A0A3Q0KQ45_SCHMA Loading...

Protein-tyrosine-phosphatase AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KQ45, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,373 aa.

						>A0A3Q0KQ45_SCHMA|A0A3Q0KQ45
MFEAANALVLFSAVIIHPNIWCIKLSTLPVPLLRTNVTRHFRVGSDITLKCGENHHLNPTLVLWLDPLNKTTSKETISLRNASIAQSGEYYCRLFLNGDLKYHQSLLVVIQDKPFSPTSIVIQALSESSMNVSWVFGNSQNSPISLHTVYLHDNNSLVLQKNVSSPLSSTTLHNLKPYTCYTLYIRALNDIGWSEFSKPSHSLTLPGLPVAHPAVHIINVSSHSISLDVGIATLKDVIQDNVKRCIDQDARFISLLHGPLVGYIVTVATTQPYKFASKTLYNASGSYSQIVDISHLKPYTRYNLSFAFYNGRFSGPFTSLVVSTTEGIPGKPRIKNFESSSNSLSIDWDSNADAVGKILAYKLELHTCSKNDTQSSKRLKTVQVDSKELQFVFGNLDHNTCYIIRVASATKAGFGHFSEIEVRTKFEAPSPPVAVGAFLLDTNDILINWTCSNESSSILKNPQYLICWHFHSFLSEQKCLLTQTSSKKELAYCYCDQQQQFQWTVIPLSVFKEAKSGRIIFTIRSSVSQTNCTDYVNCEIQSENSNEISLNLSSSTQRYFHTTLKYHLKLDNIAIVGIVSITLLVFFCVIIGACFANRVHCFLIMCRETGSCYRKTDISTKYKRIAPFHLSKNTYKAISSKEFRAHVNACHADDDAGFQAEFESLEQNVQTNWSTSVARSSENIAKNRYSNILAYDHSRVILKETGSKSDYINANYVDGYHRRAAYIAAQGPIPSTFDDFWLMVWEQNSNVIVMISNFVERGRRKCDKYWPSSGHQTYGNVSVRMISEVVRAFFTIRVFSVRHIKTKRGSKDRLVYHYQYTDWRDFDVPPSPLPVLKFVEASVTHWTFDRGPIVVHCSAGVGRTGTYICIESLIRQLKVEQAVSVRGFLEHIRQQRMKLVQTEQQYAFIHDALREYILYPYHSIRPLNFSDYLRHLYELDSTGTSNLMRQFEMCMDFRCDSAGSLHSGTLNVDQTKLPYCSSTTDSSGIDSSVLHGFLNVCEYIVTRHPLGNSVTEFWKVVWDANSSLIICLSDQNLLPFWPDEVEQTRTIGWLHINFARMDQCSDSLVRFQFLLTSDREDYALACTLLHFSAWPSIDLENPHESRIASDLLELATHLENDNSEFSNSSAPIVLVDNTGGYRVGIFCAIRILISQFLNDLLLDVYFVFKMLCLQRPHLFRGYWDLEFVYTLMQYYLKNESSPSWQSNSIGSRYATLYYMLEGRDNSSKVSTGDQHTSPRRILGNLFSGRRRLTYPKCQRPTRNNNDSLLFNETTTISRNNSFRNHSNYNNSFLQHTSQHLCNSISNRTCIFTDPYHQEEPLLSNHFSNNRGHAVYRLLSKHQSVEFLSFQSINNHNNNNRKYFTGNQMEYPTL
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	35	Very low	227 Å²	227	146.3 Å²	146.3	100%	1.118	80%	0.799	S	S	*	*				0	119.9	0	-167.8	-172.8	-65.3	0	0	105.7
2	F	35.5	Very low	34.9	Very low	201 Å²	201	142.4 Å²	142.4	88%	0.882	79%	0.79	S	S	*	*			trans	63.5	130.9	-166.9	-74	-80.1	0	0	0	117.2
3	E	29	Very low	34.7	Very low	182 Å²	182	138.5 Å²	138.5	85%	0.85	79%	0.788	S	S	*	*			trans	-136.6	175.9	-177.2	-60.5	167	96.3	0	0	107.9
4	A	35.1	Very low	34.9	Very low	100 Å²	100	139 Å²	139	83%	0.826	80%	0.795	S	S	*	*			trans	69.1	164.1	149.3	0	0	0	0	0	119.7
5	A	37.2	Very low	34.9	Very low	75 Å²	75	139.7 Å²	139.7	62%	0.62	79%	0.793	S	S	*	*			cis	-175	153	-37.5	0	0	0	0	0	110.1
6	N	36.1	Very low	35.1	Very low	163 Å²	163	141.5 Å²	141.5	87%	0.872	80%	0.797	S	S	*	*			trans	61.8	166.4	150	-67.5	-16.2	0	0	0	118.8
7	A	34	Very low	34.9	Very low	76 Å²	76	143.3 Å²	143.3	63%	0.628	80%	0.797	S	S	*	*			cis	-167.7	-157	-30.7	0	0	0	0	0	108.2
8	L	36.5	Very low	35.3	Very low	162 Å²	162	140.5 Å²	140.5	85%	0.848	79%	0.786	S	S	*	*			trans	84.6	136.9	174.7	-70.4	107.8	0	0	0	117.7
9	V	37.9	Very low	35.3	Very low	108 Å²	108	141 Å²	141	66%	0.655	79%	0.787	S	S	*	*			cis	-164.5	150.6	-17.7	100	0	0	0	0	111.8
10	L	34.6	Very low	35.3	Very low	123 Å²	123	141.7 Å²	141.7	64%	0.644	79%	0.787	S	S	*	*			trans	32	143.8	155	-60.4	160	0	0	0	121.1
11	F	36.3	Very low	35.3	Very low	192 Å²	192	146.1 Å²	146.1	84%	0.842	79%	0.792	S	S	*	*				-151.4	177.7	53.6	-100.5	-81.3	0	0	0	115.1
12	S	33.5	Very low	35.3	Very low	100 Å²	100	141.1 Å²	141.1	70%	0.699	78%	0.779	S	S	*	*			trans	-122.6	155	-155.2	56.2	0	0	0	0	117.1
13	A	32.5	Very low	35.4	Very low	92 Å²	92	139.6 Å²	139.6	76%	0.76	78%	0.778	S	S	*	*			trans	-27.2	147.5	171.4	0	0	0	0	0	120.8
14	V	37.1	Very low	35.6	Very low	145 Å²	145	139.7 Å²	139.7	88%	0.879	78%	0.775	S	S	*	*			trans	-134	151.9	146.1	-179.9	0	0	0	0	108.6
15	I	35.2	Very low	35.5	Very low	149 Å²	149	142.4 Å²	142.4	76%	0.764	78%	0.775	S	S	*	*			trans	-101.9	153.2	-172.3	-59.3	158.2	0	0	0	110.1
16	I	37.8	Very low	35.4	Very low	169 Å²	169	143.5 Å²	143.5	87%	0.867	78%	0.778	S	S	*	*			trans	170	152.9	137.3	-87.2	154.9	0	0	0	111.9
17	H	31.9	Very low	35.4	Very low	172 Å²	172	141.6 Å²	141.6	80%	0.796	77%	0.773	S	S	*	*			trans	-143.4	168.3	-173.2	-150.3	2	0	0	0	106.4
18	P	42.4	Very low	35.5	Very low	93 Å²	93	146 Å²	146	60%	0.604	79%	0.785	S	S	*	*			cis	-113.1	-173.1	-38	13.8	11.2	0	0	0	112.2
19	N	34.7	Very low	35.6	Very low	150 Å²	150	143.8 Å²	143.8	80%	0.802	78%	0.78	S	S	*	*			trans	28.1	129	150.9	-59	-15.9	0	0	0	121.5
20	I	36	Very low	35.4	Very low	154 Å²	154	144.6 Å²	144.6	79%	0.79	79%	0.785	S	S	*	*				-178.5	128.5	121.1	-95.5	155.9	0	0	0	113.2
21	W	34.2	Very low	35.6	Very low	235 Å²	235	143.7 Å²	143.7	89%	0.89	79%	0.787	S	S	*	*			trans	43.4	140.4	148	-66.8	47.5	0	0	0	123.4
22	C	33.3	Very low	35.8	Very low	123 Å²	123	142.6 Å²	142.6	83%	0.831	79%	0.789	S	S	*	*			trans	-83.7	143.1	166.3	-52.5	0	0	0	0	112.6
23	I	38.9	Very low	36.2	Very low	169 Å²	169	144.1 Å²	144.1	87%	0.867	79%	0.788	S	S	*	*			trans	-132.5	150.1	157.8	-64.5	-175.7	0	0	0	108.8
24	K	31.5	Very low	36.8	Very low	184 Å²	184	149.3 Å²	149.3	80%	0.8	79%	0.788	S	S	*	*			trans	-105.8	177.6	-174.9	-95.4	-177.3	173.5	179.2	0	112.4
25	L	33.6	Very low	37.5	Very low	156 Å²	156	144.9 Å²	144.9	82%	0.817	76%	0.761	S	S	*	*			trans	82.3	118.3	166.6	-63.9	119.4	0	0	0	114
26	S	36.2	Very low	38.9	Very low	98 Å²	98	143 Å²	143	69%	0.685	75%	0.753	S	S	*	*				93.7	145.8	55.2	81	0	0	0	0	111.7
27	T	35.6	Very low	40.5	Very low	124 Å²	124	137.2 Å²	137.2	76%	0.761	73%	0.725	S	S	*	*			cis	-148.9	144.6	11.1	44.4	0	0	0	0	110.7
28	L	35.4	Very low	42.9	Very low	168 Å²	168	132.3 Å²	132.3	88%	0.88	71%	0.708	S	S	*	*			trans	-145.1	163.7	160.1	-86.1	177.4	0	0	0	110.4
29	P	38.6	Very low	45	Very low	116 Å²	116	131.8 Å²	131.8	75%	0.753	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-69.9	153.7	-157.9	-23.2	35	0	0	0	117	P31	P29-P31 WeakPolarHBondContact O-CD 3.22Å
30	V	34	Very low	47.6	Very low	125 Å²	125	129.9 Å²	129.9	76%	0.758	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-79.3	120.2	-175.8	175.5	0	0	0	0	112.2
31	P	38.5	Very low	50.1	Low	104 Å²	104	124.9 Å²	124.9	68%	0.675	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-76.5	159.6	161	-6.9	25.7	0	0	0	110.8	P29 L33	P29-P31 WeakPolarHBondContact O-CD 3.22Å; P31-L33 PolarHBondContact O-N 3.03Å; P31-L33 VanDerWaalsContact O-N 3.11Å
32	L	41.4	Very low	52.7	Low	169 Å²	169	120.5 Å²	120.5	89%	0.885	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-48.4	118.1	173.9	-79.2	160.5	0	0	0	111.4	R34	L32-R34 VanDerWaalsContact C-N 3.32Å; L32-R34 PolarHBondContact O-N 3.07Å
33	L	40.5	Very low	55.3	Low	131 Å²	131	117.4 Å²	117.4	69%	0.686	61%	0.613	S	S	*	*			trans	-76.9	74.8	-164.8	-157.5	86.6	0	0	0	112.8	P31 T35	P31-L33 PolarHBondContact O-N 3.03Å; P31-L33 VanDerWaalsContact O-N 3.11Å; L33-T35 VanDerWaalsContact C-N 3.31Å; L33-T35 HydrophobicContact CD2-CG2 3.8Å; L33-T35 HydrophobicContact CG-CG2 4.07Å; L33-T35 PolarHBondContact O-N 3.4Å; L33-T35 PolarHBondContact O-OG1 3.22Å
34	R	46.2	Very low	57.6	Low	201 Å²	201	111 Å²	111	76%	0.758	59%	0.588	S	S	*	*			trans	-60.4	90.3	169.2	-85.2	-171.9	169.6	177.8	-2.9	110.5	L32 N36	L32-R34 VanDerWaalsContact C-N 3.32Å; L32-R34 PolarHBondContact O-N 3.07Å; R34-N36 PolarHBondContact O-N 3.21Å
35	T	52.3	Low	60.3	Low	52 Å²	52	104 Å²	104	32%	0.319	56%	0.562	S	S	.	*			trans	-93.1	88.3	172.3	38.9	0	0	0	0	108.8	L33 V37	L33-T35 VanDerWaalsContact C-N 3.31Å; L33-T35 HydrophobicContact CD2-CG2 3.8Å; L33-T35 HydrophobicContact CG-CG2 4.07Å; L33-T35 PolarHBondContact O-N 3.4Å; L33-T35 PolarHBondContact O-OG1 3.22Å; T35-V37 VanDerWaalsContact C-N 3.26Å; T35-V37 PolarHBondContact O-N 3.46Å
36	N	63.8	Low	63	Low	109 Å²	109	101.7 Å²	101.7	58%	0.583	55%	0.551	S	S	*	*			trans	-69.2	87.6	168.3	-75.2	27.4	0	0	0	108.3	R34	R34-N36 PolarHBondContact O-N 3.21Å
37	V	71.5	Confident	65.5	Low	48 Å²	48	97.1 Å²	97.1	29%	0.291	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	133.8	178.7	176.8	0	0	0	0	108.4	T35 R39 S105 L106 L107	T35-V37 VanDerWaalsContact C-N 3.26Å; T35-V37 PolarHBondContact O-N 3.46Å; V37-R39 HydrophobicContact CG1-CG 4.16Å; V37-S105 PolarHBondContact N-O 3.42Å; V37-L106 HydrophobicContact CB-CD1 3.74Å; V37-L106 HydrophobicContact CG1-CD1 3.74Å; V37-L106 CarbonylContact O-C 3.54Å; V37-L106 WeakPolarHBondContact O-CA 3.31Å; V37-L107 PolarHBondContact O-N 3.29Å
38	T	82.8	Confident	68	Low	70 Å²	70	95.3 Å²	95.3	43%	0.429	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131.7	168.6	-54.5	0	0	0	0	109.1	L107 V109	T38-L107 CarbonylContact C-O 3.54Å; T38-L107 VanDerWaalsContact CA-O 3.3Å; T38-L107 WeakPolarHBondContact CA-O 3.35Å; T38-L107 HydrophobicContact CG2-CB 4.29Å; T38-L107 HydrophobicContact CG2-CD2 4.09Å; T38-L107 HydrophobicContact CG2-CG 4.18Å; T38-V109 HydrophobicContact CG2-CG2 3.96Å
39	R	85	Confident	70.4	Confident	82 Å²	82	87.3 Å²	87.3	31%	0.309	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.7	172.5	-69.6	-173.1	179.5	-179.1	1	109.8	V37 F41 E53 L106 L107 V109	V37-R39 HydrophobicContact CG1-CG 4.16Å; R39-F41 HydrophobicContact CB-CD2 4.33Å; R39-F41 HydrophobicContact CB-CE2 3.46Å; R39-F41 VanDerWaalsContact CB-CE2 3.46Å; R39-F41 HydrophobicContact CB-CZ 3.82Å; R39-E53 IonicContact CZ-OE2 3.13Å; R39-E53 IonicContact NH1-OE1 3.67Å; R39-E53 IonicContact NH1-OE2 3.22Å; R39-E53 PolarHBondContact NH1-OE2 2.77Å; R39-E53 IonicContact NH2-OE2 2.77Å; R39-E53 PolarHBondContact NH2-OE2 2.79Å; R39-L106 HydrophobicContact CG-CD1 4.11Å; R39-L107 PolarHBondContact N-O 3.39Å; R39-V109 PolarHBondContact O-N 3.04Å
40	H	89.2	Confident	72.6	Confident	109 Å²	109	86.5 Å²	86.5	51%	0.505	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137.5	177.6	-66.7	-100.7	0	0	0	110.4	V109 Q111	H40-V109 CarbonylContact C-O 3.6Å; H40-V109 WeakPolarHBondContact CA-O 3.34Å; H40-Q111 PolarHBondContact ND1-NE2 2.86Å
41	F	89.2	Confident	74.7	Confident	50 Å²	50	81 Å²	81	22%	0.219	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	159.3	178.6	-59.8	-83.1	0	0	0	110.7	R39 I47 V108 V109 I110 Q111	R39-F41 HydrophobicContact CB-CD2 4.33Å; R39-F41 HydrophobicContact CB-CE2 3.46Å; R39-F41 VanDerWaalsContact CB-CE2 3.46Å; R39-F41 HydrophobicContact CB-CZ 3.82Å; F41-I47 HydrophobicContact CB-CD1 3.65Å; F41-I47 HydrophobicContact CB-CG1 4.18Å; F41-I47 HydrophobicContact CD1-CD1 4.07Å; F41-I47 HydrophobicContact CD1-CG1 3.79Å; F41-I47 HydrophobicContact CD1-CG2 4.37Å; F41-I47 HydrophobicContact CD2-CD1 3.65Å; F41-I47 HydrophobicContact CD2-CG1 4.2Å; F41-I47 HydrophobicContact CD2-CG2 4.26Å; F41-I47 HydrophobicContact CE1-CG1 4.17Å; F41-I47 HydrophobicContact CE1-CG2 3.92Å; F41-I47 HydrophobicContact CE2-CD1 4.26Å; F41-I47 HydrophobicContact CE2-CG2 3.77Å; F41-I47 HydrophobicContact CG-CD1 3.52Å; F41-I47 HydrophobicContact CG-CG1 3.8Å; F41-I47 HydrophobicContact CZ-CG2 3.59Å; F41-V108 HydrophobicContact CD2-CG1 3.95Å; F41-V108 HydrophobicContact CE2-CG1 4.11Å; F41-V109 PolarHBondContact N-O 3.33Å; F41-I110 HydrophobicContact CB-CG1 4.44Å; F41-I110 CarbonylContact O-C 3.59Å; F41-I110 WeakPolarHBondContact O-CA 3.48Å; F41-Q111 PolarHBondContact O-N 2.84Å
42	R	89.3	Confident	76.2	Confident	143 Å²	143	76.2 Å²	76.2	54%	0.54	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	150.6	173.5	-65	-172.7	166.9	172.9	-7.1	110.7	G44 S45 Q111 I191	R42-G44 PolarHBondContact O-N 3.25Å; R42-S45 PolarHBondContact N-OG 2.99Å; R42-S45 VanDerWaalsContact O-CB 3.26Å; R42-S45 WeakPolarHBondContact O-CB 3.44Å; R42-S45 PolarHBondContact O-N 3.31Å; R42-S45 VanDerWaalsContact O-N 3.09Å; R42-S45 PolarHBondContact O-OG 3.46Å; R42-Q111 WeakPolarHBondContact CA-O 3.2Å; R42-I191 HydrophobicContact CG-CD1 4.25Å
43	V	88.7	Confident	77.4	Confident	57 Å²	57	72.7 Å²	72.7	35%	0.345	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	138.8	166.4	168.9	0	0	0	0	110.1	S45 A82 I84 I110 Q111 D112	V43-S45 VanDerWaalsContact C-N 3.3Å; V43-S45 PolarHBondContact O-N 3.44Å; V43-A82 WeakPolarHBondContact CA-O 3.41Å; V43-I84 HydrophobicContact CG2-CD1 4.18Å; V43-I84 HydrophobicContact CG2-CG1 3.69Å; V43-I110 HydrophobicContact CB-CG2 4.49Å; V43-I110 HydrophobicContact CG2-CG2 3.72Å; V43-Q111 PolarHBondContact N-O 3.14Å; V43-D112 HydrophobicContact CB-CB 4.31Å; V43-D112 HydrophobicContact CG2-CB 3.73Å
44	G	87.3	Confident	78.4	Confident	34 Å²	34	73.5 Å²	73.5	35%	0.351	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	-1.7	-176.2	0	0	0	0	0	115.4	R42 N81 A82	R42-G44 PolarHBondContact O-N 3.25Å; G44-N81 WeakPolarHBondContact CA-OD1 3.44Å; G44-A82 PolarHBondContact N-O 2.89Å
45	S	87.3	Confident	79.2	Confident	37 Å²	37	68.6 Å²	68.6	26%	0.259	36%	0.357	S	S	.	.			trans	-66.8	139	173.6	-56	0	0	0	0	111.4	R42 V43 A82	R42-S45 PolarHBondContact N-OG 2.99Å; R42-S45 VanDerWaalsContact O-CB 3.26Å; R42-S45 WeakPolarHBondContact O-CB 3.44Å; R42-S45 PolarHBondContact O-N 3.31Å; R42-S45 VanDerWaalsContact O-N 3.09Å; R42-S45 PolarHBondContact O-OG 3.46Å; V43-S45 VanDerWaalsContact C-N 3.3Å; V43-S45 PolarHBondContact O-N 3.44Å; S45-A82 VanDerWaalsContact O-CB 3.27Å; S45-A82 WeakPolarHBondContact O-CB 3.36Å; S45-A82 PolarHBondContact O-N 3.06Å
46	D	90.1	Very high	79.6	Confident	109 Å²	109	75.8 Å²	75.8	58%	0.583	39%	0.386	S	S	*	.			trans	-82.4	109.7	162.8	-88.5	15.8	0	0	0	108.4	L79 R80 N81	D46-L79 CarbonylContact C-O 3.54Å; D46-L79 WeakPolarHBondContact CA-O 3.24Å; D46-R80 WeakPolarHBondContact OD1-CA 3.46Å; D46-N81 PolarHBondContact OD1-N 2.95Å
47	I	87.9	Confident	79.7	Confident	2 Å²	2	74 Å²	74	1%	0.01	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	124.6	-173.2	-55.1	170.4	0	0	0	109.1	F41 L49 S78 L79 A82 I110	F41-I47 HydrophobicContact CB-CD1 3.65Å; F41-I47 HydrophobicContact CB-CG1 4.18Å; F41-I47 HydrophobicContact CD1-CD1 4.07Å; F41-I47 HydrophobicContact CD1-CG1 3.79Å; F41-I47 HydrophobicContact CD1-CG2 4.37Å; F41-I47 HydrophobicContact CD2-CD1 3.65Å; F41-I47 HydrophobicContact CD2-CG1 4.2Å; F41-I47 HydrophobicContact CD2-CG2 4.26Å; F41-I47 HydrophobicContact CE1-CG1 4.17Å; F41-I47 HydrophobicContact CE1-CG2 3.92Å; F41-I47 HydrophobicContact CE2-CD1 4.26Å; F41-I47 HydrophobicContact CE2-CG2 3.77Å; F41-I47 HydrophobicContact CG-CD1 3.52Å; F41-I47 HydrophobicContact CG-CG1 3.8Å; F41-I47 HydrophobicContact CZ-CG2 3.59Å; I47-L49 HydrophobicContact CG2-CD2 3.61Å; I47-L49 HydrophobicContact CG2-CG 4.09Å; I47-S78 CarbonylContact O-C 3.48Å; I47-S78 VanDerWaalsContact O-CA 3.31Å; I47-S78 WeakPolarHBondContact O-CA 3.38Å; I47-L79 HydrophobicContact CB-CB 4.26Å; I47-L79 HydrophobicContact CB-CD1 4.39Å; I47-L79 HydrophobicContact CD1-CD1 4.29Å; I47-L79 PolarHBondContact N-O 2.81Å; I47-L79 PolarHBondContact O-N 2.73Å; I47-A82 HydrophobicContact CD1-CB 3.52Å; I47-A82 HydrophobicContact CG1-CB 4.11Å; I47-I110 HydrophobicContact CD1-CD1 4.11Å; I47-I110 HydrophobicContact CD1-CG1 4.06Å
48	T	88	Confident	79.7	Confident	85 Å²	85	78.7 Å²	78.7	52%	0.521	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	133.4	169	-62.5	0	0	0	0	110.5	T76 I77 S78	T48-T76 HydrophobicContact CG2-CG2 4.32Å; T48-I77 CarbonylContact C-O 3.52Å; T48-I77 WeakPolarHBondContact CA-O 3.27Å; T48-S78 PolarHBondContact OG1-OG 3.19Å
49	L	86.5	Confident	79.1	Confident	1 Å²	1	77.2 Å²	77.2	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	123.4	-176.7	-51.1	178	0	0	0	108.5	I47 W64 T76 I77 Y90 L106 V108	I47-L49 HydrophobicContact CG2-CD2 3.61Å; I47-L49 HydrophobicContact CG2-CG 4.09Å; L49-W64 HydrophobicContact CB-CH2 3.93Å; L49-W64 HydrophobicContact CB-CZ2 4.23Å; L49-T76 CarbonylContact O-C 3.54Å; L49-T76 WeakPolarHBondContact O-CA 3.44Å; L49-I77 HydrophobicContact CB-CB 4.4Å; L49-I77 HydrophobicContact CD1-CG2 4.24Å; L49-I77 PolarHBondContact N-O 2.76Å; L49-I77 PolarHBondContact O-N 3.46Å; L49-Y90 HydrophobicContact CD1-CD1 4.09Å; L49-Y90 HydrophobicContact CD1-CE1 4.31Å; L49-Y90 HydrophobicContact CD1-CG 4.25Å; L49-L106 HydrophobicContact CB-CD2 4.45Å; L49-L106 HydrophobicContact CD1-CD2 4.01Å; L49-L106 HydrophobicContact CD2-CD2 3.86Å; L49-L106 HydrophobicContact CG-CD2 4.32Å; L49-V108 HydrophobicContact CD1-CG2 4.08Å
50	K	84.5	Confident	78.8	Confident	98 Å²	98	77.6 Å²	77.6	43%	0.426	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.7	175.9	-172.4	173.8	-178	178	0	111.2	E53 T76	K50-E53 HydrophobicContact CB-CG 4.28Å; K50-T76 HydrophobicContact CB-CG2 3.92Å; K50-T76 HydrophobicContact CG-CG2 3.98Å
51	C	78.4	Confident	78.5	Confident	9 Å²	9	76 Å²	76	6%	0.061	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	134.8	177.3	-175.5	0	0	0	0	110.8	V62 W64 E75 C92	C51-V62 HydrophobicContact CB-CG1 4.09Å; C51-W64 HydrophobicContact CB-CH2 4.41Å; C51-W64 HydrophobicContact CB-CZ2 3.68Å; C51-E75 PolarHBondContact N-O 2.75Å; C51-C92 HydrophobicContact CB-CB 3.9Å; C51-C92 WeakPolarHBondContact CB-SG 3.47Å; C51-C92 WeakPolarHBondContact SG-CB 3.17Å; C51-C92 CovalentContact SG-SG 2.02Å; C51-C92 PolarHBondContact SG-SG 2.99Å
52	G	70.5	Confident	78.2	Confident	5 Å²	5	74 Å²	74	5%	0.052	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	38.5	178.3	0	0	0	0	0	113.2	N54 H55	G52-N54 PolarHBondContact O-N 3.36Å; G52-H55 PolarHBondContact O-N 2.77Å
53	E	66.7	Low	78.1	Confident	94 Å²	94	70.5 Å²	70.5	44%	0.439	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-21.4	-172	-150.9	161.5	-119.1	0	0	114.6	R39 K50	R39-E53 IonicContact CZ-OE2 3.13Å; R39-E53 IonicContact NH1-OE1 3.67Å; R39-E53 IonicContact NH1-OE2 3.22Å; R39-E53 PolarHBondContact NH1-OE2 2.77Å; R39-E53 IonicContact NH2-OE2 2.77Å; R39-E53 PolarHBondContact NH2-OE2 2.79Å; K50-E53 HydrophobicContact CB-CG 4.28Å
54	N	62	Low	78.1	Confident	148 Å²	148	68 Å²	68	79%	0.791	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	10.3	178.1	-64.6	-22.2	0	0	0	115.1	G52	G52-N54 PolarHBondContact O-N 3.36Å
55	H	61.9	Low	78.1	Confident	98 Å²	98	68.9 Å²	68.9	45%	0.454	36%	0.362	S	S	.	.			trans	-117.8	118.8	-175	-71.2	-66.3	0	0	0	113.1	G52 L57 Y102	G52-H55 PolarHBondContact O-N 2.77Å; H55-L57 HydrophobicContact CB-CD1 4.34Å; H55-L57 HydrophobicContact CB-CG 4.38Å; H55-L57 PolarHBondContact O-N 3.11Å; H55-Y102 AromaticContact CD2-CD2 3.53Å; H55-Y102 AromaticContact CD2-CE2 3.42Å; H55-Y102 VanDerWaalsContact CD2-CE2 3.42Å; H55-Y102 WeakPolarHBondContact CD2-CE2 3.28Å; H55-Y102 AromaticContact NE2-CD2 3.5Å; H55-Y102 AromaticContact NE2-CE2 3.34Å; H55-Y102 VanDerWaalsContact NE2-CE2 3.34Å; H55-Y102 WeakPolarHBondContact NE2-CE2 3.37Å
56	H	61.9	Low	78	Confident	203 Å²	203	68.1 Å²	68.1	94%	0.94	36%	0.355	S	S	*	.			trans	-77.8	59.5	170.8	-63.1	-72.6	0	0	0	112
57	L	64.7	Low	77.7	Confident	72 Å²	72	65 Å²	65	38%	0.377	34%	0.341	S	S	.	.			trans	-112	135.5	173.6	-66	172.5	0	0	0	109	H55 P59 K101	H55-L57 HydrophobicContact CB-CD1 4.34Å; H55-L57 HydrophobicContact CB-CG 4.38Å; H55-L57 PolarHBondContact O-N 3.11Å; L57-P59 VanDerWaalsContact O-CD 3.24Å; L57-P59 WeakPolarHBondContact O-CD 3.47Å; L57-K101 HydrophobicContact CD1-CB 4.5Å
58	N	70.9	Confident	77.4	Confident	147 Å²	147	69.3 Å²	69.3	79%	0.786	36%	0.363	S	S	*	.			trans	-91.2	101.2	168.8	-70.7	-4.7	0	0	0	108	L96	N58-L96 WeakPolarHBondContact O-CD1 3.21Å
59	P	70.7	Confident	77	Confident	39 Å²	39	71.5 Å²	71.5	25%	0.253	37%	0.372	S	S	.	.			trans	-74.7	148.4	-172.9	32.4	-36.6	0	0	0	112.2	L57 V62 L94	L57-P59 VanDerWaalsContact O-CD 3.24Å; L57-P59 WeakPolarHBondContact O-CD 3.47Å; P59-V62 HydrophobicContact CB-CG2 3.98Å; P59-V62 HydrophobicContact CG-CG2 3.64Å; P59-L94 HydrophobicContact CB-CD1 4.26Å; P59-L94 HydrophobicContact CB-CD2 3.87Å; P59-L94 HydrophobicContact CB-CG 3.73Å; P59-L94 HydrophobicContact CG-CG 4.5Å
60	T	79.2	Confident	76.8	Confident	90 Å²	90	77.6 Å²	77.6	55%	0.552	40%	0.399	S	S	*	.	S	Bend	trans	-80.6	-27.9	169.3	-39.7	0	0	0	0	111.2	F95 L96 N97	T60-F95 PolarHBondContact N-O 3.24Å; T60-L96 WeakPolarHBondContact OG1-CA 3.47Å; T60-N97 PolarHBondContact OG1-N 2.91Å
61	L	82.1	Confident	76.7	Confident	75 Å²	75	78 Å²	78	39%	0.393	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	136	174.5	177.2	64.5	0	0	0	110.4	L63 F95	L61-L63 HydrophobicContact CD1-CD2 4.15Å; L61-L63 HydrophobicContact CD1-CG 4.38Å; L61-L63 HydrophobicContact CD2-CD1 4.08Å; L61-L63 HydrophobicContact CD2-CD2 4.34Å; L61-L63 HydrophobicContact CD2-CG 4.01Å; L61-L63 HydrophobicContact CG-CD2 4.36Å; L61-L63 HydrophobicContact CG-CG 4.06Å; L61-F95 HydrophobicContact CB-CB 4.31Å; L61-F95 HydrophobicContact CB-CD2 4.42Å; L61-F95 HydrophobicContact CD2-CD2 4.33Å; L61-F95 HydrophobicContact CG-CD2 4.4Å; L61-F95 PolarHBondContact N-O 3.03Å; L61-F95 PolarHBondContact O-N 2.82Å
62	V	84.3	Confident	77	Confident	9 Å²	9	79.7 Å²	79.7	6%	0.055	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	143.1	163.4	-178.4	0	0	0	0	107.8	C51 P59 S73 L94	C51-V62 HydrophobicContact CB-CG1 4.09Å; P59-V62 HydrophobicContact CB-CG2 3.98Å; P59-V62 HydrophobicContact CG-CG2 3.64Å; V62-S73 VanDerWaalsContact O-CA 3.25Å; V62-S73 WeakPolarHBondContact O-CA 3.47Å; V62-L94 HydrophobicContact CG2-CG 4.37Å
63	L	86.7	Confident	77.6	Confident	68 Å²	68	83.4 Å²	83.4	36%	0.356	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	118.1	171.3	-69.3	177.7	0	0	0	109.5	L61 C92 R93 F95	L61-L63 HydrophobicContact CD1-CD2 4.15Å; L61-L63 HydrophobicContact CD1-CG 4.38Å; L61-L63 HydrophobicContact CD2-CD1 4.08Å; L61-L63 HydrophobicContact CD2-CD2 4.34Å; L61-L63 HydrophobicContact CD2-CG 4.01Å; L61-L63 HydrophobicContact CG-CD2 4.36Å; L61-L63 HydrophobicContact CG-CG 4.06Å; L63-C92 CarbonylContact O-C 3.57Å; L63-C92 WeakPolarHBondContact O-CA 3.47Å; L63-R93 PolarHBondContact N-O 2.84Å; L63-R93 PolarHBondContact O-N 2.87Å; L63-F95 HydrophobicContact CD1-CE2 4.05Å; L63-F95 HydrophobicContact CG-CE2 4.48Å
64	W	88.2	Confident	78.4	Confident	5 Å²	5	85.7 Å²	85.7	2%	0.019	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	154.6	166.4	-73.2	97.2	0	0	0	111.7	L49 C51 T71 T72 K74 E75 I77 Y91 C92	L49-W64 HydrophobicContact CB-CH2 3.93Å; L49-W64 HydrophobicContact CB-CZ2 4.23Å; C51-W64 HydrophobicContact CB-CH2 4.41Å; C51-W64 HydrophobicContact CB-CZ2 3.68Å; W64-T71 VanDerWaalsContact O-CA 3.23Å; W64-T71 WeakPolarHBondContact O-CA 3.45Å; W64-T71 WeakPolarHBondContact O-CB 3.38Å; W64-T72 HydrophobicContact CB-CG2 3.94Å; W64-T72 HydrophobicContact CG-CG2 4.36Å; W64-T72 PolarHBondContact N-O 3.46Å; W64-T72 PolarHBondContact O-N 3.18Å; W64-K74 PolarHBondContact NE1-O 2.81Å; W64-E75 PolarHBondContact NE1-O 2.6Å; W64-I77 HydrophobicContact CB-CD1 3.63Å; W64-I77 HydrophobicContact CB-CG1 4.27Å; W64-I77 HydrophobicContact CD2-CD1 3.84Å; W64-I77 HydrophobicContact CD2-CG1 4.17Å; W64-I77 HydrophobicContact CE3-CD1 4.06Å; W64-I77 HydrophobicContact CG-CD1 3.71Å; W64-I77 HydrophobicContact CG-CG1 3.98Å; W64-Y91 CarbonylContact C-O 3.53Å; W64-Y91 VanDerWaalsContact CA-O 3.32Å; W64-Y91 WeakPolarHBondContact CA-O 3.41Å; W64-C92 HydrophobicContact CD2-CB 4.05Å; W64-C92 HydrophobicContact CE3-CB 3.85Å; W64-C92 HydrophobicContact CH2-CB 4.37Å; W64-C92 HydrophobicContact CZ3-CB 4.01Å
65	L	87.8	Confident	79.2	Confident	52 Å²	52	83.8 Å²	83.8	27%	0.272	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	126.3	164.9	-178.7	67.8	0	0	0	108.3	N69 T71 Y91	L65-N69 HydrophobicContact CD1-CB 4.49Å; L65-T71 HydrophobicContact CD1-CG2 3.64Å; L65-Y91 HydrophobicContact CB-CD2 4.28Å; L65-Y91 HydrophobicContact CD2-CD2 3.91Å; L65-Y91 HydrophobicContact CD2-CE2 4.42Å; L65-Y91 HydrophobicContact CG-CD2 4.3Å; L65-Y91 PolarHBondContact N-O 2.9Å; L65-Y91 PolarHBondContact O-N 2.87Å
