE1 4.38Å; V515-F549 HydrophobicContact CG2-CD1 4.07Å; V515-F549 HydrophobicContact CG2-CE1 4.44Å
516	G	76.1	Confident	73.7	Confident	2 Å²	2	51.1 Å²	51.1	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	149.6	170.5	0	0	0	0	0	111.4	N522 V547 S548	G516-N522 WeakPolarHBondContact CA-OD1 3.11Å; G516-N522 PolarHBondContact N-OD1 2.95Å; G516-V547 WeakPolarHBondContact O-CA 3.36Å; G516-S548 WeakPolarHBondContact CA-OG 3.44Å; G516-S548 PolarHBondContact N-O 2.92Å; G516-S548 PolarHBondContact O-N 2.86Å; G516-S548 PolarHBondContact O-OG 3.24Å
517	M	75.3	Confident	73.3	Confident	53 Å²	53	48.6 Å²	48.6	26%	0.261	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	136.2	-179.5	-75.3	178.3	169.4	0	0	110.4	S519 R520 A545 T546 V547	M517-S519 PolarHBondContact O-N 3.09Å; M517-R520 VanDerWaalsContact O-CB 3.25Å; M517-R520 WeakPolarHBondContact O-CB 3.35Å; M517-R520 WeakPolarHBondContact O-CG 3.31Å; M517-R520 PolarHBondContact O-N 2.69Å; M517-A545 HydrophobicContact CB-CB 4.42Å; M517-A545 HydrophobicContact CG-CB 4.42Å; M517-T546 CarbonylContact C-O 3.54Å; M517-T546 WeakPolarHBondContact CA-O 3.3Å; M517-V547 HydrophobicContact CG-CG2 4.1Å
518	N	59.8	Low	73.4	Confident	91 Å²	91	47.6 Å²	47.6	49%	0.487	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	45	55.4	171.7	-66.4	-25.2	0	0	0	113.5	R520 A545 T546	N518-R520 PolarHBondContact O-N 2.95Å; N518-R520 VanDerWaalsContact O-N 3.13Å; N518-A545 WeakPolarHBondContact ND2-CB 3.27Å; N518-A545 WeakPolarHBondContact OD1-CB 3.49Å; N518-T546 PolarHBondContact N-O 3.44Å; N518-T546 PolarHBondContact OD1-N 2.62Å
519	S	49	Very low	73.6	Confident	132 Å²	132	47.8 Å²	47.8	92%	0.923	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	11.4	-177.7	62.8	0	0	0	0	117.5	M517	M517-S519 PolarHBondContact O-N 3.09Å
520	R	51.5	Low	73.5	Confident	168 Å²	168	48.3 Å²	48.3	63%	0.634	26%	0.259	S	S	*	.			trans	-69.5	165.8	165.4	-61.4	-178.6	177.8	-161.3	-0.6	111.1	M517 N518	M517-R520 VanDerWaalsContact O-CB 3.25Å; M517-R520 WeakPolarHBondContact O-CB 3.35Å; M517-R520 WeakPolarHBondContact O-CG 3.31Å; M517-R520 PolarHBondContact O-N 2.69Å; N518-R520 PolarHBondContact O-N 2.95Å; N518-R520 VanDerWaalsContact O-N 3.13Å
521	T	54.1	Low	73.6	Confident	76 Å²	76	52.2 Å²	52.2	47%	0.466	28%	0.284	S	S	.	.			trans	-60.6	155.1	173.1	43	0	0	0	0	112	E225 T523	E225-T521 WeakPolarHBondContact OE2-CB 3.35Å; E225-T521 PolarHBondContact OE2-OG1 3.08Å; T521-T523 PolarHBondContact O-N 3.41Å
522	N	59.5	Low	73.7	Confident	16 Å²	16	54.4 Å²	54.4	9%	0.086	29%	0.293	C	S	.	.			trans	-83.6	106.3	179.5	-56.8	-38.4	0	0	0	108.3	K226 M514 G516 S548 T550	K226-N522 PolarHBondContact NZ-ND2 2.91Å; M514-N522 HydrophobicContact CB-CB 3.77Å; M514-N522 HydrophobicContact SD-CB 4.47Å; G516-N522 WeakPolarHBondContact CA-OD1 3.11Å; G516-N522 PolarHBondContact N-OD1 2.95Å; N522-S548 PolarHBondContact OD1-OG 2.72Å; N522-T550 VanDerWaalsContact CG-OG1 3.32Å; N522-T550 PolarHBondContact ND2-OG1 2.84Å
523	T	59.8	Low	73.9	Confident	63 Å²	63	55.6 Å²	55.6	39%	0.387	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	136.9	-179.9	66.2	0	0	0	0	110.6	M514 V515 T521 V525	M514-T523 CarbonylContact C-O 3.51Å; M514-T523 WeakPolarHBondContact CA-O 3.46Å; M514-T523 WeakPolarHBondContact CB-O 3.03Å; V515-T523 PolarHBondContact N-O 2.02Å; V515-T523 PolarHBondContact O-N 2.86Å; V515-T523 PolarHBondContact O-OG1 3.04Å; V515-T523 VanDerWaalsContact O-OG1 3.13Å; T521-T523 PolarHBondContact O-N 3.41Å; T523-V525 PolarHBondContact O-N 3.07Å
524	P	63.8	Low	74.1	Confident	65 Å²	65	61.1 Å²	61.1	42%	0.422	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	122.3	175.1	27.5	-32.8	0	0	0	111.3	M514	M514-P524 HydrophobicContact CG-CB 4.12Å
525	V	72.3	Confident	74.5	Confident	51 Å²	51	63.6 Å²	63.6	31%	0.309	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-43.6	178.5	176	0	0	0	0	110.6	F513 V515 T523 Y539	F513-V525 HydrophobicContact CD1-CB 4.17Å; F513-V525 HydrophobicContact CD1-CG1 4.48Å; F513-V525 PolarHBondContact O-N 2.88Å; V515-V525 HydrophobicContact CB-CG2 4Å; V515-V525 HydrophobicContact CG2-CG2 3.7Å; T523-V525 PolarHBondContact O-N 3.07Å; V525-Y539 HydrophobicContact CG1-CD2 3.68Å; V525-Y539 HydrophobicContact CG1-CE2 3.78Å; V525-Y539 HydrophobicContact CG2-CE2 4.16Å
526	E	77	Confident	75.1	Confident	56 Å²	56	67.4 Å²	67.4	26%	0.262	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	154.2	-176.5	-174.4	55.4	-87.3	0	0	111	F513 W528 Y537	F513-E526 PolarHBondContact N-O 2.75Å; F513-E526 PolarHBondContact O-N 3.17Å; E526-W528 HydrophobicContact CB-CH2 3.91Å; E526-W528 HydrophobicContact CB-CZ2 3.92Å; E526-W528 HydrophobicContact CG-CD2 4.3Å; E526-W528 HydrophobicContact CG-CH2 3.74Å; E526-W528 HydrophobicContact CG-CZ2 3.24Å; E526-W528 HydrophobicContact CG-CZ3 4.46Å; E526-Y537 HydrophobicContact CB-CE1 4.5Å; E526-Y537 HydrophobicContact CB-CE2 4.31Å; E526-Y537 HydrophobicContact CG-CE2 4.03Å
527	T	79.6	Confident	75.7	Confident	41 Å²	41	69 Å²	69	25%	0.252	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	113.8	-178.3	-55.9	0	0	0	0	112.6	E510 L511 Y512	E510-T527 HydrophobicContact CB-CG2 4.47Å; L511-T527 CarbonylContact O-C 3.54Å; L511-T527 WeakPolarHBondContact O-CA 3.15Å; Y512-T527 HydrophobicContact CD1-CG2 3.81Å; Y512-T527 VanDerWaalsContact CD1-OG1 3.29Å; Y512-T527 WeakPolarHBondContact CD1-OG1 3.48Å; Y512-T527 HydrophobicContact CD2-CG2 4.47Å; Y512-T527 HydrophobicContact CE1-CG2 3.72Å; Y512-T527 HydrophobicContact CE2-CG2 4.38Å; Y512-T527 HydrophobicContact CG-CG2 4.2Å
528	W	83.9	Confident	76.2	Confident	24 Å²	24	69.4 Å²	69.4	9%	0.091	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	128.9	177.3	-54	-81.4	0	0	0	111.2	F499 F501 L511 F513 E526 K532 Y537	F499-W528 HydrophobicContact CE2-CH2 4.21Å; F499-W528 AromaticContact CZ-CH2 3.75Å; F499-W528 HydrophobicContact CZ-CH2 3.75Å; F499-W528 HydrophobicContact CZ-CZ3 4.27Å; F501-W528 HydrophobicContact CE1-CD2 4.33Å; F501-W528 HydrophobicContact CE1-CH2 4.44Å; F501-W528 HydrophobicContact CE1-CZ2 4.07Å; F501-W528 HydrophobicContact CE2-CB 4.45Å; F501-W528 AromaticContact CE2-CD2 3.84Å; F501-W528 HydrophobicContact CE2-CD2 3.84Å; F501-W528 HydrophobicContact CE2-CE3 4.06Å; F501-W528 AromaticContact CE2-CG 4Å; F501-W528 HydrophobicContact CE2-CG 4Å; F501-W528 AromaticContact CZ-CD1 3.93Å; F501-W528 AromaticContact CZ-CD2 3.4Å; F501-W528 HydrophobicContact CZ-CD2 3.4Å; F501-W528 AromaticContact CZ-CE2 3.43Å; F501-W528 VanDerWaalsContact CZ-CE2 3.43Å; F501-W528 AromaticContact CZ-CE3 3.86Å; F501-W528 HydrophobicContact CZ-CE3 3.86Å; F501-W528 AromaticContact CZ-CG 3.74Å; F501-W528 HydrophobicContact CZ-CG 3.74Å; F501-W528 HydrophobicContact CZ-CH2 4.37Å; F501-W528 AromaticContact CZ-CZ2 3.92Å; F501-W528 HydrophobicContact CZ-CZ2 3.92Å; F501-W528 HydrophobicContact CZ-CZ3 4.33Å; F501-W528 AromaticContact CZ-NE1 3.74Å; L511-W528 HydrophobicContact CB-CE3 4.24Å; L511-W528 HydrophobicContact CD2-CE3 3.91Å; L511-W528 HydrophobicContact CD2-CZ3 4.36Å; L511-W528 HydrophobicContact CG-CE3 3.93Å; L511-W528 HydrophobicContact CG-CZ3 4.35Å; L511-W528 PolarHBondContact N-O 2.91Å; L511-W528 PolarHBondContact O-N 2.88Å; F513-W528 HydrophobicContact CB-CH2 3.64Å; F513-W528 HydrophobicContact CB-CZ3 3.61Å; F513-W528 HydrophobicContact CG-CH2 4.47Å; E526-W528 HydrophobicContact CB-CH2 3.91Å; E526-W528 HydrophobicContact CB-CZ2 3.92Å; E526-W528 HydrophobicContact CG-CD2 4.3Å; E526-W528 HydrophobicContact CG-CH2 3.74Å; E526-W528 HydrophobicContact CG-CZ2 3.24Å; E526-W528 HydrophobicContact CG-CZ3 4.46Å; W528-K532 HydrophobicContact CB-CG 4.15Å; W528-Y537 HydrophobicContact CH2-CD1 4.14Å; W528-Y537 HydrophobicContact CH2-CE1 4.47Å; W528-Y537 HydrophobicContact CH2-CG 4.18Å; W528-Y537 HydrophobicContact CZ2-CD1 4.12Å; W528-Y537 AromaticContact CZ2-CD2 3.77Å; W528-Y537 HydrophobicContact CZ2-CD2 3.77Å; W528-Y537 HydrophobicContact CZ2-CE2 4.19Å; W528-Y537 AromaticContact CZ2-CG 3.72Å; W528-Y537 HydrophobicContact CZ2-CG 3.72Å
529	K	84.4	Confident	77.5	Confident	99 Å²	99	67.8 Å²	67.8	43%	0.43	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	139.5	179.6	-50.9	-161.4	-177	-153.2	0	112.5	C509 E510 K532	C509-K529 WeakPolarHBondContact O-CA 3.31Å; E510-K529 HydrophobicContact CG-CD 4.38Å; E510-K529 HydrophobicContact CG-CG 4.26Å; E510-K529 WeakPolarHBondContact OE1-CD 3.46Å; E510-K529 WeakPolarHBondContact OE1-CE 3.29Å; E510-K529 IonicContact OE1-NZ 3.92Å; E510-K529 PolarHBondContact OE1-NZ 2.83Å; K529-K532 VanDerWaalsContact O-CE 3.26Å; K529-K532 WeakPolarHBondContact O-CE 3.36Å
530	G	85.9	Confident	79	Confident	11 Å²	11	64.2 Å²	64.2	11%	0.113	35%	0.349	C	S	.	.	S	Bend	trans	64.5	-164.8	-179.8	0	0	0	0	0	114	T503 C509 K532	T503-G530 PolarHBondContact OG1-O 2.95Å; C509-G530 PolarHBondContact O-N 2.6Å; C509-G530 VanDerWaalsContact SG-CA 3.59Å; G530-K532 PolarHBondContact O-N 3.39Å
531	T	90.5	Very high	80.5	Confident	88 Å²	88	56.2 Å²	56.2	54%	0.54	32%	0.319	S	S	.	.			trans	-66	126.1	178.9	-70.5	0	0	0	0	111.8	T503 C505	T503-T531 CarbonylContact O-C 3.56Å; T503-T531 VanDerWaalsContact O-CA 3.27Å; T503-T531 WeakPolarHBondContact O-CA 3.28Å; C505-T531 PolarHBondContact N-OG1 3.36Å; C505-T531 PolarHBondContact O-OG1 2.93Å
532	K	90.6	Very high	81.6	Confident	45 Å²	45	57.2 Å²	57.2	20%	0.196	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	125.4	171.5	-57.5	-61.4	-173.1	-173.4	0	109.1	T503 W528 K529 G530 Q808	T503-K532 PolarHBondContact N-O 3Å; T503-K532 PolarHBondContact O-N 3.2Å; T503-K532 WeakPolarHBondContact OG1-CB 3.3Å; T503-K532 PolarHBondContact OG1-N 3.36Å; W528-K532 HydrophobicContact CB-CG 4.15Å; K529-K532 VanDerWaalsContact O-CE 3.26Å; K529-K532 WeakPolarHBondContact O-CE 3.36Å; G530-K532 PolarHBondContact O-N 3.39Å; K532-Q808 VanDerWaalsContact NZ-OE1 3.09Å
533	G	90.1	Very high	82.2	Confident	59 Å²	59	61.1 Å²	61.1	61%	0.608	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.7	161.6	172.5	0	0	0	0	0	112.5	Q535	G533-Q535 PolarHBondContact O-N 3.41Å; G533-Q535 VanDerWaalsContact O-N 3.12Å
534	K	92.4	Very high	83.1	Confident	116 Å²	116	62 Å²	62	50%	0.504	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	113.4	-174.2	-171.1	164.4	179.1	160.3	0	112.7	V500 F501 E502 Y573	V500-K534 HydrophobicContact CG1-CG 3.91Å; F501-K534 WeakPolarHBondContact O-CA 3.31Å; E502-K534 HydrophobicContact CB-CB 4.37Å; K534-Y573 HydrophobicContact CD-CD2 3.8Å; K534-Y573 HydrophobicContact CD-CE2 3.66Å; K534-Y573 HydrophobicContact CD-CG 4.43Å; K534-Y573 VanDerWaalsContact CE-CG 3.5Å; K534-Y573 HydrophobicContact CG-CD2 4.17Å; K534-Y573 HydrophobicContact CG-CE2 4.19Å; K534-Y573 VanDerWaalsContact NZ-CD2 3.35Å
535	Q	88.8	Confident	83.9	Confident	74 Å²	74	59.1 Å²	59.1	35%	0.346	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	163	-173.9	62.4	-178.7	-13.3	0	0	111.7	V500 F501 G533	V500-Q535 WeakPolarHBondContact CA-O 3.42Å; F501-Q535 HydrophobicContact CD1-CG 4.29Å; F501-Q535 HydrophobicContact CE1-CG 3.76Å; F501-Q535 HydrophobicContact CE2-CG 4.4Å; F501-Q535 HydrophobicContact CZ-CG 3.83Å; F501-Q535 PolarHBondContact N-O 3.34Å; F501-Q535 PolarHBondContact O-N 3.14Å; G533-Q535 PolarHBondContact O-N 3.41Å; G533-Q535 VanDerWaalsContact O-N 3.12Å
536	S	91.7	Very high	84.5	Confident	85 Å²	85	59.8 Å²	59.8	59%	0.594	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	131.5	177.2	58.9	0	0	0	0	111.6	F499	F499-S536 WeakPolarHBondContact O-CA 3.12Å
537	Y	89.6	Confident	85	Confident	37 Å²	37	57.2 Å²	57.2	15%	0.145	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	146.5	169.9	-177.6	-102	0	0	0	110.4	T498 F499 F513 E526 W528	T498-Y537 CarbonylContact C-O 3.58Å; T498-Y537 VanDerWaalsContact CA-O 3.29Å; T498-Y537 WeakPolarHBondContact CA-O 3.46Å; F499-Y537 AromaticContact CE1-CD1 3.71Å; F499-Y537 HydrophobicContact CE1-CD1 3.71Å; F499-Y537 AromaticContact CZ-CD1 3.77Å; F499-Y537 HydrophobicContact CZ-CD1 3.77Å; F499-Y537 HydrophobicContact CZ-CG 4.35Å; F499-Y537 PolarHBondContact N-O 2.84Å; F499-Y537 PolarHBondContact O-N 3.17Å; F513-Y537 HydrophobicContact CD1-CD1 4.38Å; F513-Y537 AromaticContact CD1-CE1 3.81Å; F513-Y537 HydrophobicContact CD1-CE1 3.81Å; F513-Y537 HydrophobicContact CE1-CE1 4.02Å; E526-Y537 HydrophobicContact CB-CE1 4.5Å; E526-Y537 HydrophobicContact CB-CE2 4.31Å; E526-Y537 HydrophobicContact CG-CE2 4.03Å; W528-Y537 HydrophobicContact CH2-CD1 4.14Å; W528-Y537 HydrophobicContact CH2-CE1 4.47Å; W528-Y537 HydrophobicContact CH2-CG 4.18Å; W528-Y537 HydrophobicContact CZ2-CD1 4.12Å; W528-Y537 AromaticContact CZ2-CD2 3.77Å; W528-Y537 HydrophobicContact CZ2-CD2 3.77Å; W528-Y537 HydrophobicContact CZ2-CE2 4.19Å; W528-Y537 AromaticContact CZ2-CG 3.72Å; W528-Y537 HydrophobicContact CZ2-CG 3.72Å
538	T	86.8	Confident	85.4	Confident	61 Å²	61	56.3 Å²	56.3	37%	0.374	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	134.3	177	-61.5	0	0	0	0	109.8	R496 I497 T498	R496-T538 HydrophobicContact CB-CG2 4.24Å; I497-T538 CarbonylContact O-C 3.58Å; I497-T538 VanDerWaalsContact O-CA 3.27Å; I497-T538 WeakPolarHBondContact O-CA 3.4Å; T498-T538 WeakPolarHBondContact CG2-OG1 3.19Å; T498-T538 WeakPolarHBondContact OG1-CG2 3.41Å; T498-T538 PolarHBondContact OG1-OG1 2.81Å
539	Y	86	Confident	85.7	Confident	56 Å²	56	55.2 Å²	55.2	22%	0.22	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	142.3	173.6	173.6	-99.2	0	0	0	110.6	R496 I497 F513 V515 V525 I541 F549	R496-Y539 VanDerWaalsContact CA-O 3.31Å; R496-Y539 WeakPolarHBondContact CA-O 3.35Å; R496-Y539 WeakPolarHBondContact CB-O 3.5Å; I497-Y539 HydrophobicContact CG2-CD1 4.09Å; I497-Y539 HydrophobicContact CG2-CG 4.5Å; I497-Y539 PolarHBondContact N-O 3.17Å; I497-Y539 PolarHBondContact O-N 2.7Å; F513-Y539 HydrophobicContact CE1-CD1 4.39Å; F513-Y539 HydrophobicContact CE1-CG 4.05Å; V515-Y539 HydrophobicContact CB-CE1 4.37Å; V515-Y539 HydrophobicContact CG1-CE1 4.04Å; V515-Y539 HydrophobicContact CG2-CD1 4.05Å; V515-Y539 HydrophobicContact CG2-CE1 3.8Å; V525-Y539 HydrophobicContact CG1-CD2 3.68Å; V525-Y539 HydrophobicContact CG1-CE2 3.78Å; V525-Y539 HydrophobicContact CG2-CE2 4.16Å; Y539-I541 HydrophobicContact CD1-CD1 4.28Å; Y539-I541 HydrophobicContact CD1-CG1 4.49Å; Y539-I541 HydrophobicContact CE1-CG1 4.32Å; Y539-F549 HydrophobicContact CD1-CE1 4.31Å
540	T	81.8	Confident	85.9	Confident	58 Å²	58	50.6 Å²	50.6	36%	0.356	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	133.3	-173.9	-54	0	0	0	0	110.4	E493	E493-T540 HydrophobicContact CB-CG2 3.97Å; E493-T540 HydrophobicContact CG-CG2 3.6Å
541	I	82.8	Confident	86.2	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	119.7	177.6	-61.4	81.6	0	0	0	108.1	F479 V494 A495 I497 Y539 E543 V547 F549	F479-I541 HydrophobicContact CD2-CG2 4.13Å; F479-I541 HydrophobicContact CE2-CG1 4.41Å; F479-I541 HydrophobicContact CE2-CG2 3.85Å; F479-I541 HydrophobicContact CZ-CG1 4.19Å; F479-I541 HydrophobicContact CZ-CG2 4.42Å; V494-I541 PolarHBondContact N-O 2.77Å; A495-I541 HydrophobicContact CB-CB 4.29Å; A495-I541 HydrophobicContact CB-CD1 4.36Å; A495-I541 PolarHBondContact N-O 3.06Å; A495-I541 PolarHBondContact O-N 2.93Å; I497-I541 HydrophobicContact CG2-CD1 4.24Å; Y539-I541 HydrophobicContact CD1-CD1 4.28Å; Y539-I541 HydrophobicContact CD1-CG1 4.49Å; Y539-I541 HydrophobicContact CE1-CG1 4.32Å; I541-E543 WeakPolarHBondContact CG2-O 3.29Å; I541-V547 HydrophobicContact CG2-CG2 4.48Å; I541-F549 HydrophobicContact CD1-CE1 4.03Å; I541-F549 HydrophobicContact CD1-CZ 3.76Å; I541-F549 HydrophobicContact CG1-CE1 4.13Å; I541-F549 HydrophobicContact CG1-CZ 3.85Å
542	E	75.6	Confident	86.1	Confident	97 Å²	97	46 Å²	46	45%	0.453	25%	0.254	S	S	.	.			trans	-93.4	-11.6	-176.5	-66.5	-165.2	171.6	0	0	114.7	K492	K492-E542 HydrophobicContact CB-CB 4.16Å; K492-E542 VanDerWaalsContact CB-O 3.22Å; K492-E542 WeakPolarHBondContact CB-O 3.5Å; K492-E542 HydrophobicContact CD-CB 4.42Å; K492-E542 WeakPolarHBondContact CD-O 3.28Å; K492-E542 CarbonylContact O-C 3.44Å; K492-E542 VanDerWaalsContact O-CA 3.27Å; K492-E542 WeakPolarHBondContact O-CA 3.29Å; K492-E542 VanDerWaalsContact O-O 3.08Å
543	E	72.8	Confident	86.1	Confident	97 Å²	97	43.8 Å²	43.8	45%	0.453	24%	0.244	S	C	.	.	S	Bend	trans	-137.1	146.2	-174.6	-57.1	-155.4	146.2	0	0	112.8	K492 I541 A545	K492-E543 IonicContact NZ-OE1 2.65Å; K492-E543 PolarHBondContact NZ-OE1 3.07Å; I541-E543 WeakPolarHBondContact CG2-O 3.29Å; E543-A545 VanDerWaalsContact C-N 3.33Å; E543-A545 PolarHBondContact O-N 2.04Å
544	N	80	Confident	85.9	Confident	82 Å²	82	41.6 Å²	41.6	44%	0.439	22%	0.218	S	C	.	.			trans	-79	84.7	173.4	-174	14.3	0	0	0	110.2	F479	F479-N544 PolarHBondContact N-OD1 3.24Å; F479-N544 PolarHBondContact O-ND2 2.89Å; F479-N544 VanDerWaalsContact O-ND2 3.08Å; F479-N544 PolarHBondContact O-OD1 2.91Å
545	A	80.6	Confident	85.5	Confident	5 Å²	5	36.2 Å²	36.2	4%	0.041	20%	0.195	C	C	.	.	S	Bend	trans	-125	161	178.8	0	0	0	0	0	110.4	G478 M517 N518 E543 V547	G478-A545 WeakPolarHBondContact CA-O 3.46Å; M517-A545 HydrophobicContact CB-CB 4.42Å; M517-A545 HydrophobicContact CG-CB 4.42Å; N518-A545 WeakPolarHBondContact ND2-CB 3.27Å; N518-A545 WeakPolarHBondContact OD1-CB 3.49Å; E543-A545 VanDerWaalsContact C-N 3.33Å; E543-A545 PolarHBondContact O-N 2.04Å; A545-V547 HydrophobicContact CB-CG2 4.34Å; A545-V547 PolarHBondContact O-N 2.99Å
546	T	84.8	Confident	85	Confident	65 Å²	65	33.3 Å²	33.3	40%	0.399	18%	0.182	S	C	.	.			trans	-67.6	122.5	161.1	-61.7	0	0	0	0	107.7	V475 V476 P477 M517 N518	V475-T546 HydrophobicContact CG1-CG2 4.46Å; V476-T546 WeakPolarHBondContact O-CA 3.26Å; P477-T546 PolarHBondContact O-OG1 3.48Å; M517-T546 CarbonylContact C-O 3.54Å; M517-T546 WeakPolarHBondContact CA-O 3.3Å; N518-T546 PolarHBondContact N-O 3.44Å; N518-T546 PolarHBondContact OD1-N 2.62Å
547	V	87	Confident	83.8	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133.2	-174.1	176.6	0	0	0	0	111.5	V476 F479 V515 G516 M517 I541 A545 F549	V476-V547 PolarHBondContact N-O 2.84Å; V476-V547 PolarHBondContact O-N 2.89Å; F479-V547 HydrophobicContact CE2-CB 4.11Å; F479-V547 HydrophobicContact CE2-CG2 3.79Å; F479-V547 HydrophobicContact CZ-CB 4.42Å; V515-V547 HydrophobicContact CG1-CG1 3.75Å; G516-V547 WeakPolarHBondContact O-CA 3.36Å; M517-V547 HydrophobicContact CG-CG2 4.1Å; I541-V547 HydrophobicContact CG2-CG2 4.48Å; A545-V547 HydrophobicContact CB-CG2 4.34Å; A545-V547 PolarHBondContact O-N 2.99Å; V547-F549 HydrophobicContact CB-CE2 4.32Å; V547-F549 HydrophobicContact CB-CZ 4.2Å; V547-F549 HydrophobicContact CG1-CD1 3.98Å; V547-F549 HydrophobicContact CG1-CD2 4.19Å; V547-F549 HydrophobicContact CG1-CE1 3.52Å; V547-F549 HydrophobicContact CG1-CE2 3.76Å; V547-F549 HydrophobicContact CG1-CG 4.3Å; V547-F549 HydrophobicContact CG1-CZ 3.41Å; V547-F549 VanDerWaalsContact CG1-CZ 3.41Å
548	S	87.6	Confident	82.6	Confident	23 Å²	23	36 Å²	36	16%	0.161	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	107.8	171.8	42.6	0	0	0	0	110.5	V515 G516 N522	V515-S548 WeakPolarHBondContact CA-O 3.36Å; G516-S548 WeakPolarHBondContact CA-OG 3.44Å; G516-S548 PolarHBondContact N-O 2.92Å; G516-S548 PolarHBondContact O-N 2.86Å; G516-S548 PolarHBondContact O-OG 3.24Å; N522-S548 PolarHBondContact OD1-OG 2.72Å
549	F	90.8	Very high	81.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	124.7	171.7	-57.3	-71.6	0	0	0	109	T473 L474 V476 F479 I497 F513 V515 Y539 I541 V547 W551 V577	T473-F549 CarbonylContact C-O 3.52Å; T473-F549 WeakPolarHBondContact CA-O 3.38Å; L474-F549 HydrophobicContact CB-CB 4.35Å; L474-F549 HydrophobicContact CD2-CD2 4.23Å; L474-F549 HydrophobicContact CG-CD2 4.37Å; L474-F549 PolarHBondContact N-O 3.12Å; L474-F549 PolarHBondContact O-N 2.92Å; V476-F549 HydrophobicContact CB-CE2 4.3Å; V476-F549 HydrophobicContact CG2-CD2 4.05Å; V476-F549 HydrophobicContact CG2-CE2 3.79Å; F479-F549 HydrophobicContact CZ-CE2 4.25Å; F479-F549 HydrophobicContact CZ-CZ 4.13Å; I497-F549 HydrophobicContact CB-CD1 4.49Å; I497-F549 HydrophobicContact CB-CE1 4.16Å; I497-F549 HydrophobicContact CB-CZ 4.22Å; I497-F549 HydrophobicContact CD1-CB 3.93Å; I497-F549 HydrophobicContact CD1-CD1 3.87Å; I497-F549 HydrophobicContact CD1-CD2 3.78Å; I497-F549 HydrophobicContact CD1-CE1 4.32Å; I497-F549 HydrophobicContact CD1-CE2 4.23Å; I497-F549 HydrophobicContact CD1-CG 3.57Å; I497-F549 HydrophobicContact CD1-CZ 4.48Å; I497-F549 HydrophobicContact CG2-CD1 3.86Å; I497-F549 HydrophobicContact CG2-CE1 3.55Å; I497-F549 HydrophobicContact CG2-CZ 4.09Å; F513-F549 HydrophobicContact CE2-CB 4.2Å; F513-F549 HydrophobicContact CE2-CD1 4.33Å; F513-F549 AromaticContact CZ-CD1 3.9Å; F513-F549 HydrophobicContact CZ-CD1 3.9Å; V515-F549 HydrophobicContact CG1-CD1 4.46Å; V515-F549 HydrophobicContact CG1-CE1 4.38Å; V515-F549 HydrophobicContact CG2-CD1 4.07Å; V515-F549 HydrophobicContact CG2-CE1 4.44Å; Y539-F549 HydrophobicContact CD1-CE1 4.31Å; I541-F549 HydrophobicContact CD1-CE1 4.03Å; I541-F549 HydrophobicContact CD1-CZ 3.76Å; I541-F549 HydrophobicContact CG1-CE1 4.13Å; I541-F549 HydrophobicContact CG1-CZ 3.85Å; V547-F549 HydrophobicContact CB-CE2 4.32Å; V547-F549 HydrophobicContact CB-CZ 4.2Å; V547-F549 HydrophobicContact CG1-CD1 3.98Å; V547-F549 HydrophobicContact CG1-CD2 4.19Å; V547-F549 HydrophobicContact CG1-CE1 3.52Å; V547-F549 HydrophobicContact CG1-CE2 3.76Å; V547-F549 HydrophobicContact CG1-CG 4.3Å; V547-F549 HydrophobicContact CG1-CZ 3.41Å; V547-F549 VanDerWaalsContact CG1-CZ 3.41Å; F549-W551 HydrophobicContact CB-CH2 3.84Å; F549-W551 HydrophobicContact CB-CZ3 4.09Å; F549-V577 HydrophobicContact CE2-CG1 4.41Å
550	T	88.1	Confident	79.9	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	125.4	-171.6	-45.3	0	0	0	0	111.2	I471 L472 M514 N522	I471-T550 HydrophobicContact CG2-CG2 3.59Å; L472-T550 CarbonylContact O-C 3.56Å; L472-T550 VanDerWaalsContact O-CA 3.3Å; L472-T550 WeakPolarHBondContact O-CA 3.36Å; M514-T550 HydrophobicContact CE-CG2 3.69Å; M514-T550 PolarHBondContact N-O 2.86Å; M514-T550 PolarHBondContact O-N 2.89Å; N522-T550 VanDerWaalsContact CG-OG1 3.32Å; N522-T550 PolarHBondContact ND2-OG1 2.84Å
551	W	91.9	Very high	78.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	121.5	169.8	-58.5	-97.5	0	0	0	108.4	W451 I471 L472 L474 I497 F499 Y512 F513 F549 I572 I575	W451-W551 HydrophobicContact CZ2-CB 4.07Å; I471-W551 WeakPolarHBondContact CA-O 3.41Å; L472-W551 HydrophobicContact CB-CE3 4.4Å; L472-W551 HydrophobicContact CD2-CD2 4.46Å; L472-W551 HydrophobicContact CD2-CE3 3.78Å; L472-W551 HydrophobicContact CD2-CZ3 4.26Å; L472-W551 HydrophobicContact CG-CE3 4.1Å; L472-W551 PolarHBondContact N-O 3.16Å; L472-W551 PolarHBondContact O-N 3.12Å; L474-W551 HydrophobicContact CB-CH2 4.21Å; L474-W551 HydrophobicContact CB-CZ3 3.81Å; L474-W551 HydrophobicContact CD2-CH2 4.23Å; I497-W551 HydrophobicContact CD1-CH2 3.81Å; I497-W551 HydrophobicContact CD1-CZ2 3.88Å; F499-W551 HydrophobicContact CB-CZ2 4.48Å; F499-W551 AromaticContact CD1-CZ2 3.78Å; F499-W551 HydrophobicContact CD1-CZ2 3.78Å; F499-W551 AromaticContact CD1-NE1 3.63Å; F499-W551 AromaticContact CD2-NE1 3.53Å; F499-W551 HydrophobicContact CE1-CZ2 4.14Å; F499-W551 AromaticContact CE1-NE1 3.38Å; F499-W551 AromaticContact CE2-CD1 3.89Å; F499-W551 AromaticContact CE2-NE1 3.29Å; F499-W551 VanDerWaalsContact CE2-NE1 3.29Å; F499-W551 HydrophobicContact CG-CZ2 4.12Å; F499-W551 AromaticContact CG-NE1 3.7Å; F499-W551 AromaticContact CZ-CD1 3.92Å; F499-W551 AromaticContact CZ-NE1 3.21Å; Y512-W551 WeakPolarHBondContact O-CA 3.02Å; F513-W551 AromaticContact CD2-CD1 3.88Å; F513-W551 HydrophobicContact CD2-CD2 4.33Å; F513-W551 AromaticContact CD2-CE2 3.8Å; F513-W551 HydrophobicContact CD2-CG 4.37Å; F513-W551 HydrophobicContact CD2-CZ2 4.26Å; F513-W551 AromaticContact CD2-NE1 3.5Å; F513-W551 AromaticContact CE2-CE2 3.84Å; F513-W551 AromaticContact CE2-CZ2 3.82Å; F513-W551 HydrophobicContact CE2-CZ2 3.82Å; F513-W551 AromaticContact CE2-NE1 3.94Å; F549-W551 HydrophobicContact CB-CH2 3.84Å; F549-W551 HydrophobicContact CB-CZ3 4.09Å; W551-I572 HydrophobicContact CB-CD1 4.12Å; W551-I572 HydrophobicContact CD2-CD1 3.83Å; W551-I572 HydrophobicContact CG-CD1 3.6Å; W551-I575 HydrophobicContact CH2-CD1 3.6Å; W551-I575 HydrophobicContact CH2-CG1 4.36Å; W551-I575 HydrophobicContact CH2-CG2 4.33Å; W551-I575 HydrophobicContact CZ2-CD1 3.89Å; W551-I575 HydrophobicContact CZ2-CG1 4.3Å; W551-I575 HydrophobicContact CZ3-CD1 4.01Å
552	A	88.4	Confident	77.7	Confident	2 Å²	2	42 Å²	42	2%	0.017	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125.3	174.2	0	0	0	0	0	109.6	F469 M470 I471 Y512 M514	F469-A552 HydrophobicContact CD1-CB 4.25Å; M470-A552 WeakPolarHBondContact O-CA 3.41Å; I471-A552 HydrophobicContact CG1-CB 3.89Å; Y512-A552 PolarHBondContact N-O 2.83Å; Y512-A552 PolarHBondContact O-N 2.84Å; M514-A552 HydrophobicContact CE-CB 3.43Å; M514-A552 VanDerWaalsContact CE-CB 3.43Å
553	F	90	Very high	77.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	137	177.4	-177.8	-114.5	0	0	0	110.9	W451 T460 M470 T503 C509 L511 R555 A570	W451-F553 HydrophobicContact CZ2-CB 4.48Å; T460-F553 HydrophobicContact CG2-CB 3.54Å; T460-F553 HydrophobicContact CG2-CD1 3.64Å; T460-F553 HydrophobicContact CG2-CG 3.85Å; M470-F553 PolarHBondContact N-O 2.86Å; M470-F553 PolarHBondContact O-N 2.95Å; T503-F553 HydrophobicContact CG2-CE2 4.41Å; C509-F553 HydrophobicContact CB-CE2 3.76Å; C509-F553 HydrophobicContact CB-CZ 3.8Å; L511-F553 HydrophobicContact CB-CD2 4.02Å; L511-F553 HydrophobicContact CD1-CB 4.02Å; L511-F553 HydrophobicContact CD1-CD2 4.27Å; F553-R555 HydrophobicContact CD1-CG 4.35Å; F553-R555 HydrophobicContact CE1-CG 3.7Å; F553-R555 HydrophobicContact CZ-CG 4.42Å; F553-A570 HydrophobicContact CB-CB 4.14Å; F553-A570 HydrophobicContact CD1-CB 4.34Å; F553-A570 HydrophobicContact CD2-CB 3.68Å; F553-A570 HydrophobicContact CE2-CB 4.09Å; F553-A570 HydrophobicContact CG-CB 3.8Å
554	Q	85.9	Confident	77.9	Confident	12 Å²	12	39.5 Å²	39.5	6%	0.056	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	125	178.5	-173.9	-179.7	18.9	0	0	108	N467 F469 C509 E510 T556	N467-Q554 PolarHBondContact OD1-NE2 2.9Å; F469-Q554 HydrophobicContact CD1-CB 4.04Å; F469-Q554 HydrophobicContact CE1-CB 3.92Å; F469-Q554 HydrophobicContact CE1-CG 4.23Å; F469-Q554 VanDerWaalsContact CE1-OE1 3.28Å; F469-Q554 HydrophobicContact CZ-CG 4.41Å; F469-Q554 VanDerWaalsContact CZ-OE1 3.23Å; C509-Q554 WeakPolarHBondContact CA-O 3.3Å; E510-Q554 PolarHBondContact N-O 2.8Å; E510-Q554 PolarHBondContact O-N 2.78Å; Q554-T556 VanDerWaalsContact CG-O 3.28Å; Q554-T556 WeakPolarHBondContact CG-O 3.5Å; Q554-T556 PolarHBondContact NE2-O 2.76Å
555	R	85.5	Confident	78.1	Confident	4 Å²	4	38.5 Å²	38.5	2%	0.015	20%	0.202	C	C	.	.	S	Bend	trans	-76.1	-37.7	-175.9	-64.6	170.3	159.4	95.7	3.7	111.5	T460 A461 D466 V507 C509 F553 Y565 T566 D568	T460-R555 PolarHBondContact O-NH2 2.85Å; A461-R555 VanDerWaalsContact O-CZ 3.32Å; A461-R555 PolarHBondContact O-NH1 2.86Å; A461-R555 PolarHBondContact O-NH2 2.97Å; D466-R555 HydrophobicContact CB-CB 4.11Å; D466-R555 WeakPolarHBondContact O-CB 3.47Å; D466-R555 PolarHBondContact O-N 3.13Å; V507-R555 WeakPolarHBondContact CG2-O 3.33Å; C509-R555 WeakPolarHBondContact CA-O 3.37Å; F553-R555 HydrophobicContact CD1-CG 4.35Å; F553-R555 HydrophobicContact CE1-CG 3.7Å; F553-R555 HydrophobicContact CZ-CG 4.42Å; R555-Y565 VanDerWaalsContact CD-O 3.29Å; R555-Y565 WeakPolarHBondContact CD-O 3.36Å; R555-Y565 PolarHBondContact NE-O 3.28Å; R555-T566 PolarHBondContact NH2-O 2.85Å; R555-D568 HydrophobicContact CB-CB 4.37Å; R555-D568 HydrophobicContact CG-CB 4.11Å; R555-D568 VanDerWaalsContact CZ-O 3.29Å; R555-D568 PolarHBondContact NE-O 3.41Å; R555-D568 PolarHBondContact NH2-O 3.02Å; R555-D568 VanDerWaalsContact NH2-O 3.11Å
556	T	78.3	Confident	78.2	Confident	12 Å²	12	38.7 Å²	38.7	7%	0.074	20%	0.203	C	C	.	.			trans	-144.4	145.2	173.8	-176.6	0	0	0	0	110.7	D466 N467 Q554 L558 Y565	D466-T556 HydrophobicContact CB-CG2 3.84Å; D466-T556 PolarHBondContact O-N 3Å; N467-T556 PolarHBondContact OD1-O 3.47Å; N467-T556 VanDerWaalsContact OD1-O 3.05Å; Q554-T556 VanDerWaalsContact CG-O 3.28Å; Q554-T556 WeakPolarHBondContact CG-O 3.5Å; Q554-T556 PolarHBondContact NE2-O 2.76Å; T556-L558 VanDerWaalsContact C-N 3.31Å; T556-L558 PolarHBondContact OG1-N 3.29Å; T556-Y565 HydrophobicContact CG2-CD2 4.48Å
557	T	66.2	Low	78.2	Confident	63 Å²	63	40.5 Å²	40.5	39%	0.387	21%	0.21	S	C	.	.	S	Bend	trans	-86.4	-4.3	171.5	51.9	0	0	0	0	112.9	E510	E510-T557 HydrophobicContact CG-CG2 4.35Å; E510-T557 WeakPolarHBondContact OE2-CG2 3.47Å
558	L	63	Low	78.3	Confident	115 Å²	115	40.5 Å²	40.5	60%	0.602	21%	0.21	S	C	*	.	S	Bend	trans	-85.8	128.1	176.9	-64.9	168	0	0	0	110.1	T556 E560	T556-L558 VanDerWaalsContact C-N 3.31Å; T556-L558 PolarHBondContact OG1-N 3.29Å; L558-E560 HydrophobicContact CB-CG 4.45Å; L558-E560 PolarHBondContact O-N 2.85Å
559	H	57.8	Low	78.6	Confident	111 Å²	111	40.3 Å²	40.3	51%	0.514	21%	0.208	S	C	.	.			trans	-71.4	73.4	171.3	-87.5	-104.1	0	0	0	111.5	N467	N467-H559 PolarHBondContact ND2-CD2 2.97Å; N467-H559 PolarHBondContact ND2-CE1 2.88Å; N467-H559 PolarHBondContact ND2-ND1 3.25Å; N467-H559 PolarHBondContact ND2-NE2 3.48Å
560	E	58.4	Low	78.8	Confident	76 Å²	76	40.3 Å²	40.3	36%	0.355	21%	0.208	S	C	.	.			trans	-94.7	143.7	163.2	-61.3	-163.2	124.8	0	0	110.1	L558 K564	L558-E560 HydrophobicContact CB-CG 4.45Å; L558-E560 PolarHBondContact O-N 2.85Å; E560-K564 IonicContact OE1-NZ 2.84Å; E560-K564 PolarHBondContact OE1-NZ 2.81Å; E560-K564 WeakPolarHBondContact OE2-CD 3.04Å; E560-K564 WeakPolarHBondContact OE2-CE 3.39Å; E560-K564 IonicContact OE2-NZ 3.13Å; E560-K564 PolarHBondContact OE2-NZ 2.85Å
561	T	55.2	Low	79.2	Confident	99 Å²	99	41.8 Å²	41.8	61%	0.607	21%	0.214	S	C	*	.			trans	-88.2	127.6	176.5	61.6	0	0	0	0	111.5	K325	K325-T561 PolarHBondContact NZ-OG1 3Å
562	G	63.8	Low	79.4	Confident	17 Å²	17	41.8 Å²	41.8	18%	0.175	21%	0.214	C	C	.	.	S	Bend	trans	115.4	-162.6	174.4	0	0	0	0	0	114.7	D466	D466-G562 PolarHBondContact N-O 3.12Å
563	R	75.6	Confident	79.8	Confident	42 Å²	42	43.1 Å²	43.1	16%	0.158	22%	0.219	C	C	.	.			trans	-123.9	106.8	-176.4	-64.8	174.2	-180	150.9	-0.7	109.5	A355 M356 P357 V462 G463 T566	A355-R563 PolarHBondContact O-NH1 2.89Å; A355-R563 VanDerWaalsContact O-NH1 3.16Å; A355-R563 PolarHBondContact O-NH2 3.34Å; A355-R563 VanDerWaalsContact O-NH2 3.12Å; M356-R563 VanDerWaalsContact C-NH2 3.26Å; M356-R563 PolarHBondContact O-NH2 3Å; P357-R563 PolarHBondContact O-NH1 2.9Å; P357-R563 PolarHBondContact O-NH2 3Å; P357-R563 VanDerWaalsContact O-NH2 3.16Å; V462-R563 HydrophobicContact CG1-CG 4.49Å; G463-R563 VanDerWaalsContact O-CZ 3.29Å; G463-R563 PolarHBondContact O-NE 3.13Å; G463-R563 PolarHBondContact O-NH2 2.79Å; R563-T566 HydrophobicContact CB-CG2 3.83Å; R563-T566 HydrophobicContact CG-CG2 4.47Å