66	D	85.7	Confident	80.3	Confident	21 Å²	21	81.7 Å²	81.7	11%	0.112	43%	0.434	C	S	.	.			trans	-92.6	167.8	176.3	86.6	-4	0	0	0	112.7	L68 N69 K70 Y90	D66-L68 PolarHBondContact O-N 3.14Å; D66-L68 VanDerWaalsContact OD1-C 3.23Å; D66-L68 VanDerWaalsContact OD1-CA 3.27Å; D66-L68 WeakPolarHBondContact OD1-CA 3.33Å; D66-L68 WeakPolarHBondContact OD1-CB 3.45Å; D66-L68 PolarHBondContact OD1-N 3.14Å; D66-N69 PolarHBondContact O-N 3.38Å; D66-N69 PolarHBondContact OD1-N 3.49Å; D66-K70 PolarHBondContact N-O 2.91Å; D66-K70 WeakPolarHBondContact OD1-CB 3.36Å; D66-K70 PolarHBondContact OD1-N 2.88Å; D66-Y90 HydrophobicContact CB-CD1 3.91Å; D66-Y90 HydrophobicContact CB-CE1 3.52Å
67	P	82.9	Confident	81.4	Confident	44 Å²	44	72.9 Å²	72.9	29%	0.286	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-10	178.7	-24.2	34.9	0	0	0	115	Y90	P67-Y90 HydrophobicContact CG-CD2 3.78Å; P67-Y90 HydrophobicContact CG-CE2 3.52Å; P67-Y90 HydrophobicContact CG-CG 4.45Å
68	L	81.8	Confident	82.4	Confident	92 Å²	92	73 Å²	73	48%	0.482	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	16.5	177.2	-56.1	175.2	0	0	0	111.5	D66 K70	D66-L68 PolarHBondContact O-N 3.14Å; D66-L68 VanDerWaalsContact OD1-C 3.23Å; D66-L68 VanDerWaalsContact OD1-CA 3.27Å; D66-L68 WeakPolarHBondContact OD1-CA 3.33Å; D66-L68 WeakPolarHBondContact OD1-CB 3.45Å; D66-L68 PolarHBondContact OD1-N 3.14Å; L68-K70 HydrophobicContact CB-CG 4.44Å; L68-K70 PolarHBondContact O-N 3.01Å
69	N	79.3	Confident	83.1	Confident	131 Å²	131	66.7 Å²	66.7	70%	0.701	37%	0.366	S	S	*	.	S	Bend	trans	58.5	20.6	-176.2	-70.9	-48	0	0	0	115.4	L65 D66	L65-N69 HydrophobicContact CD1-CB 4.49Å; D66-N69 PolarHBondContact O-N 3.38Å; D66-N69 PolarHBondContact OD1-N 3.49Å
70	K	82.1	Confident	83.8	Confident	130 Å²	130	74.8 Å²	74.8	57%	0.565	39%	0.392	S	S	*	.			trans	-82.7	132.9	173.5	-57	172.8	-175.3	168.4	0	109.3	D66 L68	D66-K70 PolarHBondContact N-O 2.91Å; D66-K70 WeakPolarHBondContact OD1-CB 3.36Å; D66-K70 PolarHBondContact OD1-N 2.88Å; L68-K70 HydrophobicContact CB-CG 4.44Å; L68-K70 PolarHBondContact O-N 3.01Å
71	T	82.8	Confident	84.1	Confident	107 Å²	107	76.1 Å²	76.1	66%	0.656	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	151	176.2	52.6	0	0	0	0	111.6	W64 L65	W64-T71 VanDerWaalsContact O-CA 3.23Å; W64-T71 WeakPolarHBondContact O-CA 3.45Å; W64-T71 WeakPolarHBondContact O-CB 3.38Å; L65-T71 HydrophobicContact CD1-CG2 3.64Å
72	T	85.3	Confident	84.3	Confident	44 Å²	44	72.5 Å²	72.5	27%	0.27	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	147.5	168.4	-165.5	0	0	0	0	111.7	W64 I77	W64-T72 HydrophobicContact CB-CG2 3.94Å; W64-T72 HydrophobicContact CG-CG2 4.36Å; W64-T72 PolarHBondContact N-O 3.46Å; W64-T72 PolarHBondContact O-N 3.18Å; T72-I77 HydrophobicContact CG2-CD1 4.21Å; T72-I77 HydrophobicContact CG2-CG1 3.82Å
73	S	82.9	Confident	84.6	Confident	83 Å²	83	74.4 Å²	74.4	58%	0.58	39%	0.39	S	S	*	.			trans	-95.9	4.3	179.6	52.4	0	0	0	0	114.2	V62	V62-S73 VanDerWaalsContact O-CA 3.25Å; V62-S73 WeakPolarHBondContact O-CA 3.47Å
74	K	82.5	Confident	84.6	Confident	142 Å²	142	73.3 Å²	73.3	62%	0.617	38%	0.384	S	S	*	.	S	Bend	trans	-71.6	148.6	175.9	-64.4	-177.3	179.1	-176.7	0	110.8	W64 T76	W64-K74 PolarHBondContact NE1-O 2.81Å; K74-T76 WeakPolarHBondContact CB-O 3.43Å; K74-T76 PolarHBondContact O-N 2.9Å
75	E	78.8	Confident	84.4	Confident	108 Å²	108	76.8 Å²	76.8	51%	0.505	41%	0.414	S	S	.	.	S	Bend	trans	-59	-30.3	173.2	-62	-173.6	179.7	0	0	113	C51 W64	C51-E75 PolarHBondContact N-O 2.75Å; W64-E75 PolarHBondContact NE1-O 2.6Å
76	T	84.9	Confident	84.4	Confident	54 Å²	54	76.4 Å²	76.4	33%	0.331	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	144	-175.8	50.3	0	0	0	0	112.8	T48 L49 K50 K74	T48-T76 HydrophobicContact CG2-CG2 4.32Å; L49-T76 CarbonylContact O-C 3.54Å; L49-T76 WeakPolarHBondContact O-CA 3.44Å; K50-T76 HydrophobicContact CB-CG2 3.92Å; K50-T76 HydrophobicContact CG-CG2 3.98Å; K74-T76 WeakPolarHBondContact CB-O 3.43Å; K74-T76 PolarHBondContact O-N 2.9Å
77	I	86.3	Confident	84.6	Confident	18 Å²	18	76.8 Å²	76.8	9%	0.092	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	138	160.2	-79.7	179	0	0	0	107.9	T48 L49 W64 T72 L79 Y90	T48-I77 CarbonylContact C-O 3.52Å; T48-I77 WeakPolarHBondContact CA-O 3.27Å; L49-I77 HydrophobicContact CB-CB 4.4Å; L49-I77 HydrophobicContact CD1-CG2 4.24Å; L49-I77 PolarHBondContact N-O 2.76Å; L49-I77 PolarHBondContact O-N 3.46Å; W64-I77 HydrophobicContact CB-CD1 3.63Å; W64-I77 HydrophobicContact CB-CG1 4.27Å; W64-I77 HydrophobicContact CD2-CD1 3.84Å; W64-I77 HydrophobicContact CD2-CG1 4.17Å; W64-I77 HydrophobicContact CE3-CD1 4.06Å; W64-I77 HydrophobicContact CG-CD1 3.71Å; W64-I77 HydrophobicContact CG-CG1 3.98Å; T72-I77 HydrophobicContact CG2-CD1 4.21Å; T72-I77 HydrophobicContact CG2-CG1 3.82Å; I77-L79 HydrophobicContact CG2-CD2 3.9Å; I77-L79 HydrophobicContact CG2-CG 4.17Å; I77-Y90 HydrophobicContact CD1-CD1 4.05Å; I77-Y90 HydrophobicContact CD1-CE1 4.22Å; I77-Y90 HydrophobicContact CG2-CE1 4.32Å
78	S	85.8	Confident	84.8	Confident	73 Å²	73	75.6 Å²	75.6	51%	0.51	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	121	169.8	-65.4	0	0	0	0	109.9	I47 T48	I47-S78 CarbonylContact O-C 3.48Å; I47-S78 VanDerWaalsContact O-CA 3.31Å; I47-S78 WeakPolarHBondContact O-CA 3.38Å; T48-S78 PolarHBondContact OG1-OG 3.19Å
79	L	85	Confident	85.2	Confident	16 Å²	16	74.5 Å²	74.5	8%	0.084	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	113	173.6	-47.2	172.8	0	0	0	106.7	D46 I47 I77 A82 Y90	D46-L79 CarbonylContact C-O 3.54Å; D46-L79 WeakPolarHBondContact CA-O 3.24Å; I47-L79 HydrophobicContact CB-CB 4.26Å; I47-L79 HydrophobicContact CB-CD1 4.39Å; I47-L79 HydrophobicContact CD1-CD1 4.29Å; I47-L79 PolarHBondContact N-O 2.81Å; I47-L79 PolarHBondContact O-N 2.73Å; I77-L79 HydrophobicContact CG2-CD2 3.9Å; I77-L79 HydrophobicContact CG2-CG 4.17Å; L79-A82 HydrophobicContact CB-CB 4.18Å; L79-Y90 WeakPolarHBondContact CD1-OH 3.3Å
80	R	85.2	Confident	85.7	Confident	208 Å²	208	68.3 Å²	68.3	79%	0.785	37%	0.37	S	S	*	.	S	Bend	trans	-89.2	141.6	171.2	-69.8	-169.1	176.7	-175.9	-2	110.4	D46 A82	D46-R80 WeakPolarHBondContact OD1-CA 3.46Å; R80-A82 PolarHBondContact O-N 2.84Å
81	N	86.2	Confident	86	Confident	118 Å²	118	66.2 Å²	66.2	63%	0.631	36%	0.359	S	S	*	.	S	Bend	trans	48.7	55.4	179.3	-171.9	39.9	0	0	0	112.3	G44 D46	G44-N81 WeakPolarHBondContact CA-OD1 3.44Å; D46-N81 PolarHBondContact OD1-N 2.95Å
82	A	86.4	Confident	86.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.329	C	S	.	.			trans	-65.3	142.1	-165	0	0	0	0	0	114	V43 G44 S45 I47 L79 R80 I110	V43-A82 WeakPolarHBondContact CA-O 3.41Å; G44-A82 PolarHBondContact N-O 2.89Å; S45-A82 VanDerWaalsContact O-CB 3.27Å; S45-A82 WeakPolarHBondContact O-CB 3.36Å; S45-A82 PolarHBondContact O-N 3.06Å; I47-A82 HydrophobicContact CD1-CB 3.52Å; I47-A82 HydrophobicContact CG1-CB 4.11Å; L79-A82 HydrophobicContact CB-CB 4.18Å; R80-A82 PolarHBondContact O-N 2.84Å; A82-I110 HydrophobicContact CB-CD1 3.82Å
83	S	89.4	Confident	86.2	Confident	49 Å²	49	65.6 Å²	65.6	34%	0.343	34%	0.34	S	S	.	.			trans	-115.5	156.9	-173.8	67.2	0	0	0	0	112.5	A85 Q86 I110	S83-A85 PolarHBondContact O-N 2.85Å; S83-A85 VanDerWaalsContact O-N 3.12Å; S83-Q86 WeakPolarHBondContact O-CB 2.95Å; S83-Q86 PolarHBondContact O-N 3.17Å; S83-Q86 PolarHBondContact OG-OE1 3Å; S83-I110 WeakPolarHBondContact O-CD1 3.09Å
84	I	87	Confident	86.3	Confident	45 Å²	45	62.1 Å²	62.1	23%	0.231	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-55.4	-33.7	-179.2	-77.8	-179.4	0	0	0	113.1	V43 Q86 S87 I110 D112 Q140	V43-I84 HydrophobicContact CG2-CD1 4.18Å; V43-I84 HydrophobicContact CG2-CG1 3.69Å; I84-Q86 PolarHBondContact O-N 2.82Å; I84-Q86 VanDerWaalsContact O-N 3.1Å; I84-S87 VanDerWaalsContact O-CB 3.26Å; I84-S87 WeakPolarHBondContact O-CB 3.29Å; I84-S87 PolarHBondContact O-N 3.17Å; I84-S87 PolarHBondContact O-OG 3.05Å; I84-I110 HydrophobicContact CG1-CG2 4.35Å; I84-D112 HydrophobicContact CD1-CB 3.73Å; I84-Q140 HydrophobicContact CD1-CB 3.71Å; I84-Q140 HydrophobicContact CD1-CG 4.25Å
85	A	85.4	Confident	86.3	Confident	77 Å²	77	57.5 Å²	57.5	64%	0.636	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-66.5	-6.1	177	0	0	0	0	0	114.7	S83	S83-A85 PolarHBondContact O-N 2.85Å; S83-A85 VanDerWaalsContact O-N 3.12Å
86	Q	87.3	Confident	86.5	Confident	44 Å²	44	54.6 Å²	54.6	21%	0.206	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-101.2	6.1	172.1	-63.2	162	-74.9	0	0	112.2	S83 I84 Y90 I110	S83-Q86 WeakPolarHBondContact O-CB 2.95Å; S83-Q86 PolarHBondContact O-N 3.17Å; S83-Q86 PolarHBondContact OG-OE1 3Å; I84-Q86 PolarHBondContact O-N 2.82Å; I84-Q86 VanDerWaalsContact O-N 3.1Å; Q86-Y90 PolarHBondContact O-OH 3.46Å; Q86-I110 HydrophobicContact CB-CD1 3.88Å
87	S	89.5	Confident	86.2	Confident	30 Å²	30	58.8 Å²	58.8	21%	0.21	30%	0.303	C	S	.	.			trans	-70.8	140.5	168.6	-49.5	0	0	0	0	110.2	I84 V108 I110 N141	I84-S87 VanDerWaalsContact O-CB 3.26Å; I84-S87 WeakPolarHBondContact O-CB 3.29Å; I84-S87 PolarHBondContact O-N 3.17Å; I84-S87 PolarHBondContact O-OG 3.05Å; S87-V108 CarbonylContact C-O 3.59Å; S87-V108 VanDerWaalsContact CA-O 3.26Å; S87-V108 WeakPolarHBondContact CA-O 3.49Å; S87-I110 WeakPolarHBondContact OG-CB 3.35Å; S87-I110 PolarHBondContact OG-N 2.85Å; S87-I110 PolarHBondContact OG-O 3.1Å; S87-N141 PolarHBondContact OG-ND2 3.28Å
88	G	87.8	Confident	85.8	Confident	19 Å²	19	61 Å²	61	20%	0.196	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.2	-170.6	177.7	0	0	0	0	0	113.1	V108	G88-V108 PolarHBondContact N-O 2.95Å; G88-V108 PolarHBondContact O-N 3.36Å
89	E	88.7	Confident	85.5	Confident	68 Å²	68	61.9 Å²	61.9	32%	0.318	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	116.6	-178.2	-161.6	171.8	-150.8	0	0	110.9	Y91 S105	E89-Y91 HydrophobicContact CB-CE1 4.42Å; E89-Y91 VanDerWaalsContact CD-CE1 3.44Å; E89-Y91 HydrophobicContact CG-CD1 4.34Å; E89-Y91 HydrophobicContact CG-CE1 3.63Å; E89-Y91 WeakPolarHBondContact OE2-CE1 3.02Å; E89-Y91 VanDerWaalsContact OE2-CZ 3.28Å; E89-Y91 PolarHBondContact OE2-OH 2.88Å; E89-S105 WeakPolarHBondContact CG-OG 3.25Å; E89-S105 WeakPolarHBondContact OE1-CB 3.45Å; E89-S105 PolarHBondContact OE1-OG 2.59Å
90	Y	89.5	Confident	85.4	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.008	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.7	175	-76.1	-103.9	0	0	0	109.4	L49 D66 P67 I77 L79 Q86 L106 V108	L49-Y90 HydrophobicContact CD1-CD1 4.09Å; L49-Y90 HydrophobicContact CD1-CE1 4.31Å; L49-Y90 HydrophobicContact CD1-CG 4.25Å; D66-Y90 HydrophobicContact CB-CD1 3.91Å; D66-Y90 HydrophobicContact CB-CE1 3.52Å; P67-Y90 HydrophobicContact CG-CD2 3.78Å; P67-Y90 HydrophobicContact CG-CE2 3.52Å; P67-Y90 HydrophobicContact CG-CG 4.45Å; I77-Y90 HydrophobicContact CD1-CD1 4.05Å; I77-Y90 HydrophobicContact CD1-CE1 4.22Å; I77-Y90 HydrophobicContact CG2-CE1 4.32Å; L79-Y90 WeakPolarHBondContact CD1-OH 3.3Å; Q86-Y90 PolarHBondContact O-OH 3.46Å; Y90-L106 PolarHBondContact N-O 2.87Å; Y90-L106 PolarHBondContact O-N 3.06Å; Y90-V108 HydrophobicContact CD2-CB 3.81Å; Y90-V108 HydrophobicContact CD2-CG2 3.48Å; Y90-V108 VanDerWaalsContact CD2-CG2 3.48Å; Y90-V108 HydrophobicContact CE2-CB 3.77Å; Y90-V108 HydrophobicContact CE2-CG1 4.31Å; Y90-V108 HydrophobicContact CE2-CG2 3.81Å; Y90-V108 HydrophobicContact CG-CG2 4.29Å
91	Y	88.5	Confident	85.1	Confident	86 Å²	86	60.2 Å²	60.2	34%	0.337	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.8	179.2	-48.9	-80.7	0	0	0	111	W64 L65 E89 S105	W64-Y91 CarbonylContact C-O 3.53Å; W64-Y91 VanDerWaalsContact CA-O 3.32Å; W64-Y91 WeakPolarHBondContact CA-O 3.41Å; L65-Y91 HydrophobicContact CB-CD2 4.28Å; L65-Y91 HydrophobicContact CD2-CD2 3.91Å; L65-Y91 HydrophobicContact CD2-CE2 4.42Å; L65-Y91 HydrophobicContact CG-CD2 4.3Å; L65-Y91 PolarHBondContact N-O 2.9Å; L65-Y91 PolarHBondContact O-N 2.87Å; E89-Y91 HydrophobicContact CB-CE1 4.42Å; E89-Y91 VanDerWaalsContact CD-CE1 3.44Å; E89-Y91 HydrophobicContact CG-CD1 4.34Å; E89-Y91 HydrophobicContact CG-CE1 3.63Å; E89-Y91 WeakPolarHBondContact OE2-CE1 3.02Å; E89-Y91 VanDerWaalsContact OE2-CZ 3.28Å; E89-Y91 PolarHBondContact OE2-OH 2.88Å; Y91-S105 VanDerWaalsContact CD1-OG 3.31Å; Y91-S105 WeakPolarHBondContact CD1-OG 3.37Å; Y91-S105 VanDerWaalsContact CE1-OG 3.29Å; Y91-S105 WeakPolarHBondContact CE1-OG 3.47Å
92	C	87.2	Confident	84.7	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.014	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	147.7	165.2	-174.3	0	0	0	0	111.8	C51 L63 W64 H103 Q104	C51-C92 HydrophobicContact CB-CB 3.9Å; C51-C92 WeakPolarHBondContact CB-SG 3.47Å; C51-C92 WeakPolarHBondContact SG-CB 3.17Å; C51-C92 CovalentContact SG-SG 2.02Å; C51-C92 PolarHBondContact SG-SG 2.99Å; L63-C92 CarbonylContact O-C 3.57Å; L63-C92 WeakPolarHBondContact O-CA 3.47Å; W64-C92 HydrophobicContact CD2-CB 4.05Å; W64-C92 HydrophobicContact CE3-CB 3.85Å; W64-C92 HydrophobicContact CH2-CB 4.37Å; W64-C92 HydrophobicContact CZ3-CB 4.01Å; C92-H103 WeakPolarHBondContact O-CA 3.35Å; C92-H103 PolarHBondContact O-ND1 2.84Å; C92-Q104 PolarHBondContact N-O 3.1Å; C92-Q104 PolarHBondContact O-N 2.82Å; C92-Q104 VanDerWaalsContact O-N 3.09Å
93	R	86.4	Confident	84.5	Confident	136 Å²	136	59.5 Å²	59.5	51%	0.513	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	138.1	165.5	-63.8	177.7	-175.4	163.1	3.4	109.1	L63 F95 L100	L63-R93 PolarHBondContact N-O 2.84Å; L63-R93 PolarHBondContact O-N 2.87Å; R93-F95 HydrophobicContact CB-CE2 3.73Å; R93-F95 HydrophobicContact CB-CZ 4.2Å; R93-L100 HydrophobicContact CB-CD1 3.83Å; R93-L100 HydrophobicContact CG-CD1 4.29Å
94	L	84.7	Confident	84.1	Confident	9 Å²	9	58.5 Å²	58.5	5%	0.047	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	126.3	-175.5	177.7	166	0	0	0	109.3	P59 V62 K101 Y102	P59-L94 HydrophobicContact CB-CD1 4.26Å; P59-L94 HydrophobicContact CB-CD2 3.87Å; P59-L94 HydrophobicContact CB-CG 3.73Å; P59-L94 HydrophobicContact CG-CG 4.5Å; V62-L94 HydrophobicContact CG2-CG 4.37Å; L94-K101 HydrophobicContact CD2-CB 4.39Å; L94-K101 PolarHBondContact O-N 2.83Å; L94-Y102 HydrophobicContact CB-CD1 4.46Å; L94-Y102 PolarHBondContact N-O 2.86Å; L94-Y102 PolarHBondContact O-N 3.05Å
95	F	83.2	Confident	84	Confident	46 Å²	46	56.9 Å²	56.9	20%	0.202	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	146.6	-171.7	-58.5	-101.8	0	0	0	111.8	T60 L61 L63 R93 D99 L100	T60-F95 PolarHBondContact N-O 3.24Å; L61-F95 HydrophobicContact CB-CB 4.31Å; L61-F95 HydrophobicContact CB-CD2 4.42Å; L61-F95 HydrophobicContact CD2-CD2 4.33Å; L61-F95 HydrophobicContact CG-CD2 4.4Å; L61-F95 PolarHBondContact N-O 3.03Å; L61-F95 PolarHBondContact O-N 2.82Å; L63-F95 HydrophobicContact CD1-CE2 4.05Å; L63-F95 HydrophobicContact CG-CE2 4.48Å; R93-F95 HydrophobicContact CB-CE2 3.73Å; R93-F95 HydrophobicContact CB-CZ 4.2Å; F95-D99 CarbonylContact C-O 3.5Å; F95-D99 WeakPolarHBondContact CA-O 3.19Å; F95-L100 HydrophobicContact CD1-CB 4.02Å; F95-L100 HydrophobicContact CD1-CD1 4.26Å; F95-L100 HydrophobicContact CD2-CD1 4.46Å; F95-L100 HydrophobicContact CE1-CB 3.88Å; F95-L100 HydrophobicContact CE1-CD1 3.92Å; F95-L100 HydrophobicContact CE1-CG 4.48Å; F95-L100 HydrophobicContact CE2-CD1 4.13Å; F95-L100 HydrophobicContact CZ-CD1 3.85Å
96	L	81.7	Confident	83.9	Confident	47 Å²	47	53.6 Å²	53.6	25%	0.246	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	119.1	174.9	-174.2	71.1	0	0	0	108.9	N58 T60 G98 D99 K101	N58-L96 WeakPolarHBondContact O-CD1 3.21Å; T60-L96 WeakPolarHBondContact OG1-CA 3.47Å; L96-G98 PolarHBondContact O-N 2.86Å; L96-G98 VanDerWaalsContact O-N 3.17Å; L96-D99 PolarHBondContact N-O 2.82Å; L96-D99 WeakPolarHBondContact O-CB 3.36Å; L96-D99 PolarHBondContact O-N 2.87Å; L96-K101 HydrophobicContact CB-CD 4.46Å; L96-K101 HydrophobicContact CB-CG 3.53Å; L96-K101 HydrophobicContact CD2-CG 4.37Å
97	N	79.9	Confident	84	Confident	142 Å²	142	54.9 Å²	54.9	76%	0.759	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	31.5	-178.9	-59	-7.8	0	0	0	114.1	T60	T60-N97 PolarHBondContact OG1-N 2.91Å
98	G	76.2	Confident	84	Confident	63 Å²	63	53.5 Å²	53.5	65%	0.649	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.2	-27	-177.2	0	0	0	0	0	114.5	L96	L96-G98 PolarHBondContact O-N 2.86Å; L96-G98 VanDerWaalsContact O-N 3.17Å
99	D	80.4	Confident	84.1	Confident	93 Å²	93	53.8 Å²	53.8	50%	0.497	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	134.8	178.1	-70.7	-27.7	0	0	0	111.8	F95 L96 K101	F95-D99 CarbonylContact C-O 3.5Å; F95-D99 WeakPolarHBondContact CA-O 3.19Å; L96-D99 PolarHBondContact N-O 2.82Å; L96-D99 WeakPolarHBondContact O-CB 3.36Å; L96-D99 PolarHBondContact O-N 2.87Å; D99-K101 HydrophobicContact CB-CD 3.99Å; D99-K101 VanDerWaalsContact CB-CE 3.46Å; D99-K101 VanDerWaalsContact CB-NZ 3.28Å; D99-K101 PolarHBondContact O-N 2.83Å; D99-K101 IonicContact OD2-NZ 2.73Å; D99-K101 PolarHBondContact OD2-NZ 3.07Å
100	L	83.1	Confident	84.2	Confident	90 Å²	90	50.5 Å²	50.5	47%	0.471	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	113.6	164.2	-179.3	68.5	0	0	0	109.3	R93 F95 Y102 H103	R93-L100 HydrophobicContact CB-CD1 3.83Å; R93-L100 HydrophobicContact CG-CD1 4.29Å; F95-L100 HydrophobicContact CD1-CB 4.02Å; F95-L100 HydrophobicContact CD1-CD1 4.26Å; F95-L100 HydrophobicContact CD2-CD1 4.46Å; F95-L100 HydrophobicContact CE1-CB 3.88Å; F95-L100 HydrophobicContact CE1-CD1 3.92Å; F95-L100 HydrophobicContact CE1-CG 4.48Å; F95-L100 HydrophobicContact CE2-CD1 4.13Å; F95-L100 HydrophobicContact CZ-CD1 3.85Å; L100-Y102 WeakPolarHBondContact CD1-O 3.39Å; L100-H103 HydrophobicContact CD2-CB 4.48Å
101	K	78.7	Confident	84.3	Confident	98 Å²	98	51.6 Å²	51.6	43%	0.426	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-28	179	-61.6	-53.1	-174.6	-166.1	0	113.7	L57 L94 L96 D99	L57-K101 HydrophobicContact CD1-CB 4.5Å; L94-K101 HydrophobicContact CD2-CB 4.39Å; L94-K101 PolarHBondContact O-N 2.83Å; L96-K101 HydrophobicContact CB-CD 4.46Å; L96-K101 HydrophobicContact CB-CG 3.53Å; L96-K101 HydrophobicContact CD2-CG 4.37Å; D99-K101 HydrophobicContact CB-CD 3.99Å; D99-K101 VanDerWaalsContact CB-CE 3.46Å; D99-K101 VanDerWaalsContact CB-NZ 3.28Å; D99-K101 PolarHBondContact O-N 2.83Å; D99-K101 IonicContact OD2-NZ 2.73Å; D99-K101 PolarHBondContact OD2-NZ 3.07Å
102	Y	77.2	Confident	84.5	Confident	37 Å²	37	50.2 Å²	50.2	15%	0.145	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	140.3	-177.9	-179.6	-94.2	0	0	0	111.4	H55 L94 L100 Q104	H55-Y102 AromaticContact CD2-CD2 3.53Å; H55-Y102 AromaticContact CD2-CE2 3.42Å; H55-Y102 VanDerWaalsContact CD2-CE2 3.42Å; H55-Y102 WeakPolarHBondContact CD2-CE2 3.28Å; H55-Y102 AromaticContact NE2-CD2 3.5Å; H55-Y102 AromaticContact NE2-CE2 3.34Å; H55-Y102 VanDerWaalsContact NE2-CE2 3.34Å; H55-Y102 WeakPolarHBondContact NE2-CE2 3.37Å; L94-Y102 HydrophobicContact CB-CD1 4.46Å; L94-Y102 PolarHBondContact N-O 2.86Å; L94-Y102 PolarHBondContact O-N 3.05Å; L100-Y102 WeakPolarHBondContact CD1-O 3.39Å; Y102-Q104 HydrophobicContact CE1-CB 3.71Å; Y102-Q104 VanDerWaalsContact OH-CD 3.22Å; Y102-Q104 PolarHBondContact OH-OE1 2.98Å; Y102-Q104 VanDerWaalsContact OH-OE1 3.06Å
103	H	82.9	Confident	84.7	Confident	67 Å²	67	54.9 Å²	54.9	31%	0.31	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	127.6	178	167.8	44.9	0	0	0	108.7	C92 L100	C92-H103 WeakPolarHBondContact O-CA 3.35Å; C92-H103 PolarHBondContact O-ND1 2.84Å; L100-H103 HydrophobicContact CD2-CB 4.48Å
104	Q	80	Confident	85.1	Confident	27 Å²	27	48.7 Å²	48.7	13%	0.126	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.8	-177.1	-171.7	178.3	29.3	0	0	110.5	C92 Y102	C92-Q104 PolarHBondContact N-O 3.1Å; C92-Q104 PolarHBondContact O-N 2.82Å; C92-Q104 VanDerWaalsContact O-N 3.09Å; Y102-Q104 HydrophobicContact CE1-CB 3.71Å; Y102-Q104 VanDerWaalsContact OH-CD 3.22Å; Y102-Q104 PolarHBondContact OH-OE1 2.98Å; Y102-Q104 VanDerWaalsContact OH-OE1 3.06Å
105	S	84.8	Confident	85.5	Confident	12 Å²	12	54.1 Å²	54.1	8%	0.084	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.9	165.1	-152.9	0	0	0	0	110.2	V37 E89 Y91	V37-S105 PolarHBondContact N-O 3.42Å; E89-S105 WeakPolarHBondContact CG-OG 3.25Å; E89-S105 WeakPolarHBondContact OE1-CB 3.45Å; E89-S105 PolarHBondContact OE1-OG 2.59Å; Y91-S105 VanDerWaalsContact CD1-OG 3.31Å; Y91-S105 WeakPolarHBondContact CD1-OG 3.37Å; Y91-S105 VanDerWaalsContact CE1-OG 3.29Å; Y91-S105 WeakPolarHBondContact CE1-OG 3.47Å
106	L	85.1	Confident	86	Confident	8 Å²	8	53.9 Å²	53.9	4%	0.042	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	109.8	-175.7	178.6	73.1	0	0	0	109.4	V37 R39 L49 Y90 V108	V37-L106 HydrophobicContact CB-CD1 3.74Å; V37-L106 HydrophobicContact CG1-CD1 3.74Å; V37-L106 CarbonylContact O-C 3.54Å; V37-L106 WeakPolarHBondContact O-CA 3.31Å; R39-L106 HydrophobicContact CG-CD1 4.11Å; L49-L106 HydrophobicContact CB-CD2 4.45Å; L49-L106 HydrophobicContact CD1-CD2 4.01Å; L49-L106 HydrophobicContact CD2-CD2 3.86Å; L49-L106 HydrophobicContact CG-CD2 4.32Å; Y90-L106 PolarHBondContact N-O 2.87Å; Y90-L106 PolarHBondContact O-N 3.06Å; L106-V108 HydrophobicContact CD2-CG2 4.07Å; L106-V108 HydrophobicContact CG-CG2 4.09Å; L106-V108 PolarHBondContact O-N 2.93Å
107	L	89	Confident	86.5	Confident	71 Å²	71	51.8 Å²	51.8	37%	0.372	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	114.2	174.3	-178.2	60.9	0	0	0	109.5	V37 T38 R39 V109	V37-L107 PolarHBondContact O-N 3.29Å; T38-L107 CarbonylContact C-O 3.54Å; T38-L107 VanDerWaalsContact CA-O 3.3Å; T38-L107 WeakPolarHBondContact CA-O 3.35Å; T38-L107 HydrophobicContact CG2-CB 4.29Å; T38-L107 HydrophobicContact CG2-CD2 4.09Å; T38-L107 HydrophobicContact CG2-CG 4.18Å; R39-L107 PolarHBondContact N-O 3.39Å; L107-V109 HydrophobicContact CD2-CG2 4.38Å; L107-V109 HydrophobicContact CG-CG2 4.03Å
108	V	88.8	Confident	87.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.8	177.1	177	0	0	0	0	108.3	F41 L49 S87 G88 Y90 L106 I110	F41-V108 HydrophobicContact CD2-CG1 3.95Å; F41-V108 HydrophobicContact CE2-CG1 4.11Å; L49-V108 HydrophobicContact CD1-CG2 4.08Å; S87-V108 CarbonylContact C-O 3.59Å; S87-V108 VanDerWaalsContact CA-O 3.26Å; S87-V108 WeakPolarHBondContact CA-O 3.49Å; G88-V108 PolarHBondContact N-O 2.95Å; G88-V108 PolarHBondContact O-N 3.36Å; Y90-V108 HydrophobicContact CD2-CB 3.81Å; Y90-V108 HydrophobicContact CD2-CG2 3.48Å; Y90-V108 VanDerWaalsContact CD2-CG2 3.48Å; Y90-V108 HydrophobicContact CE2-CB 3.77Å; Y90-V108 HydrophobicContact CE2-CG1 4.31Å; Y90-V108 HydrophobicContact CE2-CG2 3.81Å; Y90-V108 HydrophobicContact CG-CG2 4.29Å; L106-V108 HydrophobicContact CD2-CG2 4.07Å; L106-V108 HydrophobicContact CG-CG2 4.09Å; L106-V108 PolarHBondContact O-N 2.93Å; V108-I110 HydrophobicContact CG1-CD1 4.45Å; V108-I110 HydrophobicContact CG1-CG1 4.22Å
109	V	90.2	Very high	87.8	Confident	25 Å²	25	49.4 Å²	49.4	15%	0.152	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	108.6	-179.3	-175.3	0	0	0	0	108.8	T38 R39 H40 F41 L107 Q111 N141	T38-V109 HydrophobicContact CG2-CG2 3.96Å; R39-V109 PolarHBondContact O-N 3.04Å; H40-V109 CarbonylContact C-O 3.6Å; H40-V109 WeakPolarHBondContact CA-O 3.34Å; F41-V109 PolarHBondContact N-O 3.33Å; L107-V109 HydrophobicContact CD2-CG2 4.38Å; L107-V109 HydrophobicContact CG-CG2 4.03Å; V109-Q111 HydrophobicContact CG1-CG 3.99Å; V109-N141 HydrophobicContact CG1-CB 3.93Å
110	I	90.8	Very high	88.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	131	176.1	-60.6	161.5	0	0	0	108	F41 V43 I47 A82 S83 I84 Q86 S87 V108 N141	F41-I110 HydrophobicContact CB-CG1 4.44Å; F41-I110 CarbonylContact O-C 3.59Å; F41-I110 WeakPolarHBondContact O-CA 3.48Å; V43-I110 HydrophobicContact CB-CG2 4.49Å; V43-I110 HydrophobicContact CG2-CG2 3.72Å; I47-I110 HydrophobicContact CD1-CD1 4.11Å; I47-I110 HydrophobicContact CD1-CG1 4.06Å; A82-I110 HydrophobicContact CB-CD1 3.82Å; S83-I110 WeakPolarHBondContact O-CD1 3.09Å; I84-I110 HydrophobicContact CG1-CG2 4.35Å; Q86-I110 HydrophobicContact CB-CD1 3.88Å; S87-I110 WeakPolarHBondContact OG-CB 3.35Å; S87-I110 PolarHBondContact OG-N 2.85Å; S87-I110 PolarHBondContact OG-O 3.1Å; V108-I110 HydrophobicContact CG1-CD1 4.45Å; V108-I110 HydrophobicContact CG1-CG1 4.22Å; I110-N141 WeakPolarHBondContact O-CB 3.49Å; I110-N141 PolarHBondContact O-ND2 2.76Å
111	Q	92.4	Very high	88.7	Confident	24 Å²	24	46 Å²	46	11%	0.112	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.3	-168.9	-55.5	178	-63.4	0	0	111.4	H40 F41 R42 V43 V109 Q140 N141 I191	H40-Q111 PolarHBondContact ND1-NE2 2.86Å; F41-Q111 PolarHBondContact O-N 2.84Å; R42-Q111 WeakPolarHBondContact CA-O 3.2Å; V43-Q111 PolarHBondContact N-O 3.14Å; V109-Q111 HydrophobicContact CG1-CG 3.99Å; Q111-Q140 WeakPolarHBondContact CA-O 3.43Å; Q111-N141 HydrophobicContact CG-CB 4.01Å; Q111-N141 PolarHBondContact NE2-O 3.29Å; Q111-I191 HydrophobicContact CB-CD1 3.7Å; Q111-I191 HydrophobicContact CB-CG1 3.84Å
112	D	92.1	Very high	89.2	Confident	57 Å²	57	42.4 Å²	42.4	31%	0.305	23%	0.227	S	C	.	.			trans	-136.1	176.5	175.9	-154.8	-8.3	0	0	0	111.2	V43 I84 Q140 N189 I191	V43-D112 HydrophobicContact CB-CB 4.31Å; V43-D112 HydrophobicContact CG2-CB 3.73Å; I84-D112 HydrophobicContact CD1-CB 3.73Å; D112-Q140 HydrophobicContact CB-CB 3.96Å; D112-Q140 HydrophobicContact CB-CG 4.5Å; D112-Q140 PolarHBondContact N-O 2.93Å; D112-N189 PolarHBondContact O-ND2 3.12Å; D112-I191 WeakPolarHBondContact O-CG1 3.14Å
113	K	91.7	Very high	89.7	Confident	101 Å²	101	46.4 Å²	46.4	44%	0.439	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-57.4	150.8	169.3	-63.6	164.6	173.6	-176.2	0	110.9	Q140 W193	K113-Q140 WeakPolarHBondContact O-CB 3.21Å; K113-Q140 WeakPolarHBondContact O-CG 3.32Å; K113-W193 WeakPolarHBondContact CD-O 3.38Å
114	P	93.3	Very high	89.9	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.032	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-73.5	157.6	178.6	30	-27.1	0	0	0	110.9	N138 I144 A187 N189 G192 S194	P114-N138 CarbonylContact C-O 3.58Å; P114-N138 WeakPolarHBondContact CA-O 3.32Å; P114-I144 HydrophobicContact CB-CD1 3.84Å; P114-I144 HydrophobicContact CB-CG1 3.73Å; P114-I144 HydrophobicContact CG-CG1 4.27Å; P114-A187 HydrophobicContact CB-CB 4.28Å; P114-A187 HydrophobicContact CG-CB 3.88Å; P114-N189 HydrophobicContact CG-CB 4.31Å; P114-G192 WeakPolarHBondContact CD-O 3.41Å; P114-S194 WeakPolarHBondContact O-CA 3.27Å; P114-S194 WeakPolarHBondContact O-CB 3.42Å
115	F	93.6	Very high	90.3	Very high	123 Å²	123	47 Å²	47	54%	0.539	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-71	154.8	170	-73.5	-3.8	0	0	0	111.5	N138 Q140	F115-N138 HydrophobicContact CB-CB 4.41Å; F115-N138 HydrophobicContact CD2-CB 3.78Å; F115-N138 HydrophobicContact CE2-CB 4.36Å; F115-N138 HydrophobicContact CG-CB 4.17Å; F115-N138 PolarHBondContact N-O 3.05Å; F115-Q140 HydrophobicContact CD1-CG 4.14Å; F115-Q140 HydrophobicContact CE1-CG 4.2Å
116	S	93.2	Very high	90.4	Very high	42 Å²	42	47.3 Å²	47.3	29%	0.294	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-58.9	139.9	177.8	58.3	0	0	0	0	112	E195	S116-E195 WeakPolarHBondContact CB-O 3.22Å
117	P	93.7	Very high	90.5	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.019	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-55.3	149.8	170.4	-26.9	36.5	0	0	0	113.2	W134 V135 I185 A187	P117-W134 HydrophobicContact CB-CG 4.45Å; P117-V135 WeakPolarHBondContact CA-O 3.14Å; P117-I185 HydrophobicContact CB-CB 4.32Å; P117-I185 HydrophobicContact CB-CG2 4.31Å; P117-I185 HydrophobicContact CG-CB 4.29Å; P117-I185 HydrophobicContact CG-CG2 3.97Å; P117-A187 HydrophobicContact CG-CB 4.24Å
118	T	92.2	Very high	90.6	Very high	66 Å²	66	48.7 Å²	48.7	41%	0.405	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	174.4	-174.4	57.9	0	0	0	0	111.8	I120 V135	T118-I120 PolarHBondContact O-N 2.86Å; T118-V135 PolarHBondContact N-O 2.72Å; T118-V135 PolarHBondContact O-N 3.42Å
119	S	89.9	Confident	90.7	Very high	88 Å²	88	49.2 Å²	49.2	62%	0.615	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	49.9	51.2	173.8	-57.6	0	0	0	0	114.1	V121	S119-V121 PolarHBondContact O-N 2.9Å
120	I	91.5	Very high	90.8	Very high	28 Å²	28	48 Å²	48	14%	0.144	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	120.1	-178.8	-64.9	173.7	0	0	0	110.2	T118 I122 S133 W134 L183 I185 S197	T118-I120 PolarHBondContact O-N 2.86Å; I120-I122 HydrophobicContact CG2-CD1 4.46Å; I120-I122 HydrophobicContact CG2-CG1 4.08Å; I120-S133 WeakPolarHBondContact CA-O 3.48Å; I120-W134 HydrophobicContact CG1-CB 4.01Å; I120-L183 HydrophobicContact CD1-CD2 4.45Å; I120-L183 HydrophobicContact CG2-CD2 3.82Å; I120-I185 HydrophobicContact CD1-CB 4.27Å; I120-I185 HydrophobicContact CD1-CD1 3.76Å; I120-I185 HydrophobicContact CD1-CG1 3.77Å; I120-I185 HydrophobicContact CG1-CD1 3.91Å; I120-I185 HydrophobicContact CG1-CG1 4.47Å; I120-I185 HydrophobicContact CG2-CD1 4.41Å; I120-S197 WeakPolarHBondContact CD1-OG 3.5Å
121	V	90.7	Very high	90.9	Very high	85 Å²	85	50.6 Å²	50.6	52%	0.515	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	134.8	173	-177.4	0	0	0	0	108.7	S119 V132 S133	S119-V121 PolarHBondContact O-N 2.9Å; V121-V132 WeakPolarHBondContact O-CA 3.44Å; V121-S133 PolarHBondContact N-O 3.34Å; V121-S133 PolarHBondContact O-N 3.07Å
122	I	89.4	Confident	91	Very high	22 Å²	22	49.4 Å²	49.4	11%	0.113	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	129.8	176.1	-49.6	170.5	0	0	0	108.1	I120 M130 N131 V132 L183 S200 S202	I120-I122 HydrophobicContact CG2-CD1 4.46Å; I120-I122 HydrophobicContact CG2-CG1 4.08Å; I122-M130 HydrophobicContact CG2-CB 4.19Å; I122-M130 HydrophobicContact CG2-CG 4.29Å; I122-M130 HydrophobicContact CG2-SD 3.81Å; I122-N131 WeakPolarHBondContact CA-O 3.49Å; I122-V132 HydrophobicContact CG2-CG2 4.31Å; I122-L183 HydrophobicContact CD1-CB 3.54Å; I122-L183 HydrophobicContact CD1-CD1 3.99Å; I122-L183 HydrophobicContact CD1-CD2 4.35Å; I122-L183 HydrophobicContact CD1-CG 4.18Å; I122-L183 HydrophobicContact CG1-CD1 4.32Å; I122-S200 WeakPolarHBondContact CD1-OG 3.44Å; I122-S202 VanDerWaalsContact CG2-CB 3.42Å
123	Q	87.6	Confident	91.1	Very high	121 Å²	121	48.7 Å²	48.7	57%	0.565	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.5	124.9	179.8	-176.9	179.1	1.6	0	0	109.7	L125 M130 N131	Q123-L125 PolarHBondContact O-N 3.05Å; Q123-M130 CarbonylContact O-C 3.43Å; Q123-M130 VanDerWaalsContact O-CA 3.32Å; Q123-M130 WeakPolarHBondContact O-CA 3.5Å; Q123-N131 PolarHBondContact N-O 3.26Å; Q123-N131 PolarHBondContact O-N 3.35Å
124	A	87.7	Confident	91.2	Very high	20 Å²	20	44.3 Å²	44.3	17%	0.165	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	127.8	170.3	0	0	0	0	0	110.4	L203 L205	A124-L203 WeakPolarHBondContact CB-O 3.3Å; A124-L205 HydrophobicContact CB-CD2 3.95Å; A124-L205 HydrophobicContact CB-CG 4.03Å
125	L	87.5	Confident	91.2	Very high	86 Å²	86	47.7 Å²	47.7	45%	0.45	27%	0.272	S	S	.	.			trans	-96.8	-33.4	174.3	-64.9	179.9	0	0	0	111.2	Q123 S129 N131 T171	Q123-L125 PolarHBondContact O-N 3.05Å; L125-S129 PolarHBondContact N-O 2.81Å; L125-N131 HydrophobicContact CD1-CB 4.03Å; L125-N131 HydrophobicContact CD2-CB 4.08Å; L125-N131 HydrophobicContact CG-CB 4.01Å; L125-T171 HydrophobicContact CD1-CG2 3.6Å
126	S	88.5	Confident	91.1	Very high	18 Å²	18	45.1 Å²	45.1	13%	0.126	26%	0.261	C	S	.	.	S	Bend	trans	-149.3	-173.9	178.3	73.8	0	0	0	0	110.6	S128 S129 L205	S126-S128 PolarHBondContact O-N 3.5Å; S126-S128 PolarHBondContact OG-N 2.64Å; S126-S129 PolarHBondContact N-O 3.16Å; S126-S129 PolarHBondContact OG-N 2.81Å; S126-S129 PolarHBondContact OG-OG 2.82Å; S126-L205 PolarHBondContact O-N 2.95Å; S126-L205 VanDerWaalsContact O-N 3.13Å
127	E	87.6	Confident	90.9	Very high	61 Å²	61	43.8 Å²	43.8	29%	0.285	25%	0.253	S	S	.	.	S	Bend	trans	-66.8	-13.8	166.8	63.1	-74.7	170	0	0	113.8	K176 P177 L205 R312	E127-K176 CarbonylContact O-C 3.43Å; E127-P177 HydrophobicContact CB-CB 4.13Å; E127-P177 WeakPolarHBondContact O-CA 3.47Å; E127-L205 WeakPolarHBondContact CA-O 3.43Å; E127-L205 WeakPolarHBondContact CB-O 3.22Å; E127-R312 IonicContact OE2-CZ 3.14Å; E127-R312 IonicContact OE2-NH1 3.53Å; E127-R312 PolarHBondContact OE2-NH1 3Å; E127-R312 IonicContact OE2-NH2 3.65Å; E127-R312 PolarHBondContact OE2-NH2 2.91Å
128	S	90	Very high	90.6	Very high	47 Å²	47	47.9 Å²	47.9	33%	0.329	28%	0.275	S	S	.	.	S	Bend	trans	-130.6	7.6	179.7	67.1	0	0	0	0	114.9	S126 H173 N174 L175	S126-S128 PolarHBondContact O-N 3.5Å; S126-S128 PolarHBondContact OG-N 2.64Å; S128-H173 CarbonylContact O-C 3.59Å; S128-H173 WeakPolarHBondContact O-CA 3.32Å; S128-N174 PolarHBondContact O-N 2.87Å; S128-L175 WeakPolarHBondContact CA-O 3.18Å; S128-L175 WeakPolarHBondContact CB-O 3.41Å; S128-L175 WeakPolarHBondContact O-CB 3.44Å; S128-L175 PolarHBondContact O-N 2.79Å
129	S	91.4	Very high	90.5	Very high	12 Å²	12	47 Å²	47	8%	0.084	27%	0.272	C	S	.	.			trans	-147.6	149.4	-176.6	63.9	0	0	0	0	114.9	L125 S126 L172	L125-S129 PolarHBondContact N-O 2.81Å; S126-S129 PolarHBondContact N-O 3.16Å; S126-S129 PolarHBondContact OG-N 2.81Å; S126-S129 PolarHBondContact OG-OG 2.82Å; S129-L172 CarbonylContact C-O 3.54Å; S129-L172 WeakPolarHBondContact CA-O 3.2Å; S129-L172 WeakPolarHBondContact CB-O 2.96Å
130	M	91.8	Very high	90.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	140.3	178.2	-74.4	174.4	171.4	0	0	110.6	I122 Q123 T171 L172 L175 Y181 S202 T204	I122-M130 HydrophobicContact CG2-CB 4.19Å; I122-M130 HydrophobicContact CG2-CG 4.29Å; I122-M130 HydrophobicContact CG2-SD 3.81Å; Q123-M130 CarbonylContact O-C 3.43Å; Q123-M130 VanDerWaalsContact O-CA 3.32Å; Q123-M130 WeakPolarHBondContact O-CA 3.5Å; M130-T171 CarbonylContact O-C 3.52Å; M130-T171 WeakPolarHBondContact O-CA 3.17Å; M130-T171 WeakPolarHBondContact O-CG2 2.97Å; M130-L172 PolarHBondContact N-O 2.99Å; M130-L172 PolarHBondContact O-N 2.82Å; M130-L175 HydrophobicContact CB-CD1 4.06Å; M130-L175 HydrophobicContact CG-CD1 3.75Å; M130-L175 HydrophobicContact SD-CD1 3.82Å; M130-Y181 HydrophobicContact CE-CD2 4.09Å; M130-S202 WeakPolarHBondContact CE-O 3.25Å; M130-T204 HydrophobicContact CE-CG2 3.76Å; M130-T204 HydrophobicContact CG-CG2 4.47Å
131	N	92.9	Very high	90.3	Very high	53 Å²	53	45.8 Å²	45.8	28%	0.283	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	141	164.1	-164.3	25.7	0	0	0	109.9	I122 Q123 L125	I122-N131 WeakPolarHBondContact CA-O 3.49Å; Q123-N131 PolarHBondContact N-O 3.26Å; Q123-N131 PolarHBondContact O-N 3.35Å; L125-N131 HydrophobicContact CD1-CB 4.03Å; L125-N131 HydrophobicContact CD2-CB 4.08Å; L125-N131 HydrophobicContact CG-CB 4.01Å
132	V	93.8	Very high	90.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	132	179.3	-175.4	0	0	0	0	108.9	V121 I122 W134 S169 T170 L172 L183 I185	V121-V132 WeakPolarHBondContact O-CA 3.44Å; I122-V132 HydrophobicContact CG2-CG2 4.31Å; V132-W134 HydrophobicContact CB-CZ3 4.49Å; V132-W134 HydrophobicContact CG1-CE3 4.04Å; V132-W134 HydrophobicContact CG1-CZ3 4.11Å; V132-S169 CarbonylContact O-C 3.54Å; V132-S169 WeakPolarHBondContact O-CA 3.44Å; V132-S169 VanDerWaalsContact O-CB 3.32Å; V132-S169 WeakPolarHBondContact O-CB 3.33Å; V132-T170 PolarHBondContact N-O 2.92Å; V132-T170 PolarHBondContact O-N 2.87Å; V132-L172 HydrophobicContact CG2-CD1 3.76Å; V132-L172 HydrophobicContact CG2-CG 3.88Å; V132-L183 HydrophobicContact CB-CD1 4.29Å; V132-L183 HydrophobicContact CG1-CD1 3.69Å; V132-L183 HydrophobicContact CG1-CD2 4.01Å; V132-L183 HydrophobicContact CG2-CD1 3.55Å; V132-I185 HydrophobicContact CG1-CD1 4.26Å
133	S	94.5	Very high	90.2	Very high	41 Å²	41	45 Å²	45	29%	0.287	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	152	173.5	59.3	0	0	0	0	112.1	I120 V121 S168	I120-S133 WeakPolarHBondContact CA-O 3.48Å; V121-S133 PolarHBondContact N-O 3.34Å; V121-S133 PolarHBondContact O-N 3.07Å; S133-S168 CarbonylContact C-O 3.57Å; S133-S168 WeakPolarHBondContact CA-O 3.28Å
134	W	94.4	Very high	90.3	Very high	9 Å²	9	40 Å²	40	3%	0.034	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	165	-176.3	58.8	93.9	0	0	0	112.1	P117 I120 V132 H147 V149 V163 S168 T170 I185	P117-W134 HydrophobicContact CB-CG 4.45Å; I120-W134 HydrophobicContact CG1-CB 4.01Å; V132-W134 HydrophobicContact CB-CZ3 4.49Å; V132-W134 HydrophobicContact CG1-CE3 4.04Å; V132-W134 HydrophobicContact CG1-CZ3 4.11Å; W134-H147 AromaticContact CD1-NE2 3.95Å; W134-H147 AromaticContact CE2-CG 3.94Å; W134-H147 HydrophobicContact CZ2-CB 3.85Å; W134-H147 AromaticContact NE1-CD2 3.42Å; W134-H147 PolarHBondContact NE1-CD2 2.04Å; W134-H147 AromaticContact NE1-CE1 3.45Å; W134-H147 PolarHBondContact NE1-CE1 2.79Å; W134-H147 AromaticContact NE1-CG 3.31Å; W134-H147 VanDerWaalsContact NE1-CG 3.31Å; W134-H147 AromaticContact NE1-ND1 3.33Å; W134-H147 PolarHBondContact NE1-ND1 2.91Å; W134-H147 AromaticContact NE1-NE2 3.5Å; W134-H147 PolarHBondContact NE1-NE2 2.97Å; W134-V149 HydrophobicContact CH2-CG2 3.88Å; W134-V149 HydrophobicContact CZ3-CG2 3.86Å; W134-V163 HydrophobicContact CH2-CB 4.1Å; W134-V163 HydrophobicContact CH2-CG1 3.89Å; W134-V163 HydrophobicContact CH2-CG2 4.05Å; W134-V163 HydrophobicContact CZ2-CB 4.12Å; W134-V163 HydrophobicContact CZ2-CG1 3.89Å; W134-S168 VanDerWaalsContact CD2-O 3.3Å; W134-S168 PolarHBondContact N-O 2.88Å; W134-S168 WeakPolarHBondContact O-CB 3.33Å; W134-T170 HydrophobicContact CH2-CG2 4.27Å; W134-T170 HydrophobicContact CZ3-CG2 4.26Å; W134-I185 HydrophobicContact CB-CD1 3.81Å; W134-I185 HydrophobicContact CD2-CD1 3.57Å; W134-I185 HydrophobicContact CE3-CD1 3.44Å; W134-I185 VanDerWaalsContact CE3-CD1 3.44Å; W134-I185 HydrophobicContact CG-CD1 3.75Å; W134-I185 HydrophobicContact CZ3-CD1 4.22Å
135	V	93.7	Very high	90.4	Very high	77 Å²	77	41.7 Å²	41.7	47%	0.467	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	135	172.2	176.2	0	0	0	0	109.4	P117 T118	P117-V135 WeakPolarHBondContact CA-O 3.14Å; T118-V135 PolarHBondContact N-O 2.72Å; T118-V135 PolarHBondContact O-N 3.42Å
136	F	91.4	Very high	90.7	Very high	69 Å²	69	38.9 Å²	38.9	30%	0.303	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-57.1	142.2	177.2	-81.2	-121.8	0	0	0	111.2	I144 H147 P166	F136-I144 HydrophobicContact CD1-CB 4.43Å; F136-I144 HydrophobicContact CD1-CD1 4.11Å; F136-I144 HydrophobicContact CD1-CG2 4.38Å; F136-I144 HydrophobicContact CE1-CB 4.46Å; F136-I144 HydrophobicContact CE1-CG2 4.26Å; F136-H147 AromaticContact CD1-CE1 3.67Å; F136-H147 AromaticContact CD2-CE1 3.88Å; F136-H147 AromaticContact CE1-CE1 3.56Å; F136-H147 AromaticContact CE2-CE1 3.76Å; F136-H147 AromaticContact CG-CE1 3.83Å; F136-H147 AromaticContact CZ-CE1 3.59Å; F136-P166 WeakPolarHBondContact CZ-O 3.44Å
137	G	87.6	Confident	90.9	Very high	13 Å²	13	38 Å²	38	13%	0.134	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-75.5	167	165.8	0	0	0	0	0	112.2	S139 I144	G137-S139 PolarHBondContact O-N 2.85Å; G137-I144 WeakPolarHBondContact O-CD1 3.32Å
138	N	88.8	Confident	91.2	Very high	89 Å²	89	35.1 Å²	35.1	48%	0.476	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-61.4	132.1	169.2	-175.6	-19.3	0	0	0	109.7	P114 F115 Q140	P114-N138 CarbonylContact C-O 3.58Å; P114-N138 WeakPolarHBondContact CA-O 3.32Å; F115-N138 HydrophobicContact CB-CB 4.41Å; F115-N138 HydrophobicContact CD2-CB 3.78Å; F115-N138 HydrophobicContact CE2-CB 4.36Å; F115-N138 HydrophobicContact CG-CB 4.17Å; F115-N138 PolarHBondContact N-O 3.05Å; N138-Q140 VanDerWaalsContact C-N 3.34Å; N138-Q140 PolarHBondContact ND2-NE2 2.57Å; N138-Q140 PolarHBondContact O-N 2.83Å; N138-Q140 PolarHBondContact OD1-N 2.86Å
139	S	89.5	Confident	91.4	Very high	48 Å²	48	32.9 Å²	32.9	34%	0.336	19%	0.194	S	C	.	.			trans	-77.7	-10.8	-174.8	55.9	0	0	0	0	115.1	G137 N141 S142 N189	G137-S139 PolarHBondContact O-N 2.85Å; S139-N141 VanDerWaalsContact C-N 3.34Å; S139-N141 PolarHBondContact O-N 3.02Å; S139-S142 WeakPolarHBondContact CB-O 3.39Å; S139-S142 PolarHBondContact O-N 2.92Å; S139-N189 PolarHBondContact O-ND2 3.06Å
140	Q	89.1	Confident	91.6	Very high	19 Å²	19	33.1 Å²	33.1	9%	0.089	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	49.8	178	-57.4	-52	-22.8	0	0	113.7	I84 Q111 D112 K113 F115 N138 S142	I84-Q140 HydrophobicContact CD1-CB 3.71Å; I84-Q140 HydrophobicContact CD1-CG 4.25Å; Q111-Q140 WeakPolarHBondContact CA-O 3.43Å; D112-Q140 HydrophobicContact CB-CB 3.96Å; D112-Q140 HydrophobicContact CB-CG 4.5Å; D112-Q140 PolarHBondContact N-O 2.93Å; K113-Q140 WeakPolarHBondContact O-CB 3.21Å; K113-Q140 WeakPolarHBondContact O-CG 3.32Å; F115-Q140 HydrophobicContact CD1-CG 4.14Å; F115-Q140 HydrophobicContact CE1-CG 4.2Å; N138-Q140 VanDerWaalsContact C-N 3.34Å; N138-Q140 PolarHBondContact ND2-NE2 2.57Å; N138-Q140 PolarHBondContact O-N 2.83Å; N138-Q140 PolarHBondContact OD1-N 2.86Å; Q140-S142 PolarHBondContact O-N 2.81Å; Q140-S142 VanDerWaalsContact O-N 3.16Å
141	N	88.2	Confident	91.6	Very high	71 Å²	71	33.2 Å²	33.2	38%	0.38	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	7.3	178.6	-59.1	-25.5	0	0	0	116.6	S87 V109 I110 Q111 S139	S87-N141 PolarHBondContact OG-ND2 3.28Å; V109-N141 HydrophobicContact CG1-CB 3.93Å; I110-N141 WeakPolarHBondContact O-CB 3.49Å; I110-N141 PolarHBondContact O-ND2 2.76Å; Q111-N141 HydrophobicContact CG-CB 4.01Å; Q111-N141 PolarHBondContact NE2-O 3.29Å; S139-N141 VanDerWaalsContact C-N 3.34Å; S139-N141 PolarHBondContact O-N 3.02Å
142	S	88.5	Confident	91.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-126.6	126.6	168.4	161.6	0	0	0	0	110.4	S139 Q140 I144 N189 D190	S139-S142 WeakPolarHBondContact CB-O 3.39Å; S139-S142 PolarHBondContact O-N 2.92Å; Q140-S142 PolarHBondContact O-N 2.81Å; Q140-S142 VanDerWaalsContact O-N 3.16Å; S142-I144 PolarHBondContact O-N 2.86Å; S142-N189 WeakPolarHBondContact CB-ND2 3.4Å; S142-N189 WeakPolarHBondContact O-CB 3.16Å; S142-N189 PolarHBondContact O-ND2 2.97Å; S142-N189 WeakPolarHBondContact OG-CB 3.41Å; S142-D190 WeakPolarHBondContact OG-CB 3.08Å; S142-D190 PolarHBondContact OG-N 2.84Å; S142-D190 PolarHBondContact OG-OD2 2.91Å
143	P	90	Very high	91	Very high	92 Å²	92	33.3 Å²	33.3	60%	0.597	19%	0.193	S	C	*	.			trans	-56.8	134.9	-174.2	-26.4	35.4	0	0	0	114.1	S145 N189	P143-S145 PolarHBondContact O-N 3.39Å; P143-N189 VanDerWaalsContact O-CB 3.25Å; P143-N189 WeakPolarHBondContact O-CB 3.06Å
144	I	89.7	Confident	90.2	Very high	15 Å²	15	34.3 Å²	34.3	8%	0.077	20%	0.195	C	C	.	.			trans	-69.6	122	172.6	-66.9	168.1	0	0	0	108.6	P114 F136 G137 S142 S165 A187 L188	P114-I144 HydrophobicContact CB-CD1 3.84Å; P114-I144 HydrophobicContact CB-CG1 3.73Å; P114-I144 HydrophobicContact CG-CG1 4.27Å; F136-I144 HydrophobicContact CD1-CB 4.43Å; F136-I144 HydrophobicContact CD1-CD1 4.11Å; F136-I144 HydrophobicContact CD1-CG2 4.38Å; F136-I144 HydrophobicContact CE1-CB 4.46Å; F136-I144 HydrophobicContact CE1-CG2 4.26Å; G137-I144 WeakPolarHBondContact O-CD1 3.32Å; S142-I144 PolarHBondContact O-N 2.86Å; I144-S165 WeakPolarHBondContact O-CB 3.45Å; I144-S165 PolarHBondContact O-OG 2.83Å; I144-A187 HydrophobicContact CD1-CB 4.31Å; I144-A187 HydrophobicContact CG2-CB 4.11Å; I144-L188 CarbonylContact C-O 3.52Å; I144-L188 WeakPolarHBondContact CA-O 3.45Å
145	S	90.2	Very high	89.3	Confident	56 Å²	56	39.6 Å²	39.6	39%	0.392	22%	0.224	S	C	.	.			trans	-96.1	-35.6	-178.9	58	0	0	0	0	112.6	P143 S165 L188	P143-S145 PolarHBondContact O-N 3.39Å; S145-S165 WeakPolarHBondContact O-CB 3.49Å; S145-S165 PolarHBondContact O-N 2.62Å; S145-L188 PolarHBondContact N-O 3.02Å; S145-L188 PolarHBondContact OG-O 2.93Å
146	L	92.4	Very high	88.8	Confident	26 Å²	26	39.7 Å²	39.7	14%	0.136	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	143.6	-169	168.1	68.7	0	0	0	111.7	N162 A187 L188 W193	L146-N162 HydrophobicContact CD1-CB 3.65Å; L146-A187 CarbonylContact O-C 3.47Å; L146-A187 WeakPolarHBondContact O-CA 3.26Å; L146-L188 HydrophobicContact CB-CB 4.16Å; L146-L188 HydrophobicContact CB-CD2 4.28Å; L146-L188 HydrophobicContact CD2-CD2 3.94Å; L146-L188 PolarHBondContact O-N 2.88Å; L146-W193 HydrophobicContact CD2-CH2 3.77Å; L146-W193 HydrophobicContact CD2-CZ3 4.41Å; L146-W193 HydrophobicContact CG-CH2 4.49Å
147	H	93.5	Very high	88.7	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	144.5	158.9	-67.8	104	0	0	0	110.4	W134 F136 V163 I185 R186	W134-H147 AromaticContact CD1-NE2 3.95Å; W134-H147 AromaticContact CE2-CG 3.94Å; W134-H147 HydrophobicContact CZ2-CB 3.85Å; W134-H147 AromaticContact NE1-CD2 3.42Å; W134-H147 PolarHBondContact NE1-CD2 2.04Å; W134-H147 AromaticContact NE1-CE1 3.45Å; W134-H147 PolarHBondContact NE1-CE1 2.79Å; W134-H147 AromaticContact NE1-CG 3.31Å; W134-H147 VanDerWaalsContact NE1-CG 3.31Å; W134-H147 AromaticContact NE1-ND1 3.33Å; W134-H147 PolarHBondContact NE1-ND1 2.91Å; W134-H147 AromaticContact NE1-NE2 3.5Å; W134-H147 PolarHBondContact NE1-NE2 2.97Å; F136-H147 AromaticContact CD1-CE1 3.67Å; F136-H147 AromaticContact CD2-CE1 3.88Å; F136-H147 AromaticContact CE1-CE1 3.56Å; F136-H147 AromaticContact CE2-CE1 3.76Å; F136-H147 AromaticContact CG-CE1 3.83Å; F136-H147 AromaticContact CZ-CE1 3.59Å; H147-V163 PolarHBondContact N-O 3.12Å; H147-V163 PolarHBondContact O-N 2.83Å; H147-I185 HydrophobicContact CB-CG2 4.29Å; H147-R186 WeakPolarHBondContact CA-O 3.44Å
148	T	94.1	Very high	88.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	123.7	168.2	-52.2	0	0	0	0	110.1	Y150 Q160 K161 N162 I185 R186 W193	T148-Y150 HydrophobicContact CG2-CD2 4.09Å; T148-Y150 HydrophobicContact CG2-CE1 4.21Å; T148-Y150 HydrophobicContact CG2-CE2 3.4Å; T148-Y150 VanDerWaalsContact CG2-CZ 3.46Å; T148-Y150 WeakPolarHBondContact O-CD2 3.35Å; T148-Y150 WeakPolarHBondContact O-CE2 3.07Å; T148-Q160 HydrophobicContact CG2-CG 3.48Å; T148-Q160 VanDerWaalsContact CG2-CG 3.48Å; T148-K161 WeakPolarHBondContact CA-O 3.4Å; T148-N162 VanDerWaalsContact CG2-OD1 3.29Å; T148-N162 WeakPolarHBondContact CG2-OD1 3.49Å; T148-N162 PolarHBondContact OG1-OD1 2.74Å; T148-I185 WeakPolarHBondContact O-CA 3.47Å; T148-I185 WeakPolarHBondContact O-CG2 3.37Å; T148-R186 PolarHBondContact N-O 3.04Å; T148-R186 PolarHBondContact O-N 2.95Å; T148-R186 VanDerWaalsContact O-N 3.12Å; T148-W193 VanDerWaalsContact OG1-CH2 3.23Å; T148-W193 WeakPolarHBondContact OG1-CH2 3.36Å; T148-W193 WeakPolarHBondContact OG1-CZ3 3.47Å
149	V	93.9	Very high	88.7	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136	175.2	-179.4	0	0	0	0	109.2	W134 Q160 K161 T170 L172 L183 I185	W134-V149 HydrophobicContact CH2-CG2 3.88Å; W134-V149 HydrophobicContact CZ3-CG2 3.86Å; V149-Q160 CarbonylContact O-C 3.53Å; V149-Q160 WeakPolarHBondContact O-CA 3.37Å; V149-K161 PolarHBondContact N-O 3.31Å; V149-K161 PolarHBondContact O-N 2.95Å; V149-T170 HydrophobicContact CG2-CG2 4.34Å; V149-L172 HydrophobicContact CG1-CD1 4.41Å; V149-L183 HydrophobicContact CG1-CD1 3.69Å; V149-L183 HydrophobicContact CG1-CD2 4.2Å; V149-L183 HydrophobicContact CG1-CG 3.96Å; V149-I185 HydrophobicContact CG2-CD1 4.2Å; V149-I185 HydrophobicContact CG2-CG1 4.18Å; V149-I185 HydrophobicContact CG2-CG2 4.2Å