564	K	77.6	Confident	80	Confident	99 Å²	99	44.5 Å²	44.5	43%	0.43	23%	0.229	S	C	.	.	S	Bend	trans	-114.6	-41.1	176.4	-64	179.4	-176.1	177.5	0	111.3	D466 E560	D466-K564 WeakPolarHBondContact OD2-CA 3.38Å; D466-K564 PolarHBondContact OD2-N 3.24Å; E560-K564 IonicContact OE1-NZ 2.84Å; E560-K564 PolarHBondContact OE1-NZ 2.81Å; E560-K564 WeakPolarHBondContact OE2-CD 3.04Å; E560-K564 WeakPolarHBondContact OE2-CE 3.39Å; E560-K564 IonicContact OE2-NZ 3.13Å; E560-K564 PolarHBondContact OE2-NZ 2.85Å
565	Y	83.4	Confident	80.5	Confident	61 Å²	61	44 Å²	44	24%	0.239	23%	0.226	C	C	.	.			trans	-105.7	33.4	-168.9	-50.8	-67.3	0	0	0	112.5	D466 V507 R555 T556 N567 D568	D466-Y565 HydrophobicContact CB-CD2 4.28Å; D466-Y565 VanDerWaalsContact OD2-CD2 3.29Å; D466-Y565 WeakPolarHBondContact OD2-CD2 3.48Å; D466-Y565 PolarHBondContact OD2-N 2.93Å; V507-Y565 HydrophobicContact CB-CD1 4.46Å; V507-Y565 HydrophobicContact CB-CE1 4.43Å; V507-Y565 HydrophobicContact CG1-CD1 3.76Å; V507-Y565 HydrophobicContact CG1-CE1 3.36Å; V507-Y565 HydrophobicContact CG1-CE2 4.49Å; V507-Y565 HydrophobicContact CG1-CG 4.49Å; V507-Y565 HydrophobicContact CG2-CD1 3.84Å; V507-Y565 HydrophobicContact CG2-CD2 4.14Å; V507-Y565 HydrophobicContact CG2-CE1 4.2Å; V507-Y565 HydrophobicContact CG2-CE2 4.47Å; V507-Y565 HydrophobicContact CG2-CG 3.81Å; R555-Y565 VanDerWaalsContact CD-O 3.29Å; R555-Y565 WeakPolarHBondContact CD-O 3.36Å; R555-Y565 PolarHBondContact NE-O 3.28Å; T556-Y565 HydrophobicContact CG2-CD2 4.48Å; Y565-N567 PolarHBondContact O-N 3.46Å; Y565-N567 VanDerWaalsContact O-N 3.1Å; Y565-D568 VanDerWaalsContact O-CB 3.29Å; Y565-D568 WeakPolarHBondContact O-CB 3.38Å; Y565-D568 PolarHBondContact O-N 2.78Å
566	T	81.9	Confident	81	Confident	8 Å²	8	47 Å²	47	5%	0.049	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-32.8	-179.2	53.8	0	0	0	0	113.8	K333 V462 R555 R563 D568	K333-T566 HydrophobicContact CB-CG2 4.23Å; K333-T566 WeakPolarHBondContact CB-OG1 3.14Å; V462-T566 HydrophobicContact CG1-CG2 3.93Å; V462-T566 HydrophobicContact CG2-CG2 4.48Å; R555-T566 PolarHBondContact NH2-O 2.85Å; R563-T566 HydrophobicContact CB-CG2 3.83Å; R563-T566 HydrophobicContact CG-CG2 4.47Å; T566-D568 PolarHBondContact O-N 2.92Å
567	N	85.3	Confident	81.7	Confident	104 Å²	104	46.4 Å²	46.4	56%	0.556	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-18.4	178.1	-64.5	4.4	0	0	0	113.1	Y565 V569	Y565-N567 PolarHBondContact O-N 3.46Å; Y565-N567 VanDerWaalsContact O-N 3.1Å; N567-V569 PolarHBondContact O-N 2.59Å
568	D	90.6	Very high	82.8	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.23	C	C	.	.			trans	-73.6	121.2	174.5	-67.9	32	0	0	0	108	I504 C505 S506 V507 R555 Y565 T566	I504-D568 CarbonylContact O-C 3.48Å; I504-D568 VanDerWaalsContact O-CA 3.22Å; I504-D568 WeakPolarHBondContact O-CA 3.36Å; C505-D568 VanDerWaalsContact CA-OD2 3.24Å; C505-D568 WeakPolarHBondContact CA-OD2 3.16Å; C505-D568 HydrophobicContact CB-CB 4.37Å; C505-D568 WeakPolarHBondContact CB-OD2 3.48Å; S506-D568 WeakPolarHBondContact CB-OD1 3.39Å; S506-D568 PolarHBondContact N-OD1 2.98Å; S506-D568 PolarHBondContact N-OD2 2.86Å; S506-D568 PolarHBondContact OG-OD1 2.91Å; V507-D568 WeakPolarHBondContact CG2-OD2 3.23Å; V507-D568 PolarHBondContact N-OD2 2.92Å; R555-D568 HydrophobicContact CB-CB 4.37Å; R555-D568 HydrophobicContact CG-CB 4.11Å; R555-D568 VanDerWaalsContact CZ-O 3.29Å; R555-D568 PolarHBondContact NE-O 3.41Å; R555-D568 PolarHBondContact NH2-O 3.02Å; R555-D568 VanDerWaalsContact NH2-O 3.11Å; Y565-D568 VanDerWaalsContact O-CB 3.29Å; Y565-D568 WeakPolarHBondContact O-CB 3.38Å; Y565-D568 PolarHBondContact O-N 2.78Å; T566-D568 PolarHBondContact O-N 2.92Å
569	V	92.8	Very high	83.9	Confident	18 Å²	18	40.1 Å²	40.1	11%	0.109	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	143.7	-172.5	-67.2	0	0	0	0	112.2	Y459 T460 I504 N567	Y459-V569 HydrophobicContact CD2-CG1 4.18Å; T460-V569 VanDerWaalsContact OG1-CA 3.32Å; T460-V569 WeakPolarHBondContact OG1-CA 3.27Å; I504-V569 HydrophobicContact CB-CG2 4.24Å; I504-V569 PolarHBondContact N-O 3.28Å; I504-V569 PolarHBondContact O-N 2.86Å; N567-V569 PolarHBondContact O-N 2.59Å
570	A	95.3	Very high	85.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	144.8	158.8	0	0	0	0	0	109.7	W451 Y459 T460 T503 L511 F553	W451-A570 HydrophobicContact CH2-CB 3.85Å; W451-A570 HydrophobicContact CZ2-CB 4.41Å; Y459-A570 VanDerWaalsContact CA-O 3.3Å; Y459-A570 WeakPolarHBondContact CA-O 3.49Å; T460-A570 HydrophobicContact CG2-CB 3.9Å; T460-A570 PolarHBondContact N-O 2.87Å; T460-A570 PolarHBondContact OG1-N 3.47Å; T460-A570 VanDerWaalsContact OG1-N 3.09Å; T460-A570 PolarHBondContact OG1-O 2.7Å; T503-A570 HydrophobicContact CG2-CB 4.08Å; L511-A570 HydrophobicContact CD1-CB 3.92Å; L511-A570 HydrophobicContact CD2-CB 4.19Å; F553-A570 HydrophobicContact CB-CB 4.14Å; F553-A570 HydrophobicContact CD1-CB 4.34Å; F553-A570 HydrophobicContact CD2-CB 3.68Å; F553-A570 HydrophobicContact CE2-CB 4.09Å; F553-A570 HydrophobicContact CG-CB 3.8Å
571	K	95.8	Very high	86.7	Confident	34 Å²	34	35.1 Å²	35.1	15%	0.148	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	142.6	173.9	-53.9	175.9	-170.5	162	0	110.3	I458 F501 E502 Y573	I458-K571 CarbonylContact O-C 3.58Å; I458-K571 VanDerWaalsContact O-CA 3.26Å; I458-K571 WeakPolarHBondContact O-CA 3.49Å; F501-K571 CarbonylContact C-O 3.49Å; F501-K571 WeakPolarHBondContact CA-O 2.97Å; F501-K571 WeakPolarHBondContact CB-O 3.32Å; E502-K571 HydrophobicContact CG-CB 4.08Å; E502-K571 HydrophobicContact CG-CD 3.94Å; E502-K571 HydrophobicContact CG-CG 4.28Å; E502-K571 PolarHBondContact N-O 2.79Å; E502-K571 PolarHBondContact O-N 2.91Å; E502-K571 WeakPolarHBondContact OE1-CD 2.99Å; E502-K571 WeakPolarHBondContact OE1-CE 3.43Å; E502-K571 IonicContact OE1-NZ 2.75Å; E502-K571 PolarHBondContact OE1-NZ 2.66Å; K571-Y573 HydrophobicContact CB-CE2 4.36Å
572	I	97.1	Very high	87.9	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	121.7	171.3	-56.7	166.8	0	0	0	108.2	W451 H457 I458 L472 F499 V500 F501 W551 I575	W451-I572 HydrophobicContact CH2-CD1 3.65Å; W451-I572 HydrophobicContact CH2-CG1 3.89Å; W451-I572 HydrophobicContact CZ2-CD1 4.44Å; W451-I572 HydrophobicContact CZ3-CB 4.46Å; W451-I572 HydrophobicContact CZ3-CD1 3.75Å; W451-I572 HydrophobicContact CZ3-CG1 3.8Å; H457-I572 WeakPolarHBondContact CA-O 3.27Å; H457-I572 WeakPolarHBondContact CB-O 3.36Å; I458-I572 HydrophobicContact CD1-CB 4.26Å; I458-I572 HydrophobicContact CG1-CB 3.99Å; I458-I572 WeakPolarHBondContact CG1-O 3.38Å; I458-I572 PolarHBondContact N-O 3.37Å; I458-I572 PolarHBondContact O-N 2.9Å; L472-I572 HydrophobicContact CD2-CD1 4.17Å; F499-I572 HydrophobicContact CB-CG2 4.39Å; V500-I572 WeakPolarHBondContact O-CA 3.42Å; F501-I572 HydrophobicContact CB-CG1 4.19Å; W551-I572 HydrophobicContact CB-CD1 4.12Å; W551-I572 HydrophobicContact CD2-CD1 3.83Å; W551-I572 HydrophobicContact CG-CD1 3.6Å; I572-I575 HydrophobicContact CG2-CD1 4.01Å; I572-I575 HydrophobicContact CG2-CG1 3.67Å
573	Y	95.7	Very high	88.9	Confident	29 Å²	29	34.1 Å²	34.1	11%	0.114	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-36.1	-176.5	-74.2	-79.7	0	0	0	112.9	W426 D456 H457 V500 E502 K534 K571	W426-Y573 PolarHBondContact NE1-O 2.8Å; D456-Y573 WeakPolarHBondContact O-CD1 3.49Å; D456-Y573 WeakPolarHBondContact OD2-CE1 3.21Å; H457-Y573 HydrophobicContact CB-CD1 3.64Å; H457-Y573 HydrophobicContact CB-CE1 3.74Å; H457-Y573 HydrophobicContact CB-CG 4.18Å; V500-Y573 HydrophobicContact CG1-CD2 4.47Å; V500-Y573 PolarHBondContact O-N 3.22Å; E502-Y573 HydrophobicContact CG-CE2 3.91Å; E502-Y573 PolarHBondContact OE1-OH 3.38Å; E502-Y573 PolarHBondContact OE2-OH 3.08Å; K534-Y573 HydrophobicContact CD-CD2 3.8Å; K534-Y573 HydrophobicContact CD-CE2 3.66Å; K534-Y573 HydrophobicContact CD-CG 4.43Å; K534-Y573 VanDerWaalsContact CE-CG 3.5Å; K534-Y573 HydrophobicContact CG-CD2 4.17Å; K534-Y573 HydrophobicContact CG-CE2 4.19Å; K534-Y573 VanDerWaalsContact NZ-CD2 3.35Å; K571-Y573 HydrophobicContact CB-CE2 4.36Å
574	S	95.5	Very high	89.7	Confident	30 Å²	30	32.7 Å²	32.7	21%	0.21	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	145.4	179.7	61	0	0	0	0	111.3	Y423 F499 V500	Y423-S574 CarbonylContact O-C 3.54Å; Y423-S574 WeakPolarHBondContact O-CA 3.37Å; Y423-S574 VanDerWaalsContact O-CB 3.31Å; Y423-S574 WeakPolarHBondContact O-CB 3.3Å; F499-S574 WeakPolarHBondContact CA-O 3.24Å; F499-S574 WeakPolarHBondContact CB-O 3.25Å; V500-S574 WeakPolarHBondContact CG2-OG 3.36Å; V500-S574 PolarHBondContact N-O 2.86Å
575	I	96.4	Very high	90.3	Very high	1 Å²	1	28 Å²	28	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	124.4	173	-62	171	0	0	0	107.8	Y423 W426 M433 L474 I497 F499 W551 I572 V577	Y423-I575 HydrophobicContact CD2-CB 4.34Å; Y423-I575 PolarHBondContact N-O 2.93Å; Y423-I575 PolarHBondContact O-N 3.47Å; W426-I575 HydrophobicContact CH2-CD1 4.07Å; W426-I575 HydrophobicContact CH2-CG1 4.36Å; M433-I575 HydrophobicContact CE-CD1 3.8Å; L474-I575 HydrophobicContact CD2-CG2 3.98Å; I497-I575 HydrophobicContact CD1-CG2 3.97Å; I497-I575 HydrophobicContact CG1-CG2 4.22Å; F499-I575 HydrophobicContact CB-CG1 3.94Å; W551-I575 HydrophobicContact CH2-CD1 3.6Å; W551-I575 HydrophobicContact CH2-CG1 4.36Å; W551-I575 HydrophobicContact CH2-CG2 4.33Å; W551-I575 HydrophobicContact CZ2-CD1 3.89Å; W551-I575 HydrophobicContact CZ2-CG1 4.3Å; W551-I575 HydrophobicContact CZ3-CD1 4.01Å; I572-I575 HydrophobicContact CG2-CD1 4.01Å; I572-I575 HydrophobicContact CG2-CG1 3.67Å; I575-V577 HydrophobicContact CG2-CG2 4.14Å
576	N	94.8	Very high	90.5	Very high	67 Å²	67	26.5 Å²	26.5	36%	0.358	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	126.7	176.3	-175.4	2.4	0	0	0	109.3	F421 I497 T498	F421-N576 CarbonylContact O-C 3.5Å; F421-N576 VanDerWaalsContact O-CA 3.29Å; F421-N576 WeakPolarHBondContact O-CA 3.45Å; F421-N576 PolarHBondContact O-OD1 2.74Å; I497-N576 CarbonylContact C-O 3.51Å; I497-N576 WeakPolarHBondContact CA-O 3.21Å; T498-N576 PolarHBondContact N-O 3.02Å; T498-N576 PolarHBondContact O-N 2.87Å
577	V	93.6	Very high	90.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	123.1	177.1	-170.1	0	0	0	0	109.3	G420 F421 L474 F479 R496 I497 F549 I575 V580	G420-V577 CarbonylContact C-O 3.47Å; G420-V577 WeakPolarHBondContact CA-O 3.21Å; F421-V577 PolarHBondContact N-O 3.32Å; F421-V577 PolarHBondContact O-N 3.14Å; L474-V577 HydrophobicContact CD2-CG2 4.01Å; F479-V577 HydrophobicContact CE1-CG1 3.82Å; R496-V577 WeakPolarHBondContact O-CA 3.3Å; I497-V577 HydrophobicContact CB-CG2 4.31Å; I497-V577 HydrophobicContact CD1-CG2 3.98Å; I497-V577 HydrophobicContact CG1-CG2 3.95Å; F549-V577 HydrophobicContact CE2-CG1 4.41Å; I575-V577 HydrophobicContact CG2-CG2 4.14Å; V577-V580 HydrophobicContact CB-CG2 4.04Å; V577-V580 HydrophobicContact CG1-CG2 3.62Å
578	T	89.8	Confident	90.9	Very high	30 Å²	30	28.6 Å²	28.6	18%	0.184	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	160.3	-177.9	64	0	0	0	0	113.3	A495 R496 V580	A495-T578 WeakPolarHBondContact CB-O 3.42Å; R496-T578 HydrophobicContact CG-CG2 3.96Å; R496-T578 PolarHBondContact N-OG1 2.82Å; R496-T578 PolarHBondContact O-N 2.9Å; R496-T578 PolarHBondContact O-OG1 2.89Å; T578-V580 VanDerWaalsContact C-N 3.32Å; T578-V580 PolarHBondContact O-N 3.22Å
579	N	85.4	Confident	90.4	Very high	16 Å²	16	30.9 Å²	30.9	9%	0.086	18%	0.179	C	C	.	.	S	Bend	trans	54.5	34.5	168.7	-59.6	-22	0	0	0	115.3	V419 F479 R480 V494 A495	V419-N579 WeakPolarHBondContact O-CA 3.45Å; V419-N579 PolarHBondContact O-N 3.06Å; F479-N579 CarbonylContact C-O 3.5Å; F479-N579 WeakPolarHBondContact CA-O 3.5Å; R480-N579 PolarHBondContact N-O 2.86Å; V494-N579 PolarHBondContact O-ND2 3.38Å; A495-N579 HydrophobicContact CB-CB 4.34Å
580	V	88.9	Confident	89.7	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.006	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-76.4	133.7	-173.8	176.3	0	0	0	0	112.8	V419 F421 V476 F479 V577 T578 G582 G583	V419-V580 PolarHBondContact O-N 2.85Å; F421-V580 HydrophobicContact CD2-CG1 4.16Å; F421-V580 HydrophobicContact CD2-CG2 4.07Å; F421-V580 HydrophobicContact CE2-CB 4.46Å; F421-V580 HydrophobicContact CE2-CG1 3.65Å; F421-V580 HydrophobicContact CE2-CG2 4.39Å; F421-V580 HydrophobicContact CZ-CG1 4.01Å; V476-V580 HydrophobicContact CG1-CB 4.46Å; V476-V580 HydrophobicContact CG1-CG1 3.77Å; V476-V580 HydrophobicContact CG1-CG2 4.01Å; F479-V580 HydrophobicContact CD1-CG2 4.4Å; F479-V580 HydrophobicContact CE1-CG2 4.23Å; V577-V580 HydrophobicContact CB-CG2 4.04Å; V577-V580 HydrophobicContact CG1-CG2 3.62Å; T578-V580 VanDerWaalsContact C-N 3.32Å; T578-V580 PolarHBondContact O-N 3.22Å; V580-G582 PolarHBondContact O-N 2.82Å; V580-G583 PolarHBondContact O-N 2.99Å; V580-G583 VanDerWaalsContact O-N 3.15Å
581	M	86.5	Confident	88.9	Confident	80 Å²	80	31.6 Å²	31.6	39%	0.394	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	123.8	168.4	-75.8	-160.9	-70.2	0	0	110.8	G478 R480 G583	G478-M581 PolarHBondContact O-N 3.04Å; R480-M581 HydrophobicContact CB-CG 4.08Å; M581-G583 PolarHBondContact O-N 3.25Å
582	G	80.9	Confident	88	Confident	83 Å²	83	30 Å²	30	86%	0.856	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.7	11.2	-173.5	0	0	0	0	0	114.2	V580	V580-G582 PolarHBondContact O-N 2.82Å
583	G	85.3	Confident	86.9	Confident	13 Å²	13	33.4 Å²	33.4	13%	0.134	20%	0.195	C	C	.	.			trans	-70.5	168.2	174.2	0	0	0	0	0	113.3	G420 V580 M581	G420-G583 WeakPolarHBondContact O-CA 3.34Å; V580-G583 PolarHBondContact O-N 2.99Å; V580-G583 VanDerWaalsContact O-N 3.15Å; M581-G583 PolarHBondContact O-N 3.25Å
584	V	90.7	Very high	85.5	Confident	11 Å²	11	37.4 Å²	37.4	7%	0.067	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	170.9	177	-63.7	0	0	0	0	110.9	G385 F386 P396 V419 G420 F421	G385-V584 WeakPolarHBondContact O-CB 3.47Å; G385-V584 WeakPolarHBondContact O-CG1 3.27Å; F386-V584 HydrophobicContact CD2-CG2 3.99Å; F386-V584 HydrophobicContact CE2-CG1 4.26Å; F386-V584 HydrophobicContact CE2-CG2 3.6Å; F386-V584 HydrophobicContact CZ-CG1 4.28Å; F386-V584 HydrophobicContact CZ-CG2 4.31Å; P396-V584 HydrophobicContact CB-CG1 3.46Å; P396-V584 VanDerWaalsContact CB-CG1 3.46Å; V419-V584 CarbonylContact C-O 3.56Å; V419-V584 WeakPolarHBondContact CA-O 3.36Å; G420-V584 PolarHBondContact N-O 3.07Å; G420-V584 PolarHBondContact O-N 2.9Å; G420-V584 VanDerWaalsContact O-O 3.07Å; F421-V584 HydrophobicContact CD1-CG2 4.34Å
585	A	89.9	Confident	83.6	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.017	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.9	178.9	0	0	0	0	0	113.1	G385 Y402 S403 P417	G385-A585 WeakPolarHBondContact CA-O 3.11Å; Y402-A585 VanDerWaalsContact CA-O 3.23Å; Y402-A585 WeakPolarHBondContact CA-O 3.49Å; Y402-A585 WeakPolarHBondContact CB-O 2.92Å; S403-A585 PolarHBondContact N-O 2.86Å; P417-A585 HydrophobicContact CB-CB 3.5Å; P417-A585 VanDerWaalsContact CB-CB 3.5Å
586	S	89.4	Confident	81.6	Confident	28 Å²	28	44.3 Å²	44.3	20%	0.196	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-18.7	174.6	54.1	0	0	0	0	113.7	E422	E422-S586 WeakPolarHBondContact OE2-CB 2.75Å; E422-S586 PolarHBondContact OE2-OG 2.88Å
587	Y	88.7	Confident	79.2	Confident	131 Å²	131	49.3 Å²	49.3	51%	0.514	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	162.7	174	63.4	-79.5	0	0	0	110.4	A418 R589	A418-Y587 HydrophobicContact CB-CD1 4.37Å; A418-Y587 HydrophobicContact CB-CD2 4.1Å; A418-Y587 HydrophobicContact CB-CE1 3.99Å; A418-Y587 HydrophobicContact CB-CE2 3.72Å; A418-Y587 HydrophobicContact CB-CG 4.4Å; A418-Y587 WeakPolarHBondContact CB-O 3.18Å; A418-Y587 PolarHBondContact N-O 2.68Å; Y587-R589 HydrophobicContact CE2-CB 4.21Å
588	C	86.7	Confident	77.1	Confident	25 Å²	25	57.7 Å²	57.7	17%	0.169	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	142.6	167.7	-50.5	0	0	0	0	110.2	Y402 C411 T415 E416	Y402-C588 WeakPolarHBondContact CD1-SG 3.48Å; C411-C588 WeakPolarHBondContact CA-SG 3.11Å; C411-C588 HydrophobicContact CB-CB 3.79Å; C411-C588 WeakPolarHBondContact CB-SG 3.48Å; C411-C588 WeakPolarHBondContact SG-CB 3.18Å; C411-C588 CovalentContact SG-SG 2.04Å; C411-C588 PolarHBondContact SG-SG 3.28Å; T415-C588 WeakPolarHBondContact OG1-CB 3.39Å; E416-C588 CarbonylContact O-C 3.6Å; E416-C588 WeakPolarHBondContact O-CA 3.29Å; E416-C588 WeakPolarHBondContact O-CB 3.48Å
589	R	79.8	Confident	75.4	Confident	49 Å²	49	58.1 Å²	58.1	19%	0.185	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	149.2	179	66.5	-173.3	-168.8	-166.5	0.3	109.6	T415 E416 A418 Y587 Y633	T415-R589 CarbonylContact C-O 3.56Å; T415-R589 VanDerWaalsContact CA-O 3.22Å; T415-R589 WeakPolarHBondContact CA-O 3.31Å; T415-R589 VanDerWaalsContact CB-O 3.31Å; T415-R589 WeakPolarHBondContact CB-O 3.13Å; E416-R589 HydrophobicContact CG-CG 3.75Å; E416-R589 PolarHBondContact N-O 2.79Å; E416-R589 PolarHBondContact O-N 3.06Å; E416-R589 IonicContact OE1-CZ 3.45Å; E416-R589 IonicContact OE1-NE 3.74Å; E416-R589 PolarHBondContact OE1-NE 3.08Å; E416-R589 IonicContact OE1-NH2 3.88Å; E416-R589 PolarHBondContact OE1-NH2 3.22Å; A418-R589 HydrophobicContact CB-CG 4.34Å; Y587-R589 HydrophobicContact CE2-CB 4.21Å; R589-Y633 HydrophobicContact CB-CE2 4.41Å; R589-Y633 WeakPolarHBondContact CB-OH 3.2Å; R589-Y633 VanDerWaalsContact CD-OH 3.26Å; R589-Y633 WeakPolarHBondContact CD-OH 3.05Å; R589-Y633 VanDerWaalsContact CG-OH 3.25Å; R589-Y633 WeakPolarHBondContact CG-OH 3.49Å
590	P	78.6	Confident	74.1	Confident	32 Å²	32	60.7 Å²	60.7	21%	0.208	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	145.2	175	-23.2	33	0	0	0	111.3	I611 Y633	P590-I611 HydrophobicContact CB-CG2 4.23Å; P590-Y633 HydrophobicContact CB-CD1 3.95Å; P590-Y633 HydrophobicContact CB-CE1 3.73Å; P590-Y633 HydrophobicContact CG-CD1 4.02Å; P590-Y633 HydrophobicContact CG-CE1 4.03Å; P590-Y633 WeakPolarHBondContact O-CE1 3.32Å; P590-Y633 PolarHBondContact O-OH 3.26Å
591	C	77	Confident	72.9	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.007	39%	0.394	C	S	.	.			trans	-123.9	162.8	175	74.8	0	0	0	0	110	G414 E416 C602	G414-C591 PolarHBondContact O-N 2.88Å; E416-C591 HydrophobicContact CB-CB 4.1Å; E416-C591 HydrophobicContact CG-CB 3.99Å; C591-C602 HydrophobicContact CB-CB 3.49Å; C591-C602 VanDerWaalsContact CB-CB 3.49Å; C591-C602 WeakPolarHBondContact CB-SG 3.27Å; C591-C602 WeakPolarHBondContact SG-CA 3.31Å; C591-C602 WeakPolarHBondContact SG-CB 3.37Å; C591-C602 CovalentContact SG-SG 2.04Å; C591-C602 PolarHBondContact SG-SG 2.93Å
592	A	76.6	Confident	72.2	Confident	2 Å²	2	62.5 Å²	62.5	2%	0.017	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	139.2	168.4	0	0	0	0	0	109.7	C602 T603 G616 C618	A592-C602 CarbonylContact O-C 3.54Å; A592-C602 WeakPolarHBondContact O-CA 3.41Å; A592-T603 HydrophobicContact CB-CG2 3.6Å; A592-T603 PolarHBondContact O-N 3.41Å; A592-G616 VanDerWaalsContact CA-O 3.31Å; A592-G616 WeakPolarHBondContact CA-O 3.45Å; A592-C618 WeakPolarHBondContact CB-SG 3.35Å
593	L	74.1	Confident	71.7	Confident	70 Å²	70	60.2 Å²	60.2	37%	0.366	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.6	-179.1	-69.8	-177	0	0	0	112.2	G616	L593-G616 PolarHBondContact N-O 3.02Å
594	E	66.9	Low	70.9	Confident	114 Å²	114	61.5 Å²	61.5	53%	0.533	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.8	163.6	-93.4	169	-137.2	0	0	110.3	S596 S600 S601 T603	E594-S596 PolarHBondContact O-N 2.95Å; E594-S600 WeakPolarHBondContact O-CA 3.45Å; E594-S601 PolarHBondContact N-O 3.28Å; E594-S601 VanDerWaalsContact N-O 3.14Å; E594-S601 PolarHBondContact O-N 3.36Å; E594-T603 HydrophobicContact CG-CG2 3.91Å; E594-T603 WeakPolarHBondContact OE1-CB 3.23Å; E594-T603 VanDerWaalsContact OE1-CG2 3.29Å; E594-T603 WeakPolarHBondContact OE1-CG2 3.37Å; E594-T603 PolarHBondContact OE1-OG1 3.42Å
595	A	56.2	Low	70.2	Confident	111 Å²	111	61.4 Å²	61.4	92%	0.917	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	115	173.8	0	0	0	0	0	109.8
596	S	53.2	Low	69.6	Low	64 Å²	64	65 Å²	65	45%	0.448	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	155.4	173.8	89.4	0	0	0	0	111.2	E594 L598 G599	E594-S596 PolarHBondContact O-N 2.95Å; S596-L598 PolarHBondContact O-N 3.4Å; S596-G599 PolarHBondContact N-O 3.46Å; S596-G599 PolarHBondContact O-N 3.33Å; S596-G599 PolarHBondContact OG-O 3.08Å
597	D	46.1	Very low	68.9	Low	173 Å²	173	64.9 Å²	64.9	93%	0.925	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-10.1	-176.9	-60.7	-51.9	0	0	0	114.3
598	L	47.9	Very low	68.3	Low	175 Å²	175	58.7 Å²	58.7	92%	0.916	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	4.7	173.3	-82.5	81.2	0	0	0	113.4	S596	S596-L598 PolarHBondContact O-N 3.4Å
599	G	55.5	Low	68.1	Low	39 Å²	39	59.9 Å²	59.9	40%	0.402	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	123.8	174.1	179.3	0	0	0	0	0	113.8	S596 S601	S596-G599 PolarHBondContact N-O 3.46Å; S596-G599 PolarHBondContact O-N 3.33Å; S596-G599 PolarHBondContact OG-O 3.08Å; G599-S601 PolarHBondContact O-N 3.45Å
600	S	58.1	Low	68.3	Low	70 Å²	70	59.3 Å²	59.3	49%	0.49	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	105.8	-178.4	60.7	0	0	0	0	111.1	E594	E594-S600 WeakPolarHBondContact O-CA 3.45Å
601	S	63.3	Low	68.4	Low	74 Å²	74	58.4 Å²	58.4	52%	0.517	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	143.4	176.2	-173.5	0	0	0	0	110.8	E594 G599 T603	E594-S601 PolarHBondContact N-O 3.28Å; E594-S601 VanDerWaalsContact N-O 3.14Å; E594-S601 PolarHBondContact O-N 3.36Å; G599-S601 PolarHBondContact O-N 3.45Å; S601-T603 PolarHBondContact O-N 2.75Å
602	C	70.6	Confident	68.6	Low	46 Å²	46	60.3 Å²	60.3	31%	0.311	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	125	169.4	-72	0	0	0	0	110.3	E416 C591 A592	E416-C602 HydrophobicContact CB-CB 4.29Å; C591-C602 HydrophobicContact CB-CB 3.49Å; C591-C602 VanDerWaalsContact CB-CB 3.49Å; C591-C602 WeakPolarHBondContact CB-SG 3.27Å; C591-C602 WeakPolarHBondContact SG-CA 3.31Å; C591-C602 WeakPolarHBondContact SG-CB 3.37Å; C591-C602 CovalentContact SG-SG 2.04Å; C591-C602 PolarHBondContact SG-SG 2.93Å; A592-C602 CarbonylContact O-C 3.54Å; A592-C602 WeakPolarHBondContact O-CA 3.41Å
603	T	71.6	Confident	68.6	Low	34 Å²	34	68.2 Å²	68.2	21%	0.209	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	166.2	172.1	-161.8	0	0	0	0	110.6	A592 E594 S601	A592-T603 HydrophobicContact CB-CG2 3.6Å; A592-T603 PolarHBondContact O-N 3.41Å; E594-T603 HydrophobicContact CG-CG2 3.91Å; E594-T603 WeakPolarHBondContact OE1-CB 3.23Å; E594-T603 VanDerWaalsContact OE1-CG2 3.29Å; E594-T603 WeakPolarHBondContact OE1-CG2 3.37Å; E594-T603 PolarHBondContact OE1-OG1 3.42Å; S601-T603 PolarHBondContact O-N 2.75Å
604	S	69.1	Low	68.6	Low	41 Å²	41	72.5 Å²	72.5	29%	0.287	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-88.7	136.2	168.2	-73.7	0	0	0	0	109.8
605	C	74.6	Confident	69	Low	8 Å²	8	70 Å²	70	5%	0.054	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-62.8	146.2	170.6	-76.3	0	0	0	0	111.9	H609 I611 C618	C605-H609 HydrophobicContact CB-CB 4.1Å; C605-I611 WeakPolarHBondContact SG-CG1 3.07Å; C605-C618 WeakPolarHBondContact CA-SG 3.28Å; C605-C618 HydrophobicContact CB-CB 3.88Å; C605-C618 WeakPolarHBondContact CB-SG 3.25Å; C605-C618 VanDerWaalsContact SG-CA 3.53Å; C605-C618 WeakPolarHBondContact SG-CB 3.33Å; C605-C618 CovalentContact SG-SG 2.04Å; C605-C618 PolarHBondContact SG-SG 3.02Å
606	P	77.1	Confident	69.9	Low	79 Å²	79	65.2 Å²	65.2	51%	0.513	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-54.2	151.9	167.6	-23.2	33.6	0	0	0	111.2	G608 H609	P606-G608 PolarHBondContact O-N 3.12Å; P606-H609 WeakPolarHBondContact O-CB 3.34Å; P606-H609 PolarHBondContact O-N 3.48Å; P606-H609 VanDerWaalsContact O-N 3.14Å; P606-H609 PolarHBondContact O-ND1 2.7Å
607	A	75.8	Confident	71.3	Confident	24 Å²	24	65 Å²	65	20%	0.198	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	141	-177.8	0	0	0	0	0	111.8	A487 H609 I650	A487-A607 HydrophobicContact CB-CB 4Å; A607-H609 VanDerWaalsContact C-N 3.28Å; A607-H609 PolarHBondContact O-N 2.81Å; A607-H609 PolarHBondContact O-ND1 3.22Å; A607-I650 HydrophobicContact CB-CB 3.76Å; A607-I650 HydrophobicContact CB-CG2 3.87Å
608	G	75.1	Confident	73.1	Confident	2 Å²	2	58.8 Å²	58.8	2%	0.021	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	6.4	-176.6	0	0	0	0	0	116.8	P606 C621 I650	P606-G608 PolarHBondContact O-N 3.12Å; G608-C621 WeakPolarHBondContact O-CB 3.37Å; G608-C621 PolarHBondContact O-N 2.82Å; G608-I650 WeakPolarHBondContact CA-O 3.47Å; G608-I650 PolarHBondContact N-O 2.84Å
609	H	83.6	Confident	74.9	Confident	49 Å²	49	54.4 Å²	54.4	23%	0.227	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	136	174.2	-60.6	60.9	0	0	0	111.1	C605 P606 A607 C618 H619 L620 L627	C605-H609 HydrophobicContact CB-CB 4.1Å; P606-H609 WeakPolarHBondContact O-CB 3.34Å; P606-H609 PolarHBondContact O-N 3.48Å; P606-H609 VanDerWaalsContact O-N 3.14Å; P606-H609 PolarHBondContact O-ND1 2.7Å; A607-H609 VanDerWaalsContact C-N 3.28Å; A607-H609 PolarHBondContact O-N 2.81Å; A607-H609 PolarHBondContact O-ND1 3.22Å; H609-C618 HydrophobicContact CB-CB 4.07Å; H609-H619 CarbonylContact C-O 3.58Å; H609-H619 WeakPolarHBondContact CA-O 3.27Å; H609-H619 WeakPolarHBondContact CB-O 3.47Å; H609-L620 PolarHBondContact CD2-N 2.92Å; H609-L627 VanDerWaalsContact O-CD2 3.31Å; H609-L627 WeakPolarHBondContact O-CD2 3.05Å
610	Y	83.1	Confident	76.4	Confident	38 Å²	38	57.4 Å²	57.4	15%	0.149	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	153.6	169.8	70	-91.6	0	0	0	110.8	C618 H619 P632 C638	Y610-C618 WeakPolarHBondContact O-CA 3.5Å; Y610-H619 HydrophobicContact CD1-CB 4.14Å; Y610-H619 WeakPolarHBondContact CD1-O 3.4Å; Y610-H619 HydrophobicContact CD2-CB 4.34Å; Y610-H619 HydrophobicContact CE1-CB 3.6Å; Y610-H619 HydrophobicContact CE2-CB 3.82Å; Y610-H619 HydrophobicContact CG-CB 4.5Å; Y610-H619 VanDerWaalsContact CZ-CB 3.42Å; Y610-H619 PolarHBondContact N-O 2.84Å; Y610-H619 PolarHBondContact O-N 2.04Å; Y610-P632 CarbonylContact C-O 3.53Å; Y610-P632 WeakPolarHBondContact CA-O 3.42Å; Y610-C638 WeakPolarHBondContact CD1-SG 3.36Å
611	I	81.2	Confident	77.8	Confident	13 Å²	13	54.1 Å²	54.1	7%	0.067	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	121.8	172.7	-63.9	162.9	0	0	0	107.8	P590 C605 T617 P632 Y633 G634	P590-I611 HydrophobicContact CB-CG2 4.23Å; C605-I611 WeakPolarHBondContact SG-CG1 3.07Å; I611-T617 WeakPolarHBondContact CA-O 3.48Å; I611-P632 PolarHBondContact N-O 3.34Å; I611-Y633 HydrophobicContact CB-CD1 4.02Å; I611-Y633 HydrophobicContact CB-CE1 4.15Å; I611-Y633 HydrophobicContact CD1-CD1 4.42Å; I611-Y633 HydrophobicContact CD1-CE1 3.73Å; I611-Y633 HydrophobicContact CG2-CD1 4.27Å; I611-Y633 HydrophobicContact CG2-CE1 4.34Å; I611-G634 PolarHBondContact O-N 3.13Å
612	D	81.9	Confident	79.1	Confident	40 Å²	40	53.7 Å²	53.7	21%	0.214	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-69.7	139.8	167.3	179.8	59.6	0	0	0	111.1	D614 S615 G616 T617	D612-D614 PolarHBondContact OD2-N 2.86Å; D612-D614 VanDerWaalsContact OD2-N 3.12Å; D612-S615 WeakPolarHBondContact OD2-CB 3.04Å; D612-S615 PolarHBondContact OD2-N 2.91Å; D612-S615 PolarHBondContact OD2-OG 2.96Å; D612-G616 WeakPolarHBondContact O-CA 3.39Å; D612-G616 PolarHBondContact O-N 2.96Å; D612-T617 PolarHBondContact N-O 3.36Å
613	R	75.3	Confident	79.9	Confident	168 Å²	168	56.6 Å²	56.6	63%	0.634	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-32.9	-171.7	-93.7	-175.5	155.6	-152.2	-6.4	114.2
614	D	74.6	Confident	80.6	Confident	160 Å²	160	59 Å²	59	86%	0.856	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-25.5	-168.1	-58.7	-31.5	0	0	0	111.4	D612	D612-D614 PolarHBondContact OD2-N 2.86Å; D612-D614 VanDerWaalsContact OD2-N 3.12Å
615	S	76.5	Confident	81.5	Confident	63 Å²	63	57.9 Å²	57.9	44%	0.441	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-15.2	179.5	62.3	0	0	0	0	115.3	D612 T617	D612-S615 WeakPolarHBondContact OD2-CB 3.04Å; D612-S615 PolarHBondContact OD2-N 2.91Å; D612-S615 PolarHBondContact OD2-OG 2.96Å; S615-T617 PolarHBondContact O-N 2.97Å; S615-T617 PolarHBondContact OG-OG1 3.47Å
616	G	74.4	Confident	82.1	Confident	10 Å²	10	58.5 Å²	58.5	10%	0.103	32%	0.323	C	S	.	.			trans	67.1	21.9	179.8	0	0	0	0	0	114.4	A592 L593 D612	A592-G616 VanDerWaalsContact CA-O 3.31Å; A592-G616 WeakPolarHBondContact CA-O 3.45Å; L593-G616 PolarHBondContact N-O 3.02Å; D612-G616 WeakPolarHBondContact O-CA 3.39Å; D612-G616 PolarHBondContact O-N 2.96Å
617	T	81.9	Confident	82.2	Confident	58 Å²	58	55.7 Å²	55.7	36%	0.356	30%	0.303	S	S	.	.			trans	-95.8	159.1	179	55.3	0	0	0	0	112	I611 D612 S615 H619	I611-T617 WeakPolarHBondContact CA-O 3.48Å; D612-T617 PolarHBondContact N-O 3.36Å; S615-T617 PolarHBondContact O-N 2.97Å; S615-T617 PolarHBondContact OG-OG1 3.47Å; T617-H619 PolarHBondContact OG1-CD2 2.75Å; T617-H619 PolarHBondContact OG1-NE2 2.73Å
618	C	83.6	Confident	82	Confident	43 Å²	43	59.7 Å²	59.7	29%	0.291	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	119.5	172.9	-60.7	0	0	0	0	111.3	A592 C605 H609 Y610	A592-C618 WeakPolarHBondContact CB-SG 3.35Å; C605-C618 WeakPolarHBondContact CA-SG 3.28Å; C605-C618 HydrophobicContact CB-CB 3.88Å; C605-C618 WeakPolarHBondContact CB-SG 3.25Å; C605-C618 VanDerWaalsContact SG-CA 3.53Å; C605-C618 WeakPolarHBondContact SG-CB 3.33Å; C605-C618 CovalentContact SG-SG 2.04Å; C605-C618 PolarHBondContact SG-SG 3.02Å; H609-C618 HydrophobicContact CB-CB 4.07Å; Y610-C618 WeakPolarHBondContact O-CA 3.5Å
619	H	86.6	Confident	81.4	Confident	84 Å²	84	61.7 Å²	61.7	39%	0.389	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.2	175.8	-76.3	-96.1	0	0	0	110.6	H609 Y610 T617	H609-H619 CarbonylContact C-O 3.58Å; H609-H619 WeakPolarHBondContact CA-O 3.27Å; H609-H619 WeakPolarHBondContact CB-O 3.47Å; Y610-H619 HydrophobicContact CD1-CB 4.14Å; Y610-H619 WeakPolarHBondContact CD1-O 3.4Å; Y610-H619 HydrophobicContact CD2-CB 4.34Å; Y610-H619 HydrophobicContact CE1-CB 3.6Å; Y610-H619 HydrophobicContact CE2-CB 3.82Å; Y610-H619 HydrophobicContact CG-CB 4.5Å; Y610-H619 VanDerWaalsContact CZ-CB 3.42Å; Y610-H619 PolarHBondContact N-O 2.84Å; Y610-H619 PolarHBondContact O-N 2.04Å; T617-H619 PolarHBondContact OG1-CD2 2.75Å; T617-H619 PolarHBondContact OG1-NE2 2.73Å