150	Y	94.6	Very high	88.8	Confident	18 Å²	18	43.6 Å²	43.6	7%	0.071	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122.3	179.1	-59.4	-103.5	0	0	0	109.6	T148 L157 Q160 L183 Y184 R186 F196	T148-Y150 HydrophobicContact CG2-CD2 4.09Å; T148-Y150 HydrophobicContact CG2-CE1 4.21Å; T148-Y150 HydrophobicContact CG2-CE2 3.4Å; T148-Y150 VanDerWaalsContact CG2-CZ 3.46Å; T148-Y150 WeakPolarHBondContact O-CD2 3.35Å; T148-Y150 WeakPolarHBondContact O-CE2 3.07Å; Y150-L157 HydrophobicContact CD1-CD1 4Å; Y150-L157 HydrophobicContact CD1-CD2 4.38Å; Y150-L157 HydrophobicContact CG-CD1 4.45Å; Y150-Q160 HydrophobicContact CD1-CB 4.43Å; Y150-Q160 HydrophobicContact CD1-CG 3.97Å; Y150-Q160 HydrophobicContact CE1-CG 3.8Å; Y150-Q160 VanDerWaalsContact CE1-OE1 3.31Å; Y150-L183 CarbonylContact O-C 3.51Å; Y150-L183 VanDerWaalsContact O-CA 3.3Å; Y150-L183 WeakPolarHBondContact O-CA 3.44Å; Y150-Y184 PolarHBondContact N-O 2.97Å; Y150-Y184 PolarHBondContact O-N 2.81Å; Y150-R186 HydrophobicContact CE2-CG 4.14Å; Y150-R186 PolarHBondContact OH-NE 2.92Å; Y150-R186 PolarHBondContact OH-NH2 2.93Å; Y150-F196 HydrophobicContact CD2-CD1 4.42Å; Y150-F196 AromaticContact CD2-CE1 3.79Å; Y150-F196 HydrophobicContact CD2-CE1 3.79Å; Y150-F196 HydrophobicContact CE2-CD1 4.48Å; Y150-F196 AromaticContact CE2-CE1 3.66Å; Y150-F196 HydrophobicContact CE2-CE1 3.66Å; Y150-F196 HydrophobicContact CE2-CZ 4.49Å; Y150-F196 HydrophobicContact CG-CE1 4.34Å
151	L	93.1	Very high	88.9	Confident	1 Å²	1	46 Å²	46	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127	-179.4	-168.8	81.5	0	0	0	110.1	V158 L159 L172 L175 Y181 L183	L151-V158 PolarHBondContact O-N 2.88Å; L151-L159 HydrophobicContact CB-CB 4.18Å; L151-L159 PolarHBondContact N-O 2.69Å; L151-L159 PolarHBondContact O-N 2.95Å; L151-L172 HydrophobicContact CB-CD1 4.23Å; L151-L172 HydrophobicContact CD1-CD1 3.92Å; L151-L172 HydrophobicContact CD2-CD1 4.04Å; L151-L172 HydrophobicContact CG-CD1 4.31Å; L151-L175 HydrophobicContact CD2-CD1 4.14Å; L151-L175 HydrophobicContact CD2-CD2 3.36Å; L151-L175 HydrophobicContact CD2-CG 4.41Å; L151-Y181 HydrophobicContact CD1-CD1 4.37Å; L151-Y181 HydrophobicContact CD1-CG 4.21Å; L151-Y181 HydrophobicContact CD2-CD1 3.61Å; L151-Y181 HydrophobicContact CD2-CE1 3.98Å; L151-Y181 HydrophobicContact CD2-CG 3.93Å; L151-Y181 HydrophobicContact CG-CD1 3.71Å; L151-Y181 HydrophobicContact CG-CE1 4.48Å; L151-Y181 HydrophobicContact CG-CG 4.04Å; L151-L183 HydrophobicContact CD1-CB 4.14Å; L151-L183 HydrophobicContact CD1-CD1 3.91Å; L151-L183 HydrophobicContact CD1-CG 4.42Å
152	H	89.5	Confident	89.1	Confident	36 Å²	36	47.3 Å²	47.3	17%	0.167	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	142.7	-176.5	-58.4	75.1	0	0	0	112.3	S156 Y181 T182 Y184	H152-S156 CarbonylContact C-O 3.53Å; H152-S156 WeakPolarHBondContact CA-O 3.45Å; H152-S156 WeakPolarHBondContact CB-O 3.46Å; H152-Y181 WeakPolarHBondContact O-CA 3.03Å; H152-T182 PolarHBondContact N-O 2.88Å; H152-T182 PolarHBondContact O-N 2.89Å; H152-Y184 AromaticContact CE1-CD2 3.62Å; H152-Y184 AromaticContact CE1-CE2 3.84Å; H152-Y184 AromaticContact ND1-CD2 3.54Å; H152-Y184 AromaticContact ND1-CE2 3.62Å
153	D	85.1	Confident	89.3	Confident	20 Å²	20	47.6 Å²	47.6	11%	0.107	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	119.8	168.7	176.5	3.3	0	0	0	107	N155 S156 V158 K176 Y181	D153-N155 VanDerWaalsContact C-N 3.29Å; D153-N155 PolarHBondContact O-N 3.39Å; D153-N155 VanDerWaalsContact O-N 3.16Å; D153-S156 PolarHBondContact N-O 2.92Å; D153-S156 WeakPolarHBondContact O-CA 3.23Å; D153-S156 VanDerWaalsContact O-CB 3.32Å; D153-S156 WeakPolarHBondContact O-CB 3.43Å; D153-S156 PolarHBondContact O-N 2.74Å; D153-V158 HydrophobicContact CB-CG2 3.49Å; D153-V158 VanDerWaalsContact CB-CG2 3.49Å; D153-K176 IonicContact OD2-NZ 2.79Å; D153-K176 PolarHBondContact OD2-NZ 2.71Å; D153-Y181 HydrophobicContact CB-CD1 4.16Å; D153-Y181 HydrophobicContact CB-CE1 3.91Å
154	N	76	Confident	89.2	Confident	61 Å²	61	47 Å²	47	33%	0.326	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	42.6	52.1	-176.7	-68	-29.8	0	0	0	114.4	S156 N241	N154-S156 PolarHBondContact O-N 2.71Å; N154-S156 VanDerWaalsContact O-N 3.12Å; N154-N241 VanDerWaalsContact ND2-CG 3.32Å; N154-N241 PolarHBondContact ND2-ND2 2.86Å; N154-N241 PolarHBondContact ND2-OD1 2.81Å; N154-N241 PolarHBondContact OD1-OD1 3.2Å
155	N	77.2	Confident	89	Confident	121 Å²	121	48.5 Å²	48.5	65%	0.647	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	-4.2	-178.6	-47	-1.7	0	0	0	115.2	D153 R244	D153-N155 VanDerWaalsContact C-N 3.29Å; D153-N155 PolarHBondContact O-N 3.39Å; D153-N155 VanDerWaalsContact O-N 3.16Å; N155-R244 PolarHBondContact OD1-NH1 2.82Å; N155-R244 PolarHBondContact OD1-NH2 3.04Å
156	S	82.9	Confident	88.8	Confident	79 Å²	79	51 Å²	51	55%	0.552	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	130.1	172.5	-56.4	0	0	0	0	110.3	H152 D153 N154 V158	H152-S156 CarbonylContact C-O 3.53Å; H152-S156 WeakPolarHBondContact CA-O 3.45Å; H152-S156 WeakPolarHBondContact CB-O 3.46Å; D153-S156 PolarHBondContact N-O 2.92Å; D153-S156 WeakPolarHBondContact O-CA 3.23Å; D153-S156 VanDerWaalsContact O-CB 3.32Å; D153-S156 WeakPolarHBondContact O-CB 3.43Å; D153-S156 PolarHBondContact O-N 2.74Å; N154-S156 PolarHBondContact O-N 2.71Å; N154-S156 VanDerWaalsContact O-N 3.12Å; S156-V158 PolarHBondContact O-N 2.84Å
157	L	89.2	Confident	88.7	Confident	87 Å²	87	54.7 Å²	54.7	46%	0.455	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	120.3	176.5	-178.5	67.8	0	0	0	109.9	Y150	Y150-L157 HydrophobicContact CD1-CD1 4Å; Y150-L157 HydrophobicContact CD1-CD2 4.38Å; Y150-L157 HydrophobicContact CG-CD1 4.45Å
158	V	85.9	Confident	88.5	Confident	69 Å²	69	57.1 Å²	57.1	42%	0.418	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-35.4	179.8	173.1	0	0	0	0	111.9	L151 D153 S156 Y181	L151-V158 PolarHBondContact O-N 2.88Å; D153-V158 HydrophobicContact CB-CG2 3.49Å; D153-V158 VanDerWaalsContact CB-CG2 3.49Å; S156-V158 PolarHBondContact O-N 2.84Å; V158-Y181 HydrophobicContact CB-CE1 4.26Å; V158-Y181 HydrophobicContact CG1-CE1 4.14Å; V158-Y181 HydrophobicContact CG2-CE1 4.19Å
159	L	89.2	Confident	88.5	Confident	38 Å²	38	59.7 Å²	59.7	20%	0.199	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	132.5	-176.8	-177.5	157.6	0	0	0	110.8	L151 K161 L172	L151-L159 HydrophobicContact CB-CB 4.18Å; L151-L159 PolarHBondContact N-O 2.69Å; L151-L159 PolarHBondContact O-N 2.95Å; L159-K161 HydrophobicContact CD2-CB 3.89Å; L159-L172 HydrophobicContact CD1-CB 4.39Å; L159-L172 HydrophobicContact CD2-CD1 4.4Å; L159-L172 HydrophobicContact CD2-CD2 3.75Å
160	Q	92.7	Very high	88.4	Confident	106 Å²	106	60.6 Å²	60.6	50%	0.495	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.3	167.5	-176.2	-178.2	-44.1	0	0	109	T148 V149 Y150	T148-Q160 HydrophobicContact CG2-CG 3.48Å; T148-Q160 VanDerWaalsContact CG2-CG 3.48Å; V149-Q160 CarbonylContact O-C 3.53Å; V149-Q160 WeakPolarHBondContact O-CA 3.37Å; Y150-Q160 HydrophobicContact CD1-CB 4.43Å; Y150-Q160 HydrophobicContact CD1-CG 3.97Å; Y150-Q160 HydrophobicContact CE1-CG 3.8Å; Y150-Q160 VanDerWaalsContact CE1-OE1 3.31Å
161	K	91.3	Very high	88.3	Confident	70 Å²	70	61.7 Å²	61.7	30%	0.304	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	124.4	-180	-162.4	175.9	-171.3	-168.2	0	112	T148 V149 L159 V163 T170 T171 L172	T148-K161 WeakPolarHBondContact CA-O 3.4Å; V149-K161 PolarHBondContact N-O 3.31Å; V149-K161 PolarHBondContact O-N 2.95Å; L159-K161 HydrophobicContact CD2-CB 3.89Å; K161-V163 HydrophobicContact CG-CG2 4.43Å; K161-T170 HydrophobicContact CD-CG2 3.9Å; K161-T170 WeakPolarHBondContact CE-OG1 3.02Å; K161-T170 PolarHBondContact NZ-OG1 2.97Å; K161-T171 PolarHBondContact NZ-O 3.01Å; K161-L172 HydrophobicContact CB-CD2 4.46Å; K161-L172 HydrophobicContact CD-CD2 3.96Å
162	N	92.6	Very high	88.3	Confident	98 Å²	98	61.7 Å²	61.7	52%	0.524	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	137.2	171.9	-77.5	-13.9	0	0	0	110.3	L146 T148	L146-N162 HydrophobicContact CD1-CB 3.65Å; T148-N162 VanDerWaalsContact CG2-OD1 3.29Å; T148-N162 WeakPolarHBondContact CG2-OD1 3.49Å; T148-N162 PolarHBondContact OG1-OD1 2.74Å
163	V	91.6	Very high	88.3	Confident	7 Å²	7	64.8 Å²	64.8	4%	0.042	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	107	-176.1	179.6	0	0	0	0	109	W134 H147 K161 L167 T170	W134-V163 HydrophobicContact CH2-CB 4.1Å; W134-V163 HydrophobicContact CH2-CG1 3.89Å; W134-V163 HydrophobicContact CH2-CG2 4.05Å; W134-V163 HydrophobicContact CZ2-CB 4.12Å; W134-V163 HydrophobicContact CZ2-CG1 3.89Å; H147-V163 PolarHBondContact N-O 3.12Å; H147-V163 PolarHBondContact O-N 2.83Å; K161-V163 HydrophobicContact CG-CG2 4.43Å; V163-L167 HydrophobicContact CG1-CB 3.6Å; V163-L167 HydrophobicContact CG1-CD1 4.39Å; V163-T170 HydrophobicContact CG2-CG2 3.9Å
164	S	89.5	Confident	88.4	Confident	79 Å²	79	71.1 Å²	71.1	55%	0.552	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	141.6	-176.2	-50.5	0	0	0	0	112.3	L167	S164-L167 WeakPolarHBondContact O-CB 3.48Å; S164-L167 PolarHBondContact O-N 3.33Å
165	S	84.7	Confident	89.1	Confident	46 Å²	46	68.7 Å²	68.7	32%	0.322	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	138.3	167.2	-166.9	0	0	0	0	110.1	I144 S145	I144-S165 WeakPolarHBondContact O-CB 3.45Å; I144-S165 PolarHBondContact O-OG 2.83Å; S145-S165 WeakPolarHBondContact O-CB 3.49Å; S145-S165 PolarHBondContact O-N 2.62Å
166	P	86.5	Confident	89.5	Confident	110 Å²	110	68.2 Å²	68.2	71%	0.714	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	cis	-93.3	17.2	12.7	38.1	-37.7	0	0	0	115.5	F136 S168	F136-P166 WeakPolarHBondContact CZ-O 3.44Å; P166-S168 PolarHBondContact O-N 3.1Å
167	L	88.9	Confident	89.6	Confident	102 Å²	102	65.9 Å²	65.9	53%	0.534	37%	0.366	S	S	.	.			trans	-72.4	129.5	-175.4	-62.1	173.4	0	0	0	112.8	V163 S164	V163-L167 HydrophobicContact CG1-CB 3.6Å; V163-L167 HydrophobicContact CG1-CD1 4.39Å; S164-L167 WeakPolarHBondContact O-CB 3.48Å; S164-L167 PolarHBondContact O-N 3.33Å
168	S	90.5	Very high	89.4	Confident	52 Å²	52	63.3 Å²	63.3	36%	0.364	35%	0.351	S	S	.	.			trans	-107.3	6.3	178.7	49.2	0	0	0	0	113.8	S133 W134 P166	S133-S168 CarbonylContact C-O 3.57Å; S133-S168 WeakPolarHBondContact CA-O 3.28Å; W134-S168 VanDerWaalsContact CD2-O 3.3Å; W134-S168 PolarHBondContact N-O 2.88Å; W134-S168 WeakPolarHBondContact O-CB 3.33Å; P166-S168 PolarHBondContact O-N 3.1Å
169	S	92.6	Very high	89.2	Confident	53 Å²	53	60.9 Å²	60.9	37%	0.371	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	157.9	-177.4	58.2	0	0	0	0	112.7	V132	V132-S169 CarbonylContact O-C 3.54Å; V132-S169 WeakPolarHBondContact O-CA 3.44Å; V132-S169 VanDerWaalsContact O-CB 3.32Å; V132-S169 WeakPolarHBondContact O-CB 3.33Å
170	T	93.3	Very high	89	Confident	20 Å²	20	59.9 Å²	59.9	12%	0.123	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	150.2	175.1	-152	0	0	0	0	112	V132 W134 V149 K161 V163 L172	V132-T170 PolarHBondContact N-O 2.92Å; V132-T170 PolarHBondContact O-N 2.87Å; W134-T170 HydrophobicContact CH2-CG2 4.27Å; W134-T170 HydrophobicContact CZ3-CG2 4.26Å; V149-T170 HydrophobicContact CG2-CG2 4.34Å; K161-T170 HydrophobicContact CD-CG2 3.9Å; K161-T170 WeakPolarHBondContact CE-OG1 3.02Å; K161-T170 PolarHBondContact NZ-OG1 2.97Å; V163-T170 HydrophobicContact CG2-CG2 3.9Å; T170-L172 HydrophobicContact CG2-CD2 3.86Å
171	T	92.9	Very high	88.8	Confident	41 Å²	41	55 Å²	55	25%	0.252	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	136.8	172.1	-43.9	0	0	0	0	111.2	L125 M130 K161 H173	L125-T171 HydrophobicContact CD1-CG2 3.6Å; M130-T171 CarbonylContact O-C 3.52Å; M130-T171 WeakPolarHBondContact O-CA 3.17Å; M130-T171 WeakPolarHBondContact O-CG2 2.97Å; K161-T171 PolarHBondContact NZ-O 3.01Å; T171-H173 WeakPolarHBondContact CG2-NE2 3.36Å
172	L	91.6	Very high	88.7	Confident	1 Å²	1	52 Å²	52	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	140.4	173.2	-50.1	-172	0	0	0	108.6	S129 M130 V132 V149 L151 L159 K161 T170 L175 L183	S129-L172 CarbonylContact C-O 3.54Å; S129-L172 WeakPolarHBondContact CA-O 3.2Å; S129-L172 WeakPolarHBondContact CB-O 2.96Å; M130-L172 PolarHBondContact N-O 2.99Å; M130-L172 PolarHBondContact O-N 2.82Å; V132-L172 HydrophobicContact CG2-CD1 3.76Å; V132-L172 HydrophobicContact CG2-CG 3.88Å; V149-L172 HydrophobicContact CG1-CD1 4.41Å; L151-L172 HydrophobicContact CB-CD1 4.23Å; L151-L172 HydrophobicContact CD1-CD1 3.92Å; L151-L172 HydrophobicContact CD2-CD1 4.04Å; L151-L172 HydrophobicContact CG-CD1 4.31Å; L159-L172 HydrophobicContact CD1-CB 4.39Å; L159-L172 HydrophobicContact CD2-CD1 4.4Å; L159-L172 HydrophobicContact CD2-CD2 3.75Å; K161-L172 HydrophobicContact CB-CD2 4.46Å; K161-L172 HydrophobicContact CD-CD2 3.96Å; T170-L172 HydrophobicContact CG2-CD2 3.86Å; L172-L175 HydrophobicContact CB-CD1 4.46Å; L172-L183 HydrophobicContact CD1-CD1 4.02Å
173	H	90.9	Very high	88.7	Confident	100 Å²	100	47.4 Å²	47.4	46%	0.463	27%	0.272	S	S	.	.			trans	-132.6	175.6	-174.3	-58.7	-93.8	0	0	0	110.4	S128 T171 L175	S128-H173 CarbonylContact O-C 3.59Å; S128-H173 WeakPolarHBondContact O-CA 3.32Å; T171-H173 WeakPolarHBondContact CG2-NE2 3.36Å; H173-L175 PolarHBondContact O-N 2.04Å
174	N	87	Confident	88.8	Confident	154 Å²	154	50.6 Å²	50.6	82%	0.824	28%	0.284	S	S	*	.	S	Bend	trans	58.9	32.3	178.8	-55.7	-8.3	0	0	0	113.4	S128	S128-N174 PolarHBondContact O-N 2.87Å
175	L	89.3	Confident	89.1	Confident	10 Å²	10	46.8 Å²	46.8	5%	0.052	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-82.4	155.9	175.7	-51.7	-174.8	0	0	0	110.9	S128 M130 L151 L172 H173 Y181 T204	S128-L175 WeakPolarHBondContact CA-O 3.18Å; S128-L175 WeakPolarHBondContact CB-O 3.41Å; S128-L175 WeakPolarHBondContact O-CB 3.44Å; S128-L175 PolarHBondContact O-N 2.79Å; M130-L175 HydrophobicContact CB-CD1 4.06Å; M130-L175 HydrophobicContact CG-CD1 3.75Å; M130-L175 HydrophobicContact SD-CD1 3.82Å; L151-L175 HydrophobicContact CD2-CD1 4.14Å; L151-L175 HydrophobicContact CD2-CD2 3.36Å; L151-L175 HydrophobicContact CD2-CG 4.41Å; L172-L175 HydrophobicContact CB-CD1 4.46Å; H173-L175 PolarHBondContact O-N 2.04Å; L175-Y181 HydrophobicContact CB-CE2 3.89Å; L175-Y181 HydrophobicContact CD1-CE2 4.36Å; L175-Y181 HydrophobicContact CD2-CE2 4.49Å; L175-Y181 HydrophobicContact CG-CE2 4.47Å; L175-T204 HydrophobicContact CB-CG2 3.84Å; L175-T204 HydrophobicContact CD1-CG2 4Å
176	K	86	Confident	89.6	Confident	110 Å²	110	47.2 Å²	47.2	48%	0.478	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-73.2	143.5	172.9	-64.4	173	-176.1	170.8	0	109.9	E127 D153 T179 Y181 T204	E127-K176 CarbonylContact O-C 3.43Å; D153-K176 IonicContact OD2-NZ 2.79Å; D153-K176 PolarHBondContact OD2-NZ 2.71Å; K176-T179 HydrophobicContact CB-CG2 4.26Å; K176-T179 VanDerWaalsContact CB-OG1 3.23Å; K176-T179 WeakPolarHBondContact CB-OG1 3.24Å; K176-T179 HydrophobicContact CD-CG2 4.31Å; K176-Y181 PolarHBondContact N-OH 2.97Å; K176-T204 WeakPolarHBondContact O-CG2 3.15Å; K176-T204 PolarHBondContact O-OG1 3.34Å
177	P	85.8	Confident	89.9	Confident	31 Å²	31	42 Å²	42	20%	0.201	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	150.9	175.5	30.9	-38	0	0	0	112.7	E127 T179 H257	E127-P177 HydrophobicContact CB-CB 4.13Å; E127-P177 WeakPolarHBondContact O-CA 3.47Å; P177-T179 PolarHBondContact O-N 3.07Å; P177-T179 PolarHBondContact O-OG1 3.26Å; P177-H257 HydrophobicContact CB-CB 4Å; P177-H257 HydrophobicContact CG-CB 3.81Å; P177-H257 VanDerWaalsContact CG-CD2 3.46Å; P177-H257 WeakPolarHBondContact CG-CD2 3.39Å
178	Y	83.8	Confident	90.2	Very high	32 Å²	32	38.9 Å²	38.9	13%	0.125	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.8	31.6	-179	-152.8	-126.7	0	0	0	116.1	L203 T204 L205 P206 F252 H257	Y178-L203 HydrophobicContact CD2-CD2 3.88Å; Y178-L203 HydrophobicContact CD2-CG 4.22Å; Y178-L203 HydrophobicContact CE2-CD2 3.53Å; Y178-L203 HydrophobicContact CE2-CG 4.37Å; Y178-L203 WeakPolarHBondContact O-CD1 3.37Å; Y178-T204 WeakPolarHBondContact CA-O 3.25Å; Y178-T204 WeakPolarHBondContact CA-OG1 3.49Å; Y178-T204 PolarHBondContact N-OG1 2.85Å; Y178-L205 PolarHBondContact N-O 2.82Å; Y178-L205 VanDerWaalsContact N-O 3.11Å; Y178-P206 HydrophobicContact CD2-CB 4.46Å; Y178-P206 HydrophobicContact CD2-CG 3.86Å; Y178-P206 HydrophobicContact CE2-CG 4.06Å; Y178-F252 AromaticContact CD1-CD2 3.71Å; Y178-F252 HydrophobicContact CD1-CD2 3.71Å; Y178-F252 AromaticContact CD1-CE2 3.83Å; Y178-F252 HydrophobicContact CD1-CE2 3.83Å; Y178-F252 HydrophobicContact CE1-CD2 4.12Å; Y178-F252 WeakPolarHBondContact O-CE2 3.25Å; Y178-H257 WeakPolarHBondContact CB-O 3.2Å
179	T	82.2	Confident	90.3	Very high	18 Å²	18	36.7 Å²	36.7	11%	0.11	19%	0.186	C	C	.	.			trans	-105.4	136.6	-173.7	-63.8	0	0	0	0	111.2	K176 P177 Y181 T204	K176-T179 HydrophobicContact CB-CG2 4.26Å; K176-T179 VanDerWaalsContact CB-OG1 3.23Å; K176-T179 WeakPolarHBondContact CB-OG1 3.24Å; K176-T179 HydrophobicContact CD-CG2 4.31Å; P177-T179 PolarHBondContact O-N 3.07Å; P177-T179 PolarHBondContact O-OG1 3.26Å; T179-Y181 HydrophobicContact CG2-CD2 4.2Å; T179-Y181 HydrophobicContact CG2-CE1 4.45Å; T179-Y181 HydrophobicContact CG2-CE2 3.7Å; T179-Y181 WeakPolarHBondContact O-CD2 3.37Å; T179-T204 PolarHBondContact N-OG1 2.04Å; T179-T204 PolarHBondContact O-N 3Å
180	C	85.1	Confident	90.1	Very high	18 Å²	18	39.3 Å²	39.3	12%	0.122	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	113.5	-178.3	-179.5	0	0	0	0	110.3	S202 L203 C245	C180-S202 WeakPolarHBondContact CA-O 3.44Å; C180-L203 HydrophobicContact CB-CD1 4Å; C180-C245 HydrophobicContact CB-CB 3.73Å; C180-C245 WeakPolarHBondContact CB-SG 3.05Å; C180-C245 WeakPolarHBondContact SG-CB 3.43Å; C180-C245 CovalentContact SG-SG 2.04Å; C180-C245 PolarHBondContact SG-SG 3.32Å
181	Y	88.6	Confident	89.9	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	149.9	-178.4	-72.3	-83.4	0	0	0	112.3	M130 L151 H152 D153 V158 L175 K176 T179 H201 S202 T204	M130-Y181 HydrophobicContact CE-CD2 4.09Å; L151-Y181 HydrophobicContact CD1-CD1 4.37Å; L151-Y181 HydrophobicContact CD1-CG 4.21Å; L151-Y181 HydrophobicContact CD2-CD1 3.61Å; L151-Y181 HydrophobicContact CD2-CE1 3.98Å; L151-Y181 HydrophobicContact CD2-CG 3.93Å; L151-Y181 HydrophobicContact CG-CD1 3.71Å; L151-Y181 HydrophobicContact CG-CE1 4.48Å; L151-Y181 HydrophobicContact CG-CG 4.04Å; H152-Y181 WeakPolarHBondContact O-CA 3.03Å; D153-Y181 HydrophobicContact CB-CD1 4.16Å; D153-Y181 HydrophobicContact CB-CE1 3.91Å; V158-Y181 HydrophobicContact CB-CE1 4.26Å; V158-Y181 HydrophobicContact CG1-CE1 4.14Å; V158-Y181 HydrophobicContact CG2-CE1 4.19Å; L175-Y181 HydrophobicContact CB-CE2 3.89Å; L175-Y181 HydrophobicContact CD1-CE2 4.36Å; L175-Y181 HydrophobicContact CD2-CE2 4.49Å; L175-Y181 HydrophobicContact CG-CE2 4.47Å; K176-Y181 PolarHBondContact N-OH 2.97Å; T179-Y181 HydrophobicContact CG2-CD2 4.2Å; T179-Y181 HydrophobicContact CG2-CE1 4.45Å; T179-Y181 HydrophobicContact CG2-CE2 3.7Å; T179-Y181 WeakPolarHBondContact O-CD2 3.37Å; Y181-H201 WeakPolarHBondContact O-CA 3.47Å; Y181-S202 PolarHBondContact N-O 3Å; Y181-S202 PolarHBondContact O-N 3.09Å; Y181-S202 VanDerWaalsContact O-N 3.14Å; Y181-T204 HydrophobicContact CD2-CG2 4.35Å; Y181-T204 HydrophobicContact CE2-CG2 4.09Å
182	T	89.9	Confident	89.8	Confident	9 Å²	9	38.7 Å²	38.7	6%	0.055	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.4	174.3	-53.8	0	0	0	0	110.6	H152 Y184 P199 H201	H152-T182 PolarHBondContact N-O 2.88Å; H152-T182 PolarHBondContact O-N 2.89Å; T182-Y184 HydrophobicContact CG2-CE2 3.72Å; T182-P199 HydrophobicContact CG2-CB 3.84Å; T182-H201 VanDerWaalsContact CG2-CE1 3.41Å; T182-H201 WeakPolarHBondContact CG2-CE1 3.32Å; T182-H201 PolarHBondContact OG1-CE1 2.86Å; T182-H201 VanDerWaalsContact OG1-CE1 3.26Å; T182-H201 PolarHBondContact OG1-ND1 2.81Å
183	L	92.5	Very high	89.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	139.9	-172.6	-171.1	144.9	0	0	0	112.9	I120 I122 V132 V149 Y150 L151 L172 I185 P199 S200	I120-L183 HydrophobicContact CD1-CD2 4.45Å; I120-L183 HydrophobicContact CG2-CD2 3.82Å; I122-L183 HydrophobicContact CD1-CB 3.54Å; I122-L183 HydrophobicContact CD1-CD1 3.99Å; I122-L183 HydrophobicContact CD1-CD2 4.35Å; I122-L183 HydrophobicContact CD1-CG 4.18Å; I122-L183 HydrophobicContact CG1-CD1 4.32Å; V132-L183 HydrophobicContact CB-CD1 4.29Å; V132-L183 HydrophobicContact CG1-CD1 3.69Å; V132-L183 HydrophobicContact CG1-CD2 4.01Å; V132-L183 HydrophobicContact CG2-CD1 3.55Å; V149-L183 HydrophobicContact CG1-CD1 3.69Å; V149-L183 HydrophobicContact CG1-CD2 4.2Å; V149-L183 HydrophobicContact CG1-CG 3.96Å; Y150-L183 CarbonylContact O-C 3.51Å; Y150-L183 VanDerWaalsContact O-CA 3.3Å; Y150-L183 WeakPolarHBondContact O-CA 3.44Å; L151-L183 HydrophobicContact CD1-CB 4.14Å; L151-L183 HydrophobicContact CD1-CD1 3.91Å; L151-L183 HydrophobicContact CD1-CG 4.42Å; L172-L183 HydrophobicContact CD1-CD1 4.02Å; L183-I185 HydrophobicContact CD2-CD1 3.84Å; L183-I185 HydrophobicContact CD2-CG1 3.53Å; L183-P199 WeakPolarHBondContact O-CA 3.29Å; L183-S200 PolarHBondContact N-O 2.59Å; L183-S200 PolarHBondContact O-N 3.01Å; L183-S200 VanDerWaalsContact O-N 3.08Å
184	Y	93.5	Very high	90	Very high	74 Å²	74	38.3 Å²	38.3	29%	0.29	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	151	173.2	-52	-97.6	0	0	0	110.3	Y150 H152 T182 P199	Y150-Y184 PolarHBondContact N-O 2.97Å; Y150-Y184 PolarHBondContact O-N 2.81Å; H152-Y184 AromaticContact CE1-CD2 3.62Å; H152-Y184 AromaticContact CE1-CE2 3.84Å; H152-Y184 AromaticContact ND1-CD2 3.54Å; H152-Y184 AromaticContact ND1-CE2 3.62Å; T182-Y184 HydrophobicContact CG2-CE2 3.72Å; Y184-P199 HydrophobicContact CD1-CB 4.33Å; Y184-P199 HydrophobicContact CE1-CB 3.73Å; Y184-P199 HydrophobicContact CE1-CG 4.35Å
185	I	94.8	Very high	90.3	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	143.5	176	-44	-179.5	0	0	0	109.7	P117 I120 V132 W134 H147 T148 V149 L183 S197	P117-I185 HydrophobicContact CB-CB 4.32Å; P117-I185 HydrophobicContact CB-CG2 4.31Å; P117-I185 HydrophobicContact CG-CB 4.29Å; P117-I185 HydrophobicContact CG-CG2 3.97Å; I120-I185 HydrophobicContact CD1-CB 4.27Å; I120-I185 HydrophobicContact CD1-CD1 3.76Å; I120-I185 HydrophobicContact CD1-CG1 3.77Å; I120-I185 HydrophobicContact CG1-CD1 3.91Å; I120-I185 HydrophobicContact CG1-CG1 4.47Å; I120-I185 HydrophobicContact CG2-CD1 4.41Å; V132-I185 HydrophobicContact CG1-CD1 4.26Å; W134-I185 HydrophobicContact CB-CD1 3.81Å; W134-I185 HydrophobicContact CD2-CD1 3.57Å; W134-I185 HydrophobicContact CE3-CD1 3.44Å; W134-I185 VanDerWaalsContact CE3-CD1 3.44Å; W134-I185 HydrophobicContact CG-CD1 3.75Å; W134-I185 HydrophobicContact CZ3-CD1 4.22Å; H147-I185 HydrophobicContact CB-CG2 4.29Å; T148-I185 WeakPolarHBondContact O-CA 3.47Å; T148-I185 WeakPolarHBondContact O-CG2 3.37Å; V149-I185 HydrophobicContact CG2-CD1 4.2Å; V149-I185 HydrophobicContact CG2-CG1 4.18Å; V149-I185 HydrophobicContact CG2-CG2 4.2Å; L183-I185 HydrophobicContact CD2-CD1 3.84Å; L183-I185 HydrophobicContact CD2-CG1 3.53Å; I185-S197 PolarHBondContact N-OG 2.89Å; I185-S197 WeakPolarHBondContact O-CB 3.44Å; I185-S197 PolarHBondContact O-N 2.8Å
186	R	95	Very high	90.5	Very high	54 Å²	54	41.6 Å²	41.6	20%	0.204	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	156.8	166.9	68.3	178.5	-164.4	-155.6	3.4	111.4	H147 T148 Y150 W193 S194 F196	H147-R186 WeakPolarHBondContact CA-O 3.44Å; T148-R186 PolarHBondContact N-O 3.04Å; T148-R186 PolarHBondContact O-N 2.95Å; T148-R186 VanDerWaalsContact O-N 3.12Å; Y150-R186 HydrophobicContact CE2-CG 4.14Å; Y150-R186 PolarHBondContact OH-NE 2.92Å; Y150-R186 PolarHBondContact OH-NH2 2.93Å; R186-W193 HydrophobicContact CG-CE3 3.65Å; R186-W193 HydrophobicContact CG-CZ3 3.93Å; R186-W193 VanDerWaalsContact NE-CD2 3.28Å; R186-W193 VanDerWaalsContact NH2-CE2 3.34Å; R186-S194 WeakPolarHBondContact CA-OG 3.3Å; R186-S194 WeakPolarHBondContact CB-OG 3.19Å; R186-F196 HydrophobicContact CB-CD1 4.32Å; R186-F196 HydrophobicContact CG-CD1 4.48Å; R186-F196 HydrophobicContact CG-CE1 4.4Å
187	A	94.6	Very high	90.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	160.6	178.5	0	0	0	0	0	111.7	P114 P117 I144 L146 W193 S194	P114-A187 HydrophobicContact CB-CB 4.28Å; P114-A187 HydrophobicContact CG-CB 3.88Å; P117-A187 HydrophobicContact CG-CB 4.24Å; I144-A187 HydrophobicContact CD1-CB 4.31Å; I144-A187 HydrophobicContact CG2-CB 4.11Å; L146-A187 CarbonylContact O-C 3.47Å; L146-A187 WeakPolarHBondContact O-CA 3.26Å; A187-W193 CarbonylContact O-C 3.53Å; A187-W193 WeakPolarHBondContact O-CA 3.32Å; A187-S194 PolarHBondContact N-OG 3.06Å; A187-S194 PolarHBondContact O-N 2.93Å
188	L	94.1	Very high	91.1	Very high	38 Å²	38	44 Å²	44	20%	0.199	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.7	176.8	176.3	64.4	0	0	0	110.2	I144 S145 L146 W193	I144-L188 CarbonylContact C-O 3.52Å; I144-L188 WeakPolarHBondContact CA-O 3.45Å; S145-L188 PolarHBondContact N-O 3.02Å; S145-L188 PolarHBondContact OG-O 2.93Å; L146-L188 HydrophobicContact CB-CB 4.16Å; L146-L188 HydrophobicContact CB-CD2 4.28Å; L146-L188 HydrophobicContact CD2-CD2 3.94Å; L146-L188 PolarHBondContact O-N 2.88Å; L188-W193 HydrophobicContact CB-CD2 4.17Å; L188-W193 HydrophobicContact CB-CE3 3.76Å; L188-W193 HydrophobicContact CB-CH2 4.29Å; L188-W193 HydrophobicContact CB-CZ3 3.84Å; L188-W193 HydrophobicContact CD1-CD2 3.97Å; L188-W193 HydrophobicContact CD1-CE3 4.43Å; L188-W193 HydrophobicContact CD1-CG 4.14Å; L188-W193 HydrophobicContact CD2-CH2 4.21Å; L188-W193 HydrophobicContact CD2-CZ2 4.07Å
189	N	92.3	Very high	91.4	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.027	22%	0.221	C	C	.	.			trans	-130.8	-171.6	164.8	74.9	4.4	0	0	0	110.3	D112 P114 S139 S142 P143 I191 G192	D112-N189 PolarHBondContact O-ND2 3.12Å; P114-N189 HydrophobicContact CG-CB 4.31Å; S139-N189 PolarHBondContact O-ND2 3.06Å; S142-N189 WeakPolarHBondContact CB-ND2 3.4Å; S142-N189 WeakPolarHBondContact O-CB 3.16Å; S142-N189 PolarHBondContact O-ND2 2.97Å; S142-N189 WeakPolarHBondContact OG-CB 3.41Å; P143-N189 VanDerWaalsContact O-CB 3.25Å; P143-N189 WeakPolarHBondContact O-CB 3.06Å; N189-I191 PolarHBondContact O-N 2.63Å; N189-I191 VanDerWaalsContact O-N 3.12Å; N189-I191 WeakPolarHBondContact OD1-CA 3.48Å; N189-I191 WeakPolarHBondContact OD1-CB 3.36Å; N189-I191 PolarHBondContact OD1-N 2.86Å; N189-G192 PolarHBondContact N-O 2.91Å; N189-G192 VanDerWaalsContact N-O 3.14Å; N189-G192 PolarHBondContact O-N 3.1Å; N189-G192 PolarHBondContact OD1-N 2.94Å; N189-G192 VanDerWaalsContact OD1-N 3.11Å; N189-G192 PolarHBondContact OD1-O 2.96Å
190	D	88.8	Confident	91.7	Very high	108 Å²	108	46 Å²	46	58%	0.578	23%	0.225	S	C	*	.	S	Bend	trans	-67.2	-11.1	-176.7	-45.1	-59.6	0	0	0	114.1	S142	S142-D190 WeakPolarHBondContact OG-CB 3.08Å; S142-D190 PolarHBondContact OG-N 2.84Å; S142-D190 PolarHBondContact OG-OD2 2.91Å
191	I	89.6	Confident	91.8	Very high	33 Å²	33	49.2 Å²	49.2	17%	0.169	24%	0.237	C	C	.	.	S	Bend	trans	-97.9	-34.5	179.5	-43.2	-56.2	0	0	0	111	R42 Q111 D112 N189	R42-I191 HydrophobicContact CG-CD1 4.25Å; Q111-I191 HydrophobicContact CB-CD1 3.7Å; Q111-I191 HydrophobicContact CB-CG1 3.84Å; D112-I191 WeakPolarHBondContact O-CG1 3.14Å; N189-I191 PolarHBondContact O-N 2.63Å; N189-I191 VanDerWaalsContact O-N 3.12Å; N189-I191 WeakPolarHBondContact OD1-CA 3.48Å; N189-I191 WeakPolarHBondContact OD1-CB 3.36Å; N189-I191 PolarHBondContact OD1-N 2.86Å
192	G	89.9	Confident	91.7	Very high	15 Å²	15	50 Å²	50	16%	0.155	24%	0.244	C	C	.	.			trans	154.9	-163.2	169.6	0	0	0	0	0	114.6	P114 N189	P114-G192 WeakPolarHBondContact CD-O 3.41Å; N189-G192 PolarHBondContact N-O 2.91Å; N189-G192 VanDerWaalsContact N-O 3.14Å; N189-G192 PolarHBondContact O-N 3.1Å; N189-G192 PolarHBondContact OD1-N 2.94Å; N189-G192 VanDerWaalsContact OD1-N 3.11Å; N189-G192 PolarHBondContact OD1-O 2.96Å
193	W	94.1	Very high	91.5	Very high	86 Å²	86	52.3 Å²	52.3	33%	0.326	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-77.8	144.6	179.5	-65.7	100.4	0	0	0	112.5	K113 L146 T148 R186 A187 L188	K113-W193 WeakPolarHBondContact CD-O 3.38Å; L146-W193 HydrophobicContact CD2-CH2 3.77Å; L146-W193 HydrophobicContact CD2-CZ3 4.41Å; L146-W193 HydrophobicContact CG-CH2 4.49Å; T148-W193 VanDerWaalsContact OG1-CH2 3.23Å; T148-W193 WeakPolarHBondContact OG1-CH2 3.36Å; T148-W193 WeakPolarHBondContact OG1-CZ3 3.47Å; R186-W193 HydrophobicContact CG-CE3 3.65Å; R186-W193 HydrophobicContact CG-CZ3 3.93Å; R186-W193 VanDerWaalsContact NE-CD2 3.28Å; R186-W193 VanDerWaalsContact NH2-CE2 3.34Å; A187-W193 CarbonylContact O-C 3.53Å; A187-W193 WeakPolarHBondContact O-CA 3.32Å; L188-W193 HydrophobicContact CB-CD2 4.17Å; L188-W193 HydrophobicContact CB-CE3 3.76Å; L188-W193 HydrophobicContact CB-CH2 4.29Å; L188-W193 HydrophobicContact CB-CZ3 3.84Å; L188-W193 HydrophobicContact CD1-CD2 3.97Å; L188-W193 HydrophobicContact CD1-CE3 4.43Å; L188-W193 HydrophobicContact CD1-CG 4.14Å; L188-W193 HydrophobicContact CD2-CH2 4.21Å; L188-W193 HydrophobicContact CD2-CZ2 4.07Å
194	S	94.1	Very high	91.3	Very high	7 Å²	7	52.4 Å²	52.4	5%	0.049	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-70.1	164.1	162.2	76.6	0	0	0	0	111.5	P114 R186 A187	P114-S194 WeakPolarHBondContact O-CA 3.27Å; P114-S194 WeakPolarHBondContact O-CB 3.42Å; R186-S194 WeakPolarHBondContact CA-OG 3.3Å; R186-S194 WeakPolarHBondContact CB-OG 3.19Å; A187-S194 PolarHBondContact N-OG 3.06Å; A187-S194 PolarHBondContact O-N 2.93Å
195	E	93.2	Very high	91	Very high	139 Å²	139	52 Å²	52	65%	0.65	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-58.4	159	156.8	-63.4	-51.8	136.6	0	0	111.4	S116	S116-E195 WeakPolarHBondContact CB-O 3.22Å
196	F	93.3	Very high	90.5	Very high	95 Å²	95	53.1 Å²	53.1	42%	0.417	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-69.4	149.5	174.5	-70	-88.8	0	0	0	111.7	Y150 R186	Y150-F196 HydrophobicContact CD2-CD1 4.42Å; Y150-F196 AromaticContact CD2-CE1 3.79Å; Y150-F196 HydrophobicContact CD2-CE1 3.79Å; Y150-F196 HydrophobicContact CE2-CD1 4.48Å; Y150-F196 AromaticContact CE2-CE1 3.66Å; Y150-F196 HydrophobicContact CE2-CE1 3.66Å; Y150-F196 HydrophobicContact CE2-CZ 4.49Å; Y150-F196 HydrophobicContact CG-CE1 4.34Å; R186-F196 HydrophobicContact CB-CD1 4.32Å; R186-F196 HydrophobicContact CG-CD1 4.48Å; R186-F196 HydrophobicContact CG-CE1 4.4Å
197	S	94.2	Very high	90.1	Very high	8 Å²	8	50.7 Å²	50.7	6%	0.056	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-60.5	163.8	167.5	69.9	0	0	0	0	112.1	I120 I185	I120-S197 WeakPolarHBondContact CD1-OG 3.5Å; I185-S197 PolarHBondContact N-OG 2.89Å; I185-S197 WeakPolarHBondContact O-CB 3.44Å; I185-S197 PolarHBondContact O-N 2.8Å
198	K	89.8	Confident	89.8	Confident	183 Å²	183	55.5 Å²	55.5	80%	0.796	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-56.8	147.5	160	-66.1	-175.7	178.4	-177	0	109.9
199	P	89.8	Confident	89.4	Confident	66 Å²	66	53.8 Å²	53.8	43%	0.429	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-63.7	148.1	174.2	26.5	-33.7	0	0	0	110.9	T182 L183 Y184	T182-P199 HydrophobicContact CG2-CB 3.84Å; L183-P199 WeakPolarHBondContact O-CA 3.29Å; Y184-P199 HydrophobicContact CD1-CB 4.33Å; Y184-P199 HydrophobicContact CE1-CB 3.73Å; Y184-P199 HydrophobicContact CE1-CG 4.35Å
200	S	89.2	Confident	89	Confident	27 Å²	27	57.1 Å²	57.1	19%	0.189	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	144.3	167.9	-177.3	0	0	0	0	109.3	I122 L183	I122-S200 WeakPolarHBondContact CD1-OG 3.44Å; L183-S200 PolarHBondContact N-O 2.59Å; L183-S200 PolarHBondContact O-N 3.01Å; L183-S200 VanDerWaalsContact O-N 3.08Å
201	H	86.8	Confident	88.6	Confident	84 Å²	84	52.6 Å²	52.6	39%	0.389	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	145.2	-170.7	-57.4	-75	0	0	0	111.2	Y181 T182	Y181-H201 WeakPolarHBondContact O-CA 3.47Å; T182-H201 VanDerWaalsContact CG2-CE1 3.41Å; T182-H201 WeakPolarHBondContact CG2-CE1 3.32Å; T182-H201 PolarHBondContact OG1-CE1 2.86Å; T182-H201 VanDerWaalsContact OG1-CE1 3.26Å; T182-H201 PolarHBondContact OG1-ND1 2.81Å
202	S	86.7	Confident	88.4	Confident	20 Å²	20	56.5 Å²	56.5	14%	0.14	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	155.1	175.9	-159.4	0	0	0	0	111.8	I122 M130 C180 Y181	I122-S202 VanDerWaalsContact CG2-CB 3.42Å; M130-S202 WeakPolarHBondContact CE-O 3.25Å; C180-S202 WeakPolarHBondContact CA-O 3.44Å; Y181-S202 PolarHBondContact N-O 3Å; Y181-S202 PolarHBondContact O-N 3.09Å; Y181-S202 VanDerWaalsContact O-N 3.14Å
203	L	85.9	Confident	88.3	Confident	57 Å²	57	55.9 Å²	55.9	30%	0.298	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125.2	-178.5	-169.6	74.6	0	0	0	108.7	A124 Y178 C180 C245	A124-L203 WeakPolarHBondContact CB-O 3.3Å; Y178-L203 HydrophobicContact CD2-CD2 3.88Å; Y178-L203 HydrophobicContact CD2-CG 4.22Å; Y178-L203 HydrophobicContact CE2-CD2 3.53Å; Y178-L203 HydrophobicContact CE2-CG 4.37Å; Y178-L203 WeakPolarHBondContact O-CD1 3.37Å; C180-L203 HydrophobicContact CB-CD1 4Å; L203-C245 HydrophobicContact CB-CB 4.41Å; L203-C245 HydrophobicContact CD1-CB 4.29Å
204	T	87.9	Confident	87.9	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.012	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-63	157.8	171.4	48	0	0	0	0	110.9	M130 L175 K176 Y178 T179 Y181	M130-T204 HydrophobicContact CE-CG2 3.76Å; M130-T204 HydrophobicContact CG-CG2 4.47Å; L175-T204 HydrophobicContact CB-CG2 3.84Å; L175-T204 HydrophobicContact CD1-CG2 4Å; K176-T204 WeakPolarHBondContact O-CG2 3.15Å; K176-T204 PolarHBondContact O-OG1 3.34Å; Y178-T204 WeakPolarHBondContact CA-O 3.25Å; Y178-T204 WeakPolarHBondContact CA-OG1 3.49Å; Y178-T204 PolarHBondContact N-OG1 2.85Å; T179-T204 PolarHBondContact N-OG1 2.04Å; T179-T204 PolarHBondContact O-N 3Å; Y181-T204 HydrophobicContact CD2-CG2 4.35Å; Y181-T204 HydrophobicContact CE2-CG2 4.09Å
205	L	86.4	Confident	87.6	Confident	64 Å²	64	53.5 Å²	53.5	34%	0.335	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-65.2	159.6	177.8	-56.5	-175	0	0	0	112	A124 S126 E127 Y178 G207	A124-L205 HydrophobicContact CB-CD2 3.95Å; A124-L205 HydrophobicContact CB-CG 4.03Å; S126-L205 PolarHBondContact O-N 2.95Å; S126-L205 VanDerWaalsContact O-N 3.13Å; E127-L205 WeakPolarHBondContact CA-O 3.43Å; E127-L205 WeakPolarHBondContact CB-O 3.22Å; Y178-L205 PolarHBondContact N-O 2.82Å; Y178-L205 VanDerWaalsContact N-O 3.11Å; L205-G207 PolarHBondContact O-N 3.25Å
206	P	86	Confident	87.4	Confident	25 Å²	25	52.7 Å²	52.7	16%	0.162	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-58.1	134.3	171.5	-25.4	35	0	0	0	112.2	Y178 H257 R312 F313	Y178-P206 HydrophobicContact CD2-CB 4.46Å; Y178-P206 HydrophobicContact CD2-CG 3.86Å; Y178-P206 HydrophobicContact CE2-CG 4.06Å; P206-H257 CarbonylContact C-O 3.49Å; P206-H257 WeakPolarHBondContact CA-O 3.38Å; P206-R312 HydrophobicContact CB-CB 4.38Å; P206-R312 WeakPolarHBondContact O-CD 3.47Å; P206-R312 PolarHBondContact O-NH1 2.8Å; P206-F313 WeakPolarHBondContact O-CE2 3.31Å
207	G	86.5	Confident	87.3	Confident	2 Å²	2	51.9 Å²	51.9	2%	0.021	27%	0.274	C	S	.	.			trans	-99.8	-170.2	174	0	0	0	0	0	112.6	L205 P209 H257 N310 F313	L205-G207 PolarHBondContact O-N 3.25Å; G207-P209 WeakPolarHBondContact O-CD 3.46Å; G207-H257 PolarHBondContact N-O 3.14Å; G207-N310 PolarHBondContact O-ND2 3.32Å; G207-F313 VanDerWaalsContact C-CD2 3.41Å; G207-F313 VanDerWaalsContact O-CD2 3.3Å; G207-F313 WeakPolarHBondContact O-CD2 2.88Å
208	L	87.7	Confident	87.1	Confident	102 Å²	102	55.9 Å²	55.9	53%	0.534	29%	0.294	S	S	.	.			trans	-71.1	123.4	177.5	-178.7	67.3	0	0	0	111	H257 F313 S314	L208-H257 PolarHBondContact O-ND1 3.24Å; L208-F313 HydrophobicContact CD1-CB 4.02Å; L208-S314 VanDerWaalsContact CD1-O 3.23Å; L208-S314 WeakPolarHBondContact CD1-O 3.43Å
209	P	86	Confident	87.1	Confident	1 Å²	1	52 Å²	52	1%	0.006	28%	0.282	C	S	.	.			trans	-60.5	138.7	173.1	-19.7	29	0	0	0	111.7	G207 L256 N310 G315 P316	G207-P209 WeakPolarHBondContact O-CD 3.46Å; P209-L256 WeakPolarHBondContact CA-O 3.41Å; P209-L256 HydrophobicContact CB-CD2 4.12Å; P209-L256 WeakPolarHBondContact CG-O 3.41Å; P209-N310 HydrophobicContact CG-CB 4.07Å; P209-G315 WeakPolarHBondContact O-CA 3.16Å; P209-P316 VanDerWaalsContact O-CD 3.25Å; P209-P316 WeakPolarHBondContact O-CD 3.4Å
210	V	83.8	Confident	87.2	Confident	75 Å²	75	50.8 Å²	50.8	46%	0.455	27%	0.273	S	S	.	.			trans	-108.7	-9.6	177.1	-65.2	0	0	0	0	113.3	L255	V210-L255 HydrophobicContact CG2-CB 4.15Å; V210-L255 HydrophobicContact CG2-CD2 4.08Å; V210-L255 VanDerWaalsContact CG2-O 3.28Å; V210-L255 WeakPolarHBondContact CG2-O 3.12Å; V210-L255 PolarHBondContact N-O 3.17Å
211	A	79.4	Confident	87.3	Confident	14 Å²	14	51.2 Å²	51.2	12%	0.116	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-72.5	142.5	174.3	0	0	0	0	0	113	L255 L256 F308 P316	A211-L255 HydrophobicContact CB-CB 3.87Å; A211-L255 PolarHBondContact N-O 3.44Å; A211-L256 HydrophobicContact CB-CD2 4.04Å; A211-F308 HydrophobicContact CB-CD2 3.84Å; A211-F308 HydrophobicContact CB-CE2 3.78Å; A211-F308 WeakPolarHBondContact O-CD2 3.4Å; A211-P316 WeakPolarHBondContact O-CD 3.09Å
212	H	86.6	Confident	87.4	Confident	114 Å²	114	48.6 Å²	48.6	53%	0.528	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-94	135.9	166.1	-80.7	-99.5	0	0	0	110.5	F308	H212-F308 VanDerWaalsContact C-CE2 3.46Å; H212-F308 WeakPolarHBondContact O-CE2 3.21Å
213	P	86.6	Confident	87.5	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.019	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-65	137.5	170.1	-21.8	33.9	0	0	0	111.9	V215 V229 F306 F308 T318	P213-V215 HydrophobicContact CB-CG2 4.42Å; P213-V229 HydrophobicContact CB-CG1 4.01Å; P213-F306 HydrophobicContact CB-CB 4.32Å; P213-F306 HydrophobicContact CG-CB 4.35Å; P213-F308 HydrophobicContact CB-CE2 4.13Å; P213-F308 HydrophobicContact CB-CZ 4.1Å; P213-F308 HydrophobicContact CG-CD1 4.34Å; P213-F308 HydrophobicContact CG-CD2 3.74Å; P213-F308 HydrophobicContact CG-CE1 4.44Å; P213-F308 HydrophobicContact CG-CE2 3.84Å; P213-F308 HydrophobicContact CG-CG 4Å; P213-F308 HydrophobicContact CG-CZ 4.17Å; P213-T318 WeakPolarHBondContact O-CB 3.49Å; P213-T318 PolarHBondContact O-OG1 2.84Å
214	A	86.1	Confident	87.8	Confident	21 Å²	21	51.6 Å²	51.6	17%	0.174	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	138.5	162.6	0	0	0	0	0	108.9	V229 G230 A232	A214-V229 WeakPolarHBondContact O-CA 3.44Å; A214-G230 PolarHBondContact N-O 3.03Å; A214-G230 PolarHBondContact O-N 3.36Å; A214-A232 HydrophobicContact CB-CB 3.93Å
215	V	88.4	Confident	88	Confident	22 Å²	22	51.5 Å²	51.5	13%	0.133	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	126.2	-174.4	-174.5	0	0	0	0	109.8	P213 L227 D228 V229 F306 T318 L320	P213-V215 HydrophobicContact CB-CG2 4.42Å; V215-L227 HydrophobicContact CG1-CB 4.35Å; V215-L227 HydrophobicContact CG1-CD2 3.63Å; V215-D228 WeakPolarHBondContact CA-O 3.27Å; V215-V229 HydrophobicContact CG1-CG2 4.47Å; V215-V229 HydrophobicContact CG2-CG1 4.35Å; V215-F306 HydrophobicContact CG1-CD2 4.07Å; V215-F306 HydrophobicContact CG1-CE1 4.48Å; V215-F306 HydrophobicContact CG1-CE2 3.85Å; V215-F306 HydrophobicContact CG1-CG 4.5Å; V215-F306 HydrophobicContact CG1-CZ 4.09Å; V215-F306 HydrophobicContact CG2-CB 3.92Å; V215-F306 HydrophobicContact CG2-CD1 4.33Å; V215-F306 HydrophobicContact CG2-CD2 3.76Å; V215-F306 HydrophobicContact CG2-CE2 4.39Å; V215-F306 HydrophobicContact CG2-CG 3.74Å; V215-T318 HydrophobicContact CG2-CG2 4.1Å; V215-L320 HydrophobicContact CG1-CD2 3.85Å
216	H	87.7	Confident	88.3	Confident	121 Å²	121	49.4 Å²	49.4	56%	0.56	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	136.5	178.4	-59.2	-66.1	0	0	0	110.7	L227 D228	H216-L227 CarbonylContact O-C 3.56Å; H216-L227 WeakPolarHBondContact O-CA 3.16Å; H216-L227 WeakPolarHBondContact O-CB 3.49Å; H216-D228 PolarHBondContact N-O 3.06Å; H216-D228 PolarHBondContact O-N 2.81Å
217	I	91	Very high	88.5	Confident	78 Å²	78	48.2 Å²	48.2	40%	0.4	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	128.5	177.4	-61.6	166.5	0	0	0	109.1	V220 L227 L320 V322	I217-V220 HydrophobicContact CG2-CG2 3.75Å; I217-L227 HydrophobicContact CG1-CD2 4.02Å; I217-L320 HydrophobicContact CD1-CD1 4.26Å; I217-L320 HydrophobicContact CD1-CD2 4.1Å; I217-L320 HydrophobicContact CD1-CG 4.49Å; I217-L320 HydrophobicContact CG1-CD2 3.81Å; I217-V322 HydrophobicContact CD1-CB 4.34Å; I217-V322 HydrophobicContact CD1-CG2 4.1Å
218	I	90.7	Very high	88.7	Confident	93 Å²	93	50.2 Å²	50.2	48%	0.477	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-48.3	174	-55.4	169.2	0	0	0	110.1	S226 D228 I290	I218-S226 WeakPolarHBondContact CB-O 3.4Å; I218-S226 PolarHBondContact N-O 2.85Å; I218-D228 HydrophobicContact CD1-CB 4.14Å; I218-D228 HydrophobicContact CG1-CB 4.41Å; I218-I290 HydrophobicContact CD1-CB 4.4Å; I218-I290 HydrophobicContact CD1-CD1 3.97Å; I218-I290 HydrophobicContact CD1-CG1 3.82Å; I218-I290 HydrophobicContact CD1-CG2 3.9Å
219	N	90.7	Very high	88.6	Confident	102 Å²	102	45.4 Å²	45.4	55%	0.545	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	154.2	-175.1	-163.9	6.2	0	0	0	112.3	I225 S226	N219-I225 WeakPolarHBondContact O-CA 3.31Å; N219-S226 PolarHBondContact N-O 3.14Å; N219-S226 PolarHBondContact O-N 3Å
220	V	91.9	Very high	88.2	Confident	39 Å²	39	45.6 Å²	45.6	24%	0.236	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	117	179.3	178.8	0	0	0	0	109.7	I217 I225 V322 S323 T325	I217-V220 HydrophobicContact CG2-CG2 3.75Å; V220-I225 HydrophobicContact CG1-CG1 4.25Å; V220-I225 HydrophobicContact CG2-CG1 4.41Å; V220-I225 HydrophobicContact CG2-CG2 4.31Å; V220-V322 HydrophobicContact CG2-CG2 3.94Å; V220-S323 VanDerWaalsContact CG1-O 3.31Å; V220-S323 WeakPolarHBondContact CG1-O 3.43Å; V220-T325 HydrophobicContact CG1-CG2 4.49Å
221	S	90.7	Very high	87.6	Confident	37 Å²	37	43.6 Å²	43.6	26%	0.259	24%	0.238	S	C	.	.			trans	-105.1	-171.1	172.7	86.4	0	0	0	0	111.4	H223 S224 T324 T325	S221-H223 VanDerWaalsContact C-N 3.3Å; S221-H223 PolarHBondContact OG-N 3.08Å; S221-H223 VanDerWaalsContact OG-N 3.09Å; S221-S224 PolarHBondContact N-O 2.74Å; S221-S224 PolarHBondContact OG-N 3.36Å; S221-S224 PolarHBondContact OG-O 3.39Å; S221-S224 PolarHBondContact OG-OG 3.5Å; S221-T324 WeakPolarHBondContact O-CA 3.15Å; S221-T324 WeakPolarHBondContact O-CB 3.43Å; S221-T325 PolarHBondContact O-N 2.88Å; S221-T325 PolarHBondContact O-OG1 2.85Å
222	S	88	Confident	86.8	Confident	29 Å²	29	47 Å²	47	20%	0.203	27%	0.266	C	S	.	.	S	Bend	trans	-77.9	-15.3	173.4	54	0	0	0	0	112.8	K297 P298 T325	S222-K297 CarbonylContact O-C 3.56Å; S222-K297 VanDerWaalsContact O-C 3.26Å; S222-P298 WeakPolarHBondContact O-CA 3.34Å; S222-T325 WeakPolarHBondContact CA-O 3.42Å; S222-T325 WeakPolarHBondContact CB-O 3.38Å; S222-T325 PolarHBondContact N-OG1 2.76Å
223	H	90	Very high	85.3	Confident	99 Å²	99	46.5 Å²	46.5	46%	0.458	27%	0.271	S	S	.	.	S	Bend	trans	-135.5	0.9	-176	-62.9	86.1	0	0	0	114.4	S221 S294 H295 L296 P298	S221-H223 VanDerWaalsContact C-N 3.3Å; S221-H223 PolarHBondContact OG-N 3.08Å; S221-H223 VanDerWaalsContact OG-N 3.09Å; H223-S294 CarbonylContact O-C 3.59Å; H223-H295 PolarHBondContact O-N 3.13Å; H223-L296 WeakPolarHBondContact CA-O 3.23Å; H223-L296 PolarHBondContact CD2-O 2.82Å; H223-L296 VanDerWaalsContact CD2-O 3.29Å; H223-L296 PolarHBondContact O-N 3.21Å; H223-P298 VanDerWaalsContact CE1-CG 3.46Å; H223-P298 WeakPolarHBondContact CE1-CG 3.48Å; H223-P298 WeakPolarHBondContact NE2-CG 3.29Å
224	S	91.9	Very high	83.7	Confident	40 Å²	40	50.2 Å²	50.2	28%	0.28	29%	0.29	S	S	.	.			trans	-152.3	156.4	-178.3	63.8	0	0	0	0	113.3	S221 I293	S221-S224 PolarHBondContact N-O 2.74Å; S221-S224 PolarHBondContact OG-N 3.36Å; S221-S224 PolarHBondContact OG-O 3.39Å; S221-S224 PolarHBondContact OG-OG 3.5Å; S224-I293 CarbonylContact C-O 3.14Å; S224-I293 WeakPolarHBondContact CA-O 3.3Å; S224-I293 WeakPolarHBondContact CB-O 3.43Å
225	I	92.8	Very high	82	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	132	174.1	-61.3	172.5	0	0	0	108.1	N219 V220 L227 I293 L296 L304 V322 T324	N219-I225 WeakPolarHBondContact O-CA 3.31Å; V220-I225 HydrophobicContact CG1-CG1 4.25Å; V220-I225 HydrophobicContact CG2-CG1 4.41Å; V220-I225 HydrophobicContact CG2-CG2 4.31Å; I225-L227 HydrophobicContact CG2-CD1 3.74Å; I225-L227 HydrophobicContact CG2-CD2 4.47Å; I225-L227 HydrophobicContact CG2-CG 4.02Å; I225-I293 PolarHBondContact N-O 2.85Å; I225-I293 PolarHBondContact O-N 2.7Å; I225-L296 HydrophobicContact CB-CD1 4.31Å; I225-L296 HydrophobicContact CD1-CD1 3.61Å; I225-L296 HydrophobicContact CG1-CD1 3.69Å; I225-L304 HydrophobicContact CD1-CD1 4.39Å; I225-L304 HydrophobicContact CG2-CD1 4.38Å; I225-V322 HydrophobicContact CD1-CB 4.31Å; I225-V322 HydrophobicContact CD1-CG1 3.54Å; I225-V322 HydrophobicContact CD1-CG2 3.82Å; I225-T324 HydrophobicContact CD1-CG2 4.43Å
226	S	91.9	Very high	80.1	Confident	20 Å²	20	62.2 Å²	62.2	14%	0.14	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.1	179.4	-54.8	0	0	0	0	109.4	I218 N219 D292	I218-S226 WeakPolarHBondContact CB-O 3.4Å; I218-S226 PolarHBondContact N-O 2.85Å; N219-S226 PolarHBondContact N-O 3.14Å; N219-S226 PolarHBondContact O-N 3Å; S226-D292 WeakPolarHBondContact CB-OD1 3.41Å; S226-D292 PolarHBondContact OG-OD1 3.02Å
227	L	91	Very high	78.3	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.3	-177.2	-52.7	104.5	0	0	0	111.6	V215 H216 I217 I225 V229 I290 V291 I293 L304 F306 L320	V215-L227 HydrophobicContact CG1-CB 4.35Å; V215-L227 HydrophobicContact CG1-CD2 3.63Å; H216-L227 CarbonylContact O-C 3.56Å; H216-L227 WeakPolarHBondContact O-CA 3.16Å; H216-L227 WeakPolarHBondContact O-CB 3.49Å; I217-L227 HydrophobicContact CG1-CD2 4.02Å; I225-L227 HydrophobicContact CG2-CD1 3.74Å; I225-L227 HydrophobicContact CG2-CD2 4.47Å; I225-L227 HydrophobicContact CG2-CG 4.02Å; L227-V229 HydrophobicContact CB-CG2 4.45Å; L227-I290 CarbonylContact O-C 3.59Å; L227-I290 VanDerWaalsContact O-CA 3.3Å; L227-I290 WeakPolarHBondContact O-CA 3.45Å; L227-V291 PolarHBondContact N-O 2.87Å; L227-V291 PolarHBondContact O-N 2.92Å; L227-I293 HydrophobicContact CD1-CD1 3.84Å; L227-I293 HydrophobicContact CD1-CG1 4.3Å; L227-L304 HydrophobicContact CD1-CD1 4.17Å; L227-L304 HydrophobicContact CD2-CD1 4.34Å; L227-F306 HydrophobicContact CD1-CZ 4.02Å; L227-F306 HydrophobicContact CD2-CE2 4.44Å; L227-F306 HydrophobicContact CD2-CZ 3.98Å; L227-L320 HydrophobicContact CD2-CD2 3.38Å
228	D	88.9	Confident	76.3	Confident	45 Å²	45	59.7 Å²	59.7	24%	0.241	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	135.4	162.1	-172.4	25.8	0	0	0	109.3	V215 H216 I218 S288 Q289	V215-D228 WeakPolarHBondContact CA-O 3.27Å; H216-D228 PolarHBondContact N-O 3.06Å; H216-D228 PolarHBondContact O-N 2.81Å; I218-D228 HydrophobicContact CD1-CB 4.14Å; I218-D228 HydrophobicContact CG1-CB 4.41Å; D228-S288 WeakPolarHBondContact OD1-CB 3.35Å; D228-S288 PolarHBondContact OD1-OG 3.43Å; D228-Q289 PolarHBondContact OD1-N 3.23Å