620	L	86.7	Confident	80.3	Confident	101 Å²	101	62.6 Å²	62.6	53%	0.529	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	134.3	178.4	-179.1	65.1	0	0	0	110.7	H609	H609-L620 PolarHBondContact CD2-N 2.92Å
621	C	88.1	Confident	79.5	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.014	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-62	143.7	172.9	-85.8	0	0	0	0	111.5	G608 T625 C638 H651	G608-C621 WeakPolarHBondContact O-CB 3.37Å; G608-C621 PolarHBondContact O-N 2.82Å; C621-T625 WeakPolarHBondContact CB-OG1 3.39Å; C621-C638 WeakPolarHBondContact CA-SG 3.08Å; C621-C638 HydrophobicContact CB-CB 3.84Å; C621-C638 WeakPolarHBondContact CB-SG 3.41Å; C621-C638 WeakPolarHBondContact SG-CB 3.23Å; C621-C638 CovalentContact SG-SG 2.05Å; C621-C638 PolarHBondContact SG-SG 2.96Å; C621-H651 HydrophobicContact CB-CB 4.38Å; C621-H651 PolarHBondContact O-CE1 2.88Å
622	P	89.4	Confident	78.9	Confident	65 Å²	65	67.3 Å²	67.3	42%	0.422	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-56.9	152.7	176.9	-25.8	35	0	0	0	113.3	T625 H651	P622-T625 HydrophobicContact CB-CG2 4.11Å; P622-T625 WeakPolarHBondContact O-CB 3.46Å; P622-T625 PolarHBondContact O-N 2.74Å; P622-T625 PolarHBondContact O-OG1 3.01Å; P622-H651 PolarHBondContact O-CE1 3.42Å
623	P	87.9	Confident	78.7	Confident	106 Å²	106	67.3 Å²	67.3	69%	0.688	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	147.5	174.5	26.5	-34.9	0	0	0	111.6	T625	P623-T625 VanDerWaalsContact C-N 3.31Å
624	N	86.7	Confident	79	Confident	86 Å²	86	59.6 Å²	59.6	46%	0.46	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	29.4	-170.1	-51.7	-41.4	0	0	0	114.4	C641 N647	N624-C641 PolarHBondContact O-N 3.06Å; N624-N647 WeakPolarHBondContact CA-OD1 3.34Å; N624-N647 PolarHBondContact N-OD1 2.96Å
625	T	88.2	Confident	79.3	Confident	16 Å²	16	54.6 Å²	54.6	10%	0.098	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	153.3	171.9	73.2	0	0	0	0	112.1	C621 P622 P623 V639 N647 H651	C621-T625 WeakPolarHBondContact CB-OG1 3.39Å; P622-T625 HydrophobicContact CB-CG2 4.11Å; P622-T625 WeakPolarHBondContact O-CB 3.46Å; P622-T625 PolarHBondContact O-N 2.74Å; P622-T625 PolarHBondContact O-OG1 3.01Å; P623-T625 VanDerWaalsContact C-N 3.31Å; T625-V639 CarbonylContact C-O 3.56Å; T625-V639 WeakPolarHBondContact CA-O 3.1Å; T625-V639 WeakPolarHBondContact CB-O 3.47Å; T625-N647 VanDerWaalsContact O-CB 3.27Å; T625-N647 WeakPolarHBondContact O-CB 3.16Å; T625-H651 PolarHBondContact O-ND1 3.47Å
626	I	85.9	Confident	79.7	Confident	22 Å²	22	58.2 Å²	58.2	11%	0.113	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	139.9	174.4	52.7	166.1	0	0	0	111.7	C638 V639 N647 H651 L653 C654	I626-C638 CarbonylContact O-C 3.55Å; I626-C638 WeakPolarHBondContact O-CA 3.19Å; I626-V639 HydrophobicContact CG1-CB 4.34Å; I626-V639 PolarHBondContact N-O 3.42Å; I626-V639 PolarHBondContact O-N 2.82Å; I626-N647 HydrophobicContact CG2-CB 4.23Å; I626-H651 CarbonylContact C-O 3.56Å; I626-H651 VanDerWaalsContact CA-O 3.25Å; I626-H651 WeakPolarHBondContact CA-O 3.26Å; I626-L653 WeakPolarHBondContact CG2-O 3.47Å; I626-C654 VanDerWaalsContact CG2-SG 3.53Å
627	L	79.9	Confident	80.1	Confident	19 Å²	19	57.8 Å²	57.8	10%	0.099	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	122.6	177.8	-175.6	70.3	0	0	0	110.4	H609 A629 P632 A637 H651	H609-L627 VanDerWaalsContact O-CD2 3.31Å; H609-L627 WeakPolarHBondContact O-CD2 3.05Å; L627-A629 PolarHBondContact O-N 2.79Å; L627-P632 HydrophobicContact CD1-CB 4.1Å; L627-P632 HydrophobicContact CD2-CB 4.28Å; L627-P632 HydrophobicContact CG-CB 4.36Å; L627-A637 HydrophobicContact CD1-CB 3.79Å; L627-H651 PolarHBondContact N-O 3.35Å
628	K	71.6	Confident	80.3	Confident	109 Å²	109	55.7 Å²	55.7	47%	0.474	31%	0.306	S	S	.	.			trans	-65.9	99.5	166.6	-84.6	172.8	167.6	163.1	0	110.2	H630 Q631 A637 V639	K628-H630 PolarHBondContact O-N 3.44Å; K628-Q631 CarbonylContact O-C 3.37Å; K628-Q631 VanDerWaalsContact O-C 3.28Å; K628-Q631 PolarHBondContact O-N 2.69Å; K628-A637 PolarHBondContact N-O 3.11Å; K628-V639 HydrophobicContact CD-CG2 3.79Å; K628-V639 HydrophobicContact CG-CG2 3.91Å
629	A	63.4	Low	80.5	Confident	44 Å²	44	55.7 Å²	55.7	36%	0.364	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-32.5	179.7	0	0	0	0	0	114.4	V485 L627	V485-A629 HydrophobicContact CG2-CB 3.99Å; L627-A629 PolarHBondContact O-N 2.79Å
630	H	59.8	Low	80.7	Confident	67 Å²	67	56.1 Å²	56.1	31%	0.31	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-15.6	179	-86.3	76.1	0	0	0	115.3	E493 R496 K628	E493-H630 IonicContact OE1-CE1 2.61Å; E493-H630 PolarHBondContact OE1-CE1 2.94Å; E493-H630 IonicContact OE1-ND1 3.16Å; E493-H630 IonicContact OE1-NE2 2.72Å; E493-H630 IonicContact OE2-CE1 3.64Å; E493-H630 PolarHBondContact OE2-CE1 2.95Å; E493-H630 VanDerWaalsContact OE2-CE1 3.3Å; E493-H630 IonicContact OE2-ND1 3.13Å; E493-H630 PolarHBondContact OE2-ND1 3.01Å; R496-H630 PolarHBondContact NE-NE2 2.79Å; K628-H630 PolarHBondContact O-N 3.44Å
631	Q	65.4	Low	80.9	Confident	128 Å²	128	52.2 Å²	52.2	60%	0.598	30%	0.296	S	S	*	.			trans	-145.7	63.7	-178.1	-67.2	-175.8	-31.3	0	0	111	K628 Y633 A637	K628-Q631 CarbonylContact O-C 3.37Å; K628-Q631 VanDerWaalsContact O-C 3.28Å; K628-Q631 PolarHBondContact O-N 2.69Å; Q631-Y633 PolarHBondContact O-N 2.71Å; Q631-A637 WeakPolarHBondContact O-CB 3.5Å
632	P	69.6	Low	80.9	Confident	23 Å²	23	53 Å²	53	15%	0.149	31%	0.305	C	S	.	.			trans	-77.2	33.5	-173.2	35.7	-39.6	0	0	0	113.7	Y610 I611 L627	Y610-P632 CarbonylContact C-O 3.53Å; Y610-P632 WeakPolarHBondContact CA-O 3.42Å; I611-P632 PolarHBondContact N-O 3.34Å; L627-P632 HydrophobicContact CD1-CB 4.1Å; L627-P632 HydrophobicContact CD2-CB 4.28Å; L627-P632 HydrophobicContact CG-CB 4.36Å
633	Y	77.6	Confident	80.9	Confident	39 Å²	39	52.9 Å²	52.9	15%	0.153	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-110.5	117.2	-168.1	-60.3	-60	0	0	0	113	R589 P590 I611 Q631 Q636	R589-Y633 HydrophobicContact CB-CE2 4.41Å; R589-Y633 WeakPolarHBondContact CB-OH 3.2Å; R589-Y633 VanDerWaalsContact CD-OH 3.26Å; R589-Y633 WeakPolarHBondContact CD-OH 3.05Å; R589-Y633 VanDerWaalsContact CG-OH 3.25Å; R589-Y633 WeakPolarHBondContact CG-OH 3.49Å; P590-Y633 HydrophobicContact CB-CD1 3.95Å; P590-Y633 HydrophobicContact CB-CE1 3.73Å; P590-Y633 HydrophobicContact CG-CD1 4.02Å; P590-Y633 HydrophobicContact CG-CE1 4.03Å; P590-Y633 WeakPolarHBondContact O-CE1 3.32Å; P590-Y633 PolarHBondContact O-OH 3.26Å; I611-Y633 HydrophobicContact CB-CD1 4.02Å; I611-Y633 HydrophobicContact CB-CE1 4.15Å; I611-Y633 HydrophobicContact CD1-CD1 4.42Å; I611-Y633 HydrophobicContact CD1-CE1 3.73Å; I611-Y633 HydrophobicContact CG2-CD1 4.27Å; I611-Y633 HydrophobicContact CG2-CE1 4.34Å; Q631-Y633 PolarHBondContact O-N 2.71Å; Y633-Q636 PolarHBondContact O-NE2 2.83Å
634	G	80.4	Confident	80.9	Confident	6 Å²	6	49.4 Å²	49.4	6%	0.062	29%	0.287	C	S	.	.	S	Bend	trans	65.6	173.2	-177.5	0	0	0	0	0	114.2	I611 Q636 A637	I611-G634 PolarHBondContact O-N 3.13Å; G634-Q636 PolarHBondContact O-N 2.96Å; G634-Q636 VanDerWaalsContact O-N 3.11Å; G634-A637 WeakPolarHBondContact O-CB 3.45Å; G634-A637 PolarHBondContact O-N 2.82Å
635	A	82.3	Confident	81.1	Confident	56 Å²	56	45.8 Å²	45.8	46%	0.463	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-58.7	-29.2	-174.4	0	0	0	0	0	113.8	A637 C638	A635-A637 PolarHBondContact O-N 2.84Å; A635-A637 VanDerWaalsContact O-N 3.11Å; A635-C638 WeakPolarHBondContact O-CB 3.33Å; A635-C638 PolarHBondContact O-N 2.95Å
636	Q	83.8	Confident	81.1	Confident	138 Å²	138	48.6 Å²	48.6	65%	0.645	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-60.5	-13.6	173.1	62	-82.8	-4.5	0	0	115.1	Y633 G634 C638	Y633-Q636 PolarHBondContact O-NE2 2.83Å; G634-Q636 PolarHBondContact O-N 2.96Å; G634-Q636 VanDerWaalsContact O-N 3.11Å; Q636-C638 VanDerWaalsContact C-N 3.27Å
637	A	83	Confident	81.2	Confident	2 Å²	2	48.7 Å²	48.7	2%	0.017	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-69.8	-26.3	171.5	0	0	0	0	0	112.8	L627 K628 Q631 G634 A635 V639	L627-A637 HydrophobicContact CD1-CB 3.79Å; K628-A637 PolarHBondContact N-O 3.11Å; Q631-A637 WeakPolarHBondContact O-CB 3.5Å; G634-A637 WeakPolarHBondContact O-CB 3.45Å; G634-A637 PolarHBondContact O-N 2.82Å; A635-A637 PolarHBondContact O-N 2.84Å; A635-A637 VanDerWaalsContact O-N 3.11Å; A637-V639 PolarHBondContact O-N 2.04Å
638	C	87.2	Confident	81.3	Confident	14 Å²	14	48.1 Å²	48.1	10%	0.095	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	96.5	-179.4	-52.5	0	0	0	0	109.9	Y610 C621 I626 A635 Q636	Y610-C638 WeakPolarHBondContact CD1-SG 3.36Å; C621-C638 WeakPolarHBondContact CA-SG 3.08Å; C621-C638 HydrophobicContact CB-CB 3.84Å; C621-C638 WeakPolarHBondContact CB-SG 3.41Å; C621-C638 WeakPolarHBondContact SG-CB 3.23Å; C621-C638 CovalentContact SG-SG 2.05Å; C621-C638 PolarHBondContact SG-SG 2.96Å; I626-C638 CarbonylContact O-C 3.55Å; I626-C638 WeakPolarHBondContact O-CA 3.19Å; A635-C638 WeakPolarHBondContact O-CB 3.33Å; A635-C638 PolarHBondContact O-N 2.95Å; Q636-C638 VanDerWaalsContact C-N 3.27Å
639	V	87.7	Confident	81.7	Confident	42 Å²	42	51.2 Å²	51.2	26%	0.255	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	132.6	-179.9	-179.4	0	0	0	0	109.7	T625 I626 K628 A637	T625-V639 CarbonylContact C-O 3.56Å; T625-V639 WeakPolarHBondContact CA-O 3.1Å; T625-V639 WeakPolarHBondContact CB-O 3.47Å; I626-V639 HydrophobicContact CG1-CB 4.34Å; I626-V639 PolarHBondContact N-O 3.42Å; I626-V639 PolarHBondContact O-N 2.82Å; K628-V639 HydrophobicContact CD-CG2 3.79Å; K628-V639 HydrophobicContact CG-CG2 3.91Å; A637-V639 PolarHBondContact O-N 2.04Å
640	P	90.4	Very high	82.4	Confident	94 Å²	94	51.2 Å²	51.2	61%	0.61	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	142.1	176.5	26.3	-34.8	0	0	0	112.1
641	C	89.8	Confident	83.4	Confident	19 Å²	19	48.9 Å²	48.9	13%	0.128	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-70.7	150.8	168.8	-74.1	0	0	0	0	111.2	N624 T645 C654	N624-C641 PolarHBondContact O-N 3.06Å; C641-T645 WeakPolarHBondContact CB-OG1 3.36Å; C641-C654 WeakPolarHBondContact CA-SG 3.21Å; C641-C654 HydrophobicContact CB-CB 3.77Å; C641-C654 WeakPolarHBondContact CB-SG 3.17Å; C641-C654 WeakPolarHBondContact SG-CB 3.21Å; C641-C654 CovalentContact SG-SG 2.04Å; C641-C654 PolarHBondContact SG-SG 2.77Å
642	G	88.2	Confident	84	Confident	19 Å²	19	43.9 Å²	43.9	20%	0.196	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-68.1	169.7	179.5	0	0	0	0	0	113.4	G644 T645 I769	G642-G644 PolarHBondContact O-N 3.05Å; G642-T645 PolarHBondContact N-OG1 2.97Å; G642-T645 PolarHBondContact O-N 2.94Å; G642-T645 VanDerWaalsContact O-N 3.15Å; G642-T645 PolarHBondContact O-OG1 2.82Å; G642-I769 WeakPolarHBondContact CA-O 3.11Å
643	P	90.4	Very high	84.5	Confident	62 Å²	62	43.7 Å²	43.7	40%	0.403	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	141.4	-176.9	24.7	-35	0	0	0	111.2	T645 G770 V771 L777	P643-T645 PolarHBondContact O-N 3.35Å; P643-T645 VanDerWaalsContact O-N 3.16Å; P643-G770 CarbonylContact O-C 3.43Å; P643-G770 WeakPolarHBondContact O-CA 3.31Å; P643-V771 CarbonylContact C-O 3.58Å; P643-V771 PolarHBondContact O-N 3.3Å; P643-L777 HydrophobicContact CG-CD1 3.91Å; P643-L777 HydrophobicContact CG-CD2 3.93Å
644	G	87.2	Confident	85	Confident	32 Å²	32	42.2 Å²	42.2	33%	0.33	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	12.6	179.9	0	0	0	0	0	116.1	G642 N656	G642-G644 PolarHBondContact O-N 3.05Å; G644-N656 PolarHBondContact O-ND2 3.49Å
645	T	90.3	Very high	85.4	Confident	10 Å²	10	43.8 Å²	43.8	6%	0.061	25%	0.249	C	C	.	.			trans	-121	158.7	177.5	67	0	0	0	0	112.6	C641 G642 P643 Y655 L768 V771	C641-T645 WeakPolarHBondContact CB-OG1 3.36Å; G642-T645 PolarHBondContact N-OG1 2.97Å; G642-T645 PolarHBondContact O-N 2.94Å; G642-T645 VanDerWaalsContact O-N 3.15Å; G642-T645 PolarHBondContact O-OG1 2.82Å; P643-T645 PolarHBondContact O-N 3.35Å; P643-T645 VanDerWaalsContact O-N 3.16Å; T645-Y655 WeakPolarHBondContact CA-O 3.03Å; T645-Y655 WeakPolarHBondContact CB-O 3.32Å; T645-L768 HydrophobicContact CG2-CD2 3.48Å; T645-L768 VanDerWaalsContact CG2-CD2 3.48Å; T645-L768 HydrophobicContact CG2-CG 3.97Å; T645-V771 HydrophobicContact CG2-CG2 4.44Å
646	K	88.9	Confident	85.8	Confident	75 Å²	75	41.2 Å²	41.2	33%	0.326	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	156	-177.5	-65.6	163.1	-175.5	152.2	0	108.9	C654 Y655 D657 T659	K646-C654 WeakPolarHBondContact O-CA 3.35Å; K646-Y655 PolarHBondContact N-O 2.75Å; K646-Y655 WeakPolarHBondContact O-CD1 3.23Å; K646-Y655 PolarHBondContact O-N 3.28Å; K646-D657 IonicContact NZ-OD1 2.63Å; K646-D657 PolarHBondContact NZ-OD1 2.84Å; K646-D657 IonicContact NZ-OD2 2.67Å; K646-D657 PolarHBondContact NZ-OD2 2.91Å; K646-T659 PolarHBondContact NZ-OG1 2.81Å
647	N	87.5	Confident	86	Confident	25 Å²	25	37.2 Å²	37.2	13%	0.134	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	149.1	174.3	65.5	-91	0	0	0	111.7	N624 T625 I626 H651 L653	N624-N647 WeakPolarHBondContact CA-OD1 3.34Å; N624-N647 PolarHBondContact N-OD1 2.96Å; T625-N647 VanDerWaalsContact O-CB 3.27Å; T625-N647 WeakPolarHBondContact O-CB 3.16Å; I626-N647 HydrophobicContact CG2-CB 4.23Å; N647-H651 PolarHBondContact ND2-CD2 3.06Å; N647-H651 VanDerWaalsContact ND2-CD2 3.34Å; N647-H651 PolarHBondContact ND2-CE1 2.83Å; N647-H651 PolarHBondContact ND2-ND1 3.34Å; N647-H651 PolarHBondContact ND2-NE2 2.81Å; N647-L653 WeakPolarHBondContact CA-O 3.35Å
648	N	82.8	Confident	86.4	Confident	7 Å²	7	37.2 Å²	37.2	4%	0.037	21%	0.21	C	C	.	.			trans	-68.8	170.7	167.1	73.2	-4.5	0	0	0	111.5	I650 H651 S652 L653 Y655	N648-I650 WeakPolarHBondContact ND2-CG1 3.2Å; N648-I650 PolarHBondContact O-N 2.94Å; N648-I650 WeakPolarHBondContact OD1-CG1 3.35Å; N648-I650 PolarHBondContact OD1-N 2.86Å; N648-H651 PolarHBondContact O-N 2.81Å; N648-H651 PolarHBondContact OD1-N 2.63Å; N648-S652 PolarHBondContact ND2-OG 2.96Å; N648-S652 PolarHBondContact OD1-N 2.89Å; N648-S652 PolarHBondContact OD1-OG 2.85Å; N648-L653 HydrophobicContact CB-CD1 4.44Å; N648-L653 HydrophobicContact CB-CG 4.18Å; N648-L653 PolarHBondContact N-O 2.97Å; N648-L653 VanDerWaalsContact N-O 3.08Å; N648-L653 WeakPolarHBondContact ND2-CD2 3.02Å; N648-L653 WeakPolarHBondContact ND2-CG 3.13Å; N648-Y655 HydrophobicContact CB-CD1 4.32Å; N648-Y655 HydrophobicContact CB-CE1 4.23Å
649	K	80.4	Confident	86.5	Confident	174 Å²	174	39 Å²	39	76%	0.757	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-20.9	-175.9	-66	-172.8	-175	-174.6	0	114.9
650	I	76.7	Confident	86.6	Confident	44 Å²	44	38 Å²	38	23%	0.226	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	10.2	-178	58.8	170.3	0	0	0	112.7	D488 A607 G608 N648 S652	D488-I650 HydrophobicContact CB-CD1 3.83Å; A607-I650 HydrophobicContact CB-CB 3.76Å; A607-I650 HydrophobicContact CB-CG2 3.87Å; G608-I650 WeakPolarHBondContact CA-O 3.47Å; G608-I650 PolarHBondContact N-O 2.84Å; N648-I650 WeakPolarHBondContact ND2-CG1 3.2Å; N648-I650 PolarHBondContact O-N 2.94Å; N648-I650 WeakPolarHBondContact OD1-CG1 3.35Å; N648-I650 PolarHBondContact OD1-N 2.86Å; I650-S652 VanDerWaalsContact C-N 3.25Å; I650-S652 WeakPolarHBondContact CD1-OG 3.35Å; I650-S652 WeakPolarHBondContact CG1-OG 3.38Å; I650-S652 PolarHBondContact O-N 2.04Å
651	H	82.6	Confident	86.5	Confident	18 Å²	18	37.3 Å²	37.3	8%	0.083	21%	0.211	C	C	.	.	S	Bend	trans	47.4	40.5	-178.2	-64.3	-117.2	0	0	0	114.2	C621 P622 T625 I626 L627 N647 N648	C621-H651 HydrophobicContact CB-CB 4.38Å; C621-H651 PolarHBondContact O-CE1 2.88Å; P622-H651 PolarHBondContact O-CE1 3.42Å; T625-H651 PolarHBondContact O-ND1 3.47Å; I626-H651 CarbonylContact C-O 3.56Å; I626-H651 VanDerWaalsContact CA-O 3.25Å; I626-H651 WeakPolarHBondContact CA-O 3.26Å; L627-H651 PolarHBondContact N-O 3.35Å; N647-H651 PolarHBondContact ND2-CD2 3.06Å; N647-H651 VanDerWaalsContact ND2-CD2 3.34Å; N647-H651 PolarHBondContact ND2-CE1 2.83Å; N647-H651 PolarHBondContact ND2-ND1 3.34Å; N647-H651 PolarHBondContact ND2-NE2 2.81Å; N648-H651 PolarHBondContact O-N 2.81Å; N648-H651 PolarHBondContact OD1-N 2.63Å
652	S	76.6	Confident	86.2	Confident	22 Å²	22	37.9 Å²	37.9	15%	0.154	21%	0.212	C	C	.	.	S	Bend	trans	-105.7	-25.3	-177.6	70.4	0	0	0	0	114.3	D488 N648 I650	D488-S652 WeakPolarHBondContact OD2-CB 3.35Å; D488-S652 PolarHBondContact OD2-OG 2.96Å; N648-S652 PolarHBondContact ND2-OG 2.96Å; N648-S652 PolarHBondContact OD1-N 2.89Å; N648-S652 PolarHBondContact OD1-OG 2.85Å; I650-S652 VanDerWaalsContact C-N 3.25Å; I650-S652 WeakPolarHBondContact CD1-OG 3.35Å; I650-S652 WeakPolarHBondContact CG1-OG 3.38Å; I650-S652 PolarHBondContact O-N 2.04Å
653	L	81.5	Confident	85.6	Confident	20 Å²	20	40.5 Å²	40.5	11%	0.105	23%	0.228	C	C	.	.			trans	-142.3	155.2	178.2	72.5	92	0	0	0	111.9	E490 I626 N647 N648 Y655 G710	E490-L653 HydrophobicContact CB-CD2 3.96Å; E490-L653 WeakPolarHBondContact OE2-CD2 3.34Å; I626-L653 WeakPolarHBondContact CG2-O 3.47Å; N647-L653 WeakPolarHBondContact CA-O 3.35Å; N648-L653 HydrophobicContact CB-CD1 4.44Å; N648-L653 HydrophobicContact CB-CG 4.18Å; N648-L653 PolarHBondContact N-O 2.97Å; N648-L653 VanDerWaalsContact N-O 3.08Å; N648-L653 WeakPolarHBondContact ND2-CD2 3.02Å; N648-L653 WeakPolarHBondContact ND2-CG 3.13Å; L653-Y655 HydrophobicContact CD1-CD1 4.24Å; L653-Y655 HydrophobicContact CD1-CG 4.39Å; L653-G710 VanDerWaalsContact CD1-CA 3.48Å
654	C	87.4	Confident	84.4	Confident	8 Å²	8	43.9 Å²	43.9	5%	0.054	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128.1	172.8	-58.2	0	0	0	0	109.8	I626 C641 K646	I626-C654 VanDerWaalsContact CG2-SG 3.53Å; C641-C654 WeakPolarHBondContact CA-SG 3.21Å; C641-C654 HydrophobicContact CB-CB 3.77Å; C641-C654 WeakPolarHBondContact CB-SG 3.17Å; C641-C654 WeakPolarHBondContact SG-CB 3.21Å; C641-C654 CovalentContact SG-SG 2.04Å; C641-C654 PolarHBondContact SG-SG 2.77Å; K646-C654 WeakPolarHBondContact O-CA 3.35Å
655	Y	89.4	Confident	82.9	Confident	39 Å²	39	49.4 Å²	49.4	15%	0.153	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	164.3	177.7	77	-70.1	0	0	0	110.7	T645 K646 N648 L653 D657	T645-Y655 WeakPolarHBondContact CA-O 3.03Å; T645-Y655 WeakPolarHBondContact CB-O 3.32Å; K646-Y655 PolarHBondContact N-O 2.75Å; K646-Y655 WeakPolarHBondContact O-CD1 3.23Å; K646-Y655 PolarHBondContact O-N 3.28Å; N648-Y655 HydrophobicContact CB-CD1 4.32Å; N648-Y655 HydrophobicContact CB-CE1 4.23Å; L653-Y655 HydrophobicContact CD1-CD1 4.24Å; L653-Y655 HydrophobicContact CD1-CG 4.39Å; Y655-D657 HydrophobicContact CE2-CB 3.78Å
656	N	90.7	Very high	81	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	28%	0.281	C	S	.	.			trans	-98.5	129.6	166.6	-179.3	-94.4	0	0	0	109.1	G644 C658 T659 C706 G707 L768 V771 F799	G644-N656 PolarHBondContact O-ND2 3.49Å; N656-C658 PolarHBondContact O-N 3.46Å; N656-C658 VanDerWaalsContact O-N 3.1Å; N656-C658 WeakPolarHBondContact OD1-CA 3.3Å; N656-C658 PolarHBondContact OD1-N 3.03Å; N656-T659 PolarHBondContact ND2-O 2.82Å; N656-T659 PolarHBondContact OD1-N 3.43Å; N656-C706 HydrophobicContact CB-CB 4.3Å; N656-G707 PolarHBondContact O-N 2.91Å; N656-L768 HydrophobicContact CB-CD2 3.96Å; N656-V771 HydrophobicContact CB-CG2 4.29Å; N656-F799 HydrophobicContact CB-CE1 3.92Å; N656-F799 HydrophobicContact CB-CZ 4.49Å
657	D	88.1	Confident	79.3	Confident	54 Å²	54	55.4 Å²	55.4	29%	0.289	30%	0.299	S	S	.	.			trans	-83.4	29.4	179.4	65.3	-16.8	0	0	0	113	K646 Y655 T659	K646-D657 IonicContact NZ-OD1 2.63Å; K646-D657 PolarHBondContact NZ-OD1 2.84Å; K646-D657 IonicContact NZ-OD2 2.67Å; K646-D657 PolarHBondContact NZ-OD2 2.91Å; Y655-D657 HydrophobicContact CE2-CB 3.78Å; D657-T659 PolarHBondContact O-N 3.15Å; D657-T659 PolarHBondContact OD1-N 2.88Å; D657-T659 PolarHBondContact OD1-OG1 2.97Å
658	C	90.2	Very high	78.1	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.014	33%	0.331	C	S	.	.	S	Bend	trans	57.7	21.5	-170.4	-58.5	0	0	0	0	114.4	N656 N674 F675 S679 C706 G707	N656-C658 PolarHBondContact O-N 3.46Å; N656-C658 VanDerWaalsContact O-N 3.1Å; N656-C658 WeakPolarHBondContact OD1-CA 3.3Å; N656-C658 PolarHBondContact OD1-N 3.03Å; C658-N674 CarbonylContact O-C 3.44Å; C658-N674 WeakPolarHBondContact O-CA 3.47Å; C658-F675 HydrophobicContact CB-CB 4.11Å; C658-F675 PolarHBondContact O-N 3.4Å; C658-S679 WeakPolarHBondContact SG-CB 3.31Å; C658-C706 WeakPolarHBondContact CA-SG 3.37Å; C658-C706 HydrophobicContact CB-CB 4.05Å; C658-C706 WeakPolarHBondContact CB-SG 3.31Å; C658-C706 WeakPolarHBondContact SG-CB 3.44Å; C658-C706 CovalentContact SG-SG 2.04Å; C658-C706 PolarHBondContact SG-SG 2.75Å; C658-G707 PolarHBondContact SG-N 3.03Å; C658-G707 VanDerWaalsContact SG-N 3.41Å
659	T	90.1	Very high	77.6	Confident	51 Å²	51	64.4 Å²	64.4	31%	0.313	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	145	172.1	73	0	0	0	0	111.5	K646 N656 D657 Y673	K646-T659 PolarHBondContact NZ-OG1 2.81Å; N656-T659 PolarHBondContact ND2-O 2.82Å; N656-T659 PolarHBondContact OD1-N 3.43Å; D657-T659 PolarHBondContact O-N 3.15Å; D657-T659 PolarHBondContact OD1-N 2.88Å; D657-T659 PolarHBondContact OD1-OG1 2.97Å; T659-Y673 WeakPolarHBondContact CA-O 3.38Å
660	F	90.1	Very high	77.6	Confident	21 Å²	21	60.9 Å²	60.9	9%	0.092	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	143.6	174.6	-176.5	-105.3	0	0	0	109.9	L662 N672 Y673 F675 V771 I797	F660-L662 HydrophobicContact CE1-CB 4.05Å; F660-L662 HydrophobicContact CE1-CD1 4.4Å; F660-N672 CarbonylContact O-C 3.53Å; F660-Y673 AromaticContact CD1-CD2 4Å; F660-Y673 HydrophobicContact CD1-CD2 4Å; F660-Y673 HydrophobicContact CD1-CE2 4.41Å; F660-Y673 PolarHBondContact N-O 2.88Å; F660-Y673 PolarHBondContact O-N 3.3Å; F660-F675 HydrophobicContact CB-CE2 3.74Å; F660-F675 HydrophobicContact CB-CZ 4.13Å; F660-V771 HydrophobicContact CD2-CB 4.15Å; F660-V771 HydrophobicContact CD2-CG1 3.77Å; F660-V771 HydrophobicContact CE2-CB 4.14Å; F660-V771 HydrophobicContact CE2-CG1 3.87Å; F660-V771 WeakPolarHBondContact CE2-O 3.47Å; F660-V771 HydrophobicContact CG-CG1 4.3Å; F660-V771 HydrophobicContact CZ-CG1 4.46Å; F660-I797 HydrophobicContact CD1-CD1 3.81Å; F660-I797 HydrophobicContact CD1-CG1 4.47Å; F660-I797 HydrophobicContact CD1-CG2 4.39Å; F660-I797 HydrophobicContact CE1-CD1 4.16Å; F660-I797 HydrophobicContact CE1-CG1 4.38Å; F660-I797 HydrophobicContact CE1-CG2 4.43Å
661	S	87.4	Confident	78	Confident	81 Å²	81	59.7 Å²	59.7	57%	0.566	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.5	119.5	179.9	51	0	0	0	0	110.8	F671 N672	S661-F671 WeakPolarHBondContact CA-O 3.48Å; S661-N672 WeakPolarHBondContact CB-OD1 3.46Å
662	L	83.8	Confident	78.4	Confident	30 Å²	30	62.5 Å²	62.5	16%	0.157	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	115.6	-178.5	-176.6	73.1	0	0	0	109.6	F660 I670 F671 Y673 T773 P795	F660-L662 HydrophobicContact CE1-CB 4.05Å; F660-L662 HydrophobicContact CE1-CD1 4.4Å; L662-I670 CarbonylContact O-C 3.55Å; L662-I670 WeakPolarHBondContact O-CA 3.27Å; L662-F671 HydrophobicContact CB-CB 4.41Å; L662-F671 PolarHBondContact N-O 3.39Å; L662-F671 PolarHBondContact O-N 2.9Å; L662-Y673 HydrophobicContact CB-CE2 4.4Å; L662-T773 HydrophobicContact CD1-CG2 3.99Å; L662-T773 HydrophobicContact CD2-CG2 3.83Å; L662-P795 HydrophobicContact CD2-CG 3.78Å
663	S	74.8	Confident	79	Confident	75 Å²	75	61.7 Å²	61.7	52%	0.524	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	126.9	169.7	-170.5	0	0	0	0	109.9
664	R	65.4	Low	79.5	Confident	132 Å²	132	64.1 Å²	64.1	50%	0.498	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.7	178.1	178.4	172.3	160.8	168.6	-0.9	110.1	T666 P667	R664-T666 PolarHBondContact NE-O 3.02Å; R664-T666 PolarHBondContact O-N 3.33Å; R664-P667 VanDerWaalsContact O-O 3.06Å
665	N	55.6	Low	79.7	Confident	149 Å²	149	63.7 Å²	63.7	80%	0.797	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	-8.3	-172.7	-73.4	-11.2	0	0	0	115
666	T	50.3	Low	79.7	Confident	100 Å²	100	65 Å²	65	61%	0.613	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.3	113.7	-178.5	47.8	0	0	0	0	113.2	R664	R664-T666 PolarHBondContact NE-O 3.02Å; R664-T666 PolarHBondContact O-N 3.33Å
667	P	54.2	Low	79.5	Confident	110 Å²	110	67.7 Å²	67.7	71%	0.714	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	cis	-67.7	172.3	-34.8	35.2	-35.3	0	0	0	110.5	R664 R669	R664-P667 VanDerWaalsContact O-O 3.06Å; P667-R669 VanDerWaalsContact C-N 3.3Å; P667-R669 PolarHBondContact O-N 3.4Å
668	T	61.7	Low	79.5	Confident	129 Å²	129	65.2 Å²	65.2	79%	0.791	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.1	79.1	-178.1	53.2	0	0	0	0	113.1
669	R	72.8	Confident	79.3	Confident	93 Å²	93	67 Å²	67	35%	0.351	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	121.7	172.9	-171.6	174.1	-178.9	-155	-2.6	108.2	P667 F671 S864 D865	P667-R669 VanDerWaalsContact C-N 3.3Å; P667-R669 PolarHBondContact O-N 3.4Å; R669-F671 HydrophobicContact CB-CE2 4.42Å; R669-F671 HydrophobicContact CG-CE1 4.47Å; R669-F671 HydrophobicContact CG-CE2 4.21Å; R669-F671 HydrophobicContact CG-CZ 4.11Å; R669-S864 PolarHBondContact NE-OG 3.12Å; R669-D865 IonicContact CZ-OD1 3.12Å; R669-D865 IonicContact NH2-OD1 2.77Å; R669-D865 PolarHBondContact NH2-OD1 3.21Å
670	I	81.1	Confident	79	Confident	100 Å²	100	66.7 Å²	66.7	51%	0.513	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	120.8	177	-57	173.6	0	0	0	107.6	L662 N672	L662-I670 CarbonylContact O-C 3.55Å; L662-I670 WeakPolarHBondContact O-CA 3.27Å; I670-N672 WeakPolarHBondContact CG2-OD1 3.37Å
671	F	85.2	Confident	78.8	Confident	18 Å²	18	68.8 Å²	68.8	8%	0.079	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	113.6	172.9	-62.1	-88.4	0	0	0	108.6	S661 L662 R669 Y673 P859	S661-F671 WeakPolarHBondContact CA-O 3.48Å; L662-F671 HydrophobicContact CB-CB 4.41Å; L662-F671 PolarHBondContact N-O 3.39Å; L662-F671 PolarHBondContact O-N 2.9Å; R669-F671 HydrophobicContact CB-CE2 4.42Å; R669-F671 HydrophobicContact CG-CE1 4.47Å; R669-F671 HydrophobicContact CG-CE2 4.21Å; R669-F671 HydrophobicContact CG-CZ 4.11Å; F671-Y673 HydrophobicContact CB-CD2 4.43Å; F671-Y673 HydrophobicContact CB-CE2 3.5Å; F671-Y673 WeakPolarHBondContact O-CD2 3.45Å; F671-Y673 WeakPolarHBondContact O-CE2 3.41Å; F671-P859 HydrophobicContact CB-CB 4.27Å; F671-P859 HydrophobicContact CD1-CB 4.06Å; F671-P859 HydrophobicContact CD1-CG 4.08Å
672	N	89.7	Confident	79	Confident	78 Å²	78	66.6 Å²	66.6	42%	0.417	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	135.8	174.9	-63.6	-40	0	0	0	109.1	F660 S661 I670 P859 L860	F660-N672 CarbonylContact O-C 3.53Å; S661-N672 WeakPolarHBondContact CB-OD1 3.46Å; I670-N672 WeakPolarHBondContact CG2-OD1 3.37Å; N672-P859 CarbonylContact O-C 3.52Å; N672-P859 WeakPolarHBondContact O-CA 3.06Å; N672-L860 HydrophobicContact CB-CD1 4.14Å; N672-L860 WeakPolarHBondContact O-CB 3.45Å; N672-L860 WeakPolarHBondContact O-CG 3.4Å; N672-L860 PolarHBondContact O-N 3.11Å
673	Y	90.3	Very high	79.3	Confident	5 Å²	5	68.1 Å²	68.1	2%	0.02	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	148.3	-177.8	-60.8	-98.1	0	0	0	110.5	T659 F660 L662 F671 F675 I797 A857 P859	T659-Y673 WeakPolarHBondContact CA-O 3.38Å; F660-Y673 AromaticContact CD1-CD2 4Å; F660-Y673 HydrophobicContact CD1-CD2 4Å; F660-Y673 HydrophobicContact CD1-CE2 4.41Å; F660-Y673 PolarHBondContact N-O 2.88Å; F660-Y673 PolarHBondContact O-N 3.3Å; L662-Y673 HydrophobicContact CB-CE2 4.4Å; F671-Y673 HydrophobicContact CB-CD2 4.43Å; F671-Y673 HydrophobicContact CB-CE2 3.5Å; F671-Y673 WeakPolarHBondContact O-CD2 3.45Å; F671-Y673 WeakPolarHBondContact O-CE2 3.41Å; Y673-F675 HydrophobicContact CD1-CE1 4.22Å; Y673-F675 HydrophobicContact CD1-CZ 4.44Å; Y673-F675 HydrophobicContact CG-CE1 4.26Å; Y673-F675 HydrophobicContact CG-CZ 4.12Å; Y673-I797 HydrophobicContact CD1-CD1 3.69Å; Y673-I797 HydrophobicContact CD2-CD1 3.74Å; Y673-I797 HydrophobicContact CE1-CD1 3.62Å; Y673-I797 HydrophobicContact CE2-CD1 3.68Å; Y673-I797 HydrophobicContact CG-CD1 3.76Å; Y673-A857 WeakPolarHBondContact CD1-O 3.43Å; Y673-P859 HydrophobicContact CD1-CB 4.18Å; Y673-P859 HydrophobicContact CE1-CB 3.8Å; Y673-P859 HydrophobicContact CE1-CG 4.25Å; Y673-P859 HydrophobicContact CE2-CB 4.5Å
674	N	91.6	Very high	80	Confident	70 Å²	70	66.1 Å²	66.1	37%	0.374	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	103	175.8	-176.7	-10.5	0	0	0	110.1	C658 S676 L860	C658-N674 CarbonylContact O-C 3.44Å; C658-N674 WeakPolarHBondContact O-CA 3.47Å; N674-S676 VanDerWaalsContact C-N 3.31Å; N674-S676 PolarHBondContact O-N 3.18Å; N674-S676 WeakPolarHBondContact OD1-CB 3.48Å; N674-S676 PolarHBondContact OD1-N 2.76Å; N674-S676 PolarHBondContact OD1-OG 2.92Å; N674-L860 HydrophobicContact CB-CD1 4.35Å; N674-L860 HydrophobicContact CB-CD2 3.98Å; N674-L860 HydrophobicContact CB-CG 4.4Å
675	F	91.1	Very high	81	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	38%	0.38	C	S	.	.			trans	-89.1	15	-178.8	-46	-54.6	0	0	0	113	C658 F660 Y673 A677 L678 L705 I797 F799 L820	C658-F675 HydrophobicContact CB-CB 4.11Å; C658-F675 PolarHBondContact O-N 3.4Å; F660-F675 HydrophobicContact CB-CE2 3.74Å; F660-F675 HydrophobicContact CB-CZ 4.13Å; Y673-F675 HydrophobicContact CD1-CE1 4.22Å; Y673-F675 HydrophobicContact CD1-CZ 4.44Å; Y673-F675 HydrophobicContact CG-CE1 4.26Å; Y673-F675 HydrophobicContact CG-CZ 4.12Å; F675-A677 PolarHBondContact O-N 2.89Å; F675-L678 HydrophobicContact CB-CB 4.46Å; F675-L678 HydrophobicContact CB-CD1 4.35Å; F675-L678 HydrophobicContact CD1-CD1 4.43Å; F675-L678 WeakPolarHBondContact O-CA 3.45Å; F675-L678 WeakPolarHBondContact O-CB 3.34Å; F675-L678 PolarHBondContact O-N 2.76Å; F675-L705 HydrophobicContact CB-CD2 4.3Å; F675-I797 HydrophobicContact CE1-CD1 4.44Å; F675-I797 HydrophobicContact CZ-CD1 3.87Å; F675-I797 HydrophobicContact CZ-CG2 4.31Å; F675-F799 HydrophobicContact CD2-CE2 4.16Å; F675-F799 AromaticContact CD2-CZ 3.79Å; F675-F799 HydrophobicContact CD2-CZ 3.79Å; F675-F799 AromaticContact CE2-CE2 3.86Å; F675-F799 HydrophobicContact CE2-CE2 3.86Å; F675-F799 AromaticContact CE2-CZ 3.83Å; F675-F799 HydrophobicContact CE2-CZ 3.83Å; F675-F799 HydrophobicContact CZ-CE2 4.46Å; F675-L820 HydrophobicContact CD1-CD1 3.64Å; F675-L820 HydrophobicContact CD2-CD1 4.27Å; F675-L820 HydrophobicContact CE1-CD1 3.49Å; F675-L820 VanDerWaalsContact CE1-CD1 3.49Å; F675-L820 HydrophobicContact CE2-CD1 4.13Å; F675-L820 HydrophobicContact CG-CD1 4.03Å; F675-L820 HydrophobicContact CZ-CD1 3.76Å