229	V	86.4	Confident	74.3	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	123.3	-177.2	-170.9	0	0	0	0	109.6	P213 A214 V215 L227 Y263 S288 Q289 V291 F306	P213-V229 HydrophobicContact CB-CG1 4.01Å; A214-V229 WeakPolarHBondContact O-CA 3.44Å; V215-V229 HydrophobicContact CG1-CG2 4.47Å; V215-V229 HydrophobicContact CG2-CG1 4.35Å; L227-V229 HydrophobicContact CB-CG2 4.45Å; V229-Y263 HydrophobicContact CB-CD1 4.4Å; V229-Y263 HydrophobicContact CB-CE1 4.38Å; V229-Y263 HydrophobicContact CG1-CD1 3.45Å; V229-Y263 VanDerWaalsContact CG1-CD1 3.45Å; V229-Y263 HydrophobicContact CG1-CE1 3.61Å; V229-Y263 HydrophobicContact CG1-CG 4.17Å; V229-Y263 PolarHBondContact O-OH 3.24Å; V229-S288 CarbonylContact O-C 3.32Å; V229-S288 WeakPolarHBondContact O-CA 3.44Å; V229-Q289 PolarHBondContact N-O 2.89Å; V229-Q289 PolarHBondContact O-N 2.94Å; V229-V291 HydrophobicContact CB-CG2 4.22Å; V229-V291 HydrophobicContact CG2-CB 4.05Å; V229-V291 HydrophobicContact CG2-CG2 3.71Å; V229-F306 HydrophobicContact CG1-CD1 4.24Å; V229-F306 HydrophobicContact CG2-CD1 3.82Å; V229-F306 HydrophobicContact CG2-CE1 3.86Å
230	G	78.3	Confident	72.4	Confident	5 Å²	5	61.8 Å²	61.8	5%	0.052	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	-158.6	-173.7	0	0	0	0	0	115.2	A214 Y287	A214-G230 PolarHBondContact N-O 3.03Å; A214-G230 PolarHBondContact O-N 3.36Å; G230-Y287 VanDerWaalsContact CA-O 3.24Å; G230-Y287 WeakPolarHBondContact CA-O 3.45Å
231	I	71.1	Confident	70.3	Confident	34 Å²	34	61.9 Å²	61.9	17%	0.174	34%	0.341	C	S	.	.			trans	-111.5	116.8	-179	-62.5	161.8	0	0	0	109.6	T233 I253 Y287 F308	I231-T233 VanDerWaalsContact C-N 3.33Å; I231-T233 PolarHBondContact O-N 3.29Å; I231-I253 HydrophobicContact CD1-CD1 3.43Å; I231-I253 VanDerWaalsContact CD1-CD1 3.43Å; I231-I253 HydrophobicContact CD1-CG1 4.19Å; I231-Y287 HydrophobicContact CD1-CD1 4.36Å; I231-Y287 PolarHBondContact N-O 2.84Å; I231-F308 HydrophobicContact CD1-CZ 4.39Å; I231-F308 HydrophobicContact CG1-CE1 3.92Å; I231-F308 HydrophobicContact CG1-CE2 4.39Å; I231-F308 HydrophobicContact CG1-CZ 3.46Å; I231-F308 VanDerWaalsContact CG1-CZ 3.46Å
232	A	62	Low	68.4	Low	85 Å²	85	61.5 Å²	61.5	70%	0.702	34%	0.337	S	S	*	.	S	Bend	trans	-67	-27	-176.4	0	0	0	0	0	114.8	A214	A214-A232 HydrophobicContact CB-CB 3.93Å
233	T	55.7	Low	66.9	Low	104 Å²	104	66.9 Å²	66.9	64%	0.638	36%	0.357	S	S	*	.			trans	-137.5	93.4	-173.5	47.3	0	0	0	0	111.9	I231	I231-T233 VanDerWaalsContact C-N 3.33Å; I231-T233 PolarHBondContact O-N 3.29Å
234	L	52.8	Low	65.7	Low	81 Å²	81	67 Å²	67	42%	0.424	35%	0.354	S	S	.	.			trans	-84.5	105.9	162.5	-74.8	160.3	0	0	0	108.9	V237 Y287	L234-V237 HydrophobicContact CD2-CG2 3.73Å; L234-Y287 HydrophobicContact CD1-CD1 4.08Å; L234-Y287 HydrophobicContact CD1-CD2 3.93Å; L234-Y287 HydrophobicContact CD1-CE2 4.4Å; L234-Y287 HydrophobicContact CD1-CG 3.74Å; L234-Y287 HydrophobicContact CD2-CD1 3.84Å; L234-Y287 HydrophobicContact CD2-CE1 3.8Å; L234-Y287 HydrophobicContact CD2-CG 4.37Å
235	K	50.7	Low	64.6	Low	184 Å²	184	66 Å²	66	80%	0.8	35%	0.346	S	S	*	.			trans	-127.8	-28.5	169.8	-76.6	-165.6	170.9	-173.6	0	114.6
236	D	47.3	Very low	63	Low	111 Å²	111	73.1 Å²	73.1	59%	0.594	38%	0.383	S	S	*	.			trans	-121.3	48	-169.8	-56.1	-76.1	0	0	0	114.5	I238	D236-I238 VanDerWaalsContact C-N 3.28Å; D236-I238 PolarHBondContact O-N 2.99Å
237	V	49.6	Very low	61	Low	56 Å²	56	77.5 Å²	77.5	34%	0.339	40%	0.404	S	S	.	.			trans	-81.3	74.9	171.4	-173.3	0	0	0	0	109.9	L234 Q239	L234-V237 HydrophobicContact CD2-CG2 3.73Å; V237-Q239 HydrophobicContact CG1-CG 4.5Å; V237-Q239 PolarHBondContact O-N 2.79Å
238	I	49.5	Very low	58.8	Low	90 Å²	90	86.6 Å²	86.6	46%	0.462	45%	0.447	S	S	.	.			trans	-77.5	90.5	179.7	-54.1	174.9	0	0	0	109.8	D236 D240	D236-I238 VanDerWaalsContact C-N 3.28Å; D236-I238 PolarHBondContact O-N 2.99Å; I238-D240 VanDerWaalsContact C-N 3.29Å; I238-D240 PolarHBondContact O-N 2.77Å
239	Q	49.7	Very low	56.8	Low	138 Å²	138	91.6 Å²	91.6	65%	0.645	47%	0.474	S	S	*	.	H	α-helix	trans	-61	-30.9	-177.3	-68.3	-173	-10.9	0	0	114.3	V237 N241 V242	V237-Q239 HydrophobicContact CG1-CG 4.5Å; V237-Q239 PolarHBondContact O-N 2.79Å; Q239-N241 VanDerWaalsContact C-N 3.34Å; Q239-N241 PolarHBondContact O-N 3.09Å; Q239-V242 PolarHBondContact O-N 2.87Å
240	D	49.8	Very low	55	Low	100 Å²	100	92.9 Å²	92.9	54%	0.535	49%	0.485	S	S	.	.	H	α-helix	trans	-72.7	-23	-168.4	-73.5	-40.8	0	0	0	114.9	I238 K243	I238-D240 VanDerWaalsContact C-N 3.29Å; I238-D240 PolarHBondContact O-N 2.77Å; D240-K243 WeakPolarHBondContact OD1-CE 3.44Å; D240-K243 IonicContact OD1-NZ 2.97Å; D240-K243 PolarHBondContact OD1-NZ 2.81Å
241	N	48.1	Very low	53.9	Low	41 Å²	41	94.7 Å²	94.7	22%	0.219	49%	0.49	C	S	.	.	H	α-helix	trans	-72.1	-36.4	-179.8	-59.1	-10.7	0	0	0	111.1	N154 Q239 K243 R244	N154-N241 VanDerWaalsContact ND2-CG 3.32Å; N154-N241 PolarHBondContact ND2-ND2 2.86Å; N154-N241 PolarHBondContact ND2-OD1 2.81Å; N154-N241 PolarHBondContact OD1-OD1 3.2Å; Q239-N241 VanDerWaalsContact C-N 3.34Å; Q239-N241 PolarHBondContact O-N 3.09Å; N241-K243 VanDerWaalsContact C-N 3.32Å; N241-K243 PolarHBondContact O-N 3.29Å; N241-R244 PolarHBondContact O-N 3.47Å
242	V	50.8	Low	52.9	Low	29 Å²	29	95.2 Å²	95.2	18%	0.176	49%	0.491	C	S	.	.	H	α-helix	trans	-65.8	-34.6	-179.2	-176.3	0	0	0	0	111.5	Q239 R244 C245 A250 F252	Q239-V242 PolarHBondContact O-N 2.87Å; V242-R244 PolarHBondContact O-N 2.83Å; V242-C245 CarbonylContact O-C 3.55Å; V242-C245 PolarHBondContact O-N 3.02Å; V242-A250 HydrophobicContact CG1-CB 3.93Å; V242-F252 HydrophobicContact CG2-CB 3.77Å; V242-F252 HydrophobicContact CG2-CG 4.46Å
243	K	56.3	Low	52.8	Low	142 Å²	142	91.9 Å²	91.9	62%	0.617	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.1	179.6	-64.3	174.1	-173.6	164.2	0	114	D240 N241	D240-K243 WeakPolarHBondContact OD1-CE 3.44Å; D240-K243 IonicContact OD1-NZ 2.97Å; D240-K243 PolarHBondContact OD1-NZ 2.81Å; N241-K243 VanDerWaalsContact C-N 3.32Å; N241-K243 PolarHBondContact O-N 3.29Å
244	R	65.8	Low	53.3	Low	103 Å²	103	89.3 Å²	89.3	39%	0.389	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-20.1	176.1	-57.5	-175.7	-171.4	-163.4	4.4	113.4	N155 N241 V242	N155-R244 PolarHBondContact OD1-NH1 2.82Å; N155-R244 PolarHBondContact OD1-NH2 3.04Å; N241-R244 PolarHBondContact O-N 3.47Å; V242-R244 PolarHBondContact O-N 2.83Å
245	C	68	Low	54.2	Low	19 Å²	19	89.5 Å²	89.5	13%	0.128	45%	0.448	C	S	.	.	S	Bend	trans	-136.2	74.1	178.8	-68.7	0	0	0	0	110.3	C180 L203 V242	C180-C245 HydrophobicContact CB-CB 3.73Å; C180-C245 WeakPolarHBondContact CB-SG 3.05Å; C180-C245 WeakPolarHBondContact SG-CB 3.43Å; C180-C245 CovalentContact SG-SG 2.04Å; C180-C245 PolarHBondContact SG-SG 3.32Å; L203-C245 HydrophobicContact CB-CB 4.41Å; L203-C245 HydrophobicContact CD1-CB 4.29Å; V242-C245 CarbonylContact O-C 3.55Å; V242-C245 PolarHBondContact O-N 3.02Å
246	I	58.5	Low	55.4	Low	148 Å²	148	80.8 Å²	80.8	76%	0.759	41%	0.411	S	S	*	.			trans	-4.2	126.2	163.6	-50.8	167.5	0	0	0	114.3
247	D	50.1	Low	57.1	Low	112 Å²	112	78 Å²	78	60%	0.599	39%	0.394	S	S	*	.			cis	-142.8	178.4	33.1	-143.8	-28.3	0	0	0	114.1	D249 A250	D247-D249 VanDerWaalsContact C-N 3.32Å; D247-D249 PolarHBondContact O-N 2.56Å; D247-D249 VanDerWaalsContact O-N 3.14Å; D247-A250 PolarHBondContact O-N 2.93Å
248	Q	45.9	Very low	58.5	Low	192 Å²	192	75.4 Å²	75.4	90%	0.897	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.9	-164.6	-61.9	-174.3	7.7	0	0	117
249	D	47	Very low	59.9	Low	149 Å²	149	72.9 Å²	72.9	80%	0.797	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-0.6	-173.1	-126.2	-31	0	0	0	114.2	D247 R251	D247-D249 VanDerWaalsContact C-N 3.32Å; D247-D249 PolarHBondContact O-N 2.56Å; D247-D249 VanDerWaalsContact O-N 3.14Å; D249-R251 PolarHBondContact O-N 2.88Å
250	A	47.8	Very low	61.3	Low	28 Å²	28	67.1 Å²	67.1	23%	0.231	34%	0.341	C	S	.	.			trans	-73.7	85.8	-179.1	0	0	0	0	0	111.5	V242 D247 F252	V242-A250 HydrophobicContact CG1-CB 3.93Å; D247-A250 PolarHBondContact O-N 2.93Å; A250-F252 PolarHBondContact O-N 3.2Å
251	R	55	Low	62.9	Low	43 Å²	43	64.9 Å²	64.9	16%	0.162	33%	0.331	C	S	.	.			trans	-62.1	76.6	167.9	-68.8	-172.8	-71.4	167.2	-3.8	110.7	D249 I253 S284 G285 S286	D249-R251 PolarHBondContact O-N 2.88Å; R251-I253 PolarHBondContact O-N 2.78Å; R251-S284 PolarHBondContact NH1-O 3Å; R251-S284 PolarHBondContact NH2-O 3.49Å; R251-G285 VanDerWaalsContact NH1-C 3.32Å; R251-G285 PolarHBondContact NH1-O 2.96Å; R251-S286 PolarHBondContact NH1-O 2.85Å
252	F	51.2	Low	64.7	Low	44 Å²	44	63 Å²	63	19%	0.193	32%	0.321	C	S	.	.			trans	-69.5	99.3	-178.3	-175.3	-93.2	0	0	0	110.4	Y178 V242 A250	Y178-F252 AromaticContact CD1-CD2 3.71Å; Y178-F252 HydrophobicContact CD1-CD2 3.71Å; Y178-F252 AromaticContact CD1-CE2 3.83Å; Y178-F252 HydrophobicContact CD1-CE2 3.83Å; Y178-F252 HydrophobicContact CE1-CD2 4.12Å; Y178-F252 WeakPolarHBondContact O-CE2 3.25Å; V242-F252 HydrophobicContact CG2-CB 3.77Å; V242-F252 HydrophobicContact CG2-CG 4.46Å; A250-F252 PolarHBondContact O-N 3.2Å
253	I	60.2	Low	66.5	Low	16 Å²	16	61.6 Å²	61.6	8%	0.082	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-98.6	113.1	164.1	-64.4	135.9	0	0	0	105.4	I231 R251 L255 L256	I231-I253 HydrophobicContact CD1-CD1 3.43Å; I231-I253 VanDerWaalsContact CD1-CD1 3.43Å; I231-I253 HydrophobicContact CD1-CG1 4.19Å; R251-I253 PolarHBondContact O-N 2.78Å; I253-L255 HydrophobicContact CG2-CB 4.22Å; I253-L255 PolarHBondContact O-N 2.59Å; I253-L255 VanDerWaalsContact O-N 3.15Å; I253-L256 HydrophobicContact CB-CB 4.33Å; I253-L256 HydrophobicContact CB-CD1 4.02Å; I253-L256 HydrophobicContact CB-CG 3.94Å; I253-L256 HydrophobicContact CD1-CD1 3.64Å; I253-L256 HydrophobicContact CD1-CG 4.41Å; I253-L256 HydrophobicContact CG1-CD1 4.47Å; I253-L256 HydrophobicContact CG2-CD1 4.43Å; I253-L256 HydrophobicContact CG2-CG 3.94Å; I253-L256 WeakPolarHBondContact O-CB 3.28Å; I253-L256 PolarHBondContact O-N 2.94Å
254	S	64.4	Low	68.1	Low	49 Å²	49	55.6 Å²	55.6	34%	0.343	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-48.3	-44.9	-178.6	51.5	0	0	0	0	112.1	L256 H257	S254-L256 PolarHBondContact O-N 3.02Å; S254-H257 PolarHBondContact O-CD2 2.96Å; S254-H257 PolarHBondContact O-N 2.88Å; S254-H257 VanDerWaalsContact O-N 3.1Å
255	L	72.8	Confident	69.4	Low	86 Å²	86	50.8 Å²	50.8	45%	0.45	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-66.9	-10	179.3	-55.7	173.8	0	0	0	115.2	V210 A211 I253	V210-L255 HydrophobicContact CG2-CB 4.15Å; V210-L255 HydrophobicContact CG2-CD2 4.08Å; V210-L255 VanDerWaalsContact CG2-O 3.28Å; V210-L255 WeakPolarHBondContact CG2-O 3.12Å; V210-L255 PolarHBondContact N-O 3.17Å; A211-L255 HydrophobicContact CB-CB 3.87Å; A211-L255 PolarHBondContact N-O 3.44Å; I253-L255 HydrophobicContact CG2-CB 4.22Å; I253-L255 PolarHBondContact O-N 2.59Å; I253-L255 VanDerWaalsContact O-N 3.15Å
256	L	76.1	Confident	70.5	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-91.4	-13.5	172.6	-68.9	-175.3	0	0	0	113.4	P209 A211 I253 S254 G258 L260 F308 N310	P209-L256 WeakPolarHBondContact CA-O 3.41Å; P209-L256 HydrophobicContact CB-CD2 4.12Å; P209-L256 WeakPolarHBondContact CG-O 3.41Å; A211-L256 HydrophobicContact CB-CD2 4.04Å; I253-L256 HydrophobicContact CB-CB 4.33Å; I253-L256 HydrophobicContact CB-CD1 4.02Å; I253-L256 HydrophobicContact CB-CG 3.94Å; I253-L256 HydrophobicContact CD1-CD1 3.64Å; I253-L256 HydrophobicContact CD1-CG 4.41Å; I253-L256 HydrophobicContact CG1-CD1 4.47Å; I253-L256 HydrophobicContact CG2-CD1 4.43Å; I253-L256 HydrophobicContact CG2-CG 3.94Å; I253-L256 WeakPolarHBondContact O-CB 3.28Å; I253-L256 PolarHBondContact O-N 2.94Å; S254-L256 PolarHBondContact O-N 3.02Å; L256-G258 PolarHBondContact O-N 3.5Å; L256-L260 HydrophobicContact CD1-CB 3.68Å; L256-L260 HydrophobicContact CD1-CD1 4.02Å; L256-L260 HydrophobicContact CD1-CG 4.29Å; L256-F308 HydrophobicContact CD2-CB 3.63Å; L256-F308 HydrophobicContact CD2-CD1 4.22Å; L256-F308 HydrophobicContact CD2-CD2 3.68Å; L256-F308 HydrophobicContact CD2-CE2 4.36Å; L256-F308 HydrophobicContact CD2-CG 3.6Å; L256-N310 PolarHBondContact O-ND2 2.86Å
257	H	82.9	Confident	72.2	Confident	53 Å²	53	44.2 Å²	44.2	25%	0.245	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	32.4	-176.6	-62.2	148.2	0	0	0	113.2	P177 Y178 P206 G207 L208 S254	P177-H257 HydrophobicContact CB-CB 4Å; P177-H257 HydrophobicContact CG-CB 3.81Å; P177-H257 VanDerWaalsContact CG-CD2 3.46Å; P177-H257 WeakPolarHBondContact CG-CD2 3.39Å; Y178-H257 WeakPolarHBondContact CB-O 3.2Å; P206-H257 CarbonylContact C-O 3.49Å; P206-H257 WeakPolarHBondContact CA-O 3.38Å; G207-H257 PolarHBondContact N-O 3.14Å; L208-H257 PolarHBondContact O-ND1 3.24Å; S254-H257 PolarHBondContact O-CD2 2.96Å; S254-H257 PolarHBondContact O-N 2.88Å; S254-H257 VanDerWaalsContact O-N 3.1Å
258	G	78.7	Confident	74.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	168.4	173	-168	0	0	0	0	0	111.8	L256	L256-G258 PolarHBondContact O-N 3.5Å
259	P	78.6	Confident	76.2	Confident	37 Å²	37	31.2 Å²	31.2	24%	0.24	17%	0.173	C	C	.	.			trans	-75.4	144.5	177	32.4	-33	0	0	0	110.7	V261 N310	P259-V261 HydrophobicContact CG-CG2 4.49Å; P259-V261 PolarHBondContact O-N 2.85Å; P259-N310 WeakPolarHBondContact O-CA 3.38Å; P259-N310 VanDerWaalsContact O-CB 3.28Å; P259-N310 WeakPolarHBondContact O-CB 3.46Å
260	L	78.7	Confident	78	Confident	17 Å²	17	26.1 Å²	26.1	9%	0.089	15%	0.148	C	C	.	.			trans	-73.5	109.3	174.8	179.2	56.6	0	0	0	110.9	L256 A283 F308	L256-L260 HydrophobicContact CD1-CB 3.68Å; L256-L260 HydrophobicContact CD1-CD1 4.02Å; L256-L260 HydrophobicContact CD1-CG 4.29Å; L260-A283 HydrophobicContact CD1-CB 4.44Å; L260-A283 HydrophobicContact CD2-CB 4.15Å; L260-A283 HydrophobicContact CG-CB 3.81Å; L260-F308 HydrophobicContact CD1-CD1 3.64Å; L260-F308 HydrophobicContact CD1-CE1 4.27Å
261	V	84	Confident	79.5	Confident	54 Å²	54	33.1 Å²	33.1	33%	0.327	18%	0.176	S	C	.	.			trans	-98	-35.8	178.4	176.8	0	0	0	0	111.9	P259 A283 Y309	P259-V261 HydrophobicContact CG-CG2 4.49Å; P259-V261 PolarHBondContact O-N 2.85Å; V261-A283 PolarHBondContact O-N 3.49Å; V261-Y309 HydrophobicContact CB-CD1 4.09Å; V261-Y309 WeakPolarHBondContact CB-O 3.46Å; V261-Y309 HydrophobicContact CG1-CD1 3.98Å; V261-Y309 HydrophobicContact CG1-CE1 4.11Å; V261-Y309 PolarHBondContact N-O 2.73Å
262	G	86.6	Confident	80.6	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.1	-166.6	179.7	0	0	0	0	0	115.4	Y281 Y309	G262-Y281 CarbonylContact C-O 3.6Å; G262-Y281 WeakPolarHBondContact CA-O 3.39Å; G262-Y309 PolarHBondContact N-O 2.83Å; G262-Y309 VanDerWaalsContact N-O 3.15Å; G262-Y309 PolarHBondContact O-N 2.93Å
263	Y	87.8	Confident	82	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	122.2	-178.1	-54.8	-92.6	0	0	0	109.6	V229 Y281 A283 Q289 A307 F308	V229-Y263 HydrophobicContact CB-CD1 4.4Å; V229-Y263 HydrophobicContact CB-CE1 4.38Å; V229-Y263 HydrophobicContact CG1-CD1 3.45Å; V229-Y263 VanDerWaalsContact CG1-CD1 3.45Å; V229-Y263 HydrophobicContact CG1-CE1 3.61Å; V229-Y263 HydrophobicContact CG1-CG 4.17Å; V229-Y263 PolarHBondContact O-OH 3.24Å; Y263-Y281 PolarHBondContact N-O 2.98Å; Y263-Y281 PolarHBondContact O-N 2.95Å; Y263-A283 HydrophobicContact CE2-CB 4.15Å; Y263-Q289 HydrophobicContact CE2-CB 4.36Å; Y263-A307 CarbonylContact C-O 3.55Å; Y263-A307 WeakPolarHBondContact CA-O 3.45Å; Y263-F308 AromaticContact CD1-CD1 3.95Å; Y263-F308 HydrophobicContact CD1-CD1 3.95Å; Y263-F308 HydrophobicContact CD1-CE1 4.06Å; Y263-F308 AromaticContact CE1-CD1 3.68Å; Y263-F308 HydrophobicContact CE1-CD1 3.68Å; Y263-F308 AromaticContact CE1-CE1 3.37Å; Y263-F308 HydrophobicContact CE1-CE1 3.37Å; Y263-F308 HydrophobicContact CE1-CZ 4.38Å
264	I	90.6	Very high	83	Confident	16 Å²	16	48.7 Å²	48.7	8%	0.082	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	120.4	171.2	-69.3	168	0	0	0	107.7	K278 T279 L280 F306 A307 Y309 F317	I264-K278 HydrophobicContact CG2-CD 4.34Å; I264-K278 VanDerWaalsContact CG2-CE 3.47Å; I264-K278 HydrophobicContact CG2-CG 4.08Å; I264-T279 WeakPolarHBondContact CA-O 2.12Å; I264-L280 HydrophobicContact CG1-CD1 3.86Å; I264-F306 CarbonylContact O-C 3.55Å; I264-F306 WeakPolarHBondContact O-CA 3.49Å; I264-A307 PolarHBondContact N-O 3.36Å; I264-A307 PolarHBondContact O-N 2.95Å; I264-Y309 HydrophobicContact CD1-CD2 3.95Å; I264-Y309 HydrophobicContact CD1-CG 4.14Å; I264-F317 HydrophobicContact CG2-CE1 4.05Å; I264-F317 HydrophobicContact CG2-CZ 4.12Å
265	V	92.1	Very high	84.1	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	123.7	-179.9	-175.5	0	0	0	0	108.6	K278 T279 Y281 V291 I293 S305 F306	V265-K278 CarbonylContact O-C 3.57Å; V265-K278 WeakPolarHBondContact O-CA 3.48Å; V265-T279 PolarHBondContact N-O 3.36Å; V265-T279 PolarHBondContact O-N 2.86Å; V265-Y281 HydrophobicContact CB-CD2 4.1Å; V265-Y281 HydrophobicContact CB-CE2 3.9Å; V265-Y281 HydrophobicContact CG2-CD2 3.56Å; V265-Y281 HydrophobicContact CG2-CE2 3.75Å; V265-V291 HydrophobicContact CG2-CG1 4.25Å; V265-I293 HydrophobicContact CG1-CD1 3.84Å; V265-S305 CarbonylContact C-O 3.58Å; V265-S305 WeakPolarHBondContact CA-O 3.44Å; V265-F306 HydrophobicContact CB-CD1 4.43Å; V265-F306 HydrophobicContact CB-CE1 4.43Å; V265-F306 HydrophobicContact CG1-CD1 4.13Å; V265-F306 HydrophobicContact CG1-CE1 3.73Å; V265-F306 HydrophobicContact CG1-CZ 4.13Å; V265-F306 HydrophobicContact CG2-CD1 3.69Å; V265-F306 HydrophobicContact CG2-CE1 3.86Å
266	T	92.2	Very high	84.5	Confident	27 Å²	27	50.3 Å²	50.3	17%	0.166	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	147	170.2	62.5	0	0	0	0	110.7	F275 S277 K278 L304 S305 F317	T266-F275 HydrophobicContact CG2-CE2 4.48Å; T266-S277 WeakPolarHBondContact CA-O 3.43Å; T266-K278 HydrophobicContact CG2-CB 4.01Å; T266-K278 HydrophobicContact CG2-CD 4.15Å; T266-K278 HydrophobicContact CG2-CG 3.87Å; T266-L304 WeakPolarHBondContact O-CA 2.98Å; T266-S305 PolarHBondContact N-O 2.8Å; T266-S305 PolarHBondContact O-N 3.26Å; T266-S305 WeakPolarHBondContact OG1-CB 3.41Å; T266-F317 HydrophobicContact CG2-CE1 4.23Å
267	V	92.5	Very high	85	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.018	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	126.3	179.5	-176.4	0	0	0	0	108.5	A276 S277 I293 L296 Y302 L304	V267-A276 HydrophobicContact CB-CB 4.28Å; V267-A276 HydrophobicContact CG1-CB 4.08Å; V267-A276 WeakPolarHBondContact O-CA 2.11Å; V267-A276 WeakPolarHBondContact O-CB 2.13Å; V267-A276 PolarHBondContact O-N 2.96Å; V267-S277 WeakPolarHBondContact CG2-OG 3.46Å; V267-S277 PolarHBondContact N-O 2.73Å; V267-S277 PolarHBondContact O-N 2.83Å; V267-I293 HydrophobicContact CG2-CD1 4.36Å; V267-I293 HydrophobicContact CG2-CG2 3.95Å; V267-L296 HydrophobicContact CG1-CD2 4.06Å; V267-Y302 HydrophobicContact CG1-CD1 3.66Å; V267-Y302 HydrophobicContact CG1-CE1 4.04Å; V267-L304 HydrophobicContact CB-CD2 4.23Å; V267-L304 HydrophobicContact CG1-CD2 3.84Å; V267-L304 HydrophobicContact CG2-CD2 3.94Å
268	A	91.3	Very high	85.3	Confident	6 Å²	6	56 Å²	56	5%	0.05	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	144.8	172.1	0	0	0	0	0	111	Y273 Y302 N303	A268-Y273 HydrophobicContact CB-CD2 4.35Å; A268-Y273 HydrophobicContact CB-CE2 3.6Å; A268-Y302 CarbonylContact O-C 3.35Å; A268-Y302 VanDerWaalsContact O-CA 3.24Å; A268-Y302 WeakPolarHBondContact O-CA 3.4Å; A268-N303 PolarHBondContact N-O 3.1Å; A268-N303 PolarHBondContact O-N 2.85Å
269	T	89.1	Confident	85.9	Confident	24 Å²	24	58.9 Å²	58.9	15%	0.147	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	149.5	166.4	49.4	0	0	0	0	110.1	P272 Y273 K274 T300 Y302	T269-P272 PolarHBondContact OG1-O 2.99Å; T269-Y273 WeakPolarHBondContact O-CA 3.48Å; T269-Y273 WeakPolarHBondContact O-CD2 3.45Å; T269-K274 PolarHBondContact N-O 3.31Å; T269-K274 PolarHBondContact O-N 3.26Å; T269-K274 WeakPolarHBondContact OG1-CA 3.42Å; T269-K274 WeakPolarHBondContact OG1-CB 2.12Å; T269-K274 PolarHBondContact OG1-N 3.08Å; T269-K274 VanDerWaalsContact OG1-N 3.1Å; T269-K274 PolarHBondContact OG1-O 2.92Å; T269-T300 HydrophobicContact CG2-CG2 3.74Å; T269-Y302 HydrophobicContact CG2-CD1 3.84Å; T269-Y302 HydrophobicContact CG2-CE1 3.39Å
270	T	85	Confident	86.4	Confident	43 Å²	43	60.7 Å²	60.7	26%	0.264	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-33.1	-176.1	58.8	0	0	0	0	114.3	R301 N303 V321	T270-R301 HydrophobicContact CG2-CG 4.22Å; T270-R301 PolarHBondContact N-O 2.8Å; T270-R301 WeakPolarHBondContact OG1-CB 3.44Å; T270-R301 WeakPolarHBondContact OG1-CG 3.33Å; T270-R301 PolarHBondContact OG1-O 2.93Å; T270-N303 HydrophobicContact CG2-CB 4.08Å; T270-V321 HydrophobicContact CG2-CG1 4.38Å
271	Q	79.2	Confident	86.8	Confident	174 Å²	174	62.6 Å²	62.6	81%	0.813	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.4	111.2	-175.5	-71.1	-176.3	-16.2	0	0	110.6
272	P	78	Confident	86.8	Confident	113 Å²	113	65.2 Å²	65.2	73%	0.734	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	cis	-58.4	158.9	-17.3	30	-36.4	0	0	0	111	T269 K274	T269-P272 PolarHBondContact OG1-O 2.99Å; P272-K274 PolarHBondContact O-N 2.78Å; P272-K274 VanDerWaalsContact O-N 3.16Å
273	Y	82.2	Confident	86.3	Confident	167 Å²	167	66.3 Å²	66.3	66%	0.655	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	112.3	174.4	-179.9	-98.2	0	0	0	110.5	A268 T269	A268-Y273 HydrophobicContact CB-CD2 4.35Å; A268-Y273 HydrophobicContact CB-CE2 3.6Å; T269-Y273 WeakPolarHBondContact O-CA 3.48Å; T269-Y273 WeakPolarHBondContact O-CD2 3.45Å
274	K	81.1	Confident	85.3	Confident	151 Å²	151	68.8 Å²	68.8	66%	0.657	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138	116.4	171.2	-177.8	170.9	-178.2	171	0	110.3	T269 P272	T269-K274 PolarHBondContact N-O 3.31Å; T269-K274 PolarHBondContact O-N 3.26Å; T269-K274 WeakPolarHBondContact OG1-CA 3.42Å; T269-K274 WeakPolarHBondContact OG1-CB 2.12Å; T269-K274 PolarHBondContact OG1-N 3.08Å; T269-K274 VanDerWaalsContact OG1-N 3.1Å; T269-K274 PolarHBondContact OG1-O 2.92Å; P272-K274 PolarHBondContact O-N 2.78Å; P272-K274 VanDerWaalsContact O-N 3.16Å
275	F	85.6	Confident	83.9	Confident	108 Å²	108	71.3 Å²	71.3	47%	0.474	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	137.5	168.7	176.2	-95.8	0	0	0	110.5	T266 S277 K278	T266-F275 HydrophobicContact CG2-CE2 4.48Å; F275-S277 VanDerWaalsContact CE2-O 3.24Å; F275-S277 WeakPolarHBondContact CE2-O 2.13Å; F275-S277 WeakPolarHBondContact CZ-O 2.11Å; F275-K278 HydrophobicContact CE2-CB 4.31Å; F275-K278 HydrophobicContact CZ-CB 3.79Å
276	A	81.4	Confident	82.5	Confident	61 Å²	61	74 Å²	74	50%	0.504	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-45.4	-175.6	0	0	0	0	0	112.4	V267	V267-A276 HydrophobicContact CB-CB 4.28Å; V267-A276 HydrophobicContact CG1-CB 4.08Å; V267-A276 WeakPolarHBondContact O-CA 2.11Å; V267-A276 WeakPolarHBondContact O-CB 2.13Å; V267-A276 PolarHBondContact O-N 2.96Å
277	S	87.8	Confident	81.2	Confident	43 Å²	43	76.6 Å²	76.6	30%	0.301	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	162.4	180	62.3	0	0	0	0	113.8	T266 V267 F275	T266-S277 WeakPolarHBondContact CA-O 3.43Å; V267-S277 WeakPolarHBondContact CG2-OG 3.46Å; V267-S277 PolarHBondContact N-O 2.73Å; V267-S277 PolarHBondContact O-N 2.83Å; F275-S277 VanDerWaalsContact CE2-O 3.24Å; F275-S277 WeakPolarHBondContact CE2-O 2.13Å; F275-S277 WeakPolarHBondContact CZ-O 2.11Å
278	K	89.7	Confident	80.2	Confident	130 Å²	130	78.8 Å²	78.8	57%	0.565	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.5	119	164.1	175.2	174.7	-178.2	-178.5	0	108.2	I264 V265 T266 F275	I264-K278 HydrophobicContact CG2-CD 4.34Å; I264-K278 VanDerWaalsContact CG2-CE 3.47Å; I264-K278 HydrophobicContact CG2-CG 4.08Å; V265-K278 CarbonylContact O-C 3.57Å; V265-K278 WeakPolarHBondContact O-CA 3.48Å; T266-K278 HydrophobicContact CG2-CB 4.01Å; T266-K278 HydrophobicContact CG2-CD 4.15Å; T266-K278 HydrophobicContact CG2-CG 3.87Å; F275-K278 HydrophobicContact CE2-CB 4.31Å; F275-K278 HydrophobicContact CZ-CB 3.79Å
279	T	89.7	Confident	79.8	Confident	60 Å²	60	80.2 Å²	80.2	37%	0.368	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	140.4	-174.6	-55.8	0	0	0	0	109.9	I264 V265 Y281	I264-T279 WeakPolarHBondContact CA-O 2.12Å; V265-T279 PolarHBondContact N-O 3.36Å; V265-T279 PolarHBondContact O-N 2.86Å; T279-Y281 HydrophobicContact CG2-CD2 3.88Å; T279-Y281 HydrophobicContact CG2-CE2 3.58Å
280	L	89.5	Confident	79.6	Confident	75 Å²	75	84.1 Å²	84.1	39%	0.393	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	118.2	168.2	176.2	65	0	0	0	108.9	I264 Y309	I264-L280 HydrophobicContact CG1-CD1 3.86Å; L280-Y309 HydrophobicContact CD1-CD1 3.75Å; L280-Y309 HydrophobicContact CD1-CG 4.12Å; L280-Y309 HydrophobicContact CD2-CD1 3.9Å; L280-Y309 HydrophobicContact CD2-CE1 3.95Å
281	Y	87.6	Confident	79.8	Confident	57 Å²	57	82 Å²	82	22%	0.224	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	114.6	171	-69.2	-104.6	0	0	0	108.1	G262 Y263 V265 T279 V291 D292	G262-Y281 CarbonylContact C-O 3.6Å; G262-Y281 WeakPolarHBondContact CA-O 3.39Å; Y263-Y281 PolarHBondContact N-O 2.98Å; Y263-Y281 PolarHBondContact O-N 2.95Å; V265-Y281 HydrophobicContact CB-CD2 4.1Å; V265-Y281 HydrophobicContact CB-CE2 3.9Å; V265-Y281 HydrophobicContact CG2-CD2 3.56Å; V265-Y281 HydrophobicContact CG2-CE2 3.75Å; T279-Y281 HydrophobicContact CG2-CD2 3.88Å; T279-Y281 HydrophobicContact CG2-CE2 3.58Å; Y281-V291 HydrophobicContact CD1-CG1 4.12Å; Y281-V291 HydrophobicContact CD1-CG2 4.4Å; Y281-V291 HydrophobicContact CD2-CG1 4.23Å; Y281-V291 HydrophobicContact CE1-CG1 3.79Å; Y281-V291 HydrophobicContact CE2-CG1 3.91Å; Y281-V291 HydrophobicContact CG-CG1 4.33Å; Y281-V291 HydrophobicContact CG-CG2 4.47Å; Y281-D292 PolarHBondContact OH-O 2.85Å
282	N	84.6	Confident	80.3	Confident	110 Å²	110	78.2 Å²	78.2	59%	0.588	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.5	141	178.2	-67.6	-11.8	0	0	0	110.6	S284 Q289	N282-S284 PolarHBondContact O-N 2.77Å; N282-Q289 PolarHBondContact O-NE2 2.77Å; N282-Q289 PolarHBondContact O-OE1 3.4Å
283	A	76.1	Confident	80.9	Confident	23 Å²	23	73.2 Å²	73.2	19%	0.19	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-75.8	120.5	178.8	0	0	0	0	0	110.7	L260 V261 Y263	L260-A283 HydrophobicContact CD1-CB 4.44Å; L260-A283 HydrophobicContact CD2-CB 4.15Å; L260-A283 HydrophobicContact CG-CB 3.81Å; V261-A283 PolarHBondContact O-N 3.49Å; Y263-A283 HydrophobicContact CE2-CB 4.15Å
284	S	66	Low	81.2	Confident	52 Å²	52	68.4 Å²	68.4	36%	0.364	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-63.2	168.8	162.2	63.5	0	0	0	0	111	R251 N282 S286 Q289	R251-S284 PolarHBondContact NH1-O 3Å; R251-S284 PolarHBondContact NH2-O 3.49Å; N282-S284 PolarHBondContact O-N 2.77Å; S284-S286 PolarHBondContact O-N 2.97Å; S284-S286 VanDerWaalsContact O-N 3.08Å; S284-Q289 PolarHBondContact OG-OE1 2.96Å
285	G	60.6	Low	81.5	Confident	69 Å²	69	69.7 Å²	69.7	71%	0.711	40%	0.395	S	S	*	.	S	Bend	trans	-63.4	-11.4	179.4	0	0	0	0	0	115	R251	R251-G285 VanDerWaalsContact NH1-C 3.32Å; R251-G285 PolarHBondContact NH1-O 2.96Å
286	S	63.1	Low	81.7	Confident	59 Å²	59	65.1 Å²	65.1	41%	0.413	38%	0.375	S	S	.	.	S	Bend	trans	-76.4	158.3	175.3	-178.1	0	0	0	0	112.6	R251 S284 S288	R251-S286 PolarHBondContact NH1-O 2.85Å; S284-S286 PolarHBondContact O-N 2.97Å; S284-S286 VanDerWaalsContact O-N 3.08Å; S286-S288 WeakPolarHBondContact CB-O 3.38Å; S286-S288 PolarHBondContact OG-N 2.81Å; S286-S288 PolarHBondContact OG-O 2.83Å
287	Y	64.9	Low	82	Confident	81 Å²	81	69.1 Å²	69.1	32%	0.318	38%	0.381	S	S	.	.	S	Bend	trans	-85	-11.1	173	-66	-77.6	0	0	0	113.8	G230 I231 L234	G230-Y287 VanDerWaalsContact CA-O 3.24Å; G230-Y287 WeakPolarHBondContact CA-O 3.45Å; I231-Y287 HydrophobicContact CD1-CD1 4.36Å; I231-Y287 PolarHBondContact N-O 2.84Å; L234-Y287 HydrophobicContact CD1-CD1 4.08Å; L234-Y287 HydrophobicContact CD1-CD2 3.93Å; L234-Y287 HydrophobicContact CD1-CE2 4.4Å; L234-Y287 HydrophobicContact CD1-CG 3.74Å; L234-Y287 HydrophobicContact CD2-CD1 3.84Å; L234-Y287 HydrophobicContact CD2-CE1 3.8Å; L234-Y287 HydrophobicContact CD2-CG 4.37Å
288	S	72.5	Confident	82	Confident	48 Å²	48	67.8 Å²	67.8	34%	0.336	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	153.7	166.2	74.8	0	0	0	0	110.9	D228 V229 S286	D228-S288 WeakPolarHBondContact OD1-CB 3.35Å; D228-S288 PolarHBondContact OD1-OG 3.43Å; V229-S288 CarbonylContact O-C 3.32Å; V229-S288 WeakPolarHBondContact O-CA 3.44Å; S286-S288 WeakPolarHBondContact CB-O 3.38Å; S286-S288 PolarHBondContact OG-N 2.81Å; S286-S288 PolarHBondContact OG-O 2.83Å
289	Q	81.6	Confident	81.9	Confident	36 Å²	36	67.6 Å²	67.6	17%	0.168	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	134	-172.8	175.2	167.9	-29.4	0	0	111.3	D228 V229 Y263 N282 S284	D228-Q289 PolarHBondContact OD1-N 3.23Å; V229-Q289 PolarHBondContact N-O 2.89Å; V229-Q289 PolarHBondContact O-N 2.94Å; Y263-Q289 HydrophobicContact CE2-CB 4.36Å; N282-Q289 PolarHBondContact O-NE2 2.77Å; N282-Q289 PolarHBondContact O-OE1 3.4Å; S284-Q289 PolarHBondContact OG-OE1 2.96Å
290	I	86.3	Confident	81.8	Confident	106 Å²	106	66.3 Å²	66.3	54%	0.544	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	131.4	173.5	-57.9	179.7	0	0	0	110	I218 L227	I218-I290 HydrophobicContact CD1-CB 4.4Å; I218-I290 HydrophobicContact CD1-CD1 3.97Å; I218-I290 HydrophobicContact CD1-CG1 3.82Å; I218-I290 HydrophobicContact CD1-CG2 3.9Å; L227-I290 CarbonylContact O-C 3.59Å; L227-I290 VanDerWaalsContact O-CA 3.3Å; L227-I290 WeakPolarHBondContact O-CA 3.45Å
291	V	88	Confident	81.9	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	109.7	179.1	173.9	0	0	0	0	108.3	L227 V229 V265 Y281 I293 F306	L227-V291 PolarHBondContact N-O 2.87Å; L227-V291 PolarHBondContact O-N 2.92Å; V229-V291 HydrophobicContact CB-CG2 4.22Å; V229-V291 HydrophobicContact CG2-CB 4.05Å; V229-V291 HydrophobicContact CG2-CG2 3.71Å; V265-V291 HydrophobicContact CG2-CG1 4.25Å; Y281-V291 HydrophobicContact CD1-CG1 4.12Å; Y281-V291 HydrophobicContact CD1-CG2 4.4Å; Y281-V291 HydrophobicContact CD2-CG1 4.23Å; Y281-V291 HydrophobicContact CE1-CG1 3.79Å; Y281-V291 HydrophobicContact CE2-CG1 3.91Å; Y281-V291 HydrophobicContact CG-CG1 4.33Å; Y281-V291 HydrophobicContact CG-CG2 4.47Å; V291-I293 HydrophobicContact CG1-CG1 4.22Å; V291-F306 HydrophobicContact CG1-CE1 4.46Å
292	D	89.2	Confident	82.1	Confident	93 Å²	93	67.4 Å²	67.4	50%	0.497	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.5	171.1	-72.2	-53.9	0	0	0	111	S226 Y281	S226-D292 WeakPolarHBondContact CB-OD1 3.41Å; S226-D292 PolarHBondContact OG-OD1 3.02Å; Y281-D292 PolarHBondContact OH-O 2.85Å
293	I	90.9	Very high	82.5	Confident	8 Å²	8	64.3 Å²	64.3	4%	0.041	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	109.1	175.4	-55.7	176.7	0	0	0	107.4	S224 I225 L227 V265 V267 V291 L296 L304 F306	S224-I293 CarbonylContact C-O 3.14Å; S224-I293 WeakPolarHBondContact CA-O 3.3Å; S224-I293 WeakPolarHBondContact CB-O 3.43Å; I225-I293 PolarHBondContact N-O 2.85Å; I225-I293 PolarHBondContact O-N 2.7Å; L227-I293 HydrophobicContact CD1-CD1 3.84Å; L227-I293 HydrophobicContact CD1-CG1 4.3Å; V265-I293 HydrophobicContact CG1-CD1 3.84Å; V267-I293 HydrophobicContact CG2-CD1 4.36Å; V267-I293 HydrophobicContact CG2-CG2 3.95Å; V291-I293 HydrophobicContact CG1-CG1 4.22Å; I293-L296 HydrophobicContact CG2-CD1 4.34Å; I293-L296 HydrophobicContact CG2-CD2 4.02Å; I293-L296 HydrophobicContact CG2-CG 4.37Å; I293-L304 HydrophobicContact CD1-CD1 3.98Å; I293-L304 HydrophobicContact CD1-CD2 4.04Å; I293-F306 HydrophobicContact CD1-CZ 4.32Å
294	S	89.1	Confident	83.3	Confident	67 Å²	67	63.2 Å²	63.2	47%	0.469	33%	0.333	S	S	.	.			trans	-106.1	179.7	-176.8	58.4	0	0	0	0	112.9	H223 L296	H223-S294 CarbonylContact O-C 3.59Å; S294-L296 PolarHBondContact O-N 2.85Å
295	H	87	Confident	84.6	Confident	178 Å²	178	61.4 Å²	61.4	82%	0.824	32%	0.32	S	S	*	.	S	Bend	trans	59.9	27	177.3	-49.5	-73.7	0	0	0	115	H223	H223-H295 PolarHBondContact O-N 3.13Å
296	L	90	Very high	86.1	Confident	11 Å²	11	58.1 Å²	58.1	6%	0.058	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-74.5	160.2	170.4	-54.9	-179.1	0	0	0	110.6	H223 I225 V267 I293 S294 Y302 T324	H223-L296 WeakPolarHBondContact CA-O 3.23Å; H223-L296 PolarHBondContact CD2-O 2.82Å; H223-L296 VanDerWaalsContact CD2-O 3.29Å; H223-L296 PolarHBondContact O-N 3.21Å; I225-L296 HydrophobicContact CB-CD1 4.31Å; I225-L296 HydrophobicContact CD1-CD1 3.61Å; I225-L296 HydrophobicContact CG1-CD1 3.69Å; V267-L296 HydrophobicContact CG1-CD2 4.06Å; I293-L296 HydrophobicContact CG2-CD1 4.34Å; I293-L296 HydrophobicContact CG2-CD2 4.02Å; I293-L296 HydrophobicContact CG2-CG 4.37Å; S294-L296 PolarHBondContact O-N 2.85Å; L296-Y302 HydrophobicContact CB-CE2 3.86Å; L296-Y302 HydrophobicContact CD1-CD2 4.4Å; L296-Y302 HydrophobicContact CD1-CE2 4.37Å; L296-Y302 HydrophobicContact CD2-CD1 4.27Å; L296-Y302 HydrophobicContact CD2-CE1 3.83Å; L296-Y302 HydrophobicContact CD2-CE2 4.15Å; L296-Y302 HydrophobicContact CG-CE2 4.35Å; L296-T324 HydrophobicContact CB-CG2 3.83Å; L296-T324 HydrophobicContact CD1-CG2 3.94Å
297	K	86.8	Confident	87.5	Confident	145 Å²	145	55.3 Å²	55.3	63%	0.63	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-84.6	146.3	173.1	-70.8	-168	173	-162.4	0	110.9	S222 T300 Y302 T324	S222-K297 CarbonylContact O-C 3.56Å; S222-K297 VanDerWaalsContact O-C 3.26Å; K297-T300 HydrophobicContact CB-CG2 4.48Å; K297-T300 WeakPolarHBondContact CB-OG1 3.44Å; K297-T300 WeakPolarHBondContact O-CB 3.16Å; K297-Y302 PolarHBondContact N-OH 2.81Å; K297-T324 WeakPolarHBondContact O-CB 3.38Å; K297-T324 PolarHBondContact O-OG1 2.88Å
298	P	87.9	Confident	88.6	Confident	15 Å²	15	51.5 Å²	51.5	10%	0.097	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	155.2	168.6	-25.8	35.8	0	0	0	113.3	S222 H223 T300 V355	S222-P298 WeakPolarHBondContact O-CA 3.34Å; H223-P298 VanDerWaalsContact CE1-CG 3.46Å; H223-P298 WeakPolarHBondContact CE1-CG 3.48Å; H223-P298 WeakPolarHBondContact NE2-CG 3.29Å; P298-T300 PolarHBondContact O-N 3.22Å; P298-T300 PolarHBondContact O-OG1 2.91Å; P298-V355 HydrophobicContact CB-CB 4.13Å; P298-V355 HydrophobicContact CB-CG1 4.36Å; P298-V355 HydrophobicContact CG-CB 4.48Å; P298-V355 HydrophobicContact CG-CG1 4.29Å
299	Y	88.5	Confident	89.4	Confident	126 Å²	126	52.1 Å²	52.1	49%	0.494	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	33.5	173	-163.3	-119.3	0	0	0	114.4	T324 T325 E326	Y299-T324 PolarHBondContact N-OG1 3.16Å; Y299-T325 PolarHBondContact N-O 3.05Å; Y299-E326 HydrophobicContact CD2-CG 3.54Å; Y299-E326 HydrophobicContact CE2-CG 4.04Å; Y299-E326 HydrophobicContact CG-CG 4.24Å
300	T	88.1	Confident	89.6	Confident	33 Å²	33	50.5 Å²	50.5	20%	0.202	24%	0.24	C	C	.	.			trans	-121.7	134.9	-171.1	-62.5	0	0	0	0	110.4	T269 K297 P298 Y302 S323 T324	T269-T300 HydrophobicContact CG2-CG2 3.74Å; K297-T300 HydrophobicContact CB-CG2 4.48Å; K297-T300 WeakPolarHBondContact CB-OG1 3.44Å; K297-T300 WeakPolarHBondContact O-CB 3.16Å; P298-T300 PolarHBondContact O-N 3.22Å; P298-T300 PolarHBondContact O-OG1 2.91Å; T300-Y302 HydrophobicContact CG2-CD2 4.1Å; T300-Y302 HydrophobicContact CG2-CE2 3.5Å; T300-Y302 WeakPolarHBondContact O-CD2 3.43Å; T300-S323 WeakPolarHBondContact O-CA 3.18Å; T300-T324 PolarHBondContact N-OG1 2.86Å; T300-T324 PolarHBondContact O-N 2.87Å; T300-T324 PolarHBondContact O-OG1 2.81Å
301	R	91.1	Very high	89.4	Confident	144 Å²	144	47.4 Å²	47.4	54%	0.543	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	124.1	-179.4	-171.9	172.1	-171.7	172.5	3.7	111.3	T270 V321 S323	T270-R301 HydrophobicContact CG2-CG 4.22Å; T270-R301 PolarHBondContact N-O 2.8Å; T270-R301 WeakPolarHBondContact OG1-CB 3.44Å; T270-R301 WeakPolarHBondContact OG1-CG 3.33Å; T270-R301 PolarHBondContact OG1-O 2.93Å; R301-V321 HydrophobicContact CG-CG1 3.99Å; R301-V321 VanDerWaalsContact NE-CG1 3.29Å; R301-S323 WeakPolarHBondContact CG-OG 3.38Å
302	Y	91.9	Very high	89.3	Confident	12 Å²	12	52.3 Å²	52.3	5%	0.047	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	148.1	-176.9	-71.1	-88.9	0	0	0	111.5	V267 A268 T269 L296 K297 T300 V321 V322 T324	V267-Y302 HydrophobicContact CG1-CD1 3.66Å; V267-Y302 HydrophobicContact CG1-CE1 4.04Å; A268-Y302 CarbonylContact O-C 3.35Å; A268-Y302 VanDerWaalsContact O-CA 3.24Å; A268-Y302 WeakPolarHBondContact O-CA 3.4Å; T269-Y302 HydrophobicContact CG2-CD1 3.84Å; T269-Y302 HydrophobicContact CG2-CE1 3.39Å; L296-Y302 HydrophobicContact CB-CE2 3.86Å; L296-Y302 HydrophobicContact CD1-CD2 4.4Å; L296-Y302 HydrophobicContact CD1-CE2 4.37Å; L296-Y302 HydrophobicContact CD2-CD1 4.27Å; L296-Y302 HydrophobicContact CD2-CE1 3.83Å; L296-Y302 HydrophobicContact CD2-CE2 4.15Å; L296-Y302 HydrophobicContact CG-CE2 4.35Å; K297-Y302 PolarHBondContact N-OH 2.81Å; T300-Y302 HydrophobicContact CG2-CD2 4.1Å; T300-Y302 HydrophobicContact CG2-CE2 3.5Å; T300-Y302 WeakPolarHBondContact O-CD2 3.43Å; Y302-V321 WeakPolarHBondContact O-CA 3.4Å; Y302-V322 PolarHBondContact N-O 3.04Å; Y302-V322 PolarHBondContact O-N 2.96Å; Y302-V322 VanDerWaalsContact O-O 3.1Å; Y302-T324 HydrophobicContact CD2-CG2 4.35Å; Y302-T324 HydrophobicContact CE2-CG2 4.15Å
303	N	93.1	Very high	89.2	Confident	45 Å²	45	51 Å²	51	24%	0.241	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.9	160.8	-175	23.7	0	0	0	107.7	A268 T270 V321	A268-N303 PolarHBondContact N-O 3.1Å; A268-N303 PolarHBondContact O-N 2.85Å; T270-N303 HydrophobicContact CG2-CB 4.08Å; N303-V321 HydrophobicContact CB-CG2 4.2Å
304	L	93.5	Very high	89.1	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.8	-179.7	-52.7	178.4	0	0	0	107.9	I225 L227 T266 V267 I293 F306 S319 L320 V322	I225-L304 HydrophobicContact CD1-CD1 4.39Å; I225-L304 HydrophobicContact CG2-CD1 4.38Å; L227-L304 HydrophobicContact CD1-CD1 4.17Å; L227-L304 HydrophobicContact CD2-CD1 4.34Å; T266-L304 WeakPolarHBondContact O-CA 2.98Å; V267-L304 HydrophobicContact CB-CD2 4.23Å; V267-L304 HydrophobicContact CG1-CD2 3.84Å; V267-L304 HydrophobicContact CG2-CD2 3.94Å; I293-L304 HydrophobicContact CD1-CD1 3.98Å; I293-L304 HydrophobicContact CD1-CD2 4.04Å; L304-F306 HydrophobicContact CB-CE2 3.58Å; L304-F306 HydrophobicContact CB-CZ 3.98Å; L304-F306 HydrophobicContact CD1-CZ 4.43Å; L304-S319 CarbonylContact O-C 3.41Å; L304-S319 WeakPolarHBondContact O-CA 3.29Å; L304-L320 PolarHBondContact N-O 3.39Å; L304-L320 PolarHBondContact O-N 3.35Å; L304-V322 HydrophobicContact CD1-CG1 3.51Å; L304-V322 HydrophobicContact CG-CG1 3.92Å
305	S	93.1	Very high	89	Confident	13 Å²	13	49.9 Å²	49.9	9%	0.091	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	134.7	179.1	-48	0	0	0	0	112.4	V265 T266 T318 S319	V265-S305 CarbonylContact C-O 3.58Å; V265-S305 WeakPolarHBondContact CA-O 3.44Å; T266-S305 PolarHBondContact N-O 2.8Å; T266-S305 PolarHBondContact O-N 3.26Å; T266-S305 WeakPolarHBondContact OG1-CB 3.41Å; S305-T318 CarbonylContact C-O 3.58Å; S305-T318 VanDerWaalsContact CA-O 3.28Å; S305-T318 WeakPolarHBondContact CA-O 3.13Å; S305-S319 WeakPolarHBondContact CB-OG 3.44Å; S305-S319 PolarHBondContact OG-OG 2.79Å
306	F	92.4	Very high	89.1	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127.8	-170.2	-57.7	-101.4	0	0	0	110.5	P213 V215 L227 V229 I264 V265 V291 I293 L304 F317 T318	P213-F306 HydrophobicContact CB-CB 4.32Å; P213-F306 HydrophobicContact CG-CB 4.35Å; V215-F306 HydrophobicContact CG1-CD2 4.07Å; V215-F306 HydrophobicContact CG1-CE1 4.48Å; V215-F306 HydrophobicContact CG1-CE2 3.85Å; V215-F306 HydrophobicContact CG1-CG 4.5Å; V215-F306 HydrophobicContact CG1-CZ 4.09Å; V215-F306 HydrophobicContact CG2-CB 3.92Å; V215-F306 HydrophobicContact CG2-CD1 4.33Å; V215-F306 HydrophobicContact CG2-CD2 3.76Å; V215-F306 HydrophobicContact CG2-CE2 4.39Å; V215-F306 HydrophobicContact CG2-CG 3.74Å; L227-F306 HydrophobicContact CD1-CZ 4.02Å; L227-F306 HydrophobicContact CD2-CE2 4.44Å; L227-F306 HydrophobicContact CD2-CZ 3.98Å; V229-F306 HydrophobicContact CG1-CD1 4.24Å; V229-F306 HydrophobicContact CG2-CD1 3.82Å; V229-F306 HydrophobicContact CG2-CE1 3.86Å; I264-F306 CarbonylContact O-C 3.55Å; I264-F306 WeakPolarHBondContact O-CA 3.49Å; V265-F306 HydrophobicContact CB-CD1 4.43Å; V265-F306 HydrophobicContact CB-CE1 4.43Å; V265-F306 HydrophobicContact CG1-CD1 4.13Å; V265-F306 HydrophobicContact CG1-CE1 3.73Å; V265-F306 HydrophobicContact CG1-CZ 4.13Å; V265-F306 HydrophobicContact CG2-CD1 3.69Å; V265-F306 HydrophobicContact CG2-CE1 3.86Å; V291-F306 HydrophobicContact CG1-CE1 4.46Å; I293-F306 HydrophobicContact CD1-CZ 4.32Å; L304-F306 HydrophobicContact CB-CE2 3.58Å; L304-F306 HydrophobicContact CB-CZ 3.98Å; L304-F306 HydrophobicContact CD1-CZ 4.43Å; F306-F317 CarbonylContact O-C 3.52Å; F306-F317 WeakPolarHBondContact O-CA 3.36Å; F306-T318 PolarHBondContact N-O 3.14Å; F306-T318 PolarHBondContact O-N 3.43Å
307	A	91.4	Very high	89.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	142.9	174.3	0	0	0	0	0	111.3	Y263 I264 G315 F317	Y263-A307 CarbonylContact C-O 3.55Å; Y263-A307 WeakPolarHBondContact CA-O 3.45Å; I264-A307 PolarHBondContact N-O 3.36Å; I264-A307 PolarHBondContact O-N 2.95Å; A307-G315 WeakPolarHBondContact CB-O 3.48Å; A307-F317 HydrophobicContact CB-CD1 3.61Å; A307-F317 HydrophobicContact CB-CD2 4.22Å; A307-F317 HydrophobicContact CB-CE1 3.63Å; A307-F317 HydrophobicContact CB-CE2 4.24Å; A307-F317 HydrophobicContact CB-CG 3.92Å; A307-F317 HydrophobicContact CB-CZ 3.96Å
308	F	88.8	Confident	89.2	Confident	1 Å²	1	41.5 Å²	41.5	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	148.3	169.9	-68.6	-68.4	0	0	0	111	A211 H212 P213 I231 L256 L260 Y263 S314 G315	A211-F308 HydrophobicContact CB-CD2 3.84Å; A211-F308 HydrophobicContact CB-CE2 3.78Å; A211-F308 WeakPolarHBondContact O-CD2 3.4Å; H212-F308 VanDerWaalsContact C-CE2 3.46Å; H212-F308 WeakPolarHBondContact O-CE2 3.21Å; P213-F308 HydrophobicContact CB-CE2 4.13Å; P213-F308 HydrophobicContact CB-CZ 4.1Å; P213-F308 HydrophobicContact CG-CD1 4.34Å; P213-F308 HydrophobicContact CG-CD2 3.74Å; P213-F308 HydrophobicContact CG-CE1 4.44Å; P213-F308 HydrophobicContact CG-CE2 3.84Å; P213-F308 HydrophobicContact CG-CG 4Å; P213-F308 HydrophobicContact CG-CZ 4.17Å; I231-F308 HydrophobicContact CD1-CZ 4.39Å; I231-F308 HydrophobicContact CG1-CE1 3.92Å; I231-F308 HydrophobicContact CG1-CE2 4.39Å; I231-F308 HydrophobicContact CG1-CZ 3.46Å; I231-F308 VanDerWaalsContact CG1-CZ 3.46Å; L256-F308 HydrophobicContact CD2-CB 3.63Å; L256-F308 HydrophobicContact CD2-CD1 4.22Å; L256-F308 HydrophobicContact CD2-CD2 3.68Å; L256-F308 HydrophobicContact CD2-CE2 4.36Å; L256-F308 HydrophobicContact CD2-CG 3.6Å; L260-F308 HydrophobicContact CD1-CD1 3.64Å; L260-F308 HydrophobicContact CD1-CE1 4.27Å; Y263-F308 AromaticContact CD1-CD1 3.95Å; Y263-F308 HydrophobicContact CD1-CD1 3.95Å; Y263-F308 HydrophobicContact CD1-CE1 4.06Å; Y263-F308 AromaticContact CE1-CD1 3.68Å; Y263-F308 HydrophobicContact CE1-CD1 3.68Å; Y263-F308 AromaticContact CE1-CE1 3.37Å; Y263-F308 HydrophobicContact CE1-CE1 3.37Å; Y263-F308 HydrophobicContact CE1-CZ 4.38Å; F308-S314 CarbonylContact O-C 3.23Å; F308-S314 WeakPolarHBondContact O-CA 3.12Å; F308-G315 PolarHBondContact O-N 3.2Å
309	Y	88.7	Confident	89.3	Confident	62 Å²	62	44.2 Å²	44.2	24%	0.243	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	129.4	174.2	178.3	-116.4	0	0	0	110.3	V261 G262 I264 L280 G311 F313	V261-Y309 HydrophobicContact CB-CD1 4.09Å; V261-Y309 WeakPolarHBondContact CB-O 3.46Å; V261-Y309 HydrophobicContact CG1-CD1 3.98Å; V261-Y309 HydrophobicContact CG1-CE1 4.11Å; V261-Y309 PolarHBondContact N-O 2.73Å; G262-Y309 PolarHBondContact N-O 2.83Å; G262-Y309 VanDerWaalsContact N-O 3.15Å; G262-Y309 PolarHBondContact O-N 2.93Å; I264-Y309 HydrophobicContact CD1-CD2 3.95Å; I264-Y309 HydrophobicContact CD1-CG 4.14Å; L280-Y309 HydrophobicContact CD1-CD1 3.75Å; L280-Y309 HydrophobicContact CD1-CG 4.12Å; L280-Y309 HydrophobicContact CD2-CD1 3.9Å; L280-Y309 HydrophobicContact CD2-CE1 3.95Å; Y309-G311 PolarHBondContact OH-O 2.85Å; Y309-G311 VanDerWaalsContact OH-O 3.11Å; Y309-F313 VanDerWaalsContact CD2-O 3.29Å; Y309-F313 WeakPolarHBondContact CD2-O 3.44Å
310	N	85.6	Confident	89.4	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.011	21%	0.21	C	C	.	.			trans	-108.9	20.1	-175.6	76.5	1.5	0	0	0	114.8	G207 P209 L256 P259 R312 F313	G207-N310 PolarHBondContact O-ND2 3.32Å; P209-N310 HydrophobicContact CG-CB 4.07Å; L256-N310 PolarHBondContact O-ND2 2.86Å; P259-N310 WeakPolarHBondContact O-CA 3.38Å; P259-N310 VanDerWaalsContact O-CB 3.28Å; P259-N310 WeakPolarHBondContact O-CB 3.46Å; N310-R312 PolarHBondContact O-N 2.79Å; N310-R312 PolarHBondContact OD1-N 2.81Å; N310-F313 PolarHBondContact N-O 2.98Å; N310-F313 VanDerWaalsContact N-O 3.1Å; N310-F313 PolarHBondContact OD1-N 3.15Å; N310-F313 PolarHBondContact OD1-O 2.81Å
311	G	83.2	Confident	89.6	Confident	41 Å²	41	42 Å²	42	42%	0.423	22%	0.221	S	C	.	.	S	Bend	trans	83.3	-17.5	-178	0	0	0	0	0	114.7	Y309	Y309-G311 PolarHBondContact OH-O 2.85Å; Y309-G311 VanDerWaalsContact OH-O 3.11Å
312	R	84.9	Confident	89.5	Confident	103 Å²	103	35.8 Å²	35.8	39%	0.389	20%	0.199	S	C	.	.	S	Bend	trans	-121.5	-39.2	174.5	-169	175	172.1	-143.3	-3.5	113.1	E127 P206 N310	E127-R312 IonicContact OE2-CZ 3.14Å; E127-R312 IonicContact OE2-NH1 3.53Å; E127-R312 PolarHBondContact OE2-NH1 3Å; E127-R312 IonicContact OE2-NH2 3.65Å; E127-R312 PolarHBondContact OE2-NH2 2.91Å; P206-R312 HydrophobicContact CB-CB 4.38Å; P206-R312 WeakPolarHBondContact O-CD 3.47Å; P206-R312 PolarHBondContact O-NH1 2.8Å; N310-R312 PolarHBondContact O-N 2.79Å; N310-R312 PolarHBondContact OD1-N 2.81Å
313	F	88.1	Confident	89.5	Confident	66 Å²	66	38.1 Å²	38.1	29%	0.289	22%	0.217	S	C	.	.			trans	-135.7	155.9	-176.2	-60.9	-75.9	0	0	0	112.1	P206 G207 L208 Y309 N310	P206-F313 WeakPolarHBondContact O-CE2 3.31Å; G207-F313 VanDerWaalsContact C-CD2 3.41Å; G207-F313 VanDerWaalsContact O-CD2 3.3Å; G207-F313 WeakPolarHBondContact O-CD2 2.88Å; L208-F313 HydrophobicContact CD1-CB 4.02Å; Y309-F313 VanDerWaalsContact CD2-O 3.29Å; Y309-F313 WeakPolarHBondContact CD2-O 3.44Å; N310-F313 PolarHBondContact N-O 2.98Å; N310-F313 VanDerWaalsContact N-O 3.1Å; N310-F313 PolarHBondContact OD1-N 3.15Å; N310-F313 PolarHBondContact OD1-O 2.81Å
314	S	88.1	Confident	89.4	Confident	45 Å²	45	36.3 Å²	36.3	32%	0.315	21%	0.208	S	C	.	.	B	Isolated β-bridge	trans	-99.2	133.6	170.1	58.9	0	0	0	0	110.6	L208 F308	L208-S314 VanDerWaalsContact CD1-O 3.23Å; L208-S314 WeakPolarHBondContact CD1-O 3.43Å; F308-S314 CarbonylContact O-C 3.23Å; F308-S314 WeakPolarHBondContact O-CA 3.12Å
315	G	86	Confident	89.3	Confident	5 Å²	5	39.6 Å²	39.6	5%	0.052	23%	0.228	C	C	.	.			trans	-71.7	-175.3	173.7	0	0	0	0	0	114.1	P209 A307 F308	P209-G315 WeakPolarHBondContact O-CA 3.16Å; A307-G315 WeakPolarHBondContact CB-O 3.48Å; F308-G315 PolarHBondContact O-N 3.2Å
316	P	89.1	Confident	89.1	Confident	42 Å²	42	41 Å²	41	27%	0.273	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-65.6	151.7	174.4	30.8	-37.7	0	0	0	111.8	P209 A211	P209-P316 VanDerWaalsContact O-CD 3.25Å; P209-P316 WeakPolarHBondContact O-CD 3.4Å; A211-P316 WeakPolarHBondContact O-CD 3.09Å