676	S	89.4	Confident	82.4	Confident	66 Å²	66	55.8 Å²	55.8	46%	0.462	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-61.8	-20.1	-176.3	-57.9	0	0	0	0	113.5	N674 L678 S679	N674-S676 VanDerWaalsContact C-N 3.31Å; N674-S676 PolarHBondContact O-N 3.18Å; N674-S676 WeakPolarHBondContact OD1-CB 3.48Å; N674-S676 PolarHBondContact OD1-N 2.76Å; N674-S676 PolarHBondContact OD1-OG 2.92Å; S676-L678 PolarHBondContact O-N 3.38Å; S676-S679 PolarHBondContact O-OG 2.88Å
677	A	87.4	Confident	83.9	Confident	58 Å²	58	52.9 Å²	52.9	48%	0.479	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-79.3	-0.2	171.1	0	0	0	0	0	114	F675 A828 A856	F675-A677 PolarHBondContact O-N 2.89Å; A677-A828 HydrophobicContact CB-CB 3.94Å; A677-A856 HydrophobicContact CB-CB 3.92Å
678	L	87.7	Confident	85.3	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-118.8	8.4	178.5	-49.9	-177.7	0	0	0	112.3	F675 S676 G680 L705 L820 P829 W852 A856	F675-L678 HydrophobicContact CB-CB 4.46Å; F675-L678 HydrophobicContact CB-CD1 4.35Å; F675-L678 HydrophobicContact CD1-CD1 4.43Å; F675-L678 WeakPolarHBondContact O-CA 3.45Å; F675-L678 WeakPolarHBondContact O-CB 3.34Å; F675-L678 PolarHBondContact O-N 2.76Å; S676-L678 PolarHBondContact O-N 3.38Å; L678-G680 VanDerWaalsContact C-N 3.25Å; L678-G680 PolarHBondContact O-N 3.36Å; L678-L705 HydrophobicContact CB-CD2 3.8Å; L678-L705 HydrophobicContact CD1-CD2 4.03Å; L678-L820 HydrophobicContact CD1-CD1 4.49Å; L678-L820 HydrophobicContact CD1-CD2 4.35Å; L678-P829 HydrophobicContact CD2-CB 4.21Å; L678-P829 WeakPolarHBondContact CD2-O 3.3Å; L678-W852 HydrophobicContact CB-CH2 4.18Å; L678-W852 HydrophobicContact CB-CZ2 4.04Å; L678-W852 HydrophobicContact CD2-CZ2 3.81Å; L678-W852 HydrophobicContact CG-CZ2 4.41Å; L678-A856 HydrophobicContact CD1-CB 4.31Å; L678-A856 HydrophobicContact CD2-CB 3.93Å; L678-A856 HydrophobicContact CG-CB 3.94Å
679	S	84.9	Confident	86.2	Confident	39 Å²	39	46.1 Å²	46.1	27%	0.273	29%	0.294	S	S	.	.			trans	-85.7	11.1	-177.5	79.3	0	0	0	0	114.4	C658 S676	C658-S679 WeakPolarHBondContact SG-CB 3.31Å; S676-S679 PolarHBondContact O-OG 2.88Å
680	G	84.9	Confident	86.4	Confident	44 Å²	44	47.5 Å²	47.5	45%	0.454	30%	0.303	S	S	.	.	S	Bend	trans	-100.5	148.5	174.8	0	0	0	0	0	110.2	L678 V682	L678-G680 VanDerWaalsContact C-N 3.25Å; L678-G680 PolarHBondContact O-N 3.36Å; G680-V682 PolarHBondContact O-N 3.24Å
681	T	86.8	Confident	85.8	Confident	65 Å²	65	43.5 Å²	43.5	40%	0.399	28%	0.283	S	S	.	.			trans	-62.6	129.4	176.2	-48.3	0	0	0	0	110.4	T702 L703 M713	T681-T702 HydrophobicContact CG2-CG2 3.39Å; T681-L703 CarbonylContact C-O 3.5Å; T681-L703 WeakPolarHBondContact CA-O 3.17Å; T681-M713 PolarHBondContact OG1-O 2.91Å
682	V	90.1	Very high	84.8	Confident	35 Å²	35	47.4 Å²	47.4	21%	0.212	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143	176.4	172.9	0	0	0	0	108.4	G680 L703 L832 W852	G680-V682 PolarHBondContact O-N 3.24Å; V682-L703 PolarHBondContact N-O 3.11Å; V682-L703 WeakPolarHBondContact O-CD1 3.29Å; V682-L703 PolarHBondContact O-N 3.48Å; V682-L832 HydrophobicContact CG1-CD2 4.36Å; V682-W852 HydrophobicContact CB-CH2 4.19Å; V682-W852 HydrophobicContact CB-CZ2 4.43Å; V682-W852 HydrophobicContact CG2-CH2 3.78Å; V682-W852 HydrophobicContact CG2-CZ2 3.77Å
683	S	89.8	Confident	83.3	Confident	62 Å²	62	46.9 Å²	46.9	43%	0.434	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	150.4	175.4	-59.8	0	0	0	0	112.2	H700 F701 T702	S683-H700 WeakPolarHBondContact CB-NE2 3.4Å; S683-F701 CarbonylContact C-O 3.55Å; S683-F701 WeakPolarHBondContact CA-O 3.42Å; S683-F701 WeakPolarHBondContact CB-O 3.34Å; S683-T702 PolarHBondContact OG-OG1 3.3Å
684	L	90.3	Very high	82.2	Confident	33 Å²	33	48.7 Å²	48.7	17%	0.173	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	128.6	-178.5	177	61.6	0	0	0	109.8	F701 L832 L834 F850	L684-F701 PolarHBondContact N-O 2.81Å; L684-F701 PolarHBondContact O-N 2.71Å; L684-L832 HydrophobicContact CB-CD2 4.06Å; L684-L832 HydrophobicContact CD2-CB 4.38Å; L684-L832 HydrophobicContact CD2-CD2 4.01Å; L684-L832 HydrophobicContact CD2-CG 3.93Å; L684-L834 HydrophobicContact CD2-CD2 3.74Å; L684-L834 HydrophobicContact CD2-CG 3.89Å; L684-F850 HydrophobicContact CD2-CD1 4.45Å
685	A	86.9	Confident	81.1	Confident	49 Å²	49	46.5 Å²	46.5	41%	0.405	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	136.6	163.6	0	0	0	0	0	109.4	F698	A685-F698 HydrophobicContact CB-CD2 3.72Å; A685-F698 HydrophobicContact CB-CE2 3.96Å
686	G	84.3	Confident	80.5	Confident	15 Å²	15	50 Å²	50	16%	0.155	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	-172.4	165.5	0	0	0	0	0	112.2	H699	G686-H699 PolarHBondContact N-O 3.11Å
687	A	82.6	Confident	80.2	Confident	39 Å²	39	48 Å²	48	32%	0.322	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	155.3	171.4	0	0	0	0	0	111.1	S689	A687-S689 PolarHBondContact O-N 3.18Å; A687-S689 VanDerWaalsContact O-N 3.14Å
688	P	83	Confident	80.1	Confident	79 Å²	79	47.7 Å²	47.7	51%	0.513	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	110.7	164.6	28.5	-32.6	0	0	0	109	F690 K696 Y697	P688-F690 HydrophobicContact CB-CE2 4.45Å; P688-K696 HydrophobicContact CB-CG 4.45Å; P688-Y697 WeakPolarHBondContact CA-O 3.28Å
689	S	80.3	Confident	80.1	Confident	18 Å²	18	47.7 Å²	47.7	13%	0.126	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	155.2	173.2	-68.9	0	0	0	0	109	A687 Y697 D840	A687-S689 PolarHBondContact O-N 3.18Å; A687-S689 VanDerWaalsContact O-N 3.14Å; S689-Y697 PolarHBondContact N-O 2.92Å; S689-Y697 WeakPolarHBondContact O-CD1 3.42Å; S689-Y697 PolarHBondContact O-N 3.27Å; S689-D840 PolarHBondContact OG-OD1 3.27Å
690	F	77.8	Confident	80.4	Confident	123 Å²	123	48.1 Å²	48.1	54%	0.539	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	138.9	-176.4	-66.4	-94.2	0	0	0	109.7	P688 L695 K696	P688-F690 HydrophobicContact CB-CE2 4.45Å; F690-L695 WeakPolarHBondContact CA-O 3.41Å; F690-K696 HydrophobicContact CD1-CB 4.14Å; F690-K696 HydrophobicContact CE1-CB 3.76Å; F690-K696 HydrophobicContact CE1-CG 4.16Å; F690-K696 HydrophobicContact CZ-CB 4.43Å; F690-K696 HydrophobicContact CZ-CG 4.35Å
691	T	68.8	Low	80.7	Confident	15 Å²	15	46 Å²	46	9%	0.092	28%	0.277	C	S	.	.			trans	-72.8	178.6	172.5	63.6	0	0	0	0	110.9	E172 K693 G694 L695 Y697	E172-T691 VanDerWaalsContact CD-CB 3.41Å; E172-T691 VanDerWaalsContact CD-OG1 3.29Å; E172-T691 WeakPolarHBondContact OE2-CB 3.31Å; E172-T691 PolarHBondContact OE2-OG1 2.87Å; T691-K693 PolarHBondContact O-N 3.01Å; T691-K693 VanDerWaalsContact O-N 3.12Å; T691-G694 PolarHBondContact O-N 2.86Å; T691-L695 HydrophobicContact CG2-CB 4Å; T691-L695 PolarHBondContact N-O 2.79Å; T691-L695 WeakPolarHBondContact OG1-CA 3.38Å; T691-L695 WeakPolarHBondContact OG1-CB 3.49Å; T691-L695 WeakPolarHBondContact OG1-CG 3.41Å; T691-L695 PolarHBondContact OG1-N 3.25Å; T691-Y697 HydrophobicContact CG2-CD1 3.65Å; T691-Y697 HydrophobicContact CG2-CE1 3.64Å
692	S	62.6	Low	81	Confident	100 Å²	100	43.6 Å²	43.6	70%	0.699	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.3	-171.8	68.4	0	0	0	0	114.8	E172	E172-S692 VanDerWaalsContact CD-OG 3.26Å; E172-S692 WeakPolarHBondContact OE1-CB 3.38Å; E172-S692 PolarHBondContact OE1-N 2.98Å; E172-S692 VanDerWaalsContact OE1-N 3.1Å; E172-S692 PolarHBondContact OE1-OG 3.14Å; E172-S692 PolarHBondContact OE2-N 3.17Å; E172-S692 PolarHBondContact OE2-OG 3.04Å
693	K	60	Low	81	Confident	67 Å²	67	42 Å²	42	29%	0.291	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	20.5	174.3	-49.6	-162.7	-174.4	-168.6	0	113.7	D171 E172 C173 T691	D171-K693 IonicContact OD2-NZ 2.83Å; D171-K693 PolarHBondContact OD2-NZ 2.89Å; E172-K693 HydrophobicContact CB-CB 4.06Å; E172-K693 HydrophobicContact CB-CD 4.13Å; E172-K693 HydrophobicContact CB-CG 4.05Å; E172-K693 WeakPolarHBondContact OE2-CB 3.41Å; E172-K693 PolarHBondContact OE2-N 2.78Å; C173-K693 PolarHBondContact SG-NZ 3.16Å; T691-K693 PolarHBondContact O-N 3.01Å; T691-K693 VanDerWaalsContact O-N 3.12Å
694	G	66.2	Low	81.1	Confident	44 Å²	44	39 Å²	39	45%	0.454	23%	0.231	S	C	.	.			trans	83.3	19.4	171	0	0	0	0	0	116.9	T691 K696	T691-G694 PolarHBondContact O-N 2.86Å; G694-K696 PolarHBondContact O-N 2.81Å
695	L	69.1	Low	80.9	Confident	23 Å²	23	37.5 Å²	37.5	12%	0.12	22%	0.223	C	C	.	.			trans	-69.6	116.8	168.7	-51.5	-179.4	0	0	0	109.3	L141 E172 A248 F249 F690 T691 Y697 V750	L141-L695 HydrophobicContact CD1-CD2 3.61Å; E172-L695 HydrophobicContact CB-CD1 3.89Å; E172-L695 HydrophobicContact CB-CG 4.21Å; E172-L695 HydrophobicContact CG-CD1 4.41Å; A248-L695 WeakPolarHBondContact O-CD1 3.16Å; F249-L695 HydrophobicContact CB-CD1 4.44Å; F690-L695 WeakPolarHBondContact CA-O 3.41Å; T691-L695 HydrophobicContact CG2-CB 4Å; T691-L695 PolarHBondContact N-O 2.79Å; T691-L695 WeakPolarHBondContact OG1-CA 3.38Å; T691-L695 WeakPolarHBondContact OG1-CB 3.49Å; T691-L695 WeakPolarHBondContact OG1-CG 3.41Å; T691-L695 PolarHBondContact OG1-N 3.25Å; L695-Y697 PolarHBondContact O-N 3.24Å; L695-V750 HydrophobicContact CD2-CG1 4.45Å
696	K	78.6	Confident	80.9	Confident	74 Å²	74	35.2 Å²	35.2	32%	0.322	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	121.6	175	-179	-174.9	173.2	-172	0	109.9	P688 F690 G694 P747 E749 V750	P688-K696 HydrophobicContact CB-CG 4.45Å; F690-K696 HydrophobicContact CD1-CB 4.14Å; F690-K696 HydrophobicContact CE1-CB 3.76Å; F690-K696 HydrophobicContact CE1-CG 4.16Å; F690-K696 HydrophobicContact CZ-CB 4.43Å; F690-K696 HydrophobicContact CZ-CG 4.35Å; G694-K696 PolarHBondContact O-N 2.81Å; K696-P747 HydrophobicContact CD-CG 4.11Å; K696-P747 HydrophobicContact CG-CG 4.05Å; K696-P747 WeakPolarHBondContact O-CD 3.37Å; K696-E749 IonicContact NZ-OE1 2.83Å; K696-E749 IonicContact NZ-OE2 3.63Å; K696-E749 PolarHBondContact NZ-OE2 2.86Å; K696-V750 HydrophobicContact CB-CG2 4.24Å
697	Y	82.2	Confident	80.6	Confident	25 Å²	25	35.1 Å²	35.1	10%	0.098	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	169.5	168.9	69	-86.9	0	0	0	110.2	V251 P688 S689 T691 L695 H699 V744 I745	V251-Y697 HydrophobicContact CG1-CE2 4.28Å; V251-Y697 HydrophobicContact CG2-CE1 4.38Å; V251-Y697 HydrophobicContact CG2-CE2 4.36Å; P688-Y697 WeakPolarHBondContact CA-O 3.28Å; S689-Y697 PolarHBondContact N-O 2.92Å; S689-Y697 WeakPolarHBondContact O-CD1 3.42Å; S689-Y697 PolarHBondContact O-N 3.27Å; T691-Y697 HydrophobicContact CG2-CD1 3.65Å; T691-Y697 HydrophobicContact CG2-CE1 3.64Å; L695-Y697 PolarHBondContact O-N 3.24Å; Y697-H699 AromaticContact CE2-NE2 3.91Å; Y697-V744 HydrophobicContact CD2-CG1 3.97Å; Y697-V744 HydrophobicContact CG-CG1 4.34Å; Y697-I745 WeakPolarHBondContact CA-O 3.39Å
698	F	85.3	Confident	80.3	Confident	50 Å²	50	36.9 Å²	36.9	22%	0.219	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	147	167.7	57.8	-84.7	0	0	0	110.9	A685 H700 I745 P747	A685-F698 HydrophobicContact CB-CD2 3.72Å; A685-F698 HydrophobicContact CB-CE2 3.96Å; F698-H700 HydrophobicContact CE2-CB 4.45Å; F698-I745 HydrophobicContact CD2-CB 4.22Å; F698-I745 HydrophobicContact CE1-CB 4.07Å; F698-I745 HydrophobicContact CE1-CG2 3.83Å; F698-I745 HydrophobicContact CE2-CB 3.76Å; F698-I745 HydrophobicContact CE2-CD1 3.99Å; F698-I745 HydrophobicContact CE2-CG1 4.28Å; F698-I745 HydrophobicContact CE2-CG2 4.07Å; F698-I745 HydrophobicContact CZ-CB 3.68Å; F698-I745 HydrophobicContact CZ-CD1 4.31Å; F698-I745 HydrophobicContact CZ-CG2 3.48Å; F698-I745 VanDerWaalsContact CZ-CG2 3.48Å; F698-I745 PolarHBondContact N-O 3.11Å; F698-I745 PolarHBondContact O-N 2.91Å; F698-P747 HydrophobicContact CD1-CG 4.32Å; F698-P747 HydrophobicContact CE1-CG 4.15Å
699	H	88.1	Confident	80	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.009	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	130.7	169.8	-67.5	-54.5	0	0	0	109.6	W252 G686 Y697 F701 Q742 D840	W252-H699 AromaticContact CZ2-NE2 3.92Å; G686-H699 PolarHBondContact N-O 3.11Å; Y697-H699 AromaticContact CE2-NE2 3.91Å; H699-F701 HydrophobicContact CB-CE2 3.7Å; H699-F701 HydrophobicContact CB-CZ 3.68Å; H699-Q742 HydrophobicContact CB-CG 4.39Å; H699-Q742 PolarHBondContact ND1-NE2 2.77Å; H699-Q742 VanDerWaalsContact ND1-NE2 3.12Å; H699-D840 IonicContact CD2-OD1 2.69Å; H699-D840 PolarHBondContact CD2-OD1 2.97Å
700	H	90.2	Very high	79.6	Confident	49 Å²	49	36.8 Å²	36.8	23%	0.227	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.1	175.5	-170.2	80.9	0	0	0	109	S683 F698 Q742 V743 I745	S683-H700 WeakPolarHBondContact CB-NE2 3.4Å; F698-H700 HydrophobicContact CE2-CB 4.45Å; H700-Q742 CarbonylContact O-C 3.53Å; H700-Q742 WeakPolarHBondContact O-CA 3.06Å; H700-V743 HydrophobicContact CB-CG1 4.01Å; H700-V743 PolarHBondContact N-O 2.85Å; H700-V743 PolarHBondContact O-N 2.99Å; H700-I745 HydrophobicContact CB-CD1 3.47Å; H700-I745 VanDerWaalsContact CB-CD1 3.47Å; H700-I745 HydrophobicContact CB-CG1 3.81Å
701	F	92.2	Very high	79.6	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	134.4	-177.5	-56	-85.1	0	0	0	109.3	S683 L684 H699 L703 C741 Q742 L764 L834 D840 F848 F850	S683-F701 CarbonylContact C-O 3.55Å; S683-F701 WeakPolarHBondContact CA-O 3.42Å; S683-F701 WeakPolarHBondContact CB-O 3.34Å; L684-F701 PolarHBondContact N-O 2.81Å; L684-F701 PolarHBondContact O-N 2.71Å; H699-F701 HydrophobicContact CB-CE2 3.7Å; H699-F701 HydrophobicContact CB-CZ 3.68Å; F701-L703 HydrophobicContact CB-CD1 4.04Å; F701-C741 WeakPolarHBondContact CA-O 3.47Å; F701-Q742 HydrophobicContact CD1-CB 3.93Å; F701-Q742 HydrophobicContact CD1-CG 3.94Å; F701-Q742 HydrophobicContact CE1-CB 4.01Å; F701-Q742 VanDerWaalsContact CE1-CD 3.48Å; F701-Q742 HydrophobicContact CE1-CG 3.62Å; F701-Q742 HydrophobicContact CZ-CG 4.28Å; F701-L764 HydrophobicContact CD1-CD1 3.85Å; F701-L764 HydrophobicContact CE1-CD1 3.9Å; F701-L834 HydrophobicContact CE2-CD1 4.09Å; F701-D840 WeakPolarHBondContact CZ-O 3.33Å; F701-F848 HydrophobicContact CE1-CD1 4.24Å; F701-F848 HydrophobicContact CE1-CE1 4.21Å; F701-F850 HydrophobicContact CB-CE1 4.14Å; F701-F850 HydrophobicContact CB-CZ 4.36Å; F701-F850 HydrophobicContact CD1-CE1 4.21Å; F701-F850 AromaticContact CD1-CZ 3.85Å; F701-F850 HydrophobicContact CD1-CZ 3.85Å; F701-F850 HydrophobicContact CD2-CE1 4.32Å; F701-F850 HydrophobicContact CE1-CZ 4.32Å; F701-F850 AromaticContact CG-CE1 3.96Å; F701-F850 HydrophobicContact CG-CE1 3.96Å; F701-F850 HydrophobicContact CG-CZ 4.07Å
702	T	92.1	Very high	80.3	Confident	14 Å²	14	36.9 Å²	36.9	9%	0.086	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125.3	176.1	-63.5	0	0	0	0	108.6	T681 S683 S714 V740 C741	T681-T702 HydrophobicContact CG2-CG2 3.39Å; S683-T702 PolarHBondContact OG-OG1 3.3Å; T702-S714 WeakPolarHBondContact O-CB 3.23Å; T702-S714 PolarHBondContact O-OG 2.84Å; T702-V740 WeakPolarHBondContact O-CA 3.45Å; T702-C741 PolarHBondContact N-O 3.14Å; T702-C741 PolarHBondContact O-N 2.81Å
703	L	91.7	Very high	81.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	139.1	-163.5	-48	91.4	0	0	0	112.2	T681 V682 F701 S714 Y739 V740 I818 L832 F850	T681-L703 CarbonylContact C-O 3.5Å; T681-L703 WeakPolarHBondContact CA-O 3.17Å; V682-L703 PolarHBondContact N-O 3.11Å; V682-L703 WeakPolarHBondContact O-CD1 3.29Å; V682-L703 PolarHBondContact O-N 3.48Å; F701-L703 HydrophobicContact CB-CD1 4.04Å; L703-S714 WeakPolarHBondContact CA-OG 3.31Å; L703-S714 PolarHBondContact N-OG 3.11Å; L703-Y739 CarbonylContact C-O 3.4Å; L703-Y739 WeakPolarHBondContact CA-O 3.2Å; L703-V740 HydrophobicContact CB-CG2 4.16Å; L703-V740 HydrophobicContact CD2-CG1 4.15Å; L703-V740 HydrophobicContact CD2-CG2 4.07Å; L703-V740 HydrophobicContact CG-CG1 4.05Å; L703-V740 HydrophobicContact CG-CG2 4.16Å; L703-I818 HydrophobicContact CD2-CD1 4.08Å; L703-L832 HydrophobicContact CD1-CD2 3.51Å; L703-L832 HydrophobicContact CD2-CD2 3.86Å; L703-L832 HydrophobicContact CG-CD2 4.26Å; L703-F850 HydrophobicContact CD2-CD1 3.87Å; L703-F850 HydrophobicContact CD2-CD2 4.16Å; L703-F850 HydrophobicContact CD2-CE1 3.98Å; L703-F850 HydrophobicContact CD2-CE2 4.27Å; L703-F850 HydrophobicContact CD2-CG 3.98Å; L703-F850 HydrophobicContact CD2-CZ 4.18Å
704	N	90.6	Very high	82.5	Confident	1 Å²	1	33 Å²	33	1%	0.005	17%	0.171	C	C	.	.			trans	-130.4	136.1	166	176.7	35	0	0	0	109.5	K711 M713 S714 Y739	N704-K711 PolarHBondContact ND2-O 2.57Å; N704-M713 HydrophobicContact CB-CB 4.2Å; N704-S714 PolarHBondContact N-OG 3.03Å; N704-S714 VanDerWaalsContact N-OG 3.14Å; N704-Y739 PolarHBondContact N-O 2.81Å
705	L	87.4	Confident	83.5	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.172	C	C	.	.			trans	-95.3	-49.1	-169.9	-177.3	71.4	0	0	0	113.8	F675 L678 F799 I818 L820 W852	F675-L705 HydrophobicContact CB-CD2 4.3Å; L678-L705 HydrophobicContact CB-CD2 3.8Å; L678-L705 HydrophobicContact CD1-CD2 4.03Å; L705-F799 HydrophobicContact CD1-CB 4.18Å; L705-F799 HydrophobicContact CD1-CD1 3.63Å; L705-F799 HydrophobicContact CD1-CD2 3.86Å; L705-F799 HydrophobicContact CD1-CE1 3.9Å; L705-F799 HydrophobicContact CD1-CE2 4.13Å; L705-F799 HydrophobicContact CD1-CG 3.62Å; L705-F799 HydrophobicContact CD1-CZ 4.15Å; L705-F799 HydrophobicContact CD2-CZ 4.39Å; L705-F799 HydrophobicContact CG-CD1 4.1Å; L705-F799 HydrophobicContact CG-CE1 3.88Å; L705-F799 HydrophobicContact CG-CE2 4.47Å; L705-F799 HydrophobicContact CG-CG 4.5Å; L705-F799 HydrophobicContact CG-CZ 4.08Å; L705-I818 HydrophobicContact CD1-CB 4.36Å; L705-I818 HydrophobicContact CD1-CD1 4.35Å; L705-I818 HydrophobicContact CD1-CG2 4.13Å; L705-L820 HydrophobicContact CD1-CD2 4.05Å; L705-L820 HydrophobicContact CD2-CD1 3.99Å; L705-L820 HydrophobicContact CD2-CD2 3.91Å; L705-W852 HydrophobicContact CB-CZ3 4.06Å; L705-W852 HydrophobicContact CD2-CZ3 4.48Å
706	C	85.8	Confident	84.3	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.014	17%	0.168	C	C	.	.	S	Bend	trans	-160.5	172.3	-165.3	65.3	0	0	0	0	112	N656 C658 F799	N656-C706 HydrophobicContact CB-CB 4.3Å; C658-C706 WeakPolarHBondContact CA-SG 3.37Å; C658-C706 HydrophobicContact CB-CB 4.05Å; C658-C706 WeakPolarHBondContact CB-SG 3.31Å; C658-C706 WeakPolarHBondContact SG-CB 3.44Å; C658-C706 CovalentContact SG-SG 2.04Å; C658-C706 PolarHBondContact SG-SG 2.75Å; C706-F799 HydrophobicContact CB-CE1 4.18Å
707	G	78.3	Confident	84.4	Confident	13 Å²	13	33.2 Å²	33.2	13%	0.134	17%	0.17	C	C	.	.			trans	86	-158.1	175.2	0	0	0	0	0	113.9	N656 C658 Q709 G710	N656-G707 PolarHBondContact O-N 2.91Å; C658-G707 PolarHBondContact SG-N 3.03Å; C658-G707 VanDerWaalsContact SG-N 3.41Å; G707-Q709 PolarHBondContact O-N 3.17Å; G707-G710 PolarHBondContact O-N 2.86Å
708	N	75.3	Confident	84	Confident	76 Å²	76	32.9 Å²	32.9	41%	0.406	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	51	21.7	176.6	-56.9	-45	0	0	0	116.4	G710 K711 M713	N708-G710 PolarHBondContact O-N 2.9Å; N708-G710 VanDerWaalsContact O-N 3.16Å; N708-K711 HydrophobicContact CB-CB 4.04Å; N708-K711 WeakPolarHBondContact O-CG 3.48Å; N708-K711 PolarHBondContact O-N 3.01Å; N708-M713 HydrophobicContact CB-CG 4.37Å
709	Q	76.8	Confident	83.4	Confident	90 Å²	90	32.2 Å²	32.2	42%	0.421	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	60.9	8.4	-176.3	-65.1	178.3	64.5	0	0	116.3	G707	G707-Q709 PolarHBondContact O-N 3.17Å
710	G	73.8	Confident	82.3	Confident	4 Å²	4	32.2 Å²	32.2	4%	0.041	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	132	-18.5	-175.8	0	0	0	0	0	114.9	E490 L653 G707 N708 K712 Y739	E490-G710 WeakPolarHBondContact OE2-CA 3.38Å; L653-G710 VanDerWaalsContact CD1-CA 3.48Å; G707-G710 PolarHBondContact O-N 2.86Å; N708-G710 PolarHBondContact O-N 2.9Å; N708-G710 VanDerWaalsContact O-N 3.16Å; G710-K712 PolarHBondContact O-N 2.82Å; G710-Y739 PolarHBondContact O-OH 2.75Å
711	K	76.9	Confident	80.7	Confident	88 Å²	88	31.9 Å²	31.9	38%	0.383	17%	0.171	S	C	.	.			trans	-59.1	129	-163.2	-68.5	-176.8	178.7	-160.1	0	114.3	E490 N704 N708 M713	E490-K711 HydrophobicContact CG-CG 3.8Å; E490-K711 WeakPolarHBondContact OE1-CE 3.32Å; E490-K711 VanDerWaalsContact OE1-CG 3.26Å; E490-K711 WeakPolarHBondContact OE1-CG 3.4Å; E490-K711 WeakPolarHBondContact OE2-CA 3.41Å; E490-K711 WeakPolarHBondContact OE2-CG 3.25Å; E490-K711 PolarHBondContact OE2-N 2.92Å; N704-K711 PolarHBondContact ND2-O 2.57Å; N708-K711 HydrophobicContact CB-CB 4.04Å; N708-K711 WeakPolarHBondContact O-CG 3.48Å; N708-K711 PolarHBondContact O-N 3.01Å; K711-M713 VanDerWaalsContact C-N 3.33Å; K711-M713 HydrophobicContact CB-CG 4.22Å; K711-M713 HydrophobicContact CB-SD 3.74Å; K711-M713 WeakPolarHBondContact O-CG 3.5Å; K711-M713 PolarHBondContact O-N 3.13Å
712	K	83.2	Confident	78.7	Confident	53 Å²	53	33.7 Å²	33.7	23%	0.23	18%	0.18	C	C	.	.			trans	-65.6	85.9	166.1	-66.3	-174.2	-179.4	-168.3	0	109.8	G710 T737 A738 Y739 D766	G710-K712 PolarHBondContact O-N 2.82Å; K712-T737 WeakPolarHBondContact CD-O 3.38Å; K712-A738 CarbonylContact C-O 3.57Å; K712-A738 VanDerWaalsContact CA-O 3.3Å; K712-A738 WeakPolarHBondContact CA-O 3.48Å; K712-A738 WeakPolarHBondContact CB-O 3.25Å; K712-Y739 HydrophobicContact CG-CD2 4.47Å; K712-D766 WeakPolarHBondContact CE-O 3.44Å; K712-D766 IonicContact NZ-OD1 3.85Å; K712-D766 PolarHBondContact NZ-OD1 2.82Å
713	M	81.1	Confident	76.7	Confident	84 Å²	84	35.9 Å²	35.9	41%	0.414	19%	0.191	S	C	.	.			trans	-88.2	-6.4	-176.7	-61.8	-57.1	-62.9	0	0	114.3	T681 N704 N708 K711	T681-M713 PolarHBondContact OG1-O 2.91Å; N704-M713 HydrophobicContact CB-CB 4.2Å; N708-M713 HydrophobicContact CB-CG 4.37Å; K711-M713 VanDerWaalsContact C-N 3.33Å; K711-M713 HydrophobicContact CB-CG 4.22Å; K711-M713 HydrophobicContact CB-SD 3.74Å; K711-M713 WeakPolarHBondContact O-CG 3.5Å; K711-M713 PolarHBondContact O-N 3.13Å
714	S	87.3	Confident	74.5	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	123.4	175.6	-57.3	0	0	0	0	109.5	T702 L703 N704 T737 A738 Y739	T702-S714 WeakPolarHBondContact O-CB 3.23Å; T702-S714 PolarHBondContact O-OG 2.84Å; L703-S714 WeakPolarHBondContact CA-OG 3.31Å; L703-S714 PolarHBondContact N-OG 3.11Å; N704-S714 PolarHBondContact N-OG 3.03Å; N704-S714 VanDerWaalsContact N-OG 3.14Å; S714-T737 CarbonylContact O-C 3.6Å; S714-T737 VanDerWaalsContact O-CA 3.31Å; S714-T737 WeakPolarHBondContact O-CA 3.4Å; S714-A738 VanDerWaalsContact CB-O 3.31Å; S714-A738 WeakPolarHBondContact CB-O 3.45Å; S714-A738 PolarHBondContact N-O 3.01Å; S714-A738 VanDerWaalsContact N-O 3.11Å; S714-A738 PolarHBondContact O-N 3.11Å; S714-Y739 WeakPolarHBondContact CB-O 3.49Å; S714-Y739 PolarHBondContact OG-O 2.7Å
715	V	87.8	Confident	72.3	Confident	80 Å²	80	46.5 Å²	46.5	49%	0.485	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	134	178	-170.1	0	0	0	0	109	T717 I736 T737 C741	V715-T717 HydrophobicContact CG1-CG2 4.33Å; V715-I736 WeakPolarHBondContact CA-O 3.11Å; V715-T737 HydrophobicContact CG2-CG2 4.27Å; V715-C741 VanDerWaalsContact C-SG 3.55Å
716	C	86.5	Confident	69.8	Low	4 Å²	4	51 Å²	51	3%	0.027	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.3	173	-67.4	0	0	0	0	109.7	S735 I736 C741 V743 P761	C716-S735 WeakPolarHBondContact O-CA 3.22Å; C716-I736 HydrophobicContact CB-CD1 4.25Å; C716-I736 HydrophobicContact CB-CG1 3.91Å; C716-I736 PolarHBondContact N-O 2.94Å; C716-I736 VanDerWaalsContact N-O 3.11Å; C716-I736 PolarHBondContact O-N 3.11Å; C716-C741 HydrophobicContact CB-CB 3.78Å; C716-C741 WeakPolarHBondContact CB-SG 3.35Å; C716-C741 PolarHBondContact N-SG 3.41Å; C716-C741 VanDerWaalsContact N-SG 3.42Å; C716-C741 WeakPolarHBondContact SG-CB 3.02Å; C716-C741 CovalentContact SG-SG 2.04Å; C716-C741 PolarHBondContact SG-SG 2.05Å; C716-V743 HydrophobicContact CB-CB 4.44Å; C716-P761 HydrophobicContact CB-CB 4.25Å
717	T	80.1	Confident	67.4	Low	62 Å²	62	60.9 Å²	60.9	38%	0.38	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.1	-170.2	49.8	0	0	0	0	112.3	V715 S758	V715-T717 HydrophobicContact CG1-CG2 4.33Å; T717-S758 PolarHBondContact O-OG 2.84Å
718	D	74.4	Confident	65.6	Low	18 Å²	18	63.9 Å²	63.9	10%	0.096	34%	0.34	C	S	.	.			trans	-80	129.8	160.4	-155.3	-58.3	0	0	0	109.2	V720 S733 K734 S758 S759 Q760 P761	D718-V720 WeakPolarHBondContact OD1-CB 3.38Å; D718-V720 VanDerWaalsContact OD1-CG2 3.27Å; D718-V720 WeakPolarHBondContact OD1-CG2 3.18Å; D718-V720 PolarHBondContact OD1-N 2.96Å; D718-S733 VanDerWaalsContact O-CB 3.26Å; D718-S733 WeakPolarHBondContact O-CB 3.25Å; D718-K734 HydrophobicContact CB-CB 4.27Å; D718-K734 PolarHBondContact N-O 2.84Å; D718-S758 WeakPolarHBondContact CA-O 3.15Å; D718-S759 VanDerWaalsContact OD2-CA 3.23Å; D718-S759 WeakPolarHBondContact OD2-CA 3.42Å; D718-S759 WeakPolarHBondContact OD2-CB 3.37Å; D718-S759 PolarHBondContact OD2-OG 3.34Å; D718-Q760 PolarHBondContact OD2-N 2.69Å; D718-P761 HydrophobicContact CB-CG 4.15Å
719	N	71.1	Confident	63.9	Low	36 Å²	36	66.3 Å²	66.3	19%	0.193	35%	0.349	C	S	.	.			trans	-122	6.4	-177.8	83.2	4.9	0	0	0	114.2	T721 D722 V757 S758	N719-T721 PolarHBondContact O-N 3.24Å; N719-D722 PolarHBondContact O-N 3.21Å; N719-V757 WeakPolarHBondContact OD1-CA 3.46Å; N719-V757 WeakPolarHBondContact OD1-CG1 3.39Å; N719-S758 VanDerWaalsContact CG-OG 3.27Å; N719-S758 PolarHBondContact N-O 3.43Å; N719-S758 PolarHBondContact ND2-OG 2.54Å; N719-S758 PolarHBondContact OD1-N 3.08Å; N719-S758 PolarHBondContact OD1-O 2.9Å
720	V	65.3	Low	61.9	Low	3 Å²	3	66 Å²	66	2%	0.018	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-27.3	-174.7	174.7	0	0	0	0	113	W220 D718 V757	W220-V720 HydrophobicContact CE3-CG1 4.36Å; W220-V720 HydrophobicContact CZ3-CG1 4.28Å; D718-V720 WeakPolarHBondContact OD1-CB 3.38Å; D718-V720 VanDerWaalsContact OD1-CG2 3.27Å; D718-V720 WeakPolarHBondContact OD1-CG2 3.18Å; D718-V720 PolarHBondContact OD1-N 2.96Å; V720-V757 HydrophobicContact CB-CG1 4.44Å; V720-V757 HydrophobicContact CG2-CG1 3.66Å
721	T	56.3	Low	60.4	Low	42 Å²	42	67.6 Å²	67.6	26%	0.258	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-4.8	-178.4	53.2	0	0	0	0	114.6	N719	N719-T721 PolarHBondContact O-N 3.24Å
722	D	51.6	Low	58.8	Low	37 Å²	37	69.2 Å²	69.2	20%	0.198	39%	0.386	C	S	.	.			trans	-117.1	17.5	-153.1	-153	9.8	0	0	0	115.3	N719 R724 I725 S733	N719-D722 PolarHBondContact O-N 3.21Å; D722-R724 PolarHBondContact O-N 2.7Å; D722-R724 VanDerWaalsContact O-N 3.11Å; D722-I725 VanDerWaalsContact OD1-CB 3.29Å; D722-I725 WeakPolarHBondContact OD1-CB 3.45Å; D722-I725 VanDerWaalsContact OD1-CD1 3.23Å; D722-I725 WeakPolarHBondContact OD1-CD1 3.08Å; D722-I725 WeakPolarHBondContact OD1-CG1 3.26Å; D722-S733 WeakPolarHBondContact OD2-CB 3.43Å; D722-S733 PolarHBondContact OD2-OG 2.89Å
723	L	50.3	Low	57.3	Low	60 Å²	60	68.1 Å²	68.1	31%	0.314	39%	0.385	S	S	.	.	S	Bend	trans	-73.2	1.4	-174.4	-75.3	170.6	0	0	0	115.7	W220 Y753	W220-L723 HydrophobicContact CZ2-CD1 4.46Å; L723-Y753 HydrophobicContact CD1-CE1 4.34Å
724	R	44.7	Very low	56.3	Low	176 Å²	176	71 Å²	71	66%	0.664	40%	0.395	S	S	*	.	S	Bend	trans	-150.8	7.4	-178.2	-78.2	-162.9	-178.2	-177.8	1	116.4	A215 D722	A215-R724 PolarHBondContact O-NH1 3.03Å; D722-R724 PolarHBondContact O-N 2.7Å; D722-R724 VanDerWaalsContact O-N 3.11Å
725	I	43.5	Very low	55.5	Low	49 Å²	49	74.6 Å²	74.6	25%	0.251	42%	0.42	S	S	.	.			trans	-69.2	127.5	179.2	-58.4	-170.1	0	0	0	109.2	D722 E729 F732	D722-I725 VanDerWaalsContact OD1-CB 3.29Å; D722-I725 WeakPolarHBondContact OD1-CB 3.45Å; D722-I725 VanDerWaalsContact OD1-CD1 3.23Å; D722-I725 WeakPolarHBondContact OD1-CD1 3.08Å; D722-I725 WeakPolarHBondContact OD1-CG1 3.26Å; I725-E729 HydrophobicContact CG2-CB 3.61Å; I725-F732 HydrophobicContact CD1-CB 4.29Å; I725-F732 HydrophobicContact CD1-CD2 3.96Å; I725-F732 HydrophobicContact CD1-CG 4.49Å
726	P	35.9	Very low	55	Low	94 Å²	94	72.5 Å²	72.5	61%	0.61	41%	0.406	S	S	*	.			trans	-68.4	150.5	-179.2	27.5	-34.4	0	0	0	111.9	G728 E729	P726-G728 PolarHBondContact O-N 3.45Å; P726-E729 PolarHBondContact O-N 3.04Å
727	E	36.3	Very low	54.8	Low	210 Å²	210	75.9 Å²	75.9	98%	0.981	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	92.8	-179.3	-65.9	-172.9	153.3	0	0	111.6
728	G	38.9	Very low	55.2	Low	75 Å²	75	72.9 Å²	72.9	77%	0.773	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	162.6	-34.9	-173.9	0	0	0	0	0	112.8	P726	P726-G728 PolarHBondContact O-N 3.45Å
729	E	39.6	Very low	56	Low	127 Å²	127	72.7 Å²	72.7	59%	0.593	41%	0.407	S	S	*	.			trans	-106.6	24.6	177.7	-66.6	-165.5	167.7	0	0	113.5	I725 P726 G731	I725-E729 HydrophobicContact CG2-CB 3.61Å; P726-E729 PolarHBondContact O-N 3.04Å; E729-G731 PolarHBondContact O-N 3.11Å
730	A	35.2	Very low	57	Low	83 Å²	83	71 Å²	71	69%	0.686	40%	0.397	S	S	*	.			trans	-71.1	61	-179.8	0	0	0	0	0	113.2
731	G	41.7	Very low	58.3	Low	38 Å²	38	70.9 Å²	70.9	39%	0.392	40%	0.396	S	S	.	.			trans	-127.2	5.7	-179.9	0	0	0	0	0	114.6	E729	E729-G731 PolarHBondContact O-N 3.11Å
732	F	44	Very low	59.9	Low	122 Å²	122	69 Å²	69	54%	0.535	39%	0.385	S	S	.	.	S	Bend	trans	-106.9	-26.1	-175.7	-68	-75.7	0	0	0	114.4	I725 K734	I725-F732 HydrophobicContact CD1-CB 4.29Å; I725-F732 HydrophobicContact CD1-CD2 3.96Å; I725-F732 HydrophobicContact CD1-CG 4.49Å; F732-K734 PolarHBondContact O-N 3.01Å
733	S	51.4	Low	61.7	Low	31 Å²	31	67.6 Å²	67.6	22%	0.217	38%	0.378	C	S	.	.	S	Bend	trans	-70.6	120	172.5	29	0	0	0	0	110.9	D718 D722 S735	D718-S733 VanDerWaalsContact O-CB 3.26Å; D718-S733 WeakPolarHBondContact O-CB 3.25Å; D722-S733 WeakPolarHBondContact OD2-CB 3.43Å; D722-S733 PolarHBondContact OD2-OG 2.89Å; S733-S735 PolarHBondContact O-N 2.95Å
734	K	60.7	Low	63.3	Low	143 Å²	143	65 Å²	65	62%	0.622	36%	0.364	S	S	*	.			trans	-68	108.3	174.2	-168.7	171	-174.9	173.2	0	108.2	D718 F732 P761	D718-K734 HydrophobicContact CB-CB 4.27Å; D718-K734 PolarHBondContact N-O 2.84Å; F732-K734 PolarHBondContact O-N 3.01Å; K734-P761 HydrophobicContact CG-CG 4.46Å
735	S	70.4	Confident	65.1	Low	76 Å²	76	58 Å²	58	53%	0.531	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	146.1	179.7	59.2	0	0	0	0	110.6	C716 S733	C716-S735 WeakPolarHBondContact O-CA 3.22Å; S733-S735 PolarHBondContact O-N 2.95Å
736	I	77.3	Confident	66.7	Low	36 Å²	36	56.4 Å²	56.4	19%	0.185	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	151.1	176.6	64.5	174.8	0	0	0	110	V715 C716 C741 P761 V762	V715-I736 WeakPolarHBondContact CA-O 3.11Å; C716-I736 HydrophobicContact CB-CD1 4.25Å; C716-I736 HydrophobicContact CB-CG1 3.91Å; C716-I736 PolarHBondContact N-O 2.94Å; C716-I736 VanDerWaalsContact N-O 3.11Å; C716-I736 PolarHBondContact O-N 3.11Å; I736-C741 HydrophobicContact CD1-CB 3.83Å; I736-C741 HydrophobicContact CG1-CB 4.21Å; I736-P761 HydrophobicContact CD1-CB 3.92Å; I736-P761 HydrophobicContact CG1-CB 4.01Å; I736-V762 VanDerWaalsContact CD1-N 3.35Å; I736-V762 WeakPolarHBondContact CD1-O 3.11Å
737	T	82.9	Confident	68.6	Low	75 Å²	75	52.5 Å²	52.5	46%	0.46	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.1	173.3	68.5	0	0	0	0	110.2	K712 S714 V715	K712-T737 WeakPolarHBondContact CD-O 3.38Å; S714-T737 CarbonylContact O-C 3.6Å; S714-T737 VanDerWaalsContact O-CA 3.31Å; S714-T737 WeakPolarHBondContact O-CA 3.4Å; V715-T737 HydrophobicContact CG2-CG2 4.27Å
738	A	88.6	Confident	70	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	177.1	-173.9	0	0	0	0	0	112	K712 S714 V740 C741	K712-A738 CarbonylContact C-O 3.57Å; K712-A738 VanDerWaalsContact CA-O 3.3Å; K712-A738 WeakPolarHBondContact CA-O 3.48Å; K712-A738 WeakPolarHBondContact CB-O 3.25Å; S714-A738 VanDerWaalsContact CB-O 3.31Å; S714-A738 WeakPolarHBondContact CB-O 3.45Å; S714-A738 PolarHBondContact N-O 3.01Å; S714-A738 VanDerWaalsContact N-O 3.11Å; S714-A738 PolarHBondContact O-N 3.11Å; A738-V740 VanDerWaalsContact CB-O 3.28Å; A738-V740 WeakPolarHBondContact CB-O 3.19Å; A738-C741 HydrophobicContact CB-CB 3.96Å
739	Y	90.1	Very high	71	Confident	14 Å²	14	47.1 Å²	47.1	6%	0.055	27%	0.265	C	S	.	.	S	Bend	trans	-76.3	-43.1	154	-73.7	-92.3	0	0	0	110.3	L703 N704 G710 K712 S714 A765 D766 F801	L703-Y739 CarbonylContact C-O 3.4Å; L703-Y739 WeakPolarHBondContact CA-O 3.2Å; N704-Y739 PolarHBondContact N-O 2.81Å; G710-Y739 PolarHBondContact O-OH 2.75Å; K712-Y739 HydrophobicContact CG-CD2 4.47Å; S714-Y739 WeakPolarHBondContact CB-O 3.49Å; S714-Y739 PolarHBondContact OG-O 2.7Å; Y739-A765 WeakPolarHBondContact CB-O 3.46Å; Y739-A765 PolarHBondContact N-O 2.92Å; Y739-D766 WeakPolarHBondContact CE2-O 3.47Å; Y739-F801 HydrophobicContact CD1-CD1 4.31Å; Y739-F801 AromaticContact CD1-CE1 3.59Å; Y739-F801 HydrophobicContact CD1-CE1 3.59Å; Y739-F801 HydrophobicContact CD1-CZ 4.43Å; Y739-F801 HydrophobicContact CD2-CD1 4.33Å; Y739-F801 HydrophobicContact CD2-CE1 4.4Å; Y739-F801 HydrophobicContact CE1-CE1 4.2Å; Y739-F801 AromaticContact CG-CD1 3.96Å; Y739-F801 HydrophobicContact CG-CD1 3.96Å; Y739-F801 AromaticContact CG-CE1 3.69Å; Y739-F801 HydrophobicContact CG-CE1 3.69Å
740	V	92.6	Very high	71.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	125.7	174.2	-177	0	0	0	0	109	T702 L703 A738 L764 A765 T816 I818 F850	T702-V740 WeakPolarHBondContact O-CA 3.45Å; L703-V740 HydrophobicContact CB-CG2 4.16Å; L703-V740 HydrophobicContact CD2-CG1 4.15Å; L703-V740 HydrophobicContact CD2-CG2 4.07Å; L703-V740 HydrophobicContact CG-CG1 4.05Å; L703-V740 HydrophobicContact CG-CG2 4.16Å; A738-V740 VanDerWaalsContact CB-O 3.28Å; A738-V740 WeakPolarHBondContact CB-O 3.19Å; V740-L764 HydrophobicContact CB-CB 4.31Å; V740-L764 HydrophobicContact CG1-CB 4.08Å; V740-L764 HydrophobicContact CG1-CD1 4.14Å; V740-L764 PolarHBondContact O-N 2.87Å; V740-A765 HydrophobicContact CB-CB 3.8Å; V740-A765 HydrophobicContact CG2-CB 4.07Å; V740-A765 PolarHBondContact O-N 3.49Å; V740-A765 VanDerWaalsContact O-N 3.11Å; V740-T816 HydrophobicContact CB-CG2 4.41Å; V740-T816 HydrophobicContact CG2-CG2 4.08Å; V740-I818 HydrophobicContact CG2-CD1 4.04Å; V740-F850 HydrophobicContact CG1-CE2 4.3Å; V740-F850 HydrophobicContact CG1-CZ 4.33Å
741	C	91.9	Very high	72.4	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	158.7	172	63.5	0	0	0	0	110.9	F701 T702 V715 C716 I736 A738 V762	F701-C741 WeakPolarHBondContact CA-O 3.47Å; T702-C741 PolarHBondContact N-O 3.14Å; T702-C741 PolarHBondContact O-N 2.81Å; V715-C741 VanDerWaalsContact C-SG 3.55Å; C716-C741 HydrophobicContact CB-CB 3.78Å; C716-C741 WeakPolarHBondContact CB-SG 3.35Å; C716-C741 PolarHBondContact N-SG 3.41Å; C716-C741 VanDerWaalsContact N-SG 3.42Å; C716-C741 WeakPolarHBondContact SG-CB 3.02Å; C716-C741 CovalentContact SG-SG 2.04Å; C716-C741 PolarHBondContact SG-SG 2.05Å; I736-C741 HydrophobicContact CD1-CB 3.83Å; I736-C741 HydrophobicContact CG1-CB 4.21Å; A738-C741 HydrophobicContact CB-CB 3.96Å; C741-V762 WeakPolarHBondContact CA-O 3.06Å
742	Q	90.4	Very high	72.9	Confident	4 Å²	4	41.3 Å²	41.3	2%	0.019	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147.4	179.9	179.8	-179.7	6.2	0	0	109.4	H699 H700 F701 P761 V762 L764	H699-Q742 HydrophobicContact CB-CG 4.39Å; H699-Q742 PolarHBondContact ND1-NE2 2.77Å; H699-Q742 VanDerWaalsContact ND1-NE2 3.12Å; H700-Q742 CarbonylContact O-C 3.53Å; H700-Q742 WeakPolarHBondContact O-CA 3.06Å; F701-Q742 HydrophobicContact CD1-CB 3.93Å; F701-Q742 HydrophobicContact CD1-CG 3.94Å; F701-Q742 HydrophobicContact CE1-CB 4.01Å; F701-Q742 VanDerWaalsContact CE1-CD 3.48Å; F701-Q742 HydrophobicContact CE1-CG 3.62Å; F701-Q742 HydrophobicContact CZ-CG 4.28Å; Q742-P761 CarbonylContact O-C 3.56Å; Q742-P761 WeakPolarHBondContact O-CA 3.39Å; Q742-V762 PolarHBondContact N-O 2.88Å; Q742-V762 PolarHBondContact O-N 2.92Å; Q742-L764 HydrophobicContact CB-CD1 3.84Å; Q742-L764 HydrophobicContact CB-CG 4.12Å
743	V	88.6	Confident	73.4	Confident	7 Å²	7	40.7 Å²	40.7	4%	0.042	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.2	168.4	70.5	0	0	0	0	109.3	H700 C716 I745 S759	H700-V743 HydrophobicContact CB-CG1 4.01Å; H700-V743 PolarHBondContact N-O 2.85Å; H700-V743 PolarHBondContact O-N 2.99Å; C716-V743 HydrophobicContact CB-CB 4.44Å; V743-I745 HydrophobicContact CG1-CD1 4.46Å; V743-I745 HydrophobicContact CG1-CG1 4.12Å; V743-S759 WeakPolarHBondContact CG2-O 3.49Å
744	V	85.2	Confident	73.3	Confident	5 Å²	5	49 Å²	49	3%	0.03	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	126.3	171.3	-179	0	0	0	0	108.1	Y697 S758 S759 Q760	Y697-V744 HydrophobicContact CD2-CG1 3.97Å; Y697-V744 HydrophobicContact CG-CG1 4.34Å; V744-S758 CarbonylContact O-C 3.52Å; V744-S758 WeakPolarHBondContact O-CA 3.19Å; V744-S759 WeakPolarHBondContact CB-O 3.44Å; V744-S759 PolarHBondContact N-O 2.89Å; V744-S759 PolarHBondContact O-N 2.81Å; V744-Q760 HydrophobicContact CG2-CB 4.29Å
745	I	83.1	Confident	73.2	Confident	30 Å²	30	44.5 Å²	44.5	15%	0.154	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	126.9	172.1	-58.1	-173.1	0	0	0	109.9	Y697 F698 H700 V743 V757	Y697-I745 WeakPolarHBondContact CA-O 3.39Å; F698-I745 HydrophobicContact CD2-CB 4.22Å; F698-I745 HydrophobicContact CE1-CB 4.07Å; F698-I745 HydrophobicContact CE1-CG2 3.83Å; F698-I745 HydrophobicContact CE2-CB 3.76Å; F698-I745 HydrophobicContact CE2-CD1 3.99Å; F698-I745 HydrophobicContact CE2-CG1 4.28Å; F698-I745 HydrophobicContact CE2-CG2 4.07Å; F698-I745 HydrophobicContact CZ-CB 3.68Å; F698-I745 HydrophobicContact CZ-CD1 4.31Å; F698-I745 HydrophobicContact CZ-CG2 3.48Å; F698-I745 VanDerWaalsContact CZ-CG2 3.48Å; F698-I745 PolarHBondContact N-O 3.11Å; F698-I745 PolarHBondContact O-N 2.91Å; H700-I745 HydrophobicContact CB-CD1 3.47Å; H700-I745 VanDerWaalsContact CB-CD1 3.47Å; H700-I745 HydrophobicContact CB-CG1 3.81Å; V743-I745 HydrophobicContact CG1-CD1 4.46Å; V743-I745 HydrophobicContact CG1-CG1 4.12Å; I745-V757 WeakPolarHBondContact CA-O 3.42Å
746	I	77.1	Confident	72.9	Confident	14 Å²	14	42.3 Å²	42.3	7%	0.072	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121	170.7	-55.3	177	0	0	0	107.2	I201 F249 V750 T751 G756 V757	I201-I746 HydrophobicContact CD1-CD1 4.42Å; F249-I746 HydrophobicContact CB-CD1 4.45Å; F249-I746 HydrophobicContact CD1-CD1 4.1Å; F249-I746 HydrophobicContact CD2-CD1 4.01Å; F249-I746 HydrophobicContact CE1-CD1 4.31Å; F249-I746 HydrophobicContact CE2-CD1 4.22Å; F249-I746 HydrophobicContact CG-CD1 3.95Å; F249-I746 HydrophobicContact CZ-CD1 4.35Å; I746-V750 HydrophobicContact CG2-CB 3.97Å; I746-V750 HydrophobicContact CG2-CG1 4.1Å; I746-T751 HydrophobicContact CG2-CG2 3.81Å; I746-G756 VanDerWaalsContact O-CA 3.24Å; I746-G756 WeakPolarHBondContact O-CA 3.46Å; I746-V757 HydrophobicContact CB-CB 4.5Å; I746-V757 PolarHBondContact N-O 2.04Å; I746-V757 PolarHBondContact O-N 2.81Å
747	P	75.1	Confident	72.7	Confident	12 Å²	12	40.8 Å²	40.8	8%	0.078	24%	0.235	C	C	.	.			trans	-60.1	148.5	179.8	-19	29.8	0	0	0	112.2	K696 F698 E749 V750	K696-P747 HydrophobicContact CD-CG 4.11Å; K696-P747 HydrophobicContact CG-CG 4.05Å; K696-P747 WeakPolarHBondContact O-CD 3.37Å; F698-P747 HydrophobicContact CD1-CG 4.32Å; F698-P747 HydrophobicContact CE1-CG 4.15Å; P747-E749 HydrophobicContact CB-CB 4.36Å; P747-E749 PolarHBondContact O-N 2.78Å; P747-V750 HydrophobicContact CB-CG2 4.23Å; P747-V750 HydrophobicContact CG-CG2 4.23Å; P747-V750 WeakPolarHBondContact O-CB 3.23Å; P747-V750 PolarHBondContact O-N 3.03Å
748	S	64.9	Low	72.4	Confident	39 Å²	39	37.8 Å²	37.8	27%	0.273	22%	0.217	S	C	.	.	H	α-helix	trans	-66.4	-22.4	-179.9	70.1	0	0	0	0	113.6	V750 T751 G752 Y753 A755	S748-V750 PolarHBondContact O-N 3.08Å; S748-T751 PolarHBondContact O-N 2.85Å; S748-T751 PolarHBondContact O-OG1 2.73Å; S748-G752 PolarHBondContact O-N 3.15Å; S748-Y753 VanDerWaalsContact CB-O 3.3Å; S748-Y753 WeakPolarHBondContact CB-O 2.96Å; S748-Y753 PolarHBondContact O-N 3.48Å; S748-A755 VanDerWaalsContact CB-C 3.45Å; S748-A755 VanDerWaalsContact CB-O 3.32Å; S748-A755 WeakPolarHBondContact CB-O 3.22Å
749	E	59.8	Low	71.8	Confident	134 Å²	134	37.8 Å²	37.8	63%	0.626	22%	0.218	S	C	*	.	H	α-helix	trans	-53.1	-37.2	167	-59	161.2	168.3	0	0	111.8	K696 P747	K696-E749 IonicContact NZ-OE1 2.83Å; K696-E749 IonicContact NZ-OE2 3.63Å; K696-E749 PolarHBondContact NZ-OE2 2.86Å; P747-E749 HydrophobicContact CB-CB 4.36Å; P747-E749 PolarHBondContact O-N 2.78Å
750	V	53.7	Low	71.2	Confident	25 Å²	25	39.9 Å²	39.9	15%	0.152	23%	0.228	C	C	.	.	H	α-helix	trans	-90.2	-13.9	-174.8	-170.8	0	0	0	0	111.7	L141 L695 K696 I746 P747 S748	L141-V750 HydrophobicContact CD1-CG1 3.87Å; L141-V750 WeakPolarHBondContact CD2-O 3.43Å; L695-V750 HydrophobicContact CD2-CG1 4.45Å; K696-V750 HydrophobicContact CB-CG2 4.24Å; I746-V750 HydrophobicContact CG2-CB 3.97Å; I746-V750 HydrophobicContact CG2-CG1 4.1Å; P747-V750 HydrophobicContact CB-CG2 4.23Å; P747-V750 HydrophobicContact CG-CG2 4.23Å; P747-V750 WeakPolarHBondContact O-CB 3.23Å; P747-V750 PolarHBondContact O-N 3.03Å; S748-V750 PolarHBondContact O-N 3.08Å
751	T	51.6	Low	70.8	Confident	26 Å²	26	40.8 Å²	40.8	16%	0.16	23%	0.234	C	C	.	.	H	α-helix	trans	-111.7	-9.1	-179.7	63.8	0	0	0	0	114.1	I746 S748 V757	I746-T751 HydrophobicContact CG2-CG2 3.81Å; S748-T751 PolarHBondContact O-N 2.85Å; S748-T751 PolarHBondContact O-OG1 2.73Å; T751-V757 HydrophobicContact CG2-CG2 4.03Å
752	G	52.2	Low	70.4	Confident	75 Å²	75	42.1 Å²	42.1	77%	0.773	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.6	29.4	-177.8	0	0	0	0	0	113.8	S748	S748-G752 PolarHBondContact O-N 3.15Å
753	Y	53.7	Low	70.3	Confident	108 Å²	108	42.2 Å²	42.2	42%	0.424	24%	0.243	S	C	.	.	S	Bend	trans	-121.3	-179.8	-174.7	-149.3	-110.4	0	0	0	113.3	L723 S748	L723-Y753 HydrophobicContact CD1-CE1 4.34Å; S748-Y753 VanDerWaalsContact CB-O 3.3Å; S748-Y753 WeakPolarHBondContact CB-O 2.96Å; S748-Y753 PolarHBondContact O-N 3.48Å
754	K	50.3	Low	70.3	Confident	206 Å²	206	41.9 Å²	41.9	90%	0.896	24%	0.241	S	C	*	.	S	Bend	trans	-89.5	-5.9	177.4	-70	-173.8	177	-179.4	0	114.7
755	A	57.3	Low	70.5	Confident	48 Å²	48	41.7 Å²	41.7	40%	0.397	24%	0.24	S	C	.	.	S	Bend	trans	-146.9	151.1	-177.5	0	0	0	0	0	110	S748	S748-A755 VanDerWaalsContact CB-C 3.45Å; S748-A755 VanDerWaalsContact CB-O 3.32Å; S748-A755 WeakPolarHBondContact CB-O 3.22Å
756	G	64.1	Low	70.6	Confident	30 Å²	30	41.1 Å²	41.1	31%	0.309	24%	0.237	S	C	.	.			trans	-75.6	151.2	177.5	0	0	0	0	0	112.3	I746	I746-G756 VanDerWaalsContact O-CA 3.24Å; I746-G756 WeakPolarHBondContact O-CA 3.46Å
757	V	73.5	Confident	71.1	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.024	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	131.9	176.8	177	0	0	0	0	108.6	W220 N719 V720 I745 I746 T751	W220-V757 HydrophobicContact CH2-CG2 4.23Å; N719-V757 WeakPolarHBondContact OD1-CA 3.46Å; N719-V757 WeakPolarHBondContact OD1-CG1 3.39Å; V720-V757 HydrophobicContact CB-CG1 4.44Å; V720-V757 HydrophobicContact CG2-CG1 3.66Å; I745-V757 WeakPolarHBondContact CA-O 3.42Å; I746-V757 HydrophobicContact CB-CB 4.5Å; I746-V757 PolarHBondContact N-O 2.04Å; I746-V757 PolarHBondContact O-N 2.81Å; T751-V757 HydrophobicContact CG2-CG2 4.03Å
758	S	76.9	Confident	71.8	Confident	12 Å²	12	45.3 Å²	45.3	8%	0.084	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	129.7	175.9	65.8	0	0	0	0	110.3	T717 D718 N719 V744	T717-S758 PolarHBondContact O-OG 2.84Å; D718-S758 WeakPolarHBondContact CA-O 3.15Å; N719-S758 VanDerWaalsContact CG-OG 3.27Å; N719-S758 PolarHBondContact N-O 3.43Å; N719-S758 PolarHBondContact ND2-OG 2.54Å; N719-S758 PolarHBondContact OD1-N 3.08Å; N719-S758 PolarHBondContact OD1-O 2.9Å; V744-S758 CarbonylContact O-C 3.52Å; V744-S758 WeakPolarHBondContact O-CA 3.19Å
759	S	76.7	Confident	73	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.007	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	165.8	178	-167.2	0	0	0	0	112.4	D718 V743 V744	D718-S759 VanDerWaalsContact OD2-CA 3.23Å; D718-S759 WeakPolarHBondContact OD2-CA 3.42Å; D718-S759 WeakPolarHBondContact OD2-CB 3.37Å; D718-S759 PolarHBondContact OD2-OG 3.34Å; V743-S759 WeakPolarHBondContact CG2-O 3.49Å; V744-S759 WeakPolarHBondContact CB-O 3.44Å; V744-S759 PolarHBondContact N-O 2.89Å; V744-S759 PolarHBondContact O-N 2.81Å
760	Q	76.5	Confident	74.5	Confident	57 Å²	57	37.4 Å²	37.4	27%	0.266	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	59.2	61.6	178.9	-51.1	179.6	13.4	0	0	112.7	D718 V744 V762	D718-Q760 PolarHBondContact OD2-N 2.69Å; V744-Q760 HydrophobicContact CG2-CB 4.29Å; Q760-V762 PolarHBondContact O-N 2.75Å
761	P	84.3	Confident	76.4	Confident	20 Å²	20	36.2 Å²	36.2	13%	0.13	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	128.9	171.7	28	-34.5	0	0	0	111.1	C716 D718 K734 I736 Q742	C716-P761 HydrophobicContact CB-CB 4.25Å; D718-P761 HydrophobicContact CB-CG 4.15Å; K734-P761 HydrophobicContact CG-CG 4.46Å; I736-P761 HydrophobicContact CD1-CB 3.92Å; I736-P761 HydrophobicContact CG1-CB 4.01Å; Q742-P761 CarbonylContact O-C 3.56Å; Q742-P761 WeakPolarHBondContact O-CA 3.39Å
762	V	84.3	Confident	78.2	Confident	28 Å²	28	35.6 Å²	35.6	17%	0.17	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	134.2	-176.9	175.2	0	0	0	0	111.2	I736 C741 Q742 Q760 L764 R814	I736-V762 VanDerWaalsContact CD1-N 3.35Å; I736-V762 WeakPolarHBondContact CD1-O 3.11Å; C741-V762 WeakPolarHBondContact CA-O 3.06Å; Q742-V762 PolarHBondContact N-O 2.88Å; Q742-V762 PolarHBondContact O-N 2.92Å; Q760-V762 PolarHBondContact O-N 2.75Å; V762-L764 HydrophobicContact CG1-CD2 4.06Å; V762-R814 VanDerWaalsContact CG1-NH1 3.35Å
763	S	87.3	Confident	79.9	Confident	6 Å²	6	34 Å²	34	4%	0.042	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	134	171.4	-169	0	0	0	0	110.9	D766 S803 D805	S763-D766 VanDerWaalsContact OG-CG 3.29Å; S763-D766 PolarHBondContact OG-OD1 3.47Å; S763-D766 PolarHBondContact OG-OD2 2.95Å; S763-S803 PolarHBondContact OG-OG 3.11Å; S763-D805 WeakPolarHBondContact CB-OD2 3.04Å
764	L	89.4	Confident	81.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	-17.2	175.5	-57.8	-174.5	0	0	0	112.8	F701 V740 Q742 V762 T816 F848	F701-L764 HydrophobicContact CD1-CD1 3.85Å; F701-L764 HydrophobicContact CE1-CD1 3.9Å; V740-L764 HydrophobicContact CB-CB 4.31Å; V740-L764 HydrophobicContact CG1-CB 4.08Å; V740-L764 HydrophobicContact CG1-CD1 4.14Å; V740-L764 PolarHBondContact O-N 2.87Å; Q742-L764 HydrophobicContact CB-CD1 3.84Å; Q742-L764 HydrophobicContact CB-CG 4.12Å; V762-L764 HydrophobicContact CG1-CD2 4.06Å; L764-T816 WeakPolarHBondContact CB-OG1 3.04Å; L764-T816 PolarHBondContact O-OG1 3.02Å; L764-F848 HydrophobicContact CD1-CD1 3.69Å; L764-F848 HydrophobicContact CD1-CD2 4.47Å; L764-F848 HydrophobicContact CD1-CE1 3.89Å; L764-F848 HydrophobicContact CD1-CG 4Å; L764-F848 HydrophobicContact CD1-CZ 4.38Å; L764-F848 HydrophobicContact CD2-CD1 4.41Å; L764-F848 HydrophobicContact CD2-CD2 4.02Å; L764-F848 HydrophobicContact CD2-CE1 4.09Å; L764-F848 HydrophobicContact CD2-CE2 3.71Å; L764-F848 HydrophobicContact CD2-CG 4.38Å; L764-F848 HydrophobicContact CD2-CZ 3.73Å
765	A	89.3	Confident	83.1	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	106	-178.9	0	0	0	0	0	111.8	Y739 V740 F801	Y739-A765 WeakPolarHBondContact CB-O 3.46Å; Y739-A765 PolarHBondContact N-O 2.92Å; V740-A765 HydrophobicContact CB-CB 3.8Å; V740-A765 HydrophobicContact CG2-CB 4.07Å; V740-A765 PolarHBondContact O-N 3.49Å; V740-A765 VanDerWaalsContact O-N 3.11Å; A765-F801 HydrophobicContact CB-CB 3.44Å; A765-F801 VanDerWaalsContact CB-CB 3.44Å; A765-F801 HydrophobicContact CB-CD1 4.18Å; A765-F801 HydrophobicContact CB-CG 3.9Å
766	D	85.6	Confident	84.6	Confident	19 Å²	19	30.3 Å²	30.3	10%	0.102	17%	0.166	C	C	.	.	S	Bend	trans	-98.4	-31.4	176.9	-73.5	-73.5	0	0	0	112.7	K712 Y739 S763 R802 S803 N804	K712-D766 WeakPolarHBondContact CE-O 3.44Å; K712-D766 IonicContact NZ-OD1 3.85Å; K712-D766 PolarHBondContact NZ-OD1 2.82Å; Y739-D766 WeakPolarHBondContact CE2-O 3.47Å; S763-D766 VanDerWaalsContact OG-CG 3.29Å; S763-D766 PolarHBondContact OG-OD1 3.47Å; S763-D766 PolarHBondContact OG-OD2 2.95Å; D766-R802 PolarHBondContact N-O 2.04Å; D766-S803 VanDerWaalsContact OD2-CA 3.23Å; D766-S803 WeakPolarHBondContact OD2-CA 3.49Å; D766-S803 WeakPolarHBondContact OD2-CB 3.09Å; D766-S803 PolarHBondContact OD2-OG 3.35Å; D766-N804 HydrophobicContact CB-CB 4.45Å; D766-N804 PolarHBondContact OD2-N 2.95Å
767	R	85.8	Confident	85.8	Confident	110 Å²	110	30.4 Å²	30.4	42%	0.415	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	133.8	-176.6	175.1	175.8	170.1	-157.3	-7.3	111.2	I769 F801 R802	R767-I769 HydrophobicContact CG-CD1 4.47Å; R767-F801 VanDerWaalsContact O-CA 3.27Å; R767-F801 WeakPolarHBondContact O-CA 3.43Å; R767-R802 PolarHBondContact N-O 2.62Å; R767-R802 PolarHBondContact O-N 2.87Å
768	L	90	Very high	86.1	Confident	3 Å²	3	36 Å²	36	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.9	163.9	-177.2	66.6	0	0	0	109.6	T645 N656 F799 F801	T645-L768 HydrophobicContact CG2-CD2 3.48Å; T645-L768 VanDerWaalsContact CG2-CD2 3.48Å; T645-L768 HydrophobicContact CG2-CG 3.97Å; N656-L768 HydrophobicContact CB-CD2 3.96Å; L768-F799 HydrophobicContact CD1-CB 4.42Å; L768-F799 HydrophobicContact CD1-CD1 4.02Å; L768-F801 HydrophobicContact CB-CD1 3.99Å; L768-F801 HydrophobicContact CB-CE1 3.98Å; L768-F801 HydrophobicContact CD1-CD1 3.86Å; L768-F801 HydrophobicContact CD1-CE1 3.55Å; L768-F801 HydrophobicContact CD1-CE2 4.32Å; L768-F801 HydrophobicContact CD1-CG 4.36Å; L768-F801 HydrophobicContact CD1-CZ 3.81Å; L768-F801 HydrophobicContact CG-CE1 4.31Å
769	I	90.4	Very high	86.3	Confident	8 Å²	8	39 Å²	39	4%	0.041	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-45.5	175.2	-57.8	-57.8	0	0	0	109.9	G642 R767 L777 E778 I780 F800 R802	G642-I769 WeakPolarHBondContact CA-O 3.11Å; R767-I769 HydrophobicContact CG-CD1 4.47Å; I769-L777 HydrophobicContact CG2-CD2 4.07Å; I769-L777 HydrophobicContact CG2-CG 4.26Å; I769-E778 HydrophobicContact CG2-CB 4.06Å; I769-E778 HydrophobicContact CG2-CG 3.86Å; I769-E778 WeakPolarHBondContact CG2-OE2 3.01Å; I769-I780 HydrophobicContact CG1-CD1 4.16Å; I769-F800 HydrophobicContact CB-CB 4.27Å; I769-F800 WeakPolarHBondContact CB-O 3.48Å; I769-F800 PolarHBondContact N-O 3.09Å; I769-R802 HydrophobicContact CD1-CB 4.05Å; I769-R802 HydrophobicContact CG1-CB 4.12Å
770	G	91.4	Very high	86.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175	178.5	177.8	0	0	0	0	0	113.4	P643 F800	P643-G770 CarbonylContact O-C 3.43Å; P643-G770 WeakPolarHBondContact O-CA 3.31Å; G770-F800 PolarHBondContact N-O 2.8Å; G770-F800 PolarHBondContact O-N 2.04Å
771	V	92.8	Very high	87.3	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	122.1	176	-174.3	0	0	0	0	107.8	P643 T645 N656 F660 I797 V798 F799	P643-V771 CarbonylContact C-O 3.58Å; P643-V771 PolarHBondContact O-N 3.3Å; T645-V771 HydrophobicContact CG2-CG2 4.44Å; N656-V771 HydrophobicContact CB-CG2 4.29Å; F660-V771 HydrophobicContact CD2-CB 4.15Å; F660-V771 HydrophobicContact CD2-CG1 3.77Å; F660-V771 HydrophobicContact CE2-CB 4.14Å; F660-V771 HydrophobicContact CE2-CG1 3.87Å; F660-V771 WeakPolarHBondContact CE2-O 3.47Å; F660-V771 HydrophobicContact CG-CG1 4.3Å; F660-V771 HydrophobicContact CZ-CG1 4.46Å; V771-I797 HydrophobicContact CG1-CG2 3.45Å; V771-I797 VanDerWaalsContact CG1-CG2 3.45Å; V771-V798 WeakPolarHBondContact CA-O 3.41Å; V771-F799 HydrophobicContact CB-CE2 4.49Å; V771-F799 HydrophobicContact CG1-CD2 3.8Å; V771-F799 HydrophobicContact CG1-CE2 3.61Å; V771-F799 HydrophobicContact CG1-CG 4.39Å; V771-F799 HydrophobicContact CG1-CZ 4.09Å; V771-F799 HydrophobicContact CG2-CD1 3.64Å; V771-F799 HydrophobicContact CG2-CD2 4.07Å; V771-F799 HydrophobicContact CG2-CE1 3.62Å; V771-F799 HydrophobicContact CG2-CE2 4.02Å; V771-F799 HydrophobicContact CG2-CG 3.86Å; V771-F799 HydrophobicContact CG2-CZ 3.8Å
772	S	91.1	Very high	87.3	Confident	12 Å²	12	39.9 Å²	39.9	8%	0.084	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	165.5	175.1	-165.7	0	0	0	0	111.8	D774 V798	S772-D774 PolarHBondContact OG-N 3.27Å; S772-D774 VanDerWaalsContact OG-N 3.14Å; S772-D774 PolarHBondContact OG-OD2 3.13Å; S772-V798 PolarHBondContact N-O 2.04Å; S772-V798 PolarHBondContact O-N 3.02Å
773	T	87.9	Confident	87.3	Confident	41 Å²	41	40.7 Å²	40.7	25%	0.252	23%	0.229	S	C	.	.	S	Bend	trans	-85.7	-11.4	162.9	49.7	0	0	0	0	112.7	L662 P795 I797	L662-T773 HydrophobicContact CD1-CG2 3.99Å; L662-T773 HydrophobicContact CD2-CG2 3.83Å; T773-P795 HydrophobicContact CG2-CB 3.92Å; T773-P795 HydrophobicContact CG2-CG 3.75Å; T773-I797 HydrophobicContact CG2-CG1 4.21Å
774	D	86.5	Confident	86.8	Confident	97 Å²	97	42.5 Å²	42.5	52%	0.519	24%	0.244	S	C	.	.	S	Bend	trans	-73	143.9	176.1	-52.4	-56.6	0	0	0	110.7	S772 T776 F800	S772-D774 PolarHBondContact OG-N 3.27Å; S772-D774 VanDerWaalsContact OG-N 3.14Å; S772-D774 PolarHBondContact OG-OD2 3.13Å; D774-T776 PolarHBondContact O-N 3.48Å; D774-F800 WeakPolarHBondContact O-CZ 3.31Å
775	M	84.4	Confident	86.3	Confident	102 Å²	102	50.7 Å²	50.7	50%	0.502	28%	0.282	S	S	.	.	S	Bend	trans	-75.3	-3.5	-179.8	-65.9	-178.6	-70.3	0	0	114	S782 A784	M775-S782 PolarHBondContact O-N 2.79Å; M775-A784 HydrophobicContact SD-CB 3.76Å
776	T	88.1	Confident	85.9	Confident	86 Å²	86	51.7 Å²	51.7	53%	0.528	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	128.7	-172.9	57	0	0	0	0	112.1	D774 I780 I781	D774-T776 PolarHBondContact O-N 3.48Å; T776-I780 VanDerWaalsContact CA-O 3.3Å; T776-I780 WeakPolarHBondContact CA-O 3.1Å; T776-I781 HydrophobicContact CG2-CB 4.41Å; T776-I781 HydrophobicContact CG2-CG1 4.09Å; T776-I781 HydrophobicContact CG2-CG2 4.14Å
777	L	88.9	Confident	85.7	Confident	33 Å²	33	51.3 Å²	51.3	17%	0.173	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	129.8	176.6	-170.4	66	0	0	0	111	P643 I769 G779 I780 F800	P643-L777 HydrophobicContact CG-CD1 3.91Å; P643-L777 HydrophobicContact CG-CD2 3.93Å; I769-L777 HydrophobicContact CG2-CD2 4.07Å; I769-L777 HydrophobicContact CG2-CG 4.26Å; L777-G779 VanDerWaalsContact C-N 3.25Å; L777-G779 PolarHBondContact O-N 3.37Å; L777-G779 VanDerWaalsContact O-N 3.13Å; L777-I780 PolarHBondContact N-O 3.35Å; L777-I780 WeakPolarHBondContact O-CB 3.26Å; L777-I780 PolarHBondContact O-N 3.39Å; L777-F800 HydrophobicContact CB-CD1 4.01Å; L777-F800 HydrophobicContact CB-CD2 3.82Å; L777-F800 HydrophobicContact CB-CE1 4.11Å; L777-F800 HydrophobicContact CB-CE2 3.91Å; L777-F800 HydrophobicContact CB-CG 3.86Å; L777-F800 HydrophobicContact CB-CZ 4.06Å; L777-F800 HydrophobicContact CD2-CB 4.1Å; L777-F800 HydrophobicContact CD2-CD2 3.74Å; L777-F800 HydrophobicContact CD2-CE2 4.41Å; L777-F800 HydrophobicContact CD2-CG 4.06Å; L777-F800 HydrophobicContact CG-CD2 4.44Å
778	E	81	Confident	85.1	Confident	120 Å²	120	53.1 Å²	53.1	56%	0.561	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	43	45.2	-178.5	-62.3	-163.6	166.4	0	0	115.1	I769 I780 R802	I769-E778 HydrophobicContact CG2-CB 4.06Å; I769-E778 HydrophobicContact CG2-CG 3.86Å; I769-E778 WeakPolarHBondContact CG2-OE2 3.01Å; E778-I780 PolarHBondContact O-N 3.24Å; E778-R802 PolarHBondContact O-NH2 3.16Å; E778-R802 IonicContact OE2-NH1 3.45Å
779	G	80.7	Confident	83.9	Confident	75 Å²	75	57.6 Å²	57.6	77%	0.773	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-4.5	-179.9	0	0	0	0	0	115.4	L777	L777-G779 VanDerWaalsContact C-N 3.25Å; L777-G779 PolarHBondContact O-N 3.37Å; L777-G779 VanDerWaalsContact O-N 3.13Å
780	I	86.6	Confident	82.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	131.8	169.7	-50	173.1	0	0	0	108.1	I769 T776 L777 E778 F800 R802 T817	I769-I780 HydrophobicContact CG1-CD1 4.16Å; T776-I780 VanDerWaalsContact CA-O 3.3Å; T776-I780 WeakPolarHBondContact CA-O 3.1Å; L777-I780 PolarHBondContact N-O 3.35Å; L777-I780 WeakPolarHBondContact O-CB 3.26Å; L777-I780 PolarHBondContact O-N 3.39Å; E778-I780 PolarHBondContact O-N 3.24Å; I780-F800 HydrophobicContact CB-CD1 3.93Å; I780-F800 HydrophobicContact CB-CE1 4.43Å; I780-F800 HydrophobicContact CD1-CB 4.4Å; I780-F800 HydrophobicContact CG2-CD1 3.82Å; I780-F800 HydrophobicContact CG2-CE1 4.3Å; I780-R802 VanDerWaalsContact CG1-NH2 3.32Å; I780-T817 HydrophobicContact CG2-CG2 3.54Å
781	I	87.3	Confident	80.9	Confident	98 Å²	98	68.5 Å²	68.5	50%	0.503	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.5	177.7	-53.4	-178.3	0	0	0	108.4	T776 P783 H849	T776-I781 HydrophobicContact CG2-CB 4.41Å; T776-I781 HydrophobicContact CG2-CG1 4.09Å; T776-I781 HydrophobicContact CG2-CG2 4.14Å; I781-P783 HydrophobicContact CG2-CG 4.21Å; I781-H849 PolarHBondContact O-CE1 3.21Å; I781-H849 VanDerWaalsContact O-CE1 3.24Å
782	S	85.1	Confident	79.5	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	40%	0.403	C	S	.	.			trans	-118.5	88.4	170.7	-165.4	0	0	0	0	108.4	M775 T817 R819	M775-S782 PolarHBondContact O-N 2.79Å; S782-T817 PolarHBondContact OG-OG1 2.91Å; S782-R819 PolarHBondContact O-NH2 3.45Å; S782-R819 PolarHBondContact OG-NH2 3.3Å
783	P	84.3	Confident	78.5	Confident	45 Å²	45	73.3 Å²	73.3	29%	0.292	43%	0.432	S	S	.	.			trans	-58.6	139.5	-173.1	-24.6	33.1	0	0	0	113.2	I781 E785 L786 R819	I781-P783 HydrophobicContact CG2-CG 4.21Å; P783-E785 VanDerWaalsContact C-N 3.3Å; P783-E785 PolarHBondContact O-N 3.09Å; P783-L786 HydrophobicContact CB-CD1 4.31Å; P783-L786 HydrophobicContact CB-CG 4.22Å; P783-L786 HydrophobicContact CG-CD1 4.11Å; P783-L786 HydrophobicContact CG-CG 4.49Å; P783-R819 PolarHBondContact O-NH1 3.11Å; P783-R819 PolarHBondContact O-NH2 2.92Å
784	A	76.3	Confident	78.1	Confident	43 Å²	43	72.7 Å²	72.7	36%	0.355	43%	0.427	S	S	.	.	S	Bend	trans	-60.7	-42.2	174.3	0	0	0	0	0	111.6	M775 L786 F787	M775-A784 HydrophobicContact SD-CB 3.76Å; A784-L786 PolarHBondContact O-N 2.82Å; A784-L786 VanDerWaalsContact O-N 3.14Å; A784-F787 CarbonylContact O-C 3.56Å; A784-F787 PolarHBondContact O-N 3.07Å; A784-F787 VanDerWaalsContact O-N 3.08Å; A784-F787 VanDerWaalsContact O-O 3.08Å
785	E	79.5	Confident	77.9	Confident	173 Å²	173	70.4 Å²	70.4	81%	0.808	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.8	-171.1	-67.4	161	-157.6	0	0	114.4	P783 F787	P783-E785 VanDerWaalsContact C-N 3.3Å; P783-E785 PolarHBondContact O-N 3.09Å; E785-F787 VanDerWaalsContact C-N 3.25Å; E785-F787 PolarHBondContact O-N 3.18Å
786	L	80.8	Confident	78.1	Confident	20 Å²	20	67.1 Å²	67.1	11%	0.105	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-22.9	178.1	-68.4	178.5	0	0	0	114.1	P783 A784 P835 H849	P783-L786 HydrophobicContact CB-CD1 4.31Å; P783-L786 HydrophobicContact CB-CG 4.22Å; P783-L786 HydrophobicContact CG-CD1 4.11Å; P783-L786 HydrophobicContact CG-CG 4.49Å; A784-L786 PolarHBondContact O-N 2.82Å; A784-L786 VanDerWaalsContact O-N 3.14Å; L786-P835 HydrophobicContact CB-CB 4.13Å; L786-P835 HydrophobicContact CB-CG 4.41Å; L786-P835 HydrophobicContact CD1-CG 4.49Å; L786-P835 HydrophobicContact CD2-CB 4.08Å; L786-H849 HydrophobicContact CD1-CB 4.11Å; L786-H849 WeakPolarHBondContact CD1-CD2 3.27Å
787	F	82	Confident	78.3	Confident	12 Å²	12	63.1 Å²	63.1	5%	0.053	38%	0.377	C	S	.	.	S	Bend	trans	-141.7	97.1	-178.7	-58.8	-64.5	0	0	0	109.9	A784 E785 P835 H849 L851	A784-F787 CarbonylContact O-C 3.56Å; A784-F787 PolarHBondContact O-N 3.07Å; A784-F787 VanDerWaalsContact O-N 3.08Å; A784-F787 VanDerWaalsContact O-O 3.08Å; E785-F787 VanDerWaalsContact C-N 3.25Å; E785-F787 PolarHBondContact O-N 3.18Å; F787-P835 HydrophobicContact CE1-CB 4.2Å; F787-P835 HydrophobicContact CE1-CG 3.98Å; F787-P835 HydrophobicContact CE2-CG 4.41Å; F787-P835 HydrophobicContact CZ-CB 4.36Å; F787-P835 HydrophobicContact CZ-CG 3.68Å; F787-H849 HydrophobicContact CE2-CB 4.04Å; F787-H849 HydrophobicContact CZ-CB 4.3Å; F787-L851 HydrophobicContact CB-CD2 4.28Å; F787-L851 HydrophobicContact CD1-CB 3.55Å; F787-L851 HydrophobicContact CD1-CD2 3.89Å; F787-L851 HydrophobicContact CD1-CG 4.25Å; F787-L851 HydrophobicContact CD2-CB 4.19Å; F787-L851 HydrophobicContact CE1-CB 3.44Å; F787-L851 VanDerWaalsContact CE1-CB 3.44Å; F787-L851 HydrophobicContact CE2-CB 4.09Å; F787-L851 HydrophobicContact CG-CB 3.92Å; F787-L851 HydrophobicContact CG-CD1 4.46Å; F787-L851 HydrophobicContact CG-CD2 4.25Å; F787-L851 HydrophobicContact CG-CG 4.44Å; F787-L851 HydrophobicContact CZ-CB 3.73Å
788	H	72.7	Confident	78.5	Confident	148 Å²	148	61.8 Å²	61.8	69%	0.685	37%	0.37	S	S	*	.			trans	-42.5	128	-177.2	-59.2	-49.9	0	0	0	112.1	E790 R821	H788-E790 PolarHBondContact O-N 2.79Å; H788-R821 PolarHBondContact O-NH1 2.93Å; H788-R821 PolarHBondContact O-NH2 3.21Å
789	P	64.6	Low	79.1	Confident	97 Å²	97	56 Å²	56	63%	0.63	34%	0.343	S	S	*	.			trans	-74.6	121	-175.5	28.5	-33.7	0	0	0	111
790	E	61.4	Low	79.7	Confident	88 Å²	88	52.5 Å²	52.5	41%	0.411	31%	0.306	S	S	.	.			trans	-71.3	127.9	165.3	-70.3	-165.5	132.9	0	0	109.3	H788 S792	H788-E790 PolarHBondContact O-N 2.79Å; E790-S792 PolarHBondContact O-N 3.12Å
791	T	57.5	Low	80	Confident	149 Å²	149	52.5 Å²	52.5	91%	0.914	31%	0.306	S	S	*	.			trans	-77.9	47.9	-178.3	50.1	0	0	0	0	112.8	G793	T791-G793 PolarHBondContact O-N 2.9Å
792	S	62.3	Low	80.2	Confident	46 Å²	46	50.5 Å²	50.5	32%	0.322	29%	0.293	S	S	.	.	S	Bend	trans	-88.1	3	-171.7	-60.1	0	0	0	0	114.1	E790 I794	E790-S792 PolarHBondContact O-N 3.12Å; S792-I794 PolarHBondContact O-N 2.63Å; S792-I794 VanDerWaalsContact O-N 3.11Å
793	G	69.9	Low	80.3	Confident	66 Å²	66	50.7 Å²	50.7	68%	0.68	29%	0.294	S	S	*	.	S	Bend	trans	73.8	-5.9	174.8	0	0	0	0	0	116.4	T791	T791-G793 PolarHBondContact O-N 2.9Å
794	I	80.3	Confident	80	Confident	28 Å²	28	53.7 Å²	53.7	14%	0.144	31%	0.308	C	S	.	.	S	Bend	trans	-105.4	133.2	173.7	-64	-178.7	0	0	0	108	S792 C822 P859 M889	S792-I794 PolarHBondContact O-N 2.63Å; S792-I794 VanDerWaalsContact O-N 3.11Å; I794-C822 HydrophobicContact CG2-CB 4.45Å; I794-P859 HydrophobicContact CD1-CG 3.84Å; I794-M889 HydrophobicContact CD1-CB 3.68Å; I794-M889 HydrophobicContact CD1-CE 4.46Å; I794-M889 WeakPolarHBondContact CD1-O 3.21Å
795	P	83.2	Confident	79.8	Confident	49 Å²	49	55.3 Å²	55.3	32%	0.318	31%	0.31	S	S	.	.			trans	-72.6	143.1	175.1	30.8	-34.3	0	0	0	111.3	L662 T773	L662-P795 HydrophobicContact CD2-CG 3.78Å; T773-P795 HydrophobicContact CG2-CB 3.92Å; T773-P795 HydrophobicContact CG2-CG 3.75Å
796	D	88.4	Confident	79.4	Confident	34 Å²	34	50.5 Å²	50.5	18%	0.182	29%	0.293	C	S	.	.			trans	-62.7	149.7	166.5	-66.5	-33.3	0	0	0	110.2	R819 L820 R821	D796-R819 HydrophobicContact CB-CG 3.62Å; D796-R819 WeakPolarHBondContact OD2-CD 3.31Å; D796-L820 WeakPolarHBondContact CA-O 3.3Å; D796-R821 VanDerWaalsContact OD1-CB 3.27Å; D796-R821 WeakPolarHBondContact OD1-CB 3.34Å; D796-R821 VanDerWaalsContact OD1-CG 3.28Å; D796-R821 WeakPolarHBondContact OD1-CG 3.22Å; D796-R821 IonicContact OD1-CZ 2.78Å; D796-R821 IonicContact OD1-NE 3.88Å; D796-R821 PolarHBondContact OD1-NE 2.92Å; D796-R821 IonicContact OD1-NH2 2.81Å; D796-R821 IonicContact OD2-CZ 3.18Å; D796-R821 IonicContact OD2-NE 3.19Å; D796-R821 PolarHBondContact OD2-NE 3Å; D796-R821 IonicContact OD2-NH2 2.72Å; D796-R821 PolarHBondContact OD2-NH2 2.79Å
797	I	91.2	Very high	78.7	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.6	-179.8	-64.6	172.3	0	0	0	109.2	F660 Y673 F675 V771 T773 F799 L820	F660-I797 HydrophobicContact CD1-CD1 3.81Å; F660-I797 HydrophobicContact CD1-CG1 4.47Å; F660-I797 HydrophobicContact CD1-CG2 4.39Å; F660-I797 HydrophobicContact CE1-CD1 4.16Å; F660-I797 HydrophobicContact CE1-CG1 4.38Å; F660-I797 HydrophobicContact CE1-CG2 4.43Å; Y673-I797 HydrophobicContact CD1-CD1 3.69Å; Y673-I797 HydrophobicContact CD2-CD1 3.74Å; Y673-I797 HydrophobicContact CE1-CD1 3.62Å; Y673-I797 HydrophobicContact CE2-CD1 3.68Å; Y673-I797 HydrophobicContact CG-CD1 3.76Å; F675-I797 HydrophobicContact CE1-CD1 4.44Å; F675-I797 HydrophobicContact CZ-CD1 3.87Å; F675-I797 HydrophobicContact CZ-CG2 4.31Å; V771-I797 HydrophobicContact CG1-CG2 3.45Å; V771-I797 VanDerWaalsContact CG1-CG2 3.45Å; T773-I797 HydrophobicContact CG2-CG1 4.21Å; I797-F799 HydrophobicContact CG2-CD2 4.4Å; I797-F799 HydrophobicContact CG2-CE2 4.16Å; I797-L820 HydrophobicContact CB-CB 4.41Å; I797-L820 PolarHBondContact N-O 2.9Å; I797-L820 PolarHBondContact O-N 3.4Å
798	V	92.8	Very high	77.6	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.024	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.9	-175.4	-172.5	0	0	0	0	110.6	V771 S772 F800 T817 I818 R819	V771-V798 WeakPolarHBondContact CA-O 3.41Å; S772-V798 PolarHBondContact N-O 2.04Å; S772-V798 PolarHBondContact O-N 3.02Å; V798-F800 HydrophobicContact CB-CD2 4.27Å; V798-F800 HydrophobicContact CB-CE2 3.62Å; V798-F800 HydrophobicContact CB-CZ 3.91Å; V798-F800 HydrophobicContact CG1-CD1 4.29Å; V798-F800 HydrophobicContact CG1-CD2 3.94Å; V798-F800 HydrophobicContact CG1-CE1 3.93Å; V798-F800 HydrophobicContact CG1-CE2 3.54Å; V798-F800 HydrophobicContact CG1-CG 4.3Å; V798-F800 HydrophobicContact CG1-CZ 3.54Å; V798-F800 WeakPolarHBondContact O-CD2 3.49Å; V798-T817 HydrophobicContact CG1-CG2 4.49Å; V798-I818 WeakPolarHBondContact CA-O 3.46Å; V798-R819 HydrophobicContact CG2-CB 4.36Å; V798-R819 HydrophobicContact CG2-CG 4.15Å
799	F	94.2	Very high	77.5	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	123.2	166.6	-77.6	-121.6	0	0	0	108.4	N656 F675 L705 C706 L768 V771 I797 F801 T817 I818 L820	N656-F799 HydrophobicContact CB-CE1 3.92Å; N656-F799 HydrophobicContact CB-CZ 4.49Å; F675-F799 HydrophobicContact CD2-CE2 4.16Å; F675-F799 AromaticContact CD2-CZ 3.79Å; F675-F799 HydrophobicContact CD2-CZ 3.79Å; F675-F799 AromaticContact CE2-CE2 3.86Å; F675-F799 HydrophobicContact CE2-CE2 3.86Å; F675-F799 AromaticContact CE2-CZ 3.83Å; F675-F799 HydrophobicContact CE2-CZ 3.83Å; F675-F799 HydrophobicContact CZ-CE2 4.46Å; L705-F799 HydrophobicContact CD1-CB 4.18Å; L705-F799 HydrophobicContact CD1-CD1 3.63Å; L705-F799 HydrophobicContact CD1-CD2 3.86Å; L705-F799 HydrophobicContact CD1-CE1 3.9Å; L705-F799 HydrophobicContact CD1-CE2 4.13Å; L705-F799 HydrophobicContact CD1-CG 3.62Å; L705-F799 HydrophobicContact CD1-CZ 4.15Å; L705-F799 HydrophobicContact CD2-CZ 4.39Å; L705-F799 HydrophobicContact CG-CD1 4.1Å; L705-F799 HydrophobicContact CG-CE1 3.88Å; L705-F799 HydrophobicContact CG-CE2 4.47Å; L705-F799 HydrophobicContact CG-CG 4.5Å; L705-F799 HydrophobicContact CG-CZ 4.08Å; C706-F799 HydrophobicContact CB-CE1 4.18Å; L768-F799 HydrophobicContact CD1-CB 4.42Å; L768-F799 HydrophobicContact CD1-CD1 4.02Å; V771-F799 HydrophobicContact CB-CE2 4.49Å; V771-F799 HydrophobicContact CG1-CD2 3.8Å; V771-F799 HydrophobicContact CG1-CE2 3.61Å; V771-F799 HydrophobicContact CG1-CG 4.39Å; V771-F799 HydrophobicContact CG1-CZ 4.09Å; V771-F799 HydrophobicContact CG2-CD1 3.64Å; V771-F799 HydrophobicContact CG2-CD2 4.07Å; V771-F799 HydrophobicContact CG2-CE1 3.62Å; V771-F799 HydrophobicContact CG2-CE2 4.02Å; V771-F799 HydrophobicContact CG2-CG 3.86Å; V771-F799 HydrophobicContact CG2-CZ 3.8Å; I797-F799 HydrophobicContact CG2-CD2 4.4Å; I797-F799 HydrophobicContact CG2-CE2 4.16Å; F799-F801 HydrophobicContact CB-CD2 4.41Å; F799-F801 HydrophobicContact CB-CE2 3.61Å; F799-F801 HydrophobicContact CB-CZ 4.1Å; F799-F801 HydrophobicContact CD1-CZ 4.21Å; F799-T817 WeakPolarHBondContact O-CA 3.49Å; F799-I818 HydrophobicContact CB-CB 4.43Å; F799-I818 PolarHBondContact N-O 2.9Å; F799-I818 PolarHBondContact O-N 2.04Å; F799-L820 HydrophobicContact CD2-CD1 4.09Å; F799-L820 HydrophobicContact CD2-CG 4.26Å; F799-L820 HydrophobicContact CE2-CD1 3.56Å; F799-L820 HydrophobicContact CE2-CG 4.23Å; F799-L820 HydrophobicContact CZ-CD1 4.41Å
800	F	94.3	Very high	78.3	Confident	0 Å²	0	53 Å²	53	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.1	-178.4	-67.3	-92.2	0	0	0	110.4	I769 G770 D774 L777 I780 V798 T817	I769-F800 HydrophobicContact CB-CB 4.27Å; I769-F800 WeakPolarHBondContact CB-O 3.48Å; I769-F800 PolarHBondContact N-O 3.09Å; G770-F800 PolarHBondContact N-O 2.8Å; G770-F800 PolarHBondContact O-N 2.04Å; D774-F800 WeakPolarHBondContact O-CZ 3.31Å; L777-F800 HydrophobicContact CB-CD1 4.01Å; L777-F800 HydrophobicContact CB-CD2 3.82Å; L777-F800 HydrophobicContact CB-CE1 4.11Å; L777-F800 HydrophobicContact CB-CE2 3.91Å; L777-F800 HydrophobicContact CB-CG 3.86Å; L777-F800 HydrophobicContact CB-CZ 4.06Å; L777-F800 HydrophobicContact CD2-CB 4.1Å; L777-F800 HydrophobicContact CD2-CD2 3.74Å; L777-F800 HydrophobicContact CD2-CE2 4.41Å; L777-F800 HydrophobicContact CD2-CG 4.06Å; L777-F800 HydrophobicContact CG-CD2 4.44Å; I780-F800 HydrophobicContact CB-CD1 3.93Å; I780-F800 HydrophobicContact CB-CE1 4.43Å; I780-F800 HydrophobicContact CD1-CB 4.4Å; I780-F800 HydrophobicContact CG2-CD1 3.82Å; I780-F800 HydrophobicContact CG2-CE1 4.3Å; V798-F800 HydrophobicContact CB-CD2 4.27Å; V798-F800 HydrophobicContact CB-CE2 3.62Å; V798-F800 HydrophobicContact CB-CZ 3.91Å; V798-F800 HydrophobicContact CG1-CD1 4.29Å; V798-F800 HydrophobicContact CG1-CD2 3.94Å; V798-F800 HydrophobicContact CG1-CE1 3.93Å; V798-F800 HydrophobicContact CG1-CE2 3.54Å; V798-F800 HydrophobicContact CG1-CG 4.3Å; V798-F800 HydrophobicContact CG1-CZ 3.54Å; V798-F800 WeakPolarHBondContact O-CD2 3.49Å; F800-T817 HydrophobicContact CD1-CG2 3.77Å; F800-T817 HydrophobicContact CE1-CG2 4.02Å
801	F	92.6	Very high	78.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	156.7	177.8	-54	-97.5	0	0	0	111.6	Y739 A765 R767 L768 F799 S815 T816 I818	Y739-F801 HydrophobicContact CD1-CD1 4.31Å; Y739-F801 AromaticContact CD1-CE1 3.59Å; Y739-F801 HydrophobicContact CD1-CE1 3.59Å; Y739-F801 HydrophobicContact CD1-CZ 4.43Å; Y739-F801 HydrophobicContact CD2-CD1 4.33Å; Y739-F801 HydrophobicContact CD2-CE1 4.4Å; Y739-F801 HydrophobicContact CE1-CE1 4.2Å; Y739-F801 AromaticContact CG-CD1 3.96Å; Y739-F801 HydrophobicContact CG-CD1 3.96Å; Y739-F801 AromaticContact CG-CE1 3.69Å; Y739-F801 HydrophobicContact CG-CE1 3.69Å; A765-F801 HydrophobicContact CB-CB 3.44Å; A765-F801 VanDerWaalsContact CB-CB 3.44Å; A765-F801 HydrophobicContact CB-CD1 4.18Å; A765-F801 HydrophobicContact CB-CG 3.9Å; R767-F801 VanDerWaalsContact O-CA 3.27Å; R767-F801 WeakPolarHBondContact O-CA 3.43Å; L768-F801 HydrophobicContact CB-CD1 3.99Å; L768-F801 HydrophobicContact CB-CE1 3.98Å; L768-F801 HydrophobicContact CD1-CD1 3.86Å; L768-F801 HydrophobicContact CD1-CE1 3.55Å; L768-F801 HydrophobicContact CD1-CE2 4.32Å; L768-F801 HydrophobicContact CD1-CG 4.36Å; L768-F801 HydrophobicContact CD1-CZ 3.81Å; L768-F801 HydrophobicContact CG-CE1 4.31Å; F799-F801 HydrophobicContact CB-CD2 4.41Å; F799-F801 HydrophobicContact CB-CE2 3.61Å; F799-F801 HydrophobicContact CB-CZ 4.1Å; F799-F801 HydrophobicContact CD1-CZ 4.21Å; F801-S815 WeakPolarHBondContact O-CA 3.43Å; F801-T816 PolarHBondContact N-O 2.87Å; F801-T816 PolarHBondContact O-N 3.19Å; F801-I818 HydrophobicContact CE2-CD1 3.82Å; F801-I818 HydrophobicContact CE2-CG1 4.01Å; F801-I818 HydrophobicContact CZ-CD1 4.45Å
802	R	90.9	Very high	79.5	Confident	56 Å²	56	50.7 Å²	50.7	21%	0.211	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	142.6	172.7	-173.4	170.1	-82.8	138.1	-7.3	109.7	D766 R767 I769 E778 I780 S812 R814	D766-R802 PolarHBondContact N-O 2.04Å; R767-R802 PolarHBondContact N-O 2.62Å; R767-R802 PolarHBondContact O-N 2.87Å; I769-R802 HydrophobicContact CD1-CB 4.05Å; I769-R802 HydrophobicContact CG1-CB 4.12Å; E778-R802 PolarHBondContact O-NH2 3.16Å; E778-R802 IonicContact OE2-NH1 3.45Å; I780-R802 VanDerWaalsContact CG1-NH2 3.32Å; R802-S812 WeakPolarHBondContact CD-O 3.03Å; R802-R814 CarbonylContact C-O 3.55Å; R802-R814 WeakPolarHBondContact CA-O 3.45Å
803	S	88.1	Confident	80.3	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.028	30%	0.299	C	S	.	.			trans	-87.6	154.1	170.7	179	0	0	0	0	111.1	S763 D766 D805 R814	S763-S803 PolarHBondContact OG-OG 3.11Å; D766-S803 VanDerWaalsContact OD2-CA 3.23Å; D766-S803 WeakPolarHBondContact OD2-CA 3.49Å; D766-S803 WeakPolarHBondContact OD2-CB 3.09Å; D766-S803 PolarHBondContact OD2-OG 3.35Å; S803-D805 VanDerWaalsContact C-N 3.3Å; S803-D805 PolarHBondContact OG-N 3.37Å; S803-D805 VanDerWaalsContact OG-N 3.12Å; S803-R814 PolarHBondContact N-O 2.92Å
804	N	78.1	Confident	81.3	Confident	109 Å²	109	47 Å²	47	58%	0.583	27%	0.271	S	S	*	.	S	Bend	trans	-77	-19	171.1	-65	-20.7	0	0	0	112.2	D766 V806	D766-N804 HydrophobicContact CB-CB 4.45Å; D766-N804 PolarHBondContact OD2-N 2.95Å; N804-V806 PolarHBondContact O-N 3.14Å; N804-V806 VanDerWaalsContact O-N 3.13Å
805	D	71.7	Confident	81.9	Confident	77 Å²	77	46.2 Å²	46.2	41%	0.412	27%	0.268	S	S	.	.			trans	-74.2	99.6	-177.3	-68.7	-13.8	0	0	0	111.3	S763 S803 G813	S763-D805 WeakPolarHBondContact CB-OD2 3.04Å; S803-D805 VanDerWaalsContact C-N 3.3Å; S803-D805 PolarHBondContact OG-N 3.37Å; S803-D805 VanDerWaalsContact OG-N 3.12Å; D805-G813 WeakPolarHBondContact O-CA 3.18Å
806	V	69.6	Low	82.4	Confident	72 Å²	72	43.9 Å²	43.9	44%	0.436	25%	0.253	S	S	.	.			trans	-79.9	149.2	169	-62.4	0	0	0	0	111	N804	N804-V806 PolarHBondContact O-N 3.14Å; N804-V806 VanDerWaalsContact O-N 3.13Å
807	T	66.5	Low	82.7	Confident	43 Å²	43	42.2 Å²	42.2	26%	0.264	24%	0.244	S	C	.	.			trans	-136.5	168.4	173.4	72.9	0	0	0	0	110.9	S809 C810 S811	T807-S809 PolarHBondContact O-N 3.2Å; T807-S809 VanDerWaalsContact O-N 3.17Å; T807-S809 PolarHBondContact OG1-N 3.06Å; T807-C810 PolarHBondContact N-O 2.77Å; T807-C810 VanDerWaalsContact N-O 3.07Å; T807-C810 CarbonylContact O-C 3.48Å; T807-C810 VanDerWaalsContact O-C 3.26Å; T807-C810 PolarHBondContact O-N 2.95Å; T807-C810 WeakPolarHBondContact OG1-CB 3.47Å; T807-C810 PolarHBondContact OG1-N 3.26Å; T807-S811 PolarHBondContact O-N 3.39Å
808	Q	60	Low	82.8	Confident	173 Å²	173	42.1 Å²	42.1	81%	0.808	24%	0.244	S	C	*	.	S	Bend	trans	-58.4	-27.6	175.9	-172.9	175.2	-48.4	0	0	112.7	K532	K532-Q808 VanDerWaalsContact NZ-OE1 3.09Å
809	S	70.5	Confident	82.8	Confident	106 Å²	106	42.4 Å²	42.4	74%	0.741	25%	0.245	S	C	*	.	S	Bend	trans	-87.6	-39.9	173.8	-51.5	0	0	0	0	112.6	T807	T807-S809 PolarHBondContact O-N 3.2Å; T807-S809 VanDerWaalsContact O-N 3.17Å; T807-S809 PolarHBondContact OG1-N 3.06Å
810	C	80.1	Confident	82.7	Confident	8 Å²	8	42.6 Å²	42.6	5%	0.054	25%	0.245	C	C	.	.			trans	-108.8	73.3	-175.4	-44.2	0	0	0	0	110.4	T807 S812 G813 C846	T807-C810 PolarHBondContact N-O 2.77Å; T807-C810 VanDerWaalsContact N-O 3.07Å; T807-C810 CarbonylContact O-C 3.48Å; T807-C810 VanDerWaalsContact O-C 3.26Å; T807-C810 PolarHBondContact O-N 2.95Å; T807-C810 WeakPolarHBondContact OG1-CB 3.47Å; T807-C810 PolarHBondContact OG1-N 3.26Å; C810-S812 PolarHBondContact O-N 3.25Å; C810-S812 VanDerWaalsContact O-N 3.17Å; C810-G813 PolarHBondContact O-N 3.31Å; C810-G813 VanDerWaalsContact O-N 3.07Å; C810-C846 WeakPolarHBondContact CA-SG 3.14Å; C810-C846 HydrophobicContact CB-CB 3.88Å; C810-C846 WeakPolarHBondContact CB-SG 3.46Å; C810-C846 WeakPolarHBondContact SG-CA 3.26Å; C810-C846 WeakPolarHBondContact SG-CB 3.42Å; C810-C846 CovalentContact SG-SG 2.04Å; C810-C846 PolarHBondContact SG-SG 2.77Å
811	S	71.9	Confident	82.5	Confident	100 Å²	100	43.2 Å²	43.2	70%	0.699	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.2	-173.7	60.1	0	0	0	0	115	T807	T807-S811 PolarHBondContact O-N 3.39Å
812	S	73.8	Confident	82.4	Confident	88 Å²	88	43.7 Å²	43.7	62%	0.615	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	15.3	177.1	-57.3	0	0	0	0	113.4	R802 C810	R802-S812 WeakPolarHBondContact CD-O 3.03Å; C810-S812 PolarHBondContact O-N 3.25Å; C810-S812 VanDerWaalsContact O-N 3.17Å
813	G	79.4	Confident	82.3	Confident	6 Å²	6	42.1 Å²	42.1	6%	0.062	25%	0.247	C	C	.	.			trans	80.6	170.6	-170.3	0	0	0	0	0	112.4	D805 C810	D805-G813 WeakPolarHBondContact O-CA 3.18Å; C810-G813 PolarHBondContact O-N 3.31Å; C810-G813 VanDerWaalsContact O-N 3.07Å
814	R	89.6	Confident	82.2	Confident	28 Å²	28	44.5 Å²	44.5	11%	0.106	26%	0.262	C	S	.	.			trans	-75.7	145.6	169.8	-64.6	-176.7	-179.5	92.8	-1.8	111	V762 R802 S803 C846	V762-R814 VanDerWaalsContact CG1-NH1 3.35Å; R802-R814 CarbonylContact C-O 3.55Å; R802-R814 WeakPolarHBondContact CA-O 3.45Å; S803-R814 PolarHBondContact N-O 2.92Å; R814-C846 CarbonylContact C-O 3.6Å; R814-C846 WeakPolarHBondContact CA-O 3.46Å
815	S	92.7	Very high	82.6	Confident	11 Å²	11	47.6 Å²	47.6	8%	0.077	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	143.5	172.9	-37.3	0	0	0	0	110.1	F801 C846 N847 F848	F801-S815 WeakPolarHBondContact O-CA 3.43Å; S815-C846 PolarHBondContact N-O 2.63Å; S815-N847 WeakPolarHBondContact CB-OD1 3.49Å; S815-N847 PolarHBondContact OG-OD1 3.23Å; S815-F848 PolarHBondContact O-N 3.34Å
816	T	94.2	Very high	83.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.1	168.6	-65	0	0	0	0	110.3	V740 L764 F801 I818 F848 F850	V740-T816 HydrophobicContact CB-CG2 4.41Å; V740-T816 HydrophobicContact CG2-CG2 4.08Å; L764-T816 WeakPolarHBondContact CB-OG1 3.04Å; L764-T816 PolarHBondContact O-OG1 3.02Å; F801-T816 PolarHBondContact N-O 2.87Å; F801-T816 PolarHBondContact O-N 3.19Å; T816-I818 HydrophobicContact CG2-CG1 4.27Å; T816-F848 CarbonylContact C-O 3.48Å; T816-F848 WeakPolarHBondContact CA-O 3.04Å; T816-F850 HydrophobicContact CG2-CD2 3.81Å; T816-F850 HydrophobicContact CG2-CE2 3.67Å
817	T	94.5	Very high	84.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	120.5	172	75.1	0	0	0	0	111.1	I780 S782 V798 F799 F800 F848 H849 F850	I780-T817 HydrophobicContact CG2-CG2 3.54Å; S782-T817 PolarHBondContact OG-OG1 2.91Å; V798-T817 HydrophobicContact CG1-CG2 4.49Å; F799-T817 WeakPolarHBondContact O-CA 3.49Å; F800-T817 HydrophobicContact CD1-CG2 3.77Å; F800-T817 HydrophobicContact CE1-CG2 4.02Å; T817-F848 PolarHBondContact N-O 2.98Å; T817-H849 PolarHBondContact OG1-ND1 3.46Å; T817-F850 PolarHBondContact O-N 2.98Å
818	I	93.8	Very high	84.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	114.8	172.9	-53	-179.7	0	0	0	108.2	L703 L705 V740 V798 F799 F801 T816 L820 F850 W852	L703-I818 HydrophobicContact CD2-CD1 4.08Å; L705-I818 HydrophobicContact CD1-CB 4.36Å; L705-I818 HydrophobicContact CD1-CD1 4.35Å; L705-I818 HydrophobicContact CD1-CG2 4.13Å; V740-I818 HydrophobicContact CG2-CD1 4.04Å; V798-I818 WeakPolarHBondContact CA-O 3.46Å; F799-I818 HydrophobicContact CB-CB 4.43Å; F799-I818 PolarHBondContact N-O 2.9Å; F799-I818 PolarHBondContact O-N 2.04Å; F801-I818 HydrophobicContact CE2-CD1 3.82Å; F801-I818 HydrophobicContact CE2-CG1 4.01Å; F801-I818 HydrophobicContact CZ-CD1 4.45Å; T816-I818 HydrophobicContact CG2-CG1 4.27Å; I818-L820 HydrophobicContact CG2-CD2 4.2Å; I818-F850 HydrophobicContact CG1-CB 4.45Å; I818-F850 HydrophobicContact CG1-CD2 4.4Å; I818-W852 HydrophobicContact CG2-CB 4.4Å; I818-W852 HydrophobicContact CG2-CE3 4.14Å
819	R	92.6	Very high	85.9	Confident	10 Å²	10	41.9 Å²	41.9	4%	0.038	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	112.7	179.4	-175.2	177	-59.6	171.6	8.9	109.8	S782 P783 D796 V798 F850 L851 W852	S782-R819 PolarHBondContact O-NH2 3.45Å; S782-R819 PolarHBondContact OG-NH2 3.3Å; P783-R819 PolarHBondContact O-NH1 3.11Å; P783-R819 PolarHBondContact O-NH2 2.92Å; D796-R819 HydrophobicContact CB-CG 3.62Å; D796-R819 WeakPolarHBondContact OD2-CD 3.31Å; V798-R819 HydrophobicContact CG2-CB 4.36Å; V798-R819 HydrophobicContact CG2-CG 4.15Å; R819-F850 PolarHBondContact N-O 3Å; R819-L851 HydrophobicContact CB-CD1 4.32Å; R819-L851 HydrophobicContact CG-CD1 4.14Å; R819-L851 CarbonylContact O-C 3.58Å; R819-L851 WeakPolarHBondContact O-CA 3.39Å; R819-W852 PolarHBondContact O-N 3.15Å
820	L	92.1	Very high	86.7	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.016	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	131.5	173.4	-51.1	-174.9	0	0	0	110.2	F675 L678 L705 D796 I797 F799 I818 W852 A857	F675-L820 HydrophobicContact CD1-CD1 3.64Å; F675-L820 HydrophobicContact CD2-CD1 4.27Å; F675-L820 HydrophobicContact CE1-CD1 3.49Å; F675-L820 VanDerWaalsContact CE1-CD1 3.49Å; F675-L820 HydrophobicContact CE2-CD1 4.13Å; F675-L820 HydrophobicContact CG-CD1 4.03Å; F675-L820 HydrophobicContact CZ-CD1 3.76Å; L678-L820 HydrophobicContact CD1-CD1 4.49Å; L678-L820 HydrophobicContact CD1-CD2 4.35Å; L705-L820 HydrophobicContact CD1-CD2 4.05Å; L705-L820 HydrophobicContact CD2-CD1 3.99Å; L705-L820 HydrophobicContact CD2-CD2 3.91Å; D796-L820 WeakPolarHBondContact CA-O 3.3Å; I797-L820 HydrophobicContact CB-CB 4.41Å; I797-L820 PolarHBondContact N-O 2.9Å; I797-L820 PolarHBondContact O-N 3.4Å; F799-L820 HydrophobicContact CD2-CD1 4.09Å; F799-L820 HydrophobicContact CD2-CG 4.26Å; F799-L820 HydrophobicContact CE2-CD1 3.56Å; F799-L820 HydrophobicContact CE2-CG 4.23Å; F799-L820 HydrophobicContact CZ-CD1 4.41Å; I818-L820 HydrophobicContact CG2-CD2 4.2Å; L820-W852 WeakPolarHBondContact CA-O 3.08Å; L820-W852 HydrophobicContact CD2-CB 3.86Å; L820-W852 HydrophobicContact CD2-CD2 4.46Å; L820-W852 HydrophobicContact CD2-CE3 4.4Å; L820-W852 HydrophobicContact CD2-CG 4.29Å; L820-A857 HydrophobicContact CB-CB 3.92Å
821	R	90.8	Very high	87.2	Confident	13 Å²	13	40.4 Å²	40.4	5%	0.049	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.6	176.4	178.8	167.6	-67.7	173.3	-0.8	111.6	H788 D796 N823 L851 W852 E853 S854 A857	H788-R821 PolarHBondContact O-NH1 2.93Å; H788-R821 PolarHBondContact O-NH2 3.21Å; D796-R821 VanDerWaalsContact OD1-CB 3.27Å; D796-R821 WeakPolarHBondContact OD1-CB 3.34Å; D796-R821 VanDerWaalsContact OD1-CG 3.28Å; D796-R821 WeakPolarHBondContact OD1-CG 3.22Å; D796-R821 IonicContact OD1-CZ 2.78Å; D796-R821 IonicContact OD1-NE 3.88Å; D796-R821 PolarHBondContact OD1-NE 2.92Å; D796-R821 IonicContact OD1-NH2 2.81Å; D796-R821 IonicContact OD2-CZ 3.18Å; D796-R821 IonicContact OD2-NE 3.19Å; D796-R821 PolarHBondContact OD2-NE 3Å; D796-R821 IonicContact OD2-NH2 2.72Å; D796-R821 PolarHBondContact OD2-NH2 2.79Å; R821-N823 PolarHBondContact O-N 3.43Å; R821-N823 VanDerWaalsContact O-N 3.17Å; R821-L851 HydrophobicContact CB-CD1 4.03Å; R821-W852 PolarHBondContact N-O 3.27Å; R821-E853 HydrophobicContact CB-CG 4.23Å; R821-E853 WeakPolarHBondContact CD-OE1 3.27Å; R821-E853 WeakPolarHBondContact O-CA 3.44Å; R821-S854 PolarHBondContact O-N 3.45Å; R821-A857 WeakPolarHBondContact O-CB 3.35Å
822	C	90.1	Very high	88.1	Confident	11 Å²	11	36.5 Å²	36.5	7%	0.074	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	108.2	174.4	168.6	0	0	0	0	110.7	I794 C858	I794-C822 HydrophobicContact CG2-CB 4.45Å; C822-C858 WeakPolarHBondContact CA-SG 3.39Å; C822-C858 HydrophobicContact CB-CB 3.9Å; C822-C858 WeakPolarHBondContact CB-SG 3.46Å; C822-C858 WeakPolarHBondContact SG-CA 3.37Å; C822-C858 WeakPolarHBondContact SG-CB 3.49Å; C822-C858 CovalentContact SG-SG 2.04Å; C822-C858 PolarHBondContact SG-SG 2.92Å
823	N	88.6	Confident	88.9	Confident	22 Å²	22	36 Å²	36	12%	0.118	22%	0.217	C	C	.	.			trans	-128	99.9	172.5	-168.3	-49.3	0	0	0	110	R821 M825 K826 E853 S854 V855	R821-N823 PolarHBondContact O-N 3.43Å; R821-N823 VanDerWaalsContact O-N 3.17Å; N823-M825 PolarHBondContact O-N 2.77Å; N823-M825 VanDerWaalsContact O-N 3.07Å; N823-M825 WeakPolarHBondContact OD1-CB 3.42Å; N823-M825 PolarHBondContact OD1-N 2.65Å; N823-M825 VanDerWaalsContact OD1-N 3.13Å; N823-K826 HydrophobicContact CB-CB 4.39Å; N823-K826 HydrophobicContact CB-CD 4.28Å; N823-K826 HydrophobicContact CB-CG 4.33Å; N823-K826 PolarHBondContact O-N 3.42Å; N823-K826 VanDerWaalsContact O-N 3.09Å; N823-E853 HydrophobicContact CB-CB 4.36Å; N823-S854 PolarHBondContact N-O 2.95Å; N823-S854 VanDerWaalsContact N-O 3.16Å; N823-S854 CarbonylContact O-C 3.36Å; N823-V855 PolarHBondContact O-N 2.65Å
824	P	85.4	Confident	89.4	Confident	54 Å²	54	37.2 Å²	37.2	35%	0.351	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-17.5	-176.8	-26.4	35.4	0	0	0	115.6	M889	P824-M889 HydrophobicContact CG-CE 4.13Å; P824-M889 HydrophobicContact CG-SD 3.99Å
825	M	85.8	Confident	89.3	Confident	175 Å²	175	36 Å²	36	86%	0.862	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-15.6	179.1	-56.5	-62.8	-73.9	0	0	112.7	N823	N823-M825 PolarHBondContact O-N 2.77Å; N823-M825 VanDerWaalsContact O-N 3.07Å; N823-M825 WeakPolarHBondContact OD1-CB 3.42Å; N823-M825 PolarHBondContact OD1-N 2.65Å; N823-M825 VanDerWaalsContact OD1-N 3.13Å
826	K	86.9	Confident	88.8	Confident	48 Å²	48	39.7 Å²	39.7	21%	0.209	24%	0.244	C	C	.	.	S	Bend	trans	-100.5	100.2	-177	-68.8	-173.9	171.7	-159.4	0	111.1	N823 T831 E853 V855	N823-K826 HydrophobicContact CB-CB 4.39Å; N823-K826 HydrophobicContact CB-CD 4.28Å; N823-K826 HydrophobicContact CB-CG 4.33Å; N823-K826 PolarHBondContact O-N 3.42Å; N823-K826 VanDerWaalsContact O-N 3.09Å; K826-T831 WeakPolarHBondContact CD-OG1 3.49Å; K826-T831 PolarHBondContact NZ-OG1 3Å; K826-E853 HydrophobicContact CD-CB 3.67Å; K826-E853 WeakPolarHBondContact CE-OE2 3.47Å; K826-E853 IonicContact NZ-OE2 2.77Å; K826-E853 PolarHBondContact NZ-OE2 2.04Å; K826-V855 WeakPolarHBondContact O-CB 3.44Å; K826-V855 VanDerWaalsContact O-CG1 3.3Å; K826-V855 WeakPolarHBondContact O-CG1 3.39Å; K826-V855 PolarHBondContact O-N 3.43Å
827	A	87.1	Confident	88.2	Confident	79 Å²	79	46.7 Å²	46.7	65%	0.653	28%	0.278	S	S	*	.			trans	-56.8	145.6	176.1	0	0	0	0	0	112.2	G830	A827-G830 VanDerWaalsContact O-CA 3.22Å; A827-G830 WeakPolarHBondContact O-CA 3.49Å; A827-G830 PolarHBondContact O-N 3.16Å
828	A	82.8	Confident	87.7	Confident	50 Å²	50	47.5 Å²	47.5	41%	0.413	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	143	-178.2	0	0	0	0	0	111.7	A677 V855 A856	A677-A828 HydrophobicContact CB-CB 3.94Å; A828-V855 HydrophobicContact CB-CG1 4.36Å; A828-A856 HydrophobicContact CB-CB 4.11Å
829	P	81.4	Confident	86.9	Confident	68 Å²	68	50.3 Å²	50.3	44%	0.442	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	cis	-73.5	-18.2	6.4	29.3	-35.7	0	0	0	114.9	L678 W852 S854	L678-P829 HydrophobicContact CD2-CB 4.21Å; L678-P829 WeakPolarHBondContact CD2-O 3.3Å; P829-W852 HydrophobicContact CB-CZ2 4.29Å; P829-W852 PolarHBondContact O-NE1 3.35Å; P829-S854 VanDerWaalsContact O-CB 3.26Å; P829-S854 WeakPolarHBondContact O-CB 3.47Å; P829-S854 PolarHBondContact O-OG 2.92Å
830	G	87.3	Confident	86.4	Confident	30 Å²	30	51.7 Å²	51.7	31%	0.309	31%	0.311	S	S	.	.			trans	106.8	-152.6	176.5	0	0	0	0	0	113.1	A827 E853	A827-G830 VanDerWaalsContact O-CA 3.22Å; A827-G830 WeakPolarHBondContact O-CA 3.49Å; A827-G830 PolarHBondContact O-N 3.16Å; G830-E853 CarbonylContact C-O 3.46Å; G830-E853 VanDerWaalsContact CA-O 3.31Å; G830-E853 WeakPolarHBondContact CA-O 3.37Å
831	T	89.8	Confident	85.9	Confident	53 Å²	53	51.5 Å²	51.5	33%	0.325	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.9	174.8	-39.1	0	0	0	0	110.3	K826 Q833 W852 E853	K826-T831 WeakPolarHBondContact CD-OG1 3.49Å; K826-T831 PolarHBondContact NZ-OG1 3Å; T831-Q833 HydrophobicContact CG2-CG 3.96Å; T831-W852 CarbonylContact O-C 3.54Å; T831-W852 WeakPolarHBondContact O-CA 3.38Å; T831-E853 PolarHBondContact N-O 2.84Å; T831-E853 PolarHBondContact O-N 3.43Å
832	L	90.5	Very high	85.8	Confident	18 Å²	18	51.8 Å²	51.8	9%	0.094	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	138.4	167.7	-168.5	70.7	0	0	0	109.4	V682 L684 L703 F850 L851 W852	V682-L832 HydrophobicContact CG1-CD2 4.36Å; L684-L832 HydrophobicContact CB-CD2 4.06Å; L684-L832 HydrophobicContact CD2-CB 4.38Å; L684-L832 HydrophobicContact CD2-CD2 4.01Å; L684-L832 HydrophobicContact CD2-CG 3.93Å; L703-L832 HydrophobicContact CD1-CD2 3.51Å; L703-L832 HydrophobicContact CD2-CD2 3.86Å; L703-L832 HydrophobicContact CG-CD2 4.26Å; L832-F850 HydrophobicContact CD1-CB 4.16Å; L832-L851 CarbonylContact C-O 3.6Å; L832-L851 WeakPolarHBondContact CA-O 3.37Å; L832-W852 HydrophobicContact CD1-CB 3.61Å; L832-W852 HydrophobicContact CD1-CD2 3.91Å; L832-W852 HydrophobicContact CD1-CE3 3.94Å; L832-W852 HydrophobicContact CD1-CG 3.8Å
833	Q	90.8	Very high	85.6	Confident	77 Å²	77	55 Å²	55	36%	0.36	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	152	-173.4	-63.1	-175.6	-11.6	0	0	112.1	T831 L851	T831-Q833 HydrophobicContact CG2-CG 3.96Å; Q833-L851 PolarHBondContact N-O 3.07Å; Q833-L851 PolarHBondContact O-N 2.78Å
834	L	89.9	Confident	85.4	Confident	32 Å²	32	58.3 Å²	58.3	17%	0.168	35%	0.353	C	S	.	.			trans	-95.5	161.5	170.4	-55.6	-177.9	0	0	0	110.5	L684 F701 S839 F850	L684-L834 HydrophobicContact CD2-CD2 3.74Å; L684-L834 HydrophobicContact CD2-CG 3.89Å; F701-L834 HydrophobicContact CE2-CD1 4.09Å; L834-S839 WeakPolarHBondContact CD1-O 3.46Å; L834-F850 HydrophobicContact CD2-CD1 3.48Å; L834-F850 VanDerWaalsContact CD2-CD1 3.48Å; L834-F850 HydrophobicContact CD2-CE1 3.45Å; L834-F850 VanDerWaalsContact CD2-CE1 3.45Å; L834-F850 HydrophobicContact CD2-CZ 4.49Å
835	P	88.3	Confident	85.3	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.019	35%	0.351	C	S	.	.			trans	-63.2	137	176.9	-18.9	31.9	0	0	0	111.5	L786 F787 M837 C838 H849	L786-P835 HydrophobicContact CB-CB 4.13Å; L786-P835 HydrophobicContact CB-CG 4.41Å; L786-P835 HydrophobicContact CD1-CG 4.49Å; L786-P835 HydrophobicContact CD2-CB 4.08Å; F787-P835 HydrophobicContact CE1-CB 4.2Å; F787-P835 HydrophobicContact CE1-CG 3.98Å; F787-P835 HydrophobicContact CE2-CG 4.41Å; F787-P835 HydrophobicContact CZ-CB 4.36Å; F787-P835 HydrophobicContact CZ-CG 3.68Å; P835-M837 PolarHBondContact O-N 3.25Å; P835-M837 VanDerWaalsContact O-N 3.17Å; P835-C838 HydrophobicContact CB-CB 4.22Å; P835-C838 HydrophobicContact CG-CB 4.45Å; P835-C838 CarbonylContact O-C 3.59Å; P835-C838 PolarHBondContact O-N 2.98Å; P835-H849 WeakPolarHBondContact CD-O 3.46Å; P835-H849 HydrophobicContact CG-CB 4.05Å
836	S	81.9	Confident	85.3	Confident	88 Å²	88	49.8 Å²	49.8	62%	0.615	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.9	178.3	54.7	0	0	0	0	113.7
837	M	81.7	Confident	85.5	Confident	146 Å²	146	49.2 Å²	49.2	72%	0.719	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-16.3	176.3	-58.7	-67.5	89.2	0	0	113.7	P835	P835-M837 PolarHBondContact O-N 3.25Å; P835-M837 VanDerWaalsContact O-N 3.17Å
838	C	83.6	Confident	85.8	Confident	17 Å²	17	45.5 Å²	45.5	12%	0.115	29%	0.285	C	S	.	.			trans	-141.9	81.9	-169.1	-54.3	0	0	0	0	109.8	P835 D840 G841 T842 C843	P835-C838 HydrophobicContact CB-CB 4.22Å; P835-C838 HydrophobicContact CG-CB 4.45Å; P835-C838 CarbonylContact O-C 3.59Å; P835-C838 PolarHBondContact O-N 2.98Å; C838-D840 PolarHBondContact O-N 2.81Å; C838-D840 VanDerWaalsContact O-N 3.16Å; C838-G841 PolarHBondContact O-N 3.25Å; C838-T842 WeakPolarHBondContact CB-O 3.39Å; C838-C843 HydrophobicContact CB-CB 4.16Å; C838-C843 WeakPolarHBondContact CB-SG 2.87Å; C838-C843 WeakPolarHBondContact SG-CB 3.43Å; C838-C843 CovalentContact SG-SG 2.04Å; C838-C843 PolarHBondContact SG-SG 3.1Å
839	S	78.6	Confident	86.3	Confident	59 Å²	59	43.7 Å²	43.7	41%	0.413	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20	-171	50	0	0	0	0	115.5	L834 G841	L834-S839 WeakPolarHBondContact CD1-O 3.46Å; S839-G841 VanDerWaalsContact C-N 3.33Å
840	D	80.9	Confident	86.8	Confident	39 Å²	39	40.4 Å²	40.4	21%	0.209	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	11.7	175.3	-58.5	-42.1	0	0	0	112.4	S689 H699 F701 C838 T842	S689-D840 PolarHBondContact OG-OD1 3.27Å; H699-D840 IonicContact CD2-OD1 2.69Å; H699-D840 PolarHBondContact CD2-OD1 2.97Å; F701-D840 WeakPolarHBondContact CZ-O 3.33Å; C838-D840 PolarHBondContact O-N 2.81Å; C838-D840 VanDerWaalsContact O-N 3.16Å; D840-T842 PolarHBondContact O-N 2.78Å; D840-T842 VanDerWaalsContact O-N 3.15Å
841	G	83.1	Confident	87.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.233	C	C	.	.	S	Bend	trans	77.5	-11.7	-179.9	0	0	0	0	0	115	C838 S839 F848 H849	C838-G841 PolarHBondContact O-N 3.25Å; S839-G841 VanDerWaalsContact C-N 3.33Å; G841-F848 CarbonylContact O-C 3.6Å; G841-F848 WeakPolarHBondContact O-CA 3.38Å; G841-H849 PolarHBondContact O-N 2.78Å
842	T	88.3	Confident	87.2	Confident	19 Å²	19	36.9 Å²	36.9	12%	0.117	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-130.5	150.1	177	-177.4	0	0	0	0	111	C838 D840 D844 G845 N847 F848	C838-T842 WeakPolarHBondContact CB-O 3.39Å; D840-T842 PolarHBondContact O-N 2.78Å; D840-T842 VanDerWaalsContact O-N 3.15Å; T842-D844 PolarHBondContact OG1-N 2.87Å; T842-D844 PolarHBondContact OG1-OD1 2.91Å; T842-D844 VanDerWaalsContact OG1-OD1 3.12Å; T842-G845 PolarHBondContact OG1-N 2.81Å; T842-N847 WeakPolarHBondContact CA-O 3.48Å; T842-N847 WeakPolarHBondContact CB-O 3.4Å; T842-N847 PolarHBondContact OG1-O 3.47Å; T842-F848 HydrophobicContact CG2-CD1 4.11Å; T842-F848 HydrophobicContact CG2-CE1 3.54Å; T842-F848 HydrophobicContact CG2-CE2 4.16Å; T842-F848 HydrophobicContact CG2-CZ 3.57Å
843	C	84.7	Confident	87.3	Confident	77 Å²	77	36.8 Å²	36.8	52%	0.52	22%	0.217	S	C	.	.	S	Bend	trans	-109.3	-13.2	178.3	-43.5	0	0	0	0	112.7	C838	C838-C843 HydrophobicContact CB-CB 4.16Å; C838-C843 WeakPolarHBondContact CB-SG 2.87Å; C838-C843 WeakPolarHBondContact SG-CB 3.43Å; C838-C843 CovalentContact SG-SG 2.04Å; C838-C843 PolarHBondContact SG-SG 3.1Å
844	D	84.3	Confident	87.3	Confident	92 Å²	92	33.1 Å²	33.1	49%	0.492	20%	0.2	S	C	.	.	S	Bend	trans	-130.8	-4.9	-173.6	65.9	-1.2	0	0	0	113.6	T842 C846 N847	T842-D844 PolarHBondContact OG1-N 2.87Å; T842-D844 PolarHBondContact OG1-OD1 2.91Å; T842-D844 VanDerWaalsContact OG1-OD1 3.12Å; D844-C846 VanDerWaalsContact C-N 3.28Å; D844-C846 PolarHBondContact O-N 3.41Å; D844-C846 PolarHBondContact OD1-N 3.07Å; D844-N847 PolarHBondContact OD1-N 2.55Å; D844-N847 PolarHBondContact OD2-ND2 2.77Å
845	G	82.9	Confident	87.3	Confident	31 Å²	31	33.4 Å²	33.4	32%	0.32	20%	0.203	S	C	.	.	S	Bend	trans	82.3	-3.9	-177	0	0	0	0	0	114.9	T842	T842-G845 PolarHBondContact OG1-N 2.81Å
846	C	87.3	Confident	87.4	Confident	19 Å²	19	33.9 Å²	33.9	13%	0.128	21%	0.207	C	C	.	.	S	Bend	trans	-121.2	-34.8	-175.5	-62.3	0	0	0	0	113.5	C810 R814 S815 D844	C810-C846 WeakPolarHBondContact CA-SG 3.14Å; C810-C846 HydrophobicContact CB-CB 3.88Å; C810-C846 WeakPolarHBondContact CB-SG 3.46Å; C810-C846 WeakPolarHBondContact SG-CA 3.26Å; C810-C846 WeakPolarHBondContact SG-CB 3.42Å; C810-C846 CovalentContact SG-SG 2.04Å; C810-C846 PolarHBondContact SG-SG 2.77Å; R814-C846 CarbonylContact C-O 3.6Å; R814-C846 WeakPolarHBondContact CA-O 3.46Å; S815-C846 PolarHBondContact N-O 2.63Å; D844-C846 VanDerWaalsContact C-N 3.28Å; D844-C846 PolarHBondContact O-N 3.41Å; D844-C846 PolarHBondContact OD1-N 3.07Å
847	N	90.4	Very high	87.8	Confident	37 Å²	37	29.9 Å²	29.9	20%	0.198	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.2	-179.6	-66.2	-71.9	0	0	0	110.2	S815 T842 D844	S815-N847 WeakPolarHBondContact CB-OD1 3.49Å; S815-N847 PolarHBondContact OG-OD1 3.23Å; T842-N847 WeakPolarHBondContact CA-O 3.48Å; T842-N847 WeakPolarHBondContact CB-O 3.4Å; T842-N847 PolarHBondContact OG1-O 3.47Å; D844-N847 PolarHBondContact OD1-N 2.55Å; D844-N847 PolarHBondContact OD2-ND2 2.77Å
848	F	92.8	Very high	88.2	Confident	1 Å²	1	23.1 Å²	23.1	0%	0.004	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.6	-178.4	-70.4	-103	0	0	0	110.4	F701 L764 S815 T816 T817 G841 T842 F850	F701-F848 HydrophobicContact CE1-CD1 4.24Å; F701-F848 HydrophobicContact CE1-CE1 4.21Å; L764-F848 HydrophobicContact CD1-CD1 3.69Å; L764-F848 HydrophobicContact CD1-CD2 4.47Å; L764-F848 HydrophobicContact CD1-CE1 3.89Å; L764-F848 HydrophobicContact CD1-CG 4Å; L764-F848 HydrophobicContact CD1-CZ 4.38Å; L764-F848 HydrophobicContact CD2-CD1 4.41Å; L764-F848 HydrophobicContact CD2-CD2 4.02Å; L764-F848 HydrophobicContact CD2-CE1 4.09Å; L764-F848 HydrophobicContact CD2-CE2 3.71Å; L764-F848 HydrophobicContact CD2-CG 4.38Å; L764-F848 HydrophobicContact CD2-CZ 3.73Å; S815-F848 PolarHBondContact O-N 3.34Å; T816-F848 CarbonylContact C-O 3.48Å; T816-F848 WeakPolarHBondContact CA-O 3.04Å; T817-F848 PolarHBondContact N-O 2.98Å; G841-F848 CarbonylContact O-C 3.6Å; G841-F848 WeakPolarHBondContact O-CA 3.38Å; T842-F848 HydrophobicContact CG2-CD1 4.11Å; T842-F848 HydrophobicContact CG2-CE1 3.54Å; T842-F848 HydrophobicContact CG2-CE2 4.16Å; T842-F848 HydrophobicContact CG2-CZ 3.57Å; F848-F850 HydrophobicContact CB-CE2 4.02Å
849	H	92.9	Very high	88.6	Confident	11 Å²	11	22.4 Å²	22.4	5%	0.051	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	129.1	-172	-55.8	-61.4	0	0	0	111	I781 L786 F787 T817 P835 G841	I781-H849 PolarHBondContact O-CE1 3.21Å; I781-H849 VanDerWaalsContact O-CE1 3.24Å; L786-H849 HydrophobicContact CD1-CB 4.11Å; L786-H849 WeakPolarHBondContact CD1-CD2 3.27Å; F787-H849 HydrophobicContact CE2-CB 4.04Å; F787-H849 HydrophobicContact CZ-CB 4.3Å; T817-H849 PolarHBondContact OG1-ND1 3.46Å; P835-H849 WeakPolarHBondContact CD-O 3.46Å; P835-H849 HydrophobicContact CG-CB 4.05Å; G841-H849 PolarHBondContact O-N 2.78Å
850	F	93.4	Very high	89.1	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.2	179.8	-58.3	-93.1	0	0	0	110.2	L684 F701 L703 V740 T816 T817 I818 R819 L832 L834 F848	L684-F850 HydrophobicContact CD2-CD1 4.45Å; F701-F850 HydrophobicContact CB-CE1 4.14Å; F701-F850 HydrophobicContact CB-CZ 4.36Å; F701-F850 HydrophobicContact CD1-CE1 4.21Å; F701-F850 AromaticContact CD1-CZ 3.85Å; F701-F850 HydrophobicContact CD1-CZ 3.85Å; F701-F850 HydrophobicContact CD2-CE1 4.32Å; F701-F850 HydrophobicContact CE1-CZ 4.32Å; F701-F850 AromaticContact CG-CE1 3.96Å; F701-F850 HydrophobicContact CG-CE1 3.96Å; F701-F850 HydrophobicContact CG-CZ 4.07Å; L703-F850 HydrophobicContact CD2-CD1 3.87Å; L703-F850 HydrophobicContact CD2-CD2 4.16Å; L703-F850 HydrophobicContact CD2-CE1 3.98Å; L703-F850 HydrophobicContact CD2-CE2 4.27Å; L703-F850 HydrophobicContact CD2-CG 3.98Å; L703-F850 HydrophobicContact CD2-CZ 4.18Å; V740-F850 HydrophobicContact CG1-CE2 4.3Å; V740-F850 HydrophobicContact CG1-CZ 4.33Å; T816-F850 HydrophobicContact CG2-CD2 3.81Å; T816-F850 HydrophobicContact CG2-CE2 3.67Å; T817-F850 PolarHBondContact O-N 2.98Å; I818-F850 HydrophobicContact CG1-CB 4.45Å; I818-F850 HydrophobicContact CG1-CD2 4.4Å; R819-F850 PolarHBondContact N-O 3Å; L832-F850 HydrophobicContact CD1-CB 4.16Å; L834-F850 HydrophobicContact CD2-CD1 3.48Å; L834-F850 VanDerWaalsContact CD2-CD1 3.48Å; L834-F850 HydrophobicContact CD2-CE1 3.45Å; L834-F850 VanDerWaalsContact CD2-CE1 3.45Å; L834-F850 HydrophobicContact CD2-CZ 4.49Å; F848-F850 HydrophobicContact CB-CE2 4.02Å
851	L	92.1	Very high	89.5	Confident	6 Å²	6	20.8 Å²	20.8	3%	0.031	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.3	171.8	176.7	72	0	0	0	109.5	F787 R819 R821 L832 Q833 E853	F787-L851 HydrophobicContact CB-CD2 4.28Å; F787-L851 HydrophobicContact CD1-CB 3.55Å; F787-L851 HydrophobicContact CD1-CD2 3.89Å; F787-L851 HydrophobicContact CD1-CG 4.25Å; F787-L851 HydrophobicContact CD2-CB 4.19Å; F787-L851 HydrophobicContact CE1-CB 3.44Å; F787-L851 VanDerWaalsContact CE1-CB 3.44Å; F787-L851 HydrophobicContact CE2-CB 4.09Å; F787-L851 HydrophobicContact CG-CB 3.92Å; F787-L851 HydrophobicContact CG-CD1 4.46Å; F787-L851 HydrophobicContact CG-CD2 4.25Å; F787-L851 HydrophobicContact CG-CG 4.44Å; F787-L851 HydrophobicContact CZ-CB 3.73Å; R819-L851 HydrophobicContact CB-CD1 4.32Å; R819-L851 HydrophobicContact CG-CD1 4.14Å; R819-L851 CarbonylContact O-C 3.58Å; R819-L851 WeakPolarHBondContact O-CA 3.39Å; R821-L851 HydrophobicContact CB-CD1 4.03Å; L832-L851 CarbonylContact C-O 3.6Å; L832-L851 WeakPolarHBondContact CA-O 3.37Å; Q833-L851 PolarHBondContact N-O 3.07Å; Q833-L851 PolarHBondContact O-N 2.78Å; L851-E853 HydrophobicContact CD1-CG 4.37Å; L851-E853 HydrophobicContact CD2-CG 3.85Å; L851-E853 HydrophobicContact CG-CG 3.82Å
852	W	92.8	Very high	89.7	Confident	3 Å²	3	22.7 Å²	22.7	1%	0.011	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	104.3	178.3	-161.4	-24.9	0	0	0	109.7	L678 V682 L705 I818 R819 L820 R821 P829 T831 L832	L678-W852 HydrophobicContact CB-CH2 4.18Å; L678-W852 HydrophobicContact CB-CZ2 4.04Å; L678-W852 HydrophobicContact CD2-CZ2 3.81Å; L678-W852 HydrophobicContact CG-CZ2 4.41Å; V682-W852 HydrophobicContact CB-CH2 4.19Å; V682-W852 HydrophobicContact CB-CZ2 4.43Å; V682-W852 HydrophobicContact CG2-CH2 3.78Å; V682-W852 HydrophobicContact CG2-CZ2 3.77Å; L705-W852 HydrophobicContact CB-CZ3 4.06Å; L705-W852 HydrophobicContact CD2-CZ3 4.48Å; I818-W852 HydrophobicContact CG2-CB 4.4Å; I818-W852 HydrophobicContact CG2-CE3 4.14Å; R819-W852 PolarHBondContact O-N 3.15Å; L820-W852 WeakPolarHBondContact CA-O 3.08Å; L820-W852 HydrophobicContact CD2-CB 3.86Å; L820-W852 HydrophobicContact CD2-CD2 4.46Å; L820-W852 HydrophobicContact CD2-CE3 4.4Å; L820-W852 HydrophobicContact CD2-CG 4.29Å; R821-W852 PolarHBondContact N-O 3.27Å; P829-W852 HydrophobicContact CB-CZ2 4.29Å; P829-W852 PolarHBondContact O-NE1 3.35Å; T831-W852 CarbonylContact O-C 3.54Å; T831-W852 WeakPolarHBondContact O-CA 3.38Å; L832-W852 HydrophobicContact CD1-CB 3.61Å; L832-W852 HydrophobicContact CD1-CD2 3.91Å; L832-W852 HydrophobicContact CD1-CE3 3.94Å; L832-W852 HydrophobicContact CD1-CG 3.8Å
853	E	91.8	Very high	89.4	Confident	16 Å²	16	25.1 Å²	25.1	8%	0.075	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	120.5	-177.4	-52.9	-168.1	109.9	0	0	110.7	R821 N823 K826 G830 T831 L851	R821-E853 HydrophobicContact CB-CG 4.23Å; R821-E853 WeakPolarHBondContact CD-OE1 3.27Å; R821-E853 WeakPolarHBondContact O-CA 3.44Å; N823-E853 HydrophobicContact CB-CB 4.36Å; K826-E853 HydrophobicContact CD-CB 3.67Å; K826-E853 WeakPolarHBondContact CE-OE2 3.47Å; K826-E853 IonicContact NZ-OE2 2.77Å; K826-E853 PolarHBondContact NZ-OE2 2.04Å; G830-E853 CarbonylContact C-O 3.46Å; G830-E853 VanDerWaalsContact CA-O 3.31Å; G830-E853 WeakPolarHBondContact CA-O 3.37Å; T831-E853 PolarHBondContact N-O 2.84Å; T831-E853 PolarHBondContact O-N 3.43Å; L851-E853 HydrophobicContact CD1-CG 4.37Å; L851-E853 HydrophobicContact CD2-CG 3.85Å; L851-E853 HydrophobicContact CG-CG 3.82Å
854	S	91.9	Very high	89.1	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	150	-171.6	-166.8	0	0	0	0	113.1	R821 N823 P829 A856 A857	R821-S854 PolarHBondContact O-N 3.45Å; N823-S854 PolarHBondContact N-O 2.95Å; N823-S854 VanDerWaalsContact N-O 3.16Å; N823-S854 CarbonylContact O-C 3.36Å; P829-S854 VanDerWaalsContact O-CB 3.26Å; P829-S854 WeakPolarHBondContact O-CB 3.47Å; P829-S854 PolarHBondContact O-OG 2.92Å; S854-A856 PolarHBondContact O-N 2.92Å; S854-A856 PolarHBondContact OG-N 2.99Å; S854-A857 WeakPolarHBondContact O-CB 3.35Å; S854-A857 PolarHBondContact O-N 3.35Å; S854-A857 VanDerWaalsContact O-N 3.13Å
855	V	90.4	Very high	89.1	Confident	38 Å²	38	20 Å²	20	23%	0.23	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-63.3	-25.5	166.2	69.5	0	0	0	0	111.7	N823 K826 A828 A857 C858 A891	N823-V855 PolarHBondContact O-N 2.65Å; K826-V855 WeakPolarHBondContact O-CB 3.44Å; K826-V855 VanDerWaalsContact O-CG1 3.3Å; K826-V855 WeakPolarHBondContact O-CG1 3.39Å; K826-V855 PolarHBondContact O-N 3.43Å; A828-V855 HydrophobicContact CB-CG1 4.36Å; V855-A857 VanDerWaalsContact C-N 3.29Å; V855-A857 PolarHBondContact O-N 3.28Å; V855-C858 VanDerWaalsContact O-CB 3.31Å; V855-C858 WeakPolarHBondContact O-CB 3.38Å; V855-C858 PolarHBondContact O-N 3.32Å; V855-A891 HydrophobicContact CG2-CB 3.67Å; V855-A891 VanDerWaalsContact O-CB 3.26Å; V855-A891 WeakPolarHBondContact O-CB 3.04Å
856	A	89.9	Confident	89.3	Confident	13 Å²	13	20.6 Å²	20.6	11%	0.107	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-77.2	-12	174.9	0	0	0	0	0	113.8	A677 L678 A828 S854 C858	A677-A856 HydrophobicContact CB-CB 3.92Å; L678-A856 HydrophobicContact CD1-CB 4.31Å; L678-A856 HydrophobicContact CD2-CB 3.93Å; L678-A856 HydrophobicContact CG-CB 3.94Å; A828-A856 HydrophobicContact CB-CB 4.11Å; S854-A856 PolarHBondContact O-N 2.92Å; S854-A856 PolarHBondContact OG-N 2.99Å; A856-C858 VanDerWaalsContact C-N 3.31Å
857	A	90.1	Very high	89.2	Confident	4 Å²	4	23.4 Å²	23.4	3%	0.033	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-86.3	-2.8	170	0	0	0	0	0	112.6	Y673 L820 R821 S854 V855	Y673-A857 WeakPolarHBondContact CD1-O 3.43Å; L820-A857 HydrophobicContact CB-CB 3.92Å; R821-A857 WeakPolarHBondContact O-CB 3.35Å; S854-A857 WeakPolarHBondContact O-CB 3.35Å; S854-A857 PolarHBondContact O-N 3.35Å; S854-A857 VanDerWaalsContact O-N 3.13Å; V855-A857 VanDerWaalsContact C-N 3.29Å; V855-A857 PolarHBondContact O-N 3.28Å
858	C	90.4	Very high	89	Confident	3 Å²	3	25.5 Å²	25.5	2%	0.02	15%	0.153	C	C	.	.	S	Bend	trans	-79.1	153.1	174.2	-64.5	0	0	0	0	112.5	C822 V855 A856 A891	C822-C858 WeakPolarHBondContact CA-SG 3.39Å; C822-C858 HydrophobicContact CB-CB 3.9Å; C822-C858 WeakPolarHBondContact CB-SG 3.46Å; C822-C858 WeakPolarHBondContact SG-CA 3.37Å; C822-C858 WeakPolarHBondContact SG-CB 3.49Å; C822-C858 CovalentContact SG-SG 2.04Å; C822-C858 PolarHBondContact SG-SG 2.92Å; V855-C858 VanDerWaalsContact O-CB 3.31Å; V855-C858 WeakPolarHBondContact O-CB 3.38Å; V855-C858 PolarHBondContact O-N 3.32Å; A856-C858 VanDerWaalsContact C-N 3.31Å; C858-A891 HydrophobicContact CB-CB 4.06Å
859	P	90.7	Very high	88.6	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.019	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-67.4	152.4	175	29.6	-35.3	0	0	0	111.1	F671 N672 Y673 I794 M889 C890 A891	F671-P859 HydrophobicContact CB-CB 4.27Å; F671-P859 HydrophobicContact CD1-CB 4.06Å; F671-P859 HydrophobicContact CD1-CG 4.08Å; N672-P859 CarbonylContact O-C 3.52Å; N672-P859 WeakPolarHBondContact O-CA 3.06Å; Y673-P859 HydrophobicContact CD1-CB 4.18Å; Y673-P859 HydrophobicContact CE1-CB 3.8Å; Y673-P859 HydrophobicContact CE1-CG 4.25Å; Y673-P859 HydrophobicContact CE2-CB 4.5Å; I794-P859 HydrophobicContact CD1-CG 3.84Å; P859-M889 WeakPolarHBondContact CG-O 3.05Å; P859-C890 CarbonylContact O-C 3.57Å; P859-C890 WeakPolarHBondContact O-CA 3.47Å; P859-C890 WeakPolarHBondContact O-CB 3.37Å; P859-A891 PolarHBondContact O-N 3.07Å
860	L	90.1	Very high	88.3	Confident	58 Å²	58	34.1 Å²	34.1	30%	0.304	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-60.8	132.1	169.8	-63	175.5	0	0	0	109.8	N672 N674 S862 A891	N672-L860 HydrophobicContact CB-CD1 4.14Å; N672-L860 WeakPolarHBondContact O-CB 3.45Å; N672-L860 WeakPolarHBondContact O-CG 3.4Å; N672-L860 PolarHBondContact O-N 3.11Å; N674-L860 HydrophobicContact CB-CD1 4.35Å; N674-L860 HydrophobicContact CB-CD2 3.98Å; N674-L860 HydrophobicContact CB-CG 4.4Å; L860-S862 PolarHBondContact O-N 2.98Å; L860-A891 WeakPolarHBondContact CA-O 3.32Å
861	C	88.8	Confident	87.8	Confident	6 Å²	6	35.8 Å²	35.8	4%	0.041	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-61.9	139	176.7	-62.2	0	0	0	0	110.9	W884 C890 G892 I894	C861-W884 HydrophobicContact CB-CH2 3.48Å; C861-W884 VanDerWaalsContact CB-CH2 3.48Å; C861-W884 HydrophobicContact CB-CZ2 4.33Å; C861-W884 HydrophobicContact CB-CZ3 3.64Å; C861-C890 VanDerWaalsContact CA-SG 3.51Å; C861-C890 HydrophobicContact CB-CB 3.9Å; C861-C890 WeakPolarHBondContact CB-SG 3.28Å; C861-C890 WeakPolarHBondContact SG-CB 3.49Å; C861-C890 PolarHBondContact SG-O 3.14Å; C861-C890 VanDerWaalsContact SG-O 3.4Å; C861-C890 CovalentContact SG-SG 2.04Å; C861-C890 PolarHBondContact SG-SG 2.99Å; C861-G892 WeakPolarHBondContact CB-O 3.22Å; C861-G892 PolarHBondContact N-O 3.44Å; C861-G892 PolarHBondContact SG-O 3.42Å; C861-I894 WeakPolarHBondContact O-CG1 3.26Å; C861-I894 PolarHBondContact O-N 2.84Å; C861-I894 VanDerWaalsContact O-N 3.13Å
862	S	86.6	Confident	87.2	Confident	40 Å²	40	39.7 Å²	39.7	28%	0.28	24%	0.235	S	C	.	.			trans	-126.2	174.5	-178.3	78.3	0	0	0	0	111.4	L860 S864 D865	L860-S862 PolarHBondContact O-N 2.98Å; S862-S864 PolarHBondContact O-N 3.01Å; S862-S864 VanDerWaalsContact O-N 3.11Å; S862-S864 PolarHBondContact OG-N 3.34Å; S862-S864 VanDerWaalsContact OG-N 3.12Å; S862-S864 PolarHBondContact OG-OG 3.11Å; S862-D865 WeakPolarHBondContact CA-OD2 3.29Å; S862-D865 VanDerWaalsContact CB-OD2 3.27Å; S862-D865 WeakPolarHBondContact CB-OD2 3.47Å; S862-D865 PolarHBondContact N-OD2 3.13Å; S862-D865 PolarHBondContact O-N 2.71Å; S862-D865 PolarHBondContact OG-OD2 2.67Å
863	A	82.2	Confident	86.6	Confident	69 Å²	69	41.3 Å²	41.3	57%	0.57	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-11.3	173.1	0	0	0	0	0	114.1	Y866	A863-Y866 HydrophobicContact CB-CE1 4.3Å
864	S	80	Confident	85.9	Confident	46 Å²	46	45 Å²	45	32%	0.322	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-21.2	172.4	71.7	0	0	0	0	113.4	R669 S862 R885	R669-S864 PolarHBondContact NE-OG 3.12Å; S862-S864 PolarHBondContact O-N 3.01Å; S862-S864 VanDerWaalsContact O-N 3.11Å; S862-S864 PolarHBondContact OG-N 3.34Å; S862-S864 VanDerWaalsContact OG-N 3.12Å; S862-S864 PolarHBondContact OG-OG 3.11Å; S864-R885 PolarHBondContact O-NE 3.44Å
865	D	83.2	Confident	85	Confident	17 Å²	17	49.8 Å²	49.8	9%	0.091	31%	0.31	C	S	.	.	S	Bend	trans	-88.7	-11.5	-169.9	-58.4	-72.2	0	0	0	114	R669 S862 W884 R885	R669-D865 IonicContact CZ-OD1 3.12Å; R669-D865 IonicContact NH2-OD1 2.77Å; R669-D865 PolarHBondContact NH2-OD1 3.21Å; S862-D865 WeakPolarHBondContact CA-OD2 3.29Å; S862-D865 VanDerWaalsContact CB-OD2 3.27Å; S862-D865 WeakPolarHBondContact CB-OD2 3.47Å; S862-D865 PolarHBondContact N-OD2 3.13Å; S862-D865 PolarHBondContact O-N 2.71Å; S862-D865 PolarHBondContact OG-OD2 2.67Å; D865-W884 HydrophobicContact CB-CE3 4.11Å; D865-W884 HydrophobicContact CB-CZ3 4.02Å; D865-R885 WeakPolarHBondContact O-CB 3.47Å; D865-R885 WeakPolarHBondContact O-CG 3.44Å; D865-R885 PolarHBondContact O-N 3.05Å
866	Y	86.7	Confident	84.2	Confident	43 Å²	43	49.1 Å²	49.1	17%	0.169	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	169.4	169.9	68.9	-110.4	0	0	0	112	A863 T868 Y882 M883 W884 R885 I894 L896 P897	A863-Y866 HydrophobicContact CB-CE1 4.3Å; Y866-T868 HydrophobicContact CE2-CG2 4.32Å; Y866-Y882 AromaticContact CD2-CD1 3.96Å; Y866-Y882 HydrophobicContact CD2-CD1 3.96Å; Y866-Y882 AromaticContact CE2-CD1 3.56Å; Y866-Y882 HydrophobicContact CE2-CD1 3.56Å; Y866-Y882 HydrophobicContact CE2-CE1 4.05Å; Y866-M883 CarbonylContact C-O 3.5Å; Y866-M883 VanDerWaalsContact CA-O 3.27Å; Y866-M883 WeakPolarHBondContact CA-O 3.43Å; Y866-M883 VanDerWaalsContact CB-O 3.29Å; Y866-M883 WeakPolarHBondContact CB-O 3.38Å; Y866-W884 HydrophobicContact CD1-CZ3 4.18Å; Y866-R885 PolarHBondContact O-NE 3.48Å; Y866-R885 PolarHBondContact O-NH2 3Å; Y866-I894 HydrophobicContact CD1-CD1 4.07Å; Y866-I894 HydrophobicContact CE1-CD1 3.59Å; Y866-L896 HydrophobicContact CG-CD2 4.46Å; Y866-P897 HydrophobicContact CE1-CG 4.33Å
867	H	85.9	Confident	83.8	Confident	78 Å²	78	52.3 Å²	52.3	36%	0.361	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	158.2	167.6	70	-69	0	0	0	110.1	M883 W884	H867-M883 PolarHBondContact N-O 2.81Å; H867-M883 PolarHBondContact ND1-O 2.85Å; H867-M883 PolarHBondContact O-N 3.4Å; H867-W884 PolarHBondContact ND1-O 3.43Å
868	T	86.3	Confident	83.5	Confident	81 Å²	81	55 Å²	55	50%	0.497	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.7	180	51.9	0	0	0	0	110.5	Y866 T880 Y882	Y866-T868 HydrophobicContact CE2-CG2 4.32Å; T868-T880 HydrophobicContact CG2-CG2 4.39Å; T868-Y882 HydrophobicContact CG2-CD1 3.72Å; T868-Y882 HydrophobicContact CG2-CE1 3.57Å
869	F	84.8	Confident	83.2	Confident	126 Å²	126	59.3 Å²	59.3	55%	0.553	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.3	169.3	-174.5	-91.2	0	0	0	109.5	T880 T881	F869-T880 WeakPolarHBondContact O-CA 3.31Å; F869-T881 PolarHBondContact N-O 3.02Å; F869-T881 PolarHBondContact O-N 2.98Å
870	V	85.8	Confident	83	Confident	67 Å²	67	60.2 Å²	60.2	41%	0.406	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.5	-179	-172.5	0	0	0	0	109.1	Q878 T880	V870-Q878 HydrophobicContact CG1-CG 3.66Å; V870-T880 HydrophobicContact CG2-CG2 4.14Å
871	S	82.4	Confident	82.8	Confident	34 Å²	34	59.6 Å²	59.6	24%	0.238	36%	0.36	C	S	.	.			trans	-67.9	162	178.8	81	0	0	0	0	112.3	Q878 K879	S871-Q878 PolarHBondContact O-NE2 3.05Å; S871-K879 WeakPolarHBondContact CB-O 3.39Å; S871-K879 PolarHBondContact N-O 3.49Å; S871-K879 PolarHBondContact OG-N 2.83Å; S871-K879 PolarHBondContact OG-O 2.87Å
872	S	81.1	Confident	82.7	Confident	88 Å²	88	61.5 Å²	61.5	62%	0.615	37%	0.366	S	S	*	.			trans	-58	155.8	158.9	51.5	0	0	0	0	111.2	V874	S872-V874 PolarHBondContact O-N 3.03Å
873	C	78.8	Confident	82.7	Confident	38 Å²	38	64 Å²	64	26%	0.257	38%	0.375	S	S	.	.			trans	-80	108.5	176	-179.3	0	0	0	0	109.8	C904 T906	C873-C904 WeakPolarHBondContact CA-SG 3.41Å; C873-C904 HydrophobicContact CB-CB 3.89Å; C873-C904 WeakPolarHBondContact CB-SG 3.29Å; C873-C904 WeakPolarHBondContact SG-CB 3.16Å; C873-C904 CovalentContact SG-SG 2.03Å; C873-C904 PolarHBondContact SG-SG 3.46Å; C873-T906 HydrophobicContact CB-CG2 4.35Å
874	V	77.1	Confident	82.8	Confident	92 Å²	92	63.2 Å²	63.2	56%	0.558	36%	0.357	S	S	*	.	B	Isolated β-bridge	trans	-122.3	129.1	-176.5	-177.6	0	0	0	0	109.2	S872 G876 I877	S872-V874 PolarHBondContact O-N 3.03Å; V874-G876 PolarHBondContact O-N 3.48Å; V874-G876 VanDerWaalsContact O-N 3.11Å; V874-I877 PolarHBondContact N-O 2.94Å; V874-I877 PolarHBondContact O-N 2.68Å; V874-I877 VanDerWaalsContact O-O 3.13Å
875	A	73.1	Confident	83	Confident	102 Å²	102	67.7 Å²	67.7	84%	0.843	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	30.8	-176.7	0	0	0	0	0	114.8	I877	A875-I877 VanDerWaalsContact C-N 3.33Å
876	G	74.1	Confident	82.8	Confident	24 Å²	24	75.6 Å²	75.6	25%	0.247	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	8.9	-176.8	0	0	0	0	0	114.9	V874 I903 C904	V874-G876 PolarHBondContact O-N 3.48Å; V874-G876 VanDerWaalsContact O-N 3.11Å; G876-I903 WeakPolarHBondContact O-CA 3.48Å; G876-C904 CarbonylContact C-O 3.5Å; G876-C904 VanDerWaalsContact CA-O 3.3Å; G876-C904 WeakPolarHBondContact CA-O 3.47Å; G876-C904 PolarHBondContact O-N 2.93Å
877	I	80.6	Confident	82.5	Confident	80 Å²	80	78.5 Å²	78.5	41%	0.41	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	133.5	-177.3	-58.1	177.6	0	0	0	110.3	V874 A875 K879 V901 C904	V874-I877 PolarHBondContact N-O 2.94Å; V874-I877 PolarHBondContact O-N 2.68Å; V874-I877 VanDerWaalsContact O-O 3.13Å; A875-I877 VanDerWaalsContact C-N 3.33Å; I877-K879 HydrophobicContact CG2-CG 4.43Å; I877-V901 HydrophobicContact CG2-CG1 3.47Å; I877-V901 VanDerWaalsContact CG2-CG1 3.47Å; I877-C904 PolarHBondContact N-SG 3.29Å; I877-C904 VanDerWaalsContact N-SG 3.43Å
878	Q	84.4	Confident	82.3	Confident	61 Å²	61	79 Å²	79	29%	0.285	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.4	173.4	171.8	164	61.9	0	0	109.5	V870 S871 T902 C904	V870-Q878 HydrophobicContact CG1-CG 3.66Å; S871-Q878 PolarHBondContact O-NE2 3.05Å; Q878-T902 PolarHBondContact N-O 2.93Å; Q878-T902 PolarHBondContact O-N 2.87Å; Q878-T902 PolarHBondContact O-OG1 2.82Å; Q878-C904 HydrophobicContact CB-CB 3.92Å
879	K	85.6	Confident	82.2	Confident	93 Å²	93	77 Å²	77	40%	0.404	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	127.8	-175.4	-66.8	177.5	161.1	-145.4	0	110.3	S871 I877 Q899	S871-K879 WeakPolarHBondContact CB-O 3.39Å; S871-K879 PolarHBondContact N-O 3.49Å; S871-K879 PolarHBondContact OG-N 2.83Å; S871-K879 PolarHBondContact OG-O 2.87Å; I877-K879 HydrophobicContact CG2-CG 4.43Å; K879-Q899 HydrophobicContact CB-CG 4.19Å
880	T	86.3	Confident	82.2	Confident	21 Å²	21	71.2 Å²	71.2	13%	0.129	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	115.9	170.2	-57	0	0	0	0	109.4	T868 F869 V870 Y882 Q899 K900	T868-T880 HydrophobicContact CG2-CG2 4.39Å; F869-T880 WeakPolarHBondContact O-CA 3.31Å; V870-T880 HydrophobicContact CG2-CG2 4.14Å; T880-Y882 HydrophobicContact CG2-CE2 4.32Å; T880-Q899 CarbonylContact O-C 3.53Å; T880-Q899 WeakPolarHBondContact O-CA 2.99Å; T880-K900 PolarHBondContact N-O 2.89Å; T880-K900 PolarHBondContact O-N 2.83Å
881	T	86	Confident	82.2	Confident	46 Å²	46	69 Å²	69	28%	0.282	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	146.5	175.6	-53.2	0	0	0	0	109.5	F869 M883 Q899	F869-T881 PolarHBondContact N-O 3.02Å; F869-T881 PolarHBondContact O-N 2.98Å; T881-M883 HydrophobicContact CG2-CG 4.37Å; T881-Q899 PolarHBondContact OG1-NE2 2.03Å
882	Y	86.9	Confident	82.2	Confident	45 Å²	45	69.9 Å²	69.9	18%	0.176	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.1	178.4	-59.7	-92.7	0	0	0	109	Y866 T868 T880 P897 E898 K900	Y866-Y882 AromaticContact CD2-CD1 3.96Å; Y866-Y882 HydrophobicContact CD2-CD1 3.96Å; Y866-Y882 AromaticContact CE2-CD1 3.56Å; Y866-Y882 HydrophobicContact CE2-CD1 3.56Å; Y866-Y882 HydrophobicContact CE2-CE1 4.05Å; T868-Y882 HydrophobicContact CG2-CD1 3.72Å; T868-Y882 HydrophobicContact CG2-CE1 3.57Å; T880-Y882 HydrophobicContact CG2-CE2 4.32Å; Y882-P897 HydrophobicContact CD1-CB 4.28Å; Y882-P897 HydrophobicContact CD1-CG 3.96Å; Y882-P897 HydrophobicContact CD2-CB 3.81Å; Y882-P897 HydrophobicContact CD2-CG 4.33Å; Y882-P897 VanDerWaalsContact CD2-O 3.28Å; Y882-P897 WeakPolarHBondContact CD2-O 3.43Å; Y882-P897 HydrophobicContact CE1-CB 4.28Å; Y882-P897 HydrophobicContact CE1-CG 4.13Å; Y882-P897 HydrophobicContact CE2-CB 3.83Å; Y882-P897 HydrophobicContact CG-CB 4.06Å; Y882-P897 HydrophobicContact CG-CG 4.07Å; Y882-E898 WeakPolarHBondContact CE2-O 3.21Å; Y882-K900 HydrophobicContact CE2-CB 4.49Å
883	M	84.6	Confident	82.4	Confident	94 Å²	94	68.1 Å²	68.1	46%	0.463	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.6	-179.3	-69.1	179.1	66.5	0	0	110.5	Y866 H867 T881	Y866-M883 CarbonylContact C-O 3.5Å; Y866-M883 VanDerWaalsContact CA-O 3.27Å; Y866-M883 WeakPolarHBondContact CA-O 3.43Å; Y866-M883 VanDerWaalsContact CB-O 3.29Å; Y866-M883 WeakPolarHBondContact CB-O 3.38Å; H867-M883 PolarHBondContact N-O 2.81Å; H867-M883 PolarHBondContact ND1-O 2.85Å; H867-M883 PolarHBondContact O-N 3.4Å; T881-M883 HydrophobicContact CG2-CG 4.37Å
884	W	85.9	Confident	82.7	Confident	52 Å²	52	70 Å²	70	20%	0.197	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	153.7	173.2	-64.9	118.1	0	0	0	111.2	C861 D865 Y866 H867 K888 I894 L896	C861-W884 HydrophobicContact CB-CH2 3.48Å; C861-W884 VanDerWaalsContact CB-CH2 3.48Å; C861-W884 HydrophobicContact CB-CZ2 4.33Å; C861-W884 HydrophobicContact CB-CZ3 3.64Å; D865-W884 HydrophobicContact CB-CE3 4.11Å; D865-W884 HydrophobicContact CB-CZ3 4.02Å; Y866-W884 HydrophobicContact CD1-CZ3 4.18Å; H867-W884 PolarHBondContact ND1-O 3.43Å; W884-K888 HydrophobicContact CB-CG 4.07Å; W884-K888 HydrophobicContact CD2-CD 4.49Å; W884-K888 HydrophobicContact CD2-CG 4.41Å; W884-K888 HydrophobicContact CG-CD 4.12Å; W884-K888 HydrophobicContact CG-CG 4.02Å; W884-I894 HydrophobicContact CH2-CG1 4.39Å; W884-I894 WeakPolarHBondContact CH2-O 3.29Å; W884-L896 HydrophobicContact CD2-CD2 3.94Å; W884-L896 HydrophobicContact CD2-CG 4.28Å; W884-L896 HydrophobicContact CE3-CD2 4.37Å; W884-L896 HydrophobicContact CG-CD1 4.5Å; W884-L896 HydrophobicContact CG-CD2 4.29Å; W884-L896 HydrophobicContact CH2-CD2 4.44Å; W884-L896 HydrophobicContact CZ2-CD2 4.06Å; W884-L896 HydrophobicContact CZ2-CG 3.81Å
885	R	83.9	Confident	83	Confident	139 Å²	139	70.2 Å²	70.2	53%	0.525	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-76.1	143.2	164.6	-64	173.7	-170.3	-86.3	-6.5	108.7	S864 D865 Y866 P887 K888	S864-R885 PolarHBondContact O-NE 3.44Å; D865-R885 WeakPolarHBondContact O-CB 3.47Å; D865-R885 WeakPolarHBondContact O-CG 3.44Å; D865-R885 PolarHBondContact O-N 3.05Å; Y866-R885 PolarHBondContact O-NE 3.48Å; Y866-R885 PolarHBondContact O-NH2 3Å; R885-P887 CarbonylContact O-C 3.58Å; R885-K888 WeakPolarHBondContact O-CA 3.27Å; R885-K888 PolarHBondContact O-N 3.41Å
886	E	79	Confident	83.6	Confident	183 Å²	183	68.6 Å²	68.6	86%	0.855	38%	0.378	S	S	*	.	S	Bend	trans	-102.9	138.8	175.9	-65	-176.4	169.8	0	0	110.1
887	P	79.1	Confident	84	Confident	104 Å²	104	69.8 Å²	69.8	68%	0.675	38%	0.381	S	S	*	.	S	Bend	cis	-68	147.1	-9.3	30.1	-34.9	0	0	0	112.2	R885 M889	R885-P887 CarbonylContact O-C 3.58Å; P887-M889 VanDerWaalsContact C-N 3.33Å; P887-M889 HydrophobicContact CB-CG 4.39Å; P887-M889 HydrophobicContact CB-SD 4.13Å; P887-M889 HydrophobicContact CG-CG 4.05Å; P887-M889 HydrophobicContact CG-SD 4.14Å; P887-M889 PolarHBondContact O-N 2.99Å
888	K	83.2	Confident	84.1	Confident	88 Å²	88	74.7 Å²	74.7	38%	0.383	40%	0.402	S	S	.	.			trans	-78.6	78.6	-177.6	-168.4	-150.9	176.6	-142.1	0	111.7	W884 R885 C890	W884-K888 HydrophobicContact CB-CG 4.07Å; W884-K888 HydrophobicContact CD2-CD 4.49Å; W884-K888 HydrophobicContact CD2-CG 4.41Å; W884-K888 HydrophobicContact CG-CD 4.12Å; W884-K888 HydrophobicContact CG-CG 4.02Å; R885-K888 WeakPolarHBondContact O-CA 3.27Å; R885-K888 PolarHBondContact O-N 3.41Å; K888-C890 VanDerWaalsContact CE-O 3.29Å; K888-C890 WeakPolarHBondContact CE-O 3.4Å; K888-C890 PolarHBondContact NZ-O 3.2Å; K888-C890 PolarHBondContact O-N 2.91Å
889	M	82.8	Confident	84	Confident	39 Å²	39	76 Å²	76	19%	0.192	41%	0.408	C	S	.	.			trans	-79.5	42.2	-178.7	-56.4	-55.4	-61.2	0	0	113.9	I794 P824 P859 P887	I794-M889 HydrophobicContact CD1-CB 3.68Å; I794-M889 HydrophobicContact CD1-CE 4.46Å; I794-M889 WeakPolarHBondContact CD1-O 3.21Å; P824-M889 HydrophobicContact CG-CE 4.13Å; P824-M889 HydrophobicContact CG-SD 3.99Å; P859-M889 WeakPolarHBondContact CG-O 3.05Å; P887-M889 VanDerWaalsContact C-N 3.33Å; P887-M889 HydrophobicContact CB-CG 4.39Å; P887-M889 HydrophobicContact CB-SD 4.13Å; P887-M889 HydrophobicContact CG-CG 4.05Å; P887-M889 HydrophobicContact CG-SD 4.14Å; P887-M889 PolarHBondContact O-N 2.99Å
890	C	86.3	Confident	83.9	Confident	5 Å²	5	77.5 Å²	77.5	3%	0.034	42%	0.415	C	S	.	.			trans	-151.2	148.2	178.3	72.8	0	0	0	0	113.1	P859 C861 K888	P859-C890 CarbonylContact O-C 3.57Å; P859-C890 WeakPolarHBondContact O-CA 3.47Å; P859-C890 WeakPolarHBondContact O-CB 3.37Å; C861-C890 VanDerWaalsContact CA-SG 3.51Å; C861-C890 HydrophobicContact CB-CB 3.9Å; C861-C890 WeakPolarHBondContact CB-SG 3.28Å; C861-C890 WeakPolarHBondContact SG-CB 3.49Å; C861-C890 PolarHBondContact SG-O 3.14Å; C861-C890 VanDerWaalsContact SG-O 3.4Å; C861-C890 CovalentContact SG-SG 2.04Å; C861-C890 PolarHBondContact SG-SG 2.99Å; K888-C890 VanDerWaalsContact CE-O 3.29Å; K888-C890 WeakPolarHBondContact CE-O 3.4Å; K888-C890 PolarHBondContact NZ-O 3.2Å; K888-C890 PolarHBondContact O-N 2.91Å
891	A	85.5	Confident	83.7	Confident	20 Å²	20	80.7 Å²	80.7	17%	0.165	43%	0.434	C	S	.	.			trans	-136.6	136.4	-175.3	0	0	0	0	0	111.8	V855 C858 P859 L860	V855-A891 HydrophobicContact CG2-CB 3.67Å; V855-A891 VanDerWaalsContact O-CB 3.26Å; V855-A891 WeakPolarHBondContact O-CB 3.04Å; C858-A891 HydrophobicContact CB-CB 4.06Å; P859-A891 PolarHBondContact O-N 3.07Å; L860-A891 WeakPolarHBondContact CA-O 3.32Å
892	G	83.1	Confident	83.5	Confident	54 Å²	54	80.9 Å²	80.9	56%	0.557	44%	0.435	S	S	*	.	S	Bend	trans	59.4	-154.2	-171	0	0	0	0	0	112.6	C861	C861-G892 WeakPolarHBondContact CB-O 3.22Å; C861-G892 PolarHBondContact N-O 3.44Å; C861-G892 PolarHBondContact SG-O 3.42Å
893	G	84.5	Confident	83.1	Confident	51 Å²	51	86.6 Å²	86.6	53%	0.526	47%	0.467	S	S	.	.	B	Isolated β-bridge	trans	80.5	-136.4	-175.3	0	0	0	0	0	111.5
894	I	85.3	Confident	82.6	Confident	76 Å²	76	83 Å²	83	39%	0.39	45%	0.451	S	S	.	.	S	Bend	trans	-75.9	147.2	176.7	60.9	163.6	0	0	0	112.4	C861 Y866 W884	C861-I894 WeakPolarHBondContact O-CG1 3.26Å; C861-I894 PolarHBondContact O-N 2.84Å; C861-I894 VanDerWaalsContact O-N 3.13Å; Y866-I894 HydrophobicContact CD1-CD1 4.07Å; Y866-I894 HydrophobicContact CE1-CD1 3.59Å; W884-I894 HydrophobicContact CH2-CG1 4.39Å; W884-I894 WeakPolarHBondContact CH2-O 3.29Å
895	S	84.1	Confident	81.8	Confident	98 Å²	98	90.2 Å²	90.2	69%	0.685	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-74.6	164.9	163.4	50	0	0	0	0	111.3
896	L	84.1	Confident	80.7	Confident	67 Å²	67	86.8 Å²	86.8	35%	0.351	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-65.4	130.6	165.3	-74.4	167.9	0	0	0	108.9	Y866 W884	Y866-L896 HydrophobicContact CG-CD2 4.46Å; W884-L896 HydrophobicContact CD2-CD2 3.94Å; W884-L896 HydrophobicContact CD2-CG 4.28Å; W884-L896 HydrophobicContact CE3-CD2 4.37Å; W884-L896 HydrophobicContact CG-CD1 4.5Å; W884-L896 HydrophobicContact CG-CD2 4.29Å; W884-L896 HydrophobicContact CH2-CD2 4.44Å; W884-L896 HydrophobicContact CZ2-CD2 4.06Å; W884-L896 HydrophobicContact CZ2-CG 3.81Å
897	P	83.9	Confident	79.7	Confident	49 Å²	49	85 Å²	85	32%	0.318	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-61.9	150.2	174	-21.3	32.2	0	0	0	112.1	Y866 Y882	Y866-P897 HydrophobicContact CE1-CG 4.33Å; Y882-P897 HydrophobicContact CD1-CB 4.28Å; Y882-P897 HydrophobicContact CD1-CG 3.96Å; Y882-P897 HydrophobicContact CD2-CB 3.81Å; Y882-P897 HydrophobicContact CD2-CG 4.33Å; Y882-P897 VanDerWaalsContact CD2-O 3.28Å; Y882-P897 WeakPolarHBondContact CD2-O 3.43Å; Y882-P897 HydrophobicContact CE1-CB 4.28Å; Y882-P897 HydrophobicContact CE1-CG 4.13Å; Y882-P897 HydrophobicContact CE2-CB 3.83Å; Y882-P897 HydrophobicContact CG-CB 4.06Å; Y882-P897 HydrophobicContact CG-CG 4.07Å
898	E	82.5	Confident	78.8	Confident	183 Å²	183	83.4 Å²	83.4	86%	0.855	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-61.5	152.2	175.4	-64	-172.5	164.4	0	0	112.2	Y882 K900	Y882-E898 WeakPolarHBondContact CE2-O 3.21Å; E898-K900 PolarHBondContact O-N 3.2Å
899	Q	80.9	Confident	77.8	Confident	88 Å²	88	85.9 Å²	85.9	41%	0.411	47%	0.47	S	S	.	.			trans	-61.4	107.9	-178	177.4	172.7	86.2	0	0	110.8	K879 T880 T881 V901	K879-Q899 HydrophobicContact CB-CG 4.19Å; T880-Q899 CarbonylContact O-C 3.53Å; T880-Q899 WeakPolarHBondContact O-CA 2.99Å; T881-Q899 PolarHBondContact OG1-NE2 2.03Å; Q899-V901 PolarHBondContact O-N 3.43Å
900	K	83.5	Confident	76.9	Confident	125 Å²	125	93.2 Å²	93.2	54%	0.543	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	116.9	-177.8	-173	174.9	-178.4	174.6	0	110.2	T880 Y882 E898 T902	T880-K900 PolarHBondContact N-O 2.89Å; T880-K900 PolarHBondContact O-N 2.83Å; Y882-K900 HydrophobicContact CE2-CB 4.49Å; E898-K900 PolarHBondContact O-N 3.2Å; K900-T902 HydrophobicContact CG-CG2 4.3Å
901	V	82.1	Confident	76	Confident	88 Å²	88	98.1 Å²	98.1	53%	0.533	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	133.1	175.8	-172.6	0	0	0	0	109.4	I877 Q899	I877-V901 HydrophobicContact CG2-CG1 3.47Å; I877-V901 VanDerWaalsContact CG2-CG1 3.47Å; Q899-V901 PolarHBondContact O-N 3.43Å
902	T	82.7	Confident	75	Confident	50 Å²	50	103 Å²	103	31%	0.307	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	144.4	-179.2	54.4	0	0	0	0	110.8	Q878 K900	Q878-T902 PolarHBondContact N-O 2.93Å; Q878-T902 PolarHBondContact O-N 2.87Å; Q878-T902 PolarHBondContact O-OG1 2.82Å; K900-T902 HydrophobicContact CG-CG2 4.3Å
903	I	78.8	Confident	74.5	Confident	166 Å²	166	103.3 Å²	103.3	85%	0.851	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	122.8	176.4	-58	174.6	0	0	0	108.1	G876	G876-I903 WeakPolarHBondContact O-CA 3.48Å
904	C	74.6	Confident	73.9	Confident	17 Å²	17	103 Å²	103	12%	0.115	53%	0.527	C	S	.	.			trans	-120	148.4	-179.1	60.1	0	0	0	0	110.2	C873 G876 I877 Q878	C873-C904 WeakPolarHBondContact CA-SG 3.41Å; C873-C904 HydrophobicContact CB-CB 3.89Å; C873-C904 WeakPolarHBondContact CB-SG 3.29Å; C873-C904 WeakPolarHBondContact SG-CB 3.16Å; C873-C904 CovalentContact SG-SG 2.03Å; C873-C904 PolarHBondContact SG-SG 3.46Å; G876-C904 CarbonylContact C-O 3.5Å; G876-C904 VanDerWaalsContact CA-O 3.3Å; G876-C904 WeakPolarHBondContact CA-O 3.47Å; G876-C904 PolarHBondContact O-N 2.93Å; I877-C904 PolarHBondContact N-SG 3.29Å; I877-C904 VanDerWaalsContact N-SG 3.43Å; Q878-C904 HydrophobicContact CB-CB 3.92Å
905	K	68.5	Low	73.6	Confident	204 Å²	204	104.3 Å²	104.3	89%	0.887	53%	0.533	S	S	*	.			trans	-105.8	123.6	174.1	-71.6	-178	176.4	179.3	0	109.2
906	T	60	Low	73	Confident	67 Å²	67	102.6 Å²	102.6	41%	0.411	52%	0.521	S	S	.	.			trans	-73	144.9	172.5	49.7	0	0	0	0	110.5	C873 D908	C873-T906 HydrophobicContact CB-CG2 4.35Å; T906-D908 PolarHBondContact O-N 2.93Å
907	I	59.5	Low	72.7	Confident	145 Å²	145	102 Å²	102	74%	0.744	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.4	-179.8	-67.7	169	0	0	0	112.1	F909 W910 L911	I907-F909 PolarHBondContact O-N 2.92Å; I907-W910 PolarHBondContact O-N 2.89Å; I907-L911 PolarHBondContact O-N 3.11Å
908	D	59.4	Low	72.6	Confident	72 Å²	72	101.4 Å²	101.4	39%	0.385	53%	0.528	S	S	.	.	H	α-helix	trans	-46.7	-33	176.8	-179.1	50.8	0	0	0	114.9	T906 K912	T906-D908 PolarHBondContact O-N 2.93Å; D908-K912 WeakPolarHBondContact O-CB 3.44Å; D908-K912 WeakPolarHBondContact O-CG 3.33Å; D908-K912 PolarHBondContact O-N 3.08Å; D908-K912 WeakPolarHBondContact OD1-CE 3.3Å; D908-K912 IonicContact OD1-NZ 2.96Å; D908-K912 PolarHBondContact OD1-NZ 3.45Å; D908-K912 IonicContact OD2-NZ 2.69Å; D908-K912 PolarHBondContact OD2-NZ 2.91Å
909	F	62.7	Low	72.6	Confident	139 Å²	139	96.2 Å²	96.2	61%	0.61	51%	0.509	S	S	*	.	H	α-helix	trans	-63.2	-48.5	174.8	-178.9	-96.3	0	0	0	112.5	I907 K912 V913	I907-F909 PolarHBondContact O-N 2.92Å; F909-K912 PolarHBondContact O-N 3.25Å; F909-V913 HydrophobicContact CD1-CG2 4.46Å; F909-V913 HydrophobicContact CE1-CG2 4.07Å; F909-V913 HydrophobicContact CZ-CG2 4.17Å; F909-V913 WeakPolarHBondContact O-CG2 3.48Å; F909-V913 PolarHBondContact O-N 3.4Å; F909-V913 VanDerWaalsContact O-N 3.08Å
910	W	62.2	Low	72.6	Confident	193 Å²	193	95.9 Å²	95.9	73%	0.731	52%	0.516	S	S	*	.	H	α-helix	trans	-70.2	-33.9	180	-73	109	0	0	0	112	I907 V913 G914	I907-W910 PolarHBondContact O-N 2.89Å; W910-V913 PolarHBondContact O-N 3.37Å; W910-G914 PolarHBondContact O-N 2.83Å
911	L	67.3	Low	72.5	Confident	108 Å²	108	94 Å²	94	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-61.6	-45.1	173.7	-165.2	74.1	0	0	0	111.2	I907 G914 I915	I907-L911 PolarHBondContact O-N 3.11Å; L911-G914 PolarHBondContact O-N 2.96Å; L911-I915 HydrophobicContact CG-CD1 4.09Å; L911-I915 WeakPolarHBondContact O-CG1 3.43Å; L911-I915 PolarHBondContact O-N 2.96Å
912	K	65.4	Low	72.6	Confident	123 Å²	123	92.3 Å²	92.3	54%	0.535	51%	0.51	S	S	.	.	H	α-helix	trans	-66.4	-35.8	177.9	-76	167	175.9	162.5	0	113.1	D908 F909 S916	D908-K912 WeakPolarHBondContact O-CB 3.44Å; D908-K912 WeakPolarHBondContact O-CG 3.33Å; D908-K912 PolarHBondContact O-N 3.08Å; D908-K912 WeakPolarHBondContact OD1-CE 3.3Å; D908-K912 IonicContact OD1-NZ 2.96Å; D908-K912 PolarHBondContact OD1-NZ 3.45Å; D908-K912 IonicContact OD2-NZ 2.69Å; D908-K912 PolarHBondContact OD2-NZ 2.91Å; F909-K912 PolarHBondContact O-N 3.25Å; K912-S916 PolarHBondContact O-N 2.69Å; K912-S916 VanDerWaalsContact O-N 3.07Å; K912-S916 PolarHBondContact O-OG 3.49Å
913	V	72.9	Confident	72.7	Confident	61 Å²	61	95 Å²	95	37%	0.37	52%	0.522	S	S	.	.	H	α-helix	trans	-68.2	-38.7	172	173.1	0	0	0	0	111.7	F909 W910 S916 A917	F909-V913 HydrophobicContact CD1-CG2 4.46Å; F909-V913 HydrophobicContact CE1-CG2 4.07Å; F909-V913 HydrophobicContact CZ-CG2 4.17Å; F909-V913 WeakPolarHBondContact O-CG2 3.48Å; F909-V913 PolarHBondContact O-N 3.4Å; F909-V913 VanDerWaalsContact O-N 3.08Å; W910-V913 PolarHBondContact O-N 3.37Å; V913-S916 PolarHBondContact O-OG 2.92Å; V913-S916 VanDerWaalsContact O-OG 3.12Å; V913-A917 WeakPolarHBondContact O-CB 3.09Å; V913-A917 PolarHBondContact O-N 3.3Å
914	G	72.1	Confident	72.9	Confident	45 Å²	45	92.3 Å²	92.3	46%	0.464	51%	0.508	S	S	.	.	H	α-helix	trans	-63	-45.1	174.4	0	0	0	0	0	112.8	W910 L911 A917 G918	W910-G914 PolarHBondContact O-N 2.83Å; L911-G914 PolarHBondContact O-N 2.96Å; G914-A917 PolarHBondContact O-N 2.96Å; G914-G918 PolarHBondContact O-N 3.03Å
915	I	77.8	Confident	73.3	Confident	103 Å²	103	96.9 Å²	96.9	53%	0.528	53%	0.531	S	S	.	.	H	α-helix	trans	-66.9	-38.2	179.1	-67.3	165.6	0	0	0	111.7	L911 T919	L911-I915 HydrophobicContact CG-CD1 4.09Å; L911-I915 WeakPolarHBondContact O-CG1 3.43Å; L911-I915 PolarHBondContact O-N 2.96Å; I915-T919 WeakPolarHBondContact O-CG2 3.35Å; I915-T919 PolarHBondContact O-N 2.69Å; I915-T919 PolarHBondContact O-OG1 3.36Å
916	S	73	Confident	74	Confident	61 Å²	61	91.1 Å²	91.1	43%	0.427	51%	0.513	S	S	.	.	H	α-helix	trans	-71.6	-37.3	176.7	65.5	0	0	0	0	112.6	K912 V913 T919 C920	K912-S916 PolarHBondContact O-N 2.69Å; K912-S916 VanDerWaalsContact O-N 3.07Å; K912-S916 PolarHBondContact O-OG 3.49Å; V913-S916 PolarHBondContact O-OG 2.92Å; V913-S916 VanDerWaalsContact O-OG 3.12Å; S916-T919 WeakPolarHBondContact CA-OG1 3.45Å; S916-T919 PolarHBondContact O-OG1 3.5Å; S916-C920 WeakPolarHBondContact O-CB 3.02Å; S916-C920 PolarHBondContact O-N 3.04Å; S916-C920 PolarHBondContact O-SG 2.96Å; S916-C920 VanDerWaalsContact O-SG 3.41Å
917	A	78	Confident	75	Confident	55 Å²	55	92.4 Å²	92.4	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-64.7	-42.7	172.3	0	0	0	0	0	112.3	V913 G914 T921	V913-A917 WeakPolarHBondContact O-CB 3.09Å; V913-A917 PolarHBondContact O-N 3.3Å; G914-A917 PolarHBondContact O-N 2.96Å; A917-T921 PolarHBondContact O-N 2.8Å; A917-T921 PolarHBondContact O-OG1 3.12Å
918	G	80.1	Confident	76	Confident	36 Å²	36	89 Å²	89	37%	0.371	50%	0.504	S	S	.	.	H	α-helix	trans	-63.7	-43.3	176.4	0	0	0	0	0	113.5	G914 T921 A922	G914-G918 PolarHBondContact O-N 3.03Å; G918-T921 WeakPolarHBondContact CA-OG1 3.36Å; G918-T921 PolarHBondContact O-N 3.44Å; G918-T921 PolarHBondContact O-OG1 3.13Å; G918-T921 VanDerWaalsContact O-OG1 3.04Å; G918-A922 WeakPolarHBondContact O-CB 3.41Å; G918-A922 PolarHBondContact O-N 3.2Å
919	T	82.6	Confident	76.9	Confident	74 Å²	74	89.9 Å²	89.9	45%	0.454	51%	0.512	S	S	.	.	H	α-helix	trans	-70.1	-41.4	177.5	47.4	0	0	0	0	112.2	I915 S916 T921 A922 I923	I915-T919 WeakPolarHBondContact O-CG2 3.35Å; I915-T919 PolarHBondContact O-N 2.69Å; I915-T919 PolarHBondContact O-OG1 3.36Å; S916-T919 WeakPolarHBondContact CA-OG1 3.45Å; S916-T919 PolarHBondContact O-OG1 3.5Å; T919-T921 PolarHBondContact O-N 3.5Å; T919-A922 PolarHBondContact O-N 3.35Å; T919-I923 VanDerWaalsContact O-CG1 3.28Å; T919-I923 WeakPolarHBondContact O-CG1 3.38Å; T919-I923 PolarHBondContact O-N 3.03Å
920	C	81.1	Confident	77.5	Confident	82 Å²	82	86.9 Å²	86.9	55%	0.554	51%	0.507	S	S	*	.	H	α-helix	trans	-59.2	-43	173.1	-79.3	0	0	0	0	112.8	S916 I923 L924	S916-C920 WeakPolarHBondContact O-CB 3.02Å; S916-C920 PolarHBondContact O-N 3.04Å; S916-C920 PolarHBondContact O-SG 2.96Å; S916-C920 VanDerWaalsContact O-SG 3.41Å; C920-I923 PolarHBondContact O-N 2.96Å; C920-L924 WeakPolarHBondContact O-CB 3.49Å; C920-L924 PolarHBondContact O-N 3.35Å
921	T	82.6	Confident	78.2	Confident	85 Å²	85	84 Å²	84	52%	0.521	50%	0.497	S	S	.	.	H	α-helix	trans	-69.1	-38.2	178.1	43.5	0	0	0	0	112.7	A917 G918 T919 I923 L924 L925	A917-T921 PolarHBondContact O-N 2.8Å; A917-T921 PolarHBondContact O-OG1 3.12Å; G918-T921 WeakPolarHBondContact CA-OG1 3.36Å; G918-T921 PolarHBondContact O-N 3.44Å; G918-T921 PolarHBondContact O-OG1 3.13Å; G918-T921 VanDerWaalsContact O-OG1 3.04Å; T919-T921 PolarHBondContact O-N 3.5Å; T921-I923 PolarHBondContact O-N 3.03Å; T921-L924 PolarHBondContact O-N 3.03Å; T921-L925 WeakPolarHBondContact O-CG 3.41Å; T921-L925 PolarHBondContact O-N 3.43Å
922	A	82.6	Confident	78.4	Confident	52 Å²	52	84.5 Å²	84.5	43%	0.43	50%	0.495	S	S	.	.	H	α-helix	trans	-63	-39.1	172.9	0	0	0	0	0	113	G918 T919 T926	G918-A922 WeakPolarHBondContact O-CB 3.41Å; G918-A922 PolarHBondContact O-N 3.2Å; T919-A922 PolarHBondContact O-N 3.35Å; A922-T926 WeakPolarHBondContact O-CG2 3.48Å; A922-T926 PolarHBondContact O-N 3.02Å; A922-T926 PolarHBondContact O-OG1 3.07Å
923	I	85.8	Confident	78.4	Confident	107 Å²	107	87.3 Å²	87.3	55%	0.549	50%	0.502	S	S	.	.	H	α-helix	trans	-66.2	-41.9	174.7	-68.4	165	0	0	0	110.7	T919 C920 T921 L925 T926 V927	T919-I923 VanDerWaalsContact O-CG1 3.28Å; T919-I923 WeakPolarHBondContact O-CG1 3.38Å; T919-I923 PolarHBondContact O-N 3.03Å; C920-I923 PolarHBondContact O-N 2.96Å; T921-I923 PolarHBondContact O-N 3.03Å; I923-L925 PolarHBondContact O-N 2.98Å; I923-T926 WeakPolarHBondContact CA-OG1 3.34Å; I923-T926 PolarHBondContact O-N 3.22Å; I923-T926 PolarHBondContact O-OG1 3.23Å; I923-V927 WeakPolarHBondContact O-CG2 3.37Å; I923-V927 PolarHBondContact O-N 3Å
924	L	83.5	Confident	78	Confident	109 Å²	109	92.6 Å²	92.6	57%	0.571	52%	0.52	S	S	*	.	H	α-helix	trans	-65.5	-40.5	178.9	-147.3	162.9	0	0	0	111.4	C920 T921 V927 L928	C920-L924 WeakPolarHBondContact O-CB 3.49Å; C920-L924 PolarHBondContact O-N 3.35Å; T921-L924 PolarHBondContact O-N 3.03Å; L924-V927 PolarHBondContact O-N 2.93Å; L924-L928 HydrophobicContact CD2-CD1 3.64Å; L924-L928 HydrophobicContact CD2-CG 4.13Å; L924-L928 WeakPolarHBondContact O-CG 3.31Å; L924-L928 PolarHBondContact O-N 3Å
925	L	83.1	Confident	77.4	Confident	114 Å²	114	96.5 Å²	96.5	60%	0.597	52%	0.524	S	S	*	.	H	α-helix	trans	-65.1	-39.7	174.6	-73.2	169.4	0	0	0	113.1	T921 I923 L928 T929	T921-L925 WeakPolarHBondContact O-CG 3.41Å; T921-L925 PolarHBondContact O-N 3.43Å; I923-L925 PolarHBondContact O-N 2.98Å; L925-L928 PolarHBondContact O-N 3.35Å; L925-T929 PolarHBondContact O-N 3.02Å; L925-T929 PolarHBondContact O-OG1 3.46Å; L925-T929 VanDerWaalsContact O-OG1 3.13Å
926	T	81.7	Confident	76.5	Confident	82 Å²	82	98 Å²	98	50%	0.503	53%	0.534	S	S	.	.	H	α-helix	trans	-71.8	-33.3	176.9	47.5	0	0	0	0	112.9	A922 I923 T929 C930	A922-T926 WeakPolarHBondContact O-CG2 3.48Å; A922-T926 PolarHBondContact O-N 3.02Å; A922-T926 PolarHBondContact O-OG1 3.07Å; I923-T926 WeakPolarHBondContact CA-OG1 3.34Å; I923-T926 PolarHBondContact O-N 3.22Å; I923-T926 PolarHBondContact O-OG1 3.23Å; T926-T929 WeakPolarHBondContact CA-OG1 3.5Å; T926-T929 PolarHBondContact O-OG1 2.9Å; T926-C930 WeakPolarHBondContact O-CB 3.28Å; T926-C930 PolarHBondContact O-N 3.38Å; T926-C930 PolarHBondContact O-SG 3.41Å; T926-C930 VanDerWaalsContact O-SG 3.39Å
927	V	82.6	Confident	75.4	Confident	94 Å²	94	102 Å²	102	57%	0.57	55%	0.546	S	S	*	.	H	α-helix	trans	-65.1	-40.8	169.5	170.5	0	0	0	0	111.2	I923 L924 Y931	I923-V927 WeakPolarHBondContact O-CG2 3.37Å; I923-V927 PolarHBondContact O-N 3Å; L924-V927 PolarHBondContact O-N 2.93Å; V927-Y931 WeakPolarHBondContact O-CB 3.16Å; V927-Y931 PolarHBondContact O-N 3.08Å
928	L	80.1	Confident	73.9	Confident	75 Å²	75	108.6 Å²	108.6	39%	0.393	56%	0.564	S	S	.	*	H	α-helix	trans	-65.1	-45.6	176.5	-77.3	167.2	0	0	0	112.6	L924 L925 Y931 F932	L924-L928 HydrophobicContact CD2-CD1 3.64Å; L924-L928 HydrophobicContact CD2-CG 4.13Å; L924-L928 WeakPolarHBondContact O-CG 3.31Å; L924-L928 PolarHBondContact O-N 3Å; L925-L928 PolarHBondContact O-N 3.35Å; L928-Y931 WeakPolarHBondContact O-CB 3.47Å; L928-Y931 PolarHBondContact O-N 3.49Å; L928-F932 WeakPolarHBondContact O-CD2 3.41Å; L928-F932 PolarHBondContact O-N 2.87Å
929	T	78.2	Confident	72.4	Confident	90 Å²	90	115 Å²	115	55%	0.552	59%	0.589	S	S	*	*	H	α-helix	trans	-65.6	-39.5	176.7	47.1	0	0	0	0	112	L925 T926 Y931 F932 W933	L925-T929 PolarHBondContact O-N 3.02Å; L925-T929 PolarHBondContact O-OG1 3.46Å; L925-T929 VanDerWaalsContact O-OG1 3.13Å; T926-T929 WeakPolarHBondContact CA-OG1 3.5Å; T926-T929 PolarHBondContact O-OG1 2.9Å; T929-Y931 VanDerWaalsContact C-N 3.33Å; T929-Y931 PolarHBondContact O-N 3Å; T929-F932 PolarHBondContact O-N 3.14Å; T929-W933 VanDerWaalsContact O-CB 3.31Å; T929-W933 WeakPolarHBondContact O-CB 3.32Å; T929-W933 PolarHBondContact O-N 2.98Å
930	C	75.7	Confident	70.5	Confident	76 Å²	76	120.4 Å²	120.4	51%	0.514	61%	0.609	S	S	.	*	H	α-helix	trans	-60.6	-38.4	170.5	-79.1	0	0	0	0	113	T926 K934	T926-C930 WeakPolarHBondContact O-CB 3.28Å; T926-C930 PolarHBondContact O-N 3.38Å; T926-C930 PolarHBondContact O-SG 3.41Å; T926-C930 VanDerWaalsContact O-SG 3.39Å; C930-K934 VanDerWaalsContact O-CB 3.29Å; C930-K934 WeakPolarHBondContact O-CB 3.31Å; C930-K934 PolarHBondContact O-N 3.44Å
931	Y	76.2	Confident	68.5	Low	131 Å²	131	127.1 Å²	127.1	51%	0.514	62%	0.624	S	S	.	*	H	α-helix	trans	-63.6	-47.1	174.8	173.2	-92	0	0	0	111.8	V927 L928 T929 K935	V927-Y931 WeakPolarHBondContact O-CB 3.16Å; V927-Y931 PolarHBondContact O-N 3.08Å; L928-Y931 WeakPolarHBondContact O-CB 3.47Å; L928-Y931 PolarHBondContact O-N 3.49Å; T929-Y931 VanDerWaalsContact C-N 3.33Å; T929-Y931 PolarHBondContact O-N 3Å; Y931-K935 HydrophobicContact CE1-CD 4Å; Y931-K935 VanDerWaalsContact O-CB 3.31Å; Y931-K935 WeakPolarHBondContact O-CB 3.29Å; Y931-K935 PolarHBondContact O-N 3.35Å
932	F	70.7	Confident	66.4	Low	119 Å²	119	130.6 Å²	130.6	52%	0.522	63%	0.632	S	S	.	*	H	α-helix	trans	-66.4	-40.9	177	-75.1	-67.1	0	0	0	112.7	L928 T929 K934 K935 N936	L928-F932 WeakPolarHBondContact O-CD2 3.41Å; L928-F932 PolarHBondContact O-N 2.87Å; T929-F932 PolarHBondContact O-N 3.14Å; F932-K934 PolarHBondContact O-N 3.19Å; F932-K935 WeakPolarHBondContact O-CB 3.43Å; F932-K935 PolarHBondContact O-N 3.33Å; F932-K935 VanDerWaalsContact O-N 3.14Å; F932-N936 PolarHBondContact O-N 2.91Å; F932-N936 VanDerWaalsContact O-N 3.08Å
933	W	67.1	Low	64.3	Low	182 Å²	182	138.4 Å²	138.4	69%	0.689	65%	0.652	S	S	*	*	H	α-helix	trans	-61	-45.9	176.8	-171.4	50.5	0	0	0	111.8	T929 K935 N936	T929-W933 VanDerWaalsContact O-CB 3.31Å; T929-W933 WeakPolarHBondContact O-CB 3.32Å; T929-W933 PolarHBondContact O-N 2.98Å; W933-K935 VanDerWaalsContact C-N 3.27Å; W933-K935 PolarHBondContact O-N 3.04Å; W933-N936 PolarHBondContact O-N 3.03Å
934	K	64.6	Low	61.9	Low	173 Å²	173	139 Å²	139	75%	0.752	67%	0.666	S	S	*	*	H	α-helix	trans	-67.1	-24.9	175.6	-166.1	171.5	-174.6	175.2	0	113.2	C930 F932	C930-K934 VanDerWaalsContact O-CB 3.29Å; C930-K934 WeakPolarHBondContact O-CB 3.31Å; C930-K934 PolarHBondContact O-N 3.44Å; F932-K934 PolarHBondContact O-N 3.19Å
935	K	59.3	Low	59.6	Low	126 Å²	126	142.4 Å²	142.4	55%	0.548	68%	0.676	S	S	.	*	H	α-helix	trans	-78.7	-31.9	177.7	-167.9	171.3	-176.4	173.8	0	113.2	Y931 F932 W933	Y931-K935 HydrophobicContact CE1-CD 4Å; Y931-K935 VanDerWaalsContact O-CB 3.31Å; Y931-K935 WeakPolarHBondContact O-CB 3.29Å; Y931-K935 PolarHBondContact O-N 3.35Å; F932-K935 WeakPolarHBondContact O-CB 3.43Å; F932-K935 PolarHBondContact O-N 3.33Å; F932-K935 VanDerWaalsContact O-N 3.14Å; W933-K935 VanDerWaalsContact C-N 3.27Å; W933-K935 PolarHBondContact O-N 3.04Å
936	N	58	Low	57.3	Low	135 Å²	135	144 Å²	144	72%	0.722	69%	0.685	S	S	*	*	H	α-helix	trans	-84.3	-11.5	-179	-84.8	10.2	0	0	0	115	F932 W933 K938	F932-N936 PolarHBondContact O-N 2.91Å; F932-N936 VanDerWaalsContact O-N 3.08Å; W933-N936 PolarHBondContact O-N 3.03Å; N936-K938 PolarHBondContact O-N 2.96Å
937	Q	49.5	Very low	55.1	Low	145 Å²	145	146.7 Å²	146.7	68%	0.678	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	14.6	-175.8	-101.9	-173.3	-7.6	0	0	116.8
938	K	46	Very low	52.7	Low	194 Å²	194	149.7 Å²	149.7	84%	0.843	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.2	6.1	-171.6	-143.2	-177.2	178.9	-177.4	0	116.7	N936	N936-K938 PolarHBondContact O-N 2.96Å
939	L	48.8	Very low	50.3	Low	169 Å²	169	153.2 Å²	153.2	89%	0.885	73%	0.729	S	S	*	*	S	Bend	trans	-141.3	54	-179.2	-86.6	176.5	0	0	0	114.3
940	E	42.5	Very low	48	Very low	189 Å²	189	153 Å²	153	88%	0.883	74%	0.736	S	S	*	*			trans	-141.1	25.6	169.5	-142.6	164.3	-134.1	0	0	115.1	K942	E940-K942 VanDerWaalsContact C-N 3.33Å; E940-K942 PolarHBondContact O-N 3.39Å
941	Y	40.5	Very low	45.9	Very low	222 Å²	222	155.4 Å²	155.4	87%	0.871	75%	0.749	S	S	*	*			trans	-88.7	68.2	165	-172.5	-99.8	0	0	0	111
942	K	38.3	Very low	43.9	Very low	159 Å²	159	156.4 Å²	156.4	69%	0.691	76%	0.762	S	S	*	*	S	Bend	trans	178.8	144.6	152.2	-105.3	159.6	-175	178.6	0	113.2	E940	E940-K942 VanDerWaalsContact C-N 3.33Å; E940-K942 PolarHBondContact O-N 3.39Å
943	Y	37.8	Very low	42	Very low	215 Å²	215	158.3 Å²	158.3	84%	0.843	77%	0.77	S	S	*	*			trans	68.5	62.4	166.8	-59.2	-63.8	0	0	0	119.4
944	S	36.1	Very low	40.5	Very low	121 Å²	121	155.1 Å²	155.1	85%	0.846	77%	0.767	S	S	*	*			trans	-101	90.1	139.1	52.1	0	0	0	0	110.8
945	K	34.4	Very low	39.1	Very low	180 Å²	180	152.6 Å²	152.6	78%	0.783	77%	0.77	S	S	*	*			trans	-165.6	122.1	156.5	-127.8	-175.6	177.6	-179.1	0	114.6
946	L	35	Very low	37.7	Very low	148 Å²	148	153.6 Å²	153.6	78%	0.775	78%	0.781	S	S	*	*			trans	66.6	149.2	162.5	-61.9	150.1	0	0	0	114.4
947	V	36.1	Very low	36.6	Very low	137 Å²	137	154.3 Å²	154.3	83%	0.83	78%	0.784	S	S	*	*			cis	-127.1	139.5	21.4	168.7	0	0	0	0	111.9
948	M	32.4	Very low	37.2	Very low	158 Å²	158	153.1 Å²	153.1	78%	0.778	79%	0.789	S	S	*	*			trans	-81.4	138.6	159.7	-72.8	169.1	137.6	0	0	109.9
949	N	29	Very low	36.5	Very low	149 Å²	149	148.4 Å²	148.4	80%	0.797	79%	0.786	S	S	*	*				166.1	142.9	120.3	-86.9	-23.3	0	0	0	113.2
950	A	30.5	Very low	35.6	Very low	85 Å²	85	144.8 Å²	144.8	70%	0.702	78%	0.78	S	S	*	*			trans	61.6	145.3	143.2	0	0	0	0	0	120.1
951	T	31.5	Very low	35.1	Very low	127 Å²	127	143.4 Å²	143.4	78%	0.779	78%	0.779	S	S	*	*			cis	-167.1	162.3	-14.5	21.6	0	0	0	0	109
952	L	33.1	Very low	34.9	Very low	151 Å²	151	137.5 Å²	137.5	79%	0.791	77%	0.771	S	S	*	*			trans	85.9	130.8	147.8	-123	80.1	0	0	0	121.9
953	K	31.1	Very low	34.6	Very low	159 Å²	159	136.2 Å²	136.2	69%	0.691	78%	0.78	S	S	*	*			trans	79.7	115.4	145.9	-88.6	-173.6	163.5	-80.1	0	123.5
954	D	35.3	Very low	34.2	Very low	115 Å²	115	130 Å²	130	62%	0.615	77%	0.773	S	S	*	*				62.1	125.5	129.2	-51.6	-7	0	0	0	123.4
955	C	35.4	Very low	34.1	Very low	121 Å²	121	131.8 Å²	131.8	82%	0.818	77%	0.771	S	S	*	*			trans	54.7	139.4	150.5	-60.6	0	0	0	0	119.5
956	D	30.5	Very low	34	Very low	146 Å²	146	130.6 Å²	130.6	78%	0.781	77%	0.77	S	S	*	*			cis	-153	-170.9	36.7	-139.3	-33.9	0	0	0	114.6
957	L	34.1	Very low	33.9	Very low	151 Å²	151	131.9 Å²	131.9	79%	0.791	77%	0.773	S	S	*	*			trans	-85.6	-170.3	-170.3	-63.7	161.9	0	0	0	114.9
958	P	62.9	Low	33.8	Very low	120 Å²	120	128.6 Å²	128.6	78%	0.779	77%	0.766	S	S	*	*				-136.5	178.6	-73.2	42.9	-27.3	0	0	0	114.4
959	A	31	Very low	33.6	Very low	94 Å²	94	130 Å²	130	78%	0.777	77%	0.771	S	S	*	*			trans	-169.7	134.7	148.6	0	0	0	0	0	114.6
960	A	31.3	Very low	33.8	Very low	93 Å²	93	129.4 Å²	129.4	77%	0.769	77%	0.768	S	S	*	*			trans	39	121.8	140.6	0	0	0	0	0	119.6
961	D	30.3	Very low	33.9	Very low	161 Å²	161	130.7 Å²	130.7	86%	0.861	77%	0.766	S	S	*	*			cis	56.3	141	29.4	-90.3	-10.4	0	0	0	115.5
962	S	37.7	Very low	34	Very low	98 Å²	98	132.7 Å²	132.7	69%	0.685	77%	0.767	S	S	*	*			cis	-163.5	165.1	-6.4	174.9	0	0	0	0	109.7
963	C	31	Very low	34.1	Very low	132 Å²	132	131.9 Å²	131.9	89%	0.892	76%	0.764	S	S	*	*			trans	-147.4	109	161.1	-93.7	0	0	0	0	110.5
964	A	30.5	Very low	34.2	Very low	83 Å²	83	130.5 Å²	130.5	69%	0.686	76%	0.764	S	S	*	*			trans	-169.2	121.1	147.7	0	0	0	0	0	115.2
965	I	33.1	Very low	34.1	Very low	159 Å²	159	131.3 Å²	131.3	82%	0.815	77%	0.767	S	S	*	*				30.6	122.9	126.6	-28.2	172.5	0	0	0	119.1
966	M	31.4	Very low	34	Very low	155 Å²	155	131.5 Å²	131.5	76%	0.764	76%	0.759	S	S	*	*				176.6	175.4	108.5	-90.9	-161.7	-38.4	0	0	114.4
967	E	34.1	Very low	34	Very low	176 Å²	176	132.2 Å²	132.2	82%	0.822	76%	0.755	S	S	*	*			trans	-38.2	160.6	169	-59.6	134.4	174.1	0	0	114.9
968	G	32.8	Very low	33.8	Very low	68 Å²	68	130.6 Å²	130.6	70%	0.701	75%	0.752	S	S	*	*			cis	164.9	177.2	1.9	0	0	0	0	0	111.6
969	E	29.9	Very low	32.2	Very low	188 Å²	188	129.7 Å²	129.7	88%	0.879	75%	0.748	S	S	*	*			trans	63.4	149.4	165.4	-76.2	176.1	155.2	0	0	122
970	D	32	Very low	32.2	Very low	136 Å²	136	134.7 Å²	134.7	73%	0.727	75%	0.752	S	S	*	*			trans	72.4	116.7	145.9	-71.8	10.5	0	0	0	126.4
971	V	32.7	Very low	32.1	Very low	111 Å²	111	139.9 Å²	139.9	67%	0.673	76%	0.758	S	S	*	*				79.2	100.5	125.2	179.8	0	0	0	0	120.3
972	E	35	Very low	32.3	Very low	169 Å²	169	137 Å²	137	79%	0.79	75%	0.75	S	S	*	*				60.4	155.1	129.6	-59.5	-172.2	144.2	0	0	123.6
973	D	35.3	Very low	32.1	Very low	135 Å²	135	140.3 Å²	140.3	72%	0.722	76%	0.76	S	S	*	*			trans	67.4	87.4	152.2	-70.2	11.6	0	0	0	122.3
974	D	32.4	Very low	32.3	Very low	129 Å²	129	143.4 Å²	143.4	69%	0.69	76%	0.758	S	S	*	*				95.1	139.6	106.7	-113.2	6.1	0	0	0	121.9
975	L	33.1	Very low	32.4	Very low	132 Å²	132	142.5 Å²	142.5	69%	0.691	76%	0.757	S	S	*	*			trans	46.2	127.3	145	-63.4	170.9	0	0	0	118.7
976	I	33.2	Very low	32.4	Very low	125 Å²	125	144.8 Å²	144.8	64%	0.641	76%	0.761	S	S	*	*			cis	177.7	172.2	43.3	-143.4	160.5	0	0	0	113.3
977	F	30.8	Very low	32.7	Very low	162 Å²	162	144.7 Å²	144.7	71%	0.711	76%	0.762	S	S	*	*			trans	50.6	86.4	161.5	-68	-54.5	0	0	0	123.6
978	T	29.1	Very low	32.6	Very low	116 Å²	116	144.5 Å²	144.5	71%	0.712	76%	0.759	S	S	*	*				59.3	138.7	113.7	58.5	0	0	0	0	124.8
979	S	28.7	Very low	32.5	Very low	101 Å²	101	146.7 Å²	146.7	71%	0.706	76%	0.763	S	S	*	*			trans	94.8	126.8	144.7	84.2	0	0	0	0	117
980	K	32.1	Very low	32.5	Very low	199 Å²	199	145.7 Å²	145.7	87%	0.865	76%	0.756	S	S	*	*				-150.5	171.9	53.9	-84.4	162.8	-179.7	164.1	0	114.1
981	K	29.9	Very low	32.4	Very low	202 Å²	202	145.2 Å²	145.2	88%	0.878	76%	0.758	S	S	*	*			trans	-83.3	145.1	176.4	-76.6	177.7	174.1	175.5	0	112.8
982	S	34.3	Very low	32.4	Very low	101 Å²	101	144.3 Å²	144.3	71%	0.706	76%	0.757	S	S	*	*			trans	30.9	132.4	133.9	-170.3	0	0	0	0	120.6
983	L	33.2	Very low	32.3	Very low	168 Å²	168	144.8 Å²	144.8	88%	0.88	76%	0.757	S	S	*	*			trans	-137.1	139.9	150.3	-107.6	165.7	0	0	0	111.2
984	F	34	Very low	32.1	Very low	196 Å²	196	149 Å²	149	86%	0.86	76%	0.762	S	S	*	*			trans	-73.1	163	172.1	-67.2	-111.7	0	0	0	109.8
985	G	32.6	Very low	32.3	Very low	65 Å²	65	147.3 Å²	147.3	67%	0.67	76%	0.757	S	S	*	*			cis	144.1	-168.6	7.8	0	0	0	0	0	110
986	K	33.9	Very low	33.3	Very low	206 Å²	206	146.9 Å²	146.9	90%	0.896	76%	0.762	S	S	*	*			trans	73.4	155.5	176.4	-60.8	174.8	172.8	175.1	0	115.1
987	I	37.9	Very low	33.3	Very low	153 Å²	153	147.2 Å²	147.2	79%	0.785	77%	0.765	S	S	*	*			cis	-146.7	176.1	1.4	-131.6	162	0	0	0	114.2
988	K	31.2	Very low	33.5	Very low	172 Å²	172	142.9 Å²	142.9	75%	0.748	77%	0.766	S	S	*	*			trans	-74	155.6	-170.6	-50.1	166.6	176.3	177.2	0	117.3
989	S	30.6	Very low	33.6	Very low	115 Å²	115	146.8 Å²	146.8	80%	0.804	77%	0.773	S	S	*	*			trans	-175.3	149.9	132	54	0	0	0	0	112.1
990	F	30.3	Very low	33.7	Very low	167 Å²	167	148.2 Å²	148.2	73%	0.732	77%	0.773	S	S	*	*			cis	-176	140.1	-32.2	-131.3	-71.4	0	0	0	108.1
991	T	30.6	Very low	33.8	Very low	125 Å²	125	144.2 Å²	144.2	77%	0.767	77%	0.77	S	S	*	*			trans	62	153.7	160	38.3	0	0	0	0	120.4
992	S	31.9	Very low	33.8	Very low	92 Å²	92	140.2 Å²	140.2	64%	0.643	76%	0.762	S	S	*	*			cis	-171.5	162.7	-16.7	-164.8	0	0	0	0	112.6
993	K	32.9	Very low	34.3	Very low	180 Å²	180	140.6 Å²	140.6	78%	0.783	76%	0.763	S	S	*	*			trans	71.2	146.1	157.6	-80.8	162.2	-174.3	173.9	0	118.3
994	R	31.7	Very low	34.2	Very low	223 Å²	223	139.6 Å²	139.6	84%	0.842	76%	0.757	S	S	*	*			cis	-153.7	157.3	-4.1	-155.3	176.4	-174.7	154	0.3	111
995	T	35.4	Very low	33.9	Very low	93 Å²	93	138.3 Å²	138.3	57%	0.571	75%	0.751	S	S	*	*			trans	-81.9	173.1	166.9	58.1	0	0	0	0	111.6	D997	T995-D997 WeakPolarHBondContact CB-OD1 3.36Å; T995-D997 PolarHBondContact OG1-OD1 3.01Å; T995-D997 PolarHBondContact OG1-OD2 3.25Å
996	P	54.5	Low	33.7	Very low	124 Å²	124	140.5 Å²	140.5	81%	0.805	75%	0.752	S	S	*	*				-122	-175.6	74.6	4.4	18.3	0	0	0	114.7
997	D	33.9	Very low	33.4	Very low	132 Å²	132	135.5 Å²	135.5	71%	0.706	74%	0.743	S	S	*	*				-179.9	137.2	-55.2	-83.2	-24	0	0	0	109.5	T995	T995-D997 WeakPolarHBondContact CB-OD1 3.36Å; T995-D997 PolarHBondContact OG1-OD1 3.01Å; T995-D997 PolarHBondContact OG1-OD2 3.25Å
998	G	34.2	Very low	33.1	Very low	70 Å²	70	133.8 Å²	133.8	72%	0.722	74%	0.744	S	S	*	*			trans	95.5	145.1	161.8	0	0	0	0	0	118.4
999	F	32.2	Very low	33	Very low	198 Å²	198	129.4 Å²	129.4	87%	0.868	75%	0.748	S	S	*	*			cis	-150.5	173.4	-1.6	-126.1	-86.1	0	0	0	111.9
1000	D	31.2	Very low	33	Very low	132 Å²	132	127.6 Å²	127.6	71%	0.706	75%	0.748	S	S	*	*			trans	-48.3	165	-175.5	-65.1	-57	0	0	0	117.7
1001	S	33.6	Very low	34.1	Very low	115 Å²	115	125 Å²	125	80%	0.804	75%	0.747	S	S	*	*			cis	-148.6	173.3	30.7	61	0	0	0	0	118.1
1002	V	30.5	Very low	34.1	Very low	118 Å²	118	126.1 Å²	126.1	72%	0.715	75%	0.749	S	S	*	*			trans	-130.8	167.9	-163.1	161.1	0	0	0	0	107.6
1003	P	44.9	Very low	34.1	Very low	109 Å²	109	129.4 Å²	129.4	71%	0.708	76%	0.756	S	S	*	*			cis	-120.4	-179.3	7.7	23.2	3.9	0	0	0	113.4
1004	L	29.1	Very low	34.1	Very low	147 Å²	147	127 Å²	127	77%	0.77	75%	0.752	S	S	*	*			cis	65.1	155.7	40.5	-60.2	170	0	0	0	114.2
1005	K	28.1	Very low	34.1	Very low	168 Å²	168	128.5 Å²	128.5	73%	0.73	78%	0.775	S	S	*	*			cis	-173.9	161.5	-36.1	-161.8	-165.7	-174.9	-178.3	0	107.3
1006	T	28.7	Very low	34	Very low	112 Å²	112	130.3 Å²	130.3	69%	0.687	79%	0.785	S	S	*	*			trans	65.2	124.1	150.7	29.4	0	0	0	0	122.5
1007	S	28.1	Very low	32.9	Very low	100 Å²	100	130.6 Å²	130.6	70%	0.699	78%	0.784	S	S	*	*				59.8	91	119	-166.7	0	0	0	0	120.8
1008	S	31.4	Very low	32.9	Very low	117 Å²	117	130.5 Å²	130.5	82%	0.818	79%	0.788	S	S	*	*			trans	17.7	125.3	132.5	58.4	0	0	0	0	121.2
1009	G	28.4	Very low	32.8	Very low	81 Å²	81	134.1 Å²	134.1	84%	0.835	79%	0.792	S	S	*	*			trans	-154.2	130.2	147.7	0	0	0	0	0	109
1010	G	32.1	Very low	32.8	Very low	77 Å²	77	130.1 Å²	130.1	79%	0.794	79%	0.788	S	S	*	*			trans	-97	-150.7	178.7	0	0	0	0	0	112.7
1011	P	51.6	Low	32.9	Very low	111 Å²	111	129.9 Å²	129.9	72%	0.721	79%	0.793	S	S	*	*			cis	-136.4	-167.4	1.7	43.1	-25.3	0	0	0	115.3
1012	D	31.4	Very low	32.9	Very low	150 Å²	150	131 Å²	131	80%	0.802	79%	0.792	S	S	*	*			trans	79.7	146.5	156.2	-70.1	-32.1	0	0	0	123.2
1013	M	31.7	Very low	33.1	Very low	161 Å²	161	132 Å²	132	79%	0.793	80%	0.798	S	S	*	*			trans	64.4	129.1	176.9	-61.4	-175.8	71.1	0	0	116.5
1014	D	34.3	Very low	32.1	Very low	130 Å²	130	133.9 Å²	133.9	70%	0.695	81%	0.806	S	S	*	*			cis	-148.1	167	3	-99.3	-25.5	0	0	0	111.3
1015	L	30.1	Very low	32.4	Very low	253 Å²	253	132.7 Å²	132.7	100%	1.325	81%	0.809	S	S	*	*			trans	76.3	0	177.6	-74.4	158.7	0	0	0	117.5

Retrieved 1,015 of 1,015 residues in 434.4 ms (Link to these results)

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