317	F	90.1	Very high	88.7	Confident	81 Å²	81	41.3 Å²	41.3	36%	0.355	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-90.1	129.3	-178.2	-76.3	-86.5	0	0	0	112.3	I264 T266 F306 A307	I264-F317 HydrophobicContact CG2-CE1 4.05Å; I264-F317 HydrophobicContact CG2-CZ 4.12Å; T266-F317 HydrophobicContact CG2-CE1 4.23Å; F306-F317 CarbonylContact O-C 3.52Å; F306-F317 WeakPolarHBondContact O-CA 3.36Å; A307-F317 HydrophobicContact CB-CD1 3.61Å; A307-F317 HydrophobicContact CB-CD2 4.22Å; A307-F317 HydrophobicContact CB-CE1 3.63Å; A307-F317 HydrophobicContact CB-CE2 4.24Å; A307-F317 HydrophobicContact CB-CG 3.92Å; A307-F317 HydrophobicContact CB-CZ 3.96Å
318	T	90	Very high	88.4	Confident	35 Å²	35	46.2 Å²	46.2	22%	0.215	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	125.4	159.6	-60.1	0	0	0	0	108.5	P213 V215 S305 F306	P213-T318 WeakPolarHBondContact O-CB 3.49Å; P213-T318 PolarHBondContact O-OG1 2.84Å; V215-T318 HydrophobicContact CG2-CG2 4.1Å; S305-T318 CarbonylContact C-O 3.58Å; S305-T318 VanDerWaalsContact CA-O 3.28Å; S305-T318 WeakPolarHBondContact CA-O 3.13Å; F306-T318 PolarHBondContact N-O 3.14Å; F306-T318 PolarHBondContact O-N 3.43Å
319	S	89.3	Confident	88.3	Confident	72 Å²	72	46.4 Å²	46.4	50%	0.503	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	143.4	-179.5	-61.6	0	0	0	0	112.7	L304 S305	L304-S319 CarbonylContact O-C 3.41Å; L304-S319 WeakPolarHBondContact O-CA 3.29Å; S305-S319 WeakPolarHBondContact CB-OG 3.44Å; S305-S319 PolarHBondContact OG-OG 2.79Å
320	L	90.9	Very high	88	Confident	42 Å²	42	45.5 Å²	45.5	22%	0.22	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	123.8	-172.6	174.7	64.1	0	0	0	110.2	V215 I217 L227 L304	V215-L320 HydrophobicContact CG1-CD2 3.85Å; I217-L320 HydrophobicContact CD1-CD1 4.26Å; I217-L320 HydrophobicContact CD1-CD2 4.1Å; I217-L320 HydrophobicContact CD1-CG 4.49Å; I217-L320 HydrophobicContact CG1-CD2 3.81Å; L227-L320 HydrophobicContact CD2-CD2 3.38Å; L304-L320 PolarHBondContact N-O 3.39Å; L304-L320 PolarHBondContact O-N 3.35Å
321	V	91.4	Very high	88.1	Confident	71 Å²	71	51.2 Å²	51.2	43%	0.43	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	124.7	-180	178.2	0	0	0	0	110.6	T270 R301 Y302 N303	T270-V321 HydrophobicContact CG2-CG1 4.38Å; R301-V321 HydrophobicContact CG-CG1 3.99Å; R301-V321 VanDerWaalsContact NE-CG1 3.29Å; Y302-V321 WeakPolarHBondContact O-CA 3.4Å; N303-V321 HydrophobicContact CB-CG2 4.2Å
322	V	91	Very high	88.3	Confident	13 Å²	13	49.3 Å²	49.3	8%	0.079	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	152.6	-170.8	54	0	0	0	0	110.1	I217 V220 I225 Y302 L304	I217-V322 HydrophobicContact CD1-CB 4.34Å; I217-V322 HydrophobicContact CD1-CG2 4.1Å; V220-V322 HydrophobicContact CG2-CG2 3.94Å; I225-V322 HydrophobicContact CD1-CB 4.31Å; I225-V322 HydrophobicContact CD1-CG1 3.54Å; I225-V322 HydrophobicContact CD1-CG2 3.82Å; Y302-V322 PolarHBondContact N-O 3.04Å; Y302-V322 PolarHBondContact O-N 2.96Å; Y302-V322 VanDerWaalsContact O-O 3.1Å; L304-V322 HydrophobicContact CD1-CG1 3.51Å; L304-V322 HydrophobicContact CG-CG1 3.92Å
323	S	91.3	Very high	88.5	Confident	62 Å²	62	52.3 Å²	52.3	43%	0.434	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	134.3	-178.4	-47.7	0	0	0	0	110.6	V220 T300 R301	V220-S323 VanDerWaalsContact CG1-O 3.31Å; V220-S323 WeakPolarHBondContact CG1-O 3.43Å; T300-S323 WeakPolarHBondContact O-CA 3.18Å; R301-S323 WeakPolarHBondContact CG-OG 3.38Å
324	T	91.4	Very high	88.6	Confident	6 Å²	6	50.9 Å²	50.9	4%	0.037	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-68.3	154.3	173.4	50	0	0	0	0	111.4	S221 I225 L296 K297 Y299 T300 Y302	S221-T324 WeakPolarHBondContact O-CA 3.15Å; S221-T324 WeakPolarHBondContact O-CB 3.43Å; I225-T324 HydrophobicContact CD1-CG2 4.43Å; L296-T324 HydrophobicContact CB-CG2 3.83Å; L296-T324 HydrophobicContact CD1-CG2 3.94Å; K297-T324 WeakPolarHBondContact O-CB 3.38Å; K297-T324 PolarHBondContact O-OG1 2.88Å; Y299-T324 PolarHBondContact N-OG1 3.16Å; T300-T324 PolarHBondContact N-OG1 2.86Å; T300-T324 PolarHBondContact O-N 2.87Å; T300-T324 PolarHBondContact O-OG1 2.81Å; Y302-T324 HydrophobicContact CD2-CG2 4.35Å; Y302-T324 HydrophobicContact CE2-CG2 4.15Å
325	T	90.1	Very high	88.5	Confident	70 Å²	70	54.2 Å²	54.2	43%	0.429	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-75.1	165.8	177.8	53.8	0	0	0	0	112.3	V220 S221 S222 Y299	V220-T325 HydrophobicContact CG1-CG2 4.49Å; S221-T325 PolarHBondContact O-N 2.88Å; S221-T325 PolarHBondContact O-OG1 2.85Å; S222-T325 WeakPolarHBondContact CA-O 3.42Å; S222-T325 WeakPolarHBondContact CB-O 3.38Å; S222-T325 PolarHBondContact N-OG1 2.76Å; Y299-T325 PolarHBondContact N-O 3.05Å
326	E	88.7	Confident	88.6	Confident	42 Å²	42	58.5 Å²	58.5	20%	0.196	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-63.3	145.2	176.2	-67	-179.4	-110.2	0	0	111.7	Y299 V355 G356 K357 K411	Y299-E326 HydrophobicContact CD2-CG 3.54Å; Y299-E326 HydrophobicContact CE2-CG 4.04Å; Y299-E326 HydrophobicContact CG-CG 4.24Å; E326-V355 WeakPolarHBondContact CA-O 3.46Å; E326-G356 WeakPolarHBondContact OE2-CA 3.43Å; E326-K357 PolarHBondContact OE2-N 3.45Å; E326-K411 WeakPolarHBondContact OE1-CB 3.06Å; E326-K411 PolarHBondContact OE2-N 3.14Å
327	G	85	Confident	88.5	Confident	6 Å²	6	61.5 Å²	61.5	6%	0.062	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-100.3	164.7	172.1	0	0	0	0	0	112.3	V355 T410	G327-V355 PolarHBondContact N-O 3.18Å; G327-T410 PolarHBondContact O-OG1 2.97Å
328	I	85.2	Confident	88.4	Confident	103 Å²	103	64.5 Å²	64.5	53%	0.528	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-67	133.1	172.1	-63.6	172.6	0	0	0	108.5	A412 F414	I328-A412 HydrophobicContact CG1-CB 4.1Å; I328-F414 WeakPolarHBondContact CG2-O 3.48Å
329	P	85.6	Confident	88.2	Confident	6 Å²	6	64 Å²	64	4%	0.039	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-74.9	155.6	-173	29.9	-34.7	0	0	0	113.8	V355 I358 S408 T410 G413 G415	P329-V355 HydrophobicContact CB-CG2 4.47Å; P329-I358 HydrophobicContact CB-CD1 3.8Å; P329-I358 HydrophobicContact CG-CD1 4.4Å; P329-S408 WeakPolarHBondContact CB-OG 3.28Å; P329-S408 WeakPolarHBondContact CG-O 3.33Å; P329-S408 WeakPolarHBondContact CG-OG 3.46Å; P329-T410 HydrophobicContact CB-CG2 3.96Å; P329-T410 HydrophobicContact CG-CG2 4.01Å; P329-G413 WeakPolarHBondContact CD-O 3.25Å; P329-G415 VanDerWaalsContact O-CA 3.27Å; P329-G415 WeakPolarHBondContact O-CA 3.49Å
330	G	83	Confident	88	Confident	43 Å²	43	62.3 Å²	62.3	44%	0.443	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-70.3	159.5	169.7	0	0	0	0	0	112.7	S408	G330-S408 PolarHBondContact O-OG 2.89Å
331	K	87.3	Confident	87.7	Confident	122 Å²	122	62.2 Å²	62.2	53%	0.53	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-57.8	132.7	178.3	68.8	-176.7	-175.1	174.9	0	111	N351 H416 S418	K331-N351 PolarHBondContact O-ND2 3.46Å; K331-H416 WeakPolarHBondContact CA-O 3.3Å; K331-H416 HydrophobicContact CB-CB 4.46Å; K331-H416 WeakPolarHBondContact CB-O 3.19Å; K331-S418 WeakPolarHBondContact CB-OG 3.41Å; K331-S418 WeakPolarHBondContact CD-OG 3.37Å; K331-S418 WeakPolarHBondContact CG-OG 3.42Å
332	P	88.4	Confident	87.5	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.006	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-68.3	151.9	175.3	29.2	-33.5	0	0	0	110.1	D349 Y361 V406 S418	P332-D349 WeakPolarHBondContact CA-O 3.39Å; P332-D349 WeakPolarHBondContact CB-O 3.3Å; P332-Y361 HydrophobicContact CB-CD1 4.45Å; P332-Y361 HydrophobicContact CB-CE1 4.1Å; P332-V406 WeakPolarHBondContact CD-O 3.23Å; P332-V406 HydrophobicContact CG-CB 4.12Å; P332-V406 HydrophobicContact CG-CG1 3.81Å; P332-V406 VanDerWaalsContact CG-O 3.28Å; P332-V406 WeakPolarHBondContact CG-O 3.35Å; P332-S418 WeakPolarHBondContact O-CB 3.39Å; P332-S418 PolarHBondContact O-OG 3.21Å
333	R	88.3	Confident	87.5	Confident	166 Å²	166	63.7 Å²	63.7	63%	0.626	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.1	-178	161.2	-175.3	-171.6	177.7	3.5	109.5	W348 D349	R333-W348 CarbonylContact O-C 3.57Å; R333-W348 WeakPolarHBondContact O-CA 3.5Å; R333-W348 VanDerWaalsContact O-CB 3.25Å; R333-W348 WeakPolarHBondContact O-CB 3.15Å; R333-D349 VanDerWaalsContact CB-OD1 3.29Å; R333-D349 WeakPolarHBondContact CB-OD1 3.48Å; R333-D349 PolarHBondContact N-O 3.3Å; R333-D349 PolarHBondContact O-N 2.68Å
334	I	89.5	Confident	87.5	Confident	35 Å²	35	60.7 Å²	60.7	18%	0.179	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	132.8	173.1	-59.5	165	0	0	0	107.9	I346 D347 I420	I334-I346 HydrophobicContact CD1-CD1 3.97Å; I334-I346 HydrophobicContact CG1-CD1 4.06Å; I334-I346 HydrophobicContact CG2-CD1 4Å; I334-I346 HydrophobicContact CG2-CG1 3.88Å; I334-D347 CarbonylContact C-O 3.49Å; I334-D347 WeakPolarHBondContact CA-O 3.33Å; I334-I420 HydrophobicContact CD1-CB 3.95Å; I334-I420 HydrophobicContact CD1-CG2 3.9Å; I334-I420 HydrophobicContact CG2-CD1 4.47Å
335	K	87.8	Confident	87.5	Confident	116 Å²	116	61.7 Å²	61.7	50%	0.504	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-65.3	-178.7	-86.5	178.4	162.9	153.5	0	111.4	D347 D349	K335-D347 HydrophobicContact CB-CB 4.02Å; K335-D347 PolarHBondContact N-O 3.03Å; K335-D349 HydrophobicContact CD-CB 4.45Å; K335-D349 WeakPolarHBondContact CE-OD2 3.33Å; K335-D349 IonicContact NZ-OD2 2.71Å; K335-D349 PolarHBondContact NZ-OD2 3.07Å; K335-D349 VanDerWaalsContact NZ-OD2 3.14Å
336	N	86.4	Confident	87.7	Confident	95 Å²	95	58.4 Å²	58.4	51%	0.508	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	164.3	-179	-54.2	-38.9	0	0	0	109.3	D347	N336-D347 HydrophobicContact CB-CB 4.21Å; N336-D347 WeakPolarHBondContact CB-OD2 3.33Å; N336-D347 PolarHBondContact ND2-OD2 3.05Å; N336-D347 PolarHBondContact O-N 2.71Å
337	F	88.2	Confident	87.8	Confident	105 Å²	105	58.2 Å²	58.2	46%	0.461	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	148.1	163	64.7	-81.7	0	0	0	108.2	S345 I420 V422	F337-S345 VanDerWaalsContact CA-O 3.25Å; F337-S345 WeakPolarHBondContact CA-O 3.36Å; F337-I420 HydrophobicContact CB-CD1 4.33Å; F337-I420 HydrophobicContact CD1-CD1 3.28Å; F337-I420 HydrophobicContact CE1-CD1 3.62Å; F337-I420 HydrophobicContact CG-CD1 3.82Å; F337-I420 HydrophobicContact CZ-CD1 4.39Å; F337-V422 HydrophobicContact CB-CG2 4.41Å; F337-V422 HydrophobicContact CD2-CB 4.34Å; F337-V422 HydrophobicContact CD2-CG1 3.59Å; F337-V422 HydrophobicContact CD2-CG2 3.7Å; F337-V422 HydrophobicContact CE2-CG1 3.87Å; F337-V422 HydrophobicContact CE2-CG2 4.2Å; F337-V422 HydrophobicContact CG-CG2 4.13Å
338	E	86.8	Confident	88.2	Confident	143 Å²	143	58 Å²	58	67%	0.668	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.5	173.2	-63.9	-167.1	158.1	0	0	109.8	L344 S345	E338-L344 CarbonylContact O-C 3.54Å; E338-L344 WeakPolarHBondContact O-CA 3.24Å; E338-S345 PolarHBondContact N-O 3.26Å; E338-S345 PolarHBondContact O-N 3.22Å
339	S	87.2	Confident	88.4	Confident	25 Å²	25	55 Å²	55	18%	0.175	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	141.1	171.7	67.7	0	0	0	0	112.1	R423 K425	S339-R423 VanDerWaalsContact CB-O 3.26Å; S339-R423 WeakPolarHBondContact CB-O 3.26Å; S339-R423 PolarHBondContact OG-O 3.03Å; S339-R423 VanDerWaalsContact OG-O 3.07Å; S339-K425 VanDerWaalsContact O-CD 3.32Å; S339-K425 WeakPolarHBondContact O-CD 3.45Å; S339-K425 WeakPolarHBondContact O-CE 3.13Å; S339-K425 PolarHBondContact O-NZ 3.09Å
340	S	85.1	Confident	88.1	Confident	36 Å²	36	57.1 Å²	57.1	25%	0.252	30%	0.298	S	S	.	.			trans	-108	-169.4	163.6	79.2	0	0	0	0	109.2	N342 S343 T424 K425	S340-N342 VanDerWaalsContact C-N 3.29Å; S340-N342 PolarHBondContact OG-N 3.32Å; S340-N342 PolarHBondContact OG-OD1 3.26Å; S340-S343 PolarHBondContact N-O 2.93Å; S340-S343 PolarHBondContact OG-N 2.65Å; S340-S343 PolarHBondContact OG-O 3.33Å; S340-S343 PolarHBondContact OG-OG 2.87Å; S340-T424 CarbonylContact O-C 3.52Å; S340-T424 WeakPolarHBondContact O-CA 3.24Å; S340-T424 WeakPolarHBondContact O-CB 3.33Å; S340-K425 PolarHBondContact O-N 2.93Å
341	S	83.5	Confident	87.4	Confident	41 Å²	41	58.6 Å²	58.6	29%	0.287	30%	0.296	S	S	.	.	S	Bend	trans	-69.7	-22.4	169.2	50.6	0	0	0	0	113.4	H398	S341-H398 WeakPolarHBondContact O-CA 3.39Å; S341-H398 PolarHBondContact O-N 2.77Å
342	N	88.5	Confident	86	Confident	85 Å²	85	57.3 Å²	57.3	46%	0.455	31%	0.308	S	S	.	.	S	Bend	trans	-137.6	9.7	-173.3	69.9	8.9	0	0	0	115.2	S340 N395 L396	S340-N342 VanDerWaalsContact C-N 3.29Å; S340-N342 PolarHBondContact OG-N 3.32Å; S340-N342 PolarHBondContact OG-OD1 3.26Å; N342-N395 PolarHBondContact O-N 2.83Å; N342-N395 VanDerWaalsContact O-N 3.1Å; N342-L396 WeakPolarHBondContact CA-O 3.22Å; N342-L396 PolarHBondContact O-N 3.05Å
343	S	90.2	Very high	84.8	Confident	29 Å²	29	63.6 Å²	63.6	20%	0.203	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	156.6	-178.4	68.1	0	0	0	0	113.4	S340 F393	S340-S343 PolarHBondContact N-O 2.93Å; S340-S343 PolarHBondContact OG-N 2.65Å; S340-S343 PolarHBondContact OG-O 3.33Å; S340-S343 PolarHBondContact OG-OG 2.87Å; S343-F393 CarbonylContact C-O 3.6Å; S343-F393 WeakPolarHBondContact CA-O 3.45Å; S343-F393 WeakPolarHBondContact CB-O 3.36Å
344	L	91.5	Very high	83.4	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	126.7	174.3	-62.4	176.9	0	0	0	110	E338 L365 V392 F393 L396 Y402 I404 V422 T424	E338-L344 CarbonylContact O-C 3.54Å; E338-L344 WeakPolarHBondContact O-CA 3.24Å; L344-L365 HydrophobicContact CD1-CD1 4.44Å; L344-V392 WeakPolarHBondContact O-CA 3.29Å; L344-F393 PolarHBondContact N-O 2.77Å; L344-F393 PolarHBondContact O-N 3.44Å; L344-L396 HydrophobicContact CB-CD1 4.14Å; L344-L396 HydrophobicContact CD1-CD1 3.84Å; L344-L396 HydrophobicContact CG-CD1 3.65Å; L344-Y402 HydrophobicContact CD1-CD2 3.95Å; L344-Y402 HydrophobicContact CD1-CG 4.27Å; L344-I404 HydrophobicContact CB-CD1 4.02Å; L344-I404 HydrophobicContact CD1-CD1 4.16Å; L344-I404 HydrophobicContact CD1-CG1 4.45Å; L344-V422 HydrophobicContact CD1-CB 4.22Å; L344-V422 HydrophobicContact CD2-CB 4.05Å; L344-V422 HydrophobicContact CD2-CG1 3.55Å; L344-T424 HydrophobicContact CD2-CG2 4.22Å; L344-T424 HydrophobicContact CG-CG2 4.4Å
345	S	91	Very high	82.8	Confident	27 Å²	27	59.4 Å²	59.4	19%	0.189	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	147.4	169.8	-164.8	0	0	0	0	110.5	F337 E338 F391	F337-S345 VanDerWaalsContact CA-O 3.25Å; F337-S345 WeakPolarHBondContact CA-O 3.36Å; E338-S345 PolarHBondContact N-O 3.26Å; E338-S345 PolarHBondContact O-N 3.22Å; S345-F391 WeakPolarHBondContact CA-O 3.12Å
346	I	93.6	Very high	82.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	134.4	175.1	-168.8	169.7	0	0	0	111.3	I334 W348 L363 Q390 F391 I404 V406 I420	I334-I346 HydrophobicContact CD1-CD1 3.97Å; I334-I346 HydrophobicContact CG1-CD1 4.06Å; I334-I346 HydrophobicContact CG2-CD1 4Å; I334-I346 HydrophobicContact CG2-CG1 3.88Å; I346-W348 HydrophobicContact CG2-CE3 4.3Å; I346-W348 HydrophobicContact CG2-CZ3 4.07Å; I346-W348 WeakPolarHBondContact O-CZ3 3.38Å; I346-L363 HydrophobicContact CG2-CD2 4.05Å; I346-Q390 CarbonylContact O-C 3.55Å; I346-Q390 VanDerWaalsContact O-CA 3.29Å; I346-Q390 WeakPolarHBondContact O-CA 3.49Å; I346-F391 HydrophobicContact CG2-CB 4.46Å; I346-F391 PolarHBondContact N-O 3.38Å; I346-F391 PolarHBondContact O-N 3.17Å; I346-I404 HydrophobicContact CB-CD1 4.23Å; I346-I404 HydrophobicContact CD1-CB 3.99Å; I346-I404 HydrophobicContact CD1-CD1 4.33Å; I346-I404 HydrophobicContact CD1-CG2 3.6Å; I346-I404 HydrophobicContact CG2-CG2 4.11Å; I346-V406 HydrophobicContact CD1-CG2 3.96Å; I346-I420 HydrophobicContact CD1-CG2 3.84Å
347	D	92.7	Very high	82.4	Confident	39 Å²	39	56.5 Å²	56.5	21%	0.209	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	147	175.3	-58.9	-19.3	0	0	0	110.2	I334 K335 N336 L389 Q390	I334-D347 CarbonylContact C-O 3.49Å; I334-D347 WeakPolarHBondContact CA-O 3.33Å; K335-D347 HydrophobicContact CB-CB 4.02Å; K335-D347 PolarHBondContact N-O 3.03Å; N336-D347 HydrophobicContact CB-CB 4.21Å; N336-D347 WeakPolarHBondContact CB-OD2 3.33Å; N336-D347 PolarHBondContact ND2-OD2 3.05Å; N336-D347 PolarHBondContact O-N 2.71Å; D347-L389 CarbonylContact C-O 3.51Å; D347-L389 WeakPolarHBondContact CA-O 3.49Å; D347-Q390 WeakPolarHBondContact OD1-CB 3.28Å
348	W	92.7	Very high	82.3	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.008	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	170.6	175.1	64.3	93.2	0	0	0	113.7	R333 I346 Y361 L363 V384 E388 L389 Q390 F391 V406	R333-W348 CarbonylContact O-C 3.57Å; R333-W348 WeakPolarHBondContact O-CA 3.5Å; R333-W348 VanDerWaalsContact O-CB 3.25Å; R333-W348 WeakPolarHBondContact O-CB 3.15Å; I346-W348 HydrophobicContact CG2-CE3 4.3Å; I346-W348 HydrophobicContact CG2-CZ3 4.07Å; I346-W348 WeakPolarHBondContact O-CZ3 3.38Å; W348-Y361 AromaticContact CD1-CD1 3.95Å; W348-Y361 AromaticContact CD1-CE1 3.78Å; W348-Y361 HydrophobicContact CZ2-CD2 4.21Å; W348-Y361 HydrophobicContact CZ2-CG 4.19Å; W348-Y361 AromaticContact NE1-CD1 3.37Å; W348-Y361 AromaticContact NE1-CD2 3.44Å; W348-Y361 AromaticContact NE1-CE1 3.51Å; W348-Y361 AromaticContact NE1-CE2 3.58Å; W348-Y361 AromaticContact NE1-CG 3.34Å; W348-Y361 VanDerWaalsContact NE1-CG 3.34Å; W348-Y361 AromaticContact NE1-CZ 3.62Å; W348-L363 HydrophobicContact CH2-CD1 3.85Å; W348-L363 HydrophobicContact CH2-CD2 3.84Å; W348-L363 HydrophobicContact CH2-CG 4.32Å; W348-L363 HydrophobicContact CZ2-CD1 4.15Å; W348-L363 HydrophobicContact CZ3-CD2 3.75Å; W348-V384 HydrophobicContact CH2-CG2 4.38Å; W348-V384 HydrophobicContact CZ2-CG2 3.99Å; W348-E388 WeakPolarHBondContact CZ2-O 3.36Å; W348-L389 PolarHBondContact N-O 3.15Å; W348-Q390 VanDerWaalsContact CZ3-C 3.5Å; W348-F391 HydrophobicContact CH2-CB 3.89Å; W348-F391 HydrophobicContact CZ3-CB 3.86Å; W348-V406 HydrophobicContact CD2-CG1 3.91Å; W348-V406 HydrophobicContact CE3-CG1 4.4Å; W348-V406 HydrophobicContact CE3-CG2 4.41Å; W348-V406 HydrophobicContact CG-CG1 4.08Å
349	D	88.7	Confident	82.4	Confident	40 Å²	40	50.5 Å²	50.5	21%	0.214	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	160.6	163	55.9	13	0	0	0	113.6	P332 R333 K335	P332-D349 WeakPolarHBondContact CA-O 3.39Å; P332-D349 WeakPolarHBondContact CB-O 3.3Å; R333-D349 VanDerWaalsContact CB-OD1 3.29Å; R333-D349 WeakPolarHBondContact CB-OD1 3.48Å; R333-D349 PolarHBondContact N-O 3.3Å; R333-D349 PolarHBondContact O-N 2.68Å; K335-D349 HydrophobicContact CD-CB 4.45Å; K335-D349 WeakPolarHBondContact CE-OD2 3.33Å; K335-D349 IonicContact NZ-OD2 2.71Å; K335-D349 PolarHBondContact NZ-OD2 3.07Å; K335-D349 VanDerWaalsContact NZ-OD2 3.14Å
350	S	79.9	Confident	82.6	Confident	49 Å²	49	50.4 Å²	50.4	34%	0.343	31%	0.307	S	S	.	.			trans	-65.4	133.5	167.9	-167.8	0	0	0	0	109.4	Y361	S350-Y361 WeakPolarHBondContact CB-OH 3.24Å
351	N	69.2	Low	82.9	Confident	74 Å²	74	48.9 Å²	48.9	40%	0.396	30%	0.296	S	S	.	.			trans	-61.2	139.8	161.2	-122.2	-39.9	0	0	0	108.9	K331 D353	K331-N351 PolarHBondContact O-ND2 3.46Å; N351-D353 PolarHBondContact O-N 3.36Å
352	A	56.8	Low	83.4	Confident	95 Å²	95	49 Å²	49	79%	0.785	29%	0.292	S	S	*	.	S	Bend	trans	-85.3	-5.5	-164.5	0	0	0	0	0	114.5	A354	A352-A354 PolarHBondContact O-N 2.89Å; A352-A354 VanDerWaalsContact O-N 3.14Å
353	D	62.9	Low	83.6	Confident	133 Å²	133	45 Å²	45	71%	0.711	27%	0.27	S	S	*	.			trans	-71.7	103.9	176.2	-71	-57	0	0	0	111	N351 V355	N351-D353 PolarHBondContact O-N 3.36Å; D353-V355 PolarHBondContact O-N 3.04Å
354	A	59	Low	83.8	Confident	76 Å²	76	44.3 Å²	44.3	63%	0.628	26%	0.263	S	S	*	.			trans	-74.2	61.6	-171.8	0	0	0	0	0	114.3	A352 G356	A352-A354 PolarHBondContact O-N 2.89Å; A352-A354 VanDerWaalsContact O-N 3.14Å; A354-G356 PolarHBondContact O-N 3.01Å
355	V	78.2	Confident	83.8	Confident	38 Å²	38	44.4 Å²	44.4	23%	0.23	26%	0.264	C	S	.	.	S	Bend	trans	-71.3	-6.7	173.7	-65.7	0	0	0	0	114	P298 E326 G327 P329 D353	P298-V355 HydrophobicContact CB-CB 4.13Å; P298-V355 HydrophobicContact CB-CG1 4.36Å; P298-V355 HydrophobicContact CG-CB 4.48Å; P298-V355 HydrophobicContact CG-CG1 4.29Å; E326-V355 WeakPolarHBondContact CA-O 3.46Å; G327-V355 PolarHBondContact N-O 3.18Å; P329-V355 HydrophobicContact CB-CG2 4.47Å; D353-V355 PolarHBondContact O-N 3.04Å
356	G	81.2	Confident	83.8	Confident	12 Å²	12	43.8 Å²	43.8	12%	0.124	26%	0.258	C	S	.	.	S	Bend	trans	175.5	-172.7	174.5	0	0	0	0	0	111.1	E326 A354	E326-G356 WeakPolarHBondContact OE2-CA 3.43Å; A354-G356 PolarHBondContact O-N 3.01Å
357	K	84.8	Confident	83.4	Confident	137 Å²	137	45.7 Å²	45.7	60%	0.596	27%	0.27	S	S	*	.			trans	-91.7	122.1	173.8	-175.3	179	178.2	-177.4	0	109.4	E326 L359 T410	E326-K357 PolarHBondContact OE2-N 3.45Å; K357-L359 HydrophobicContact CG-CD2 4.44Å; K357-L359 PolarHBondContact O-N 2.74Å; K357-T410 WeakPolarHBondContact O-CA 3.45Å
358	I	85.9	Confident	82.9	Confident	35 Å²	35	44.9 Å²	44.9	18%	0.179	27%	0.267	C	S	.	.			trans	-66.6	129.2	174.7	-53.2	-54.9	0	0	0	109.7	P329 Y361 S386 A409 T410	P329-I358 HydrophobicContact CB-CD1 3.8Å; P329-I358 HydrophobicContact CG-CD1 4.4Å; I358-Y361 HydrophobicContact CG2-CE1 4.36Å; I358-Y361 HydrophobicContact CG2-CE2 4.39Å; I358-S386 WeakPolarHBondContact O-CB 3.43Å; I358-A409 CarbonylContact C-O 3.58Å; I358-A409 VanDerWaalsContact CA-O 3.29Å; I358-A409 WeakPolarHBondContact CA-O 3.5Å; I358-T410 HydrophobicContact CD1-CG2 3.97Å
359	L	88.1	Confident	81.7	Confident	88 Å²	88	47.4 Å²	47.4	46%	0.461	29%	0.285	S	S	.	.			trans	-108.4	-34.9	-176.9	-56.9	-179	0	0	0	112.5	K357 S386 A409	K357-L359 HydrophobicContact CG-CD2 4.44Å; K357-L359 PolarHBondContact O-N 2.74Å; L359-S386 PolarHBondContact O-N 3.1Å; L359-A409 PolarHBondContact N-O 2.82Å
360	A	90.5	Very high	80.2	Confident	22 Å²	22	53.9 Å²	53.9	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	164.3	-177.3	0	0	0	0	0	111.7	V384 S408 A409	A360-V384 WeakPolarHBondContact CA-O 3.37Å; A360-V384 WeakPolarHBondContact CB-O 3.12Å; A360-S408 CarbonylContact O-C 3.56Å; A360-A409 PolarHBondContact O-N 3.22Å
361	Y	92.4	Very high	78.9	Confident	5 Å²	5	58 Å²	58	2%	0.02	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	152.3	163	-61.6	-81.8	0	0	0	110.8	P332 W348 S350 I358 Q383 V384 E388 L389 A407	P332-Y361 HydrophobicContact CB-CD1 4.45Å; P332-Y361 HydrophobicContact CB-CE1 4.1Å; W348-Y361 AromaticContact CD1-CD1 3.95Å; W348-Y361 AromaticContact CD1-CE1 3.78Å; W348-Y361 HydrophobicContact CZ2-CD2 4.21Å; W348-Y361 HydrophobicContact CZ2-CG 4.19Å; W348-Y361 AromaticContact NE1-CD1 3.37Å; W348-Y361 AromaticContact NE1-CD2 3.44Å; W348-Y361 AromaticContact NE1-CE1 3.51Å; W348-Y361 AromaticContact NE1-CE2 3.58Å; W348-Y361 AromaticContact NE1-CG 3.34Å; W348-Y361 VanDerWaalsContact NE1-CG 3.34Å; W348-Y361 AromaticContact NE1-CZ 3.62Å; S350-Y361 WeakPolarHBondContact CB-OH 3.24Å; I358-Y361 HydrophobicContact CG2-CE1 4.36Å; I358-Y361 HydrophobicContact CG2-CE2 4.39Å; Y361-Q383 VanDerWaalsContact O-CA 3.27Å; Y361-Q383 WeakPolarHBondContact O-CA 3.08Å; Y361-V384 HydrophobicContact CD2-CG2 4.49Å; Y361-V384 PolarHBondContact N-O 3.39Å; Y361-V384 PolarHBondContact O-N 3.48Å; Y361-E388 WeakPolarHBondContact CD2-O 3.35Å; Y361-L389 HydrophobicContact CE2-CD2 3.6Å; Y361-A407 CarbonylContact C-O 3.5Å; Y361-A407 VanDerWaalsContact CA-O 3.23Å; Y361-A407 WeakPolarHBondContact CA-O 3.32Å
362	K	93.4	Very high	78	Confident	44 Å²	44	62.4 Å²	62.4	19%	0.191	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	126.4	172.6	-178.9	-174	170.2	-157.7	0	109.4	E364 T381 V382 Q383 V406 A407 F414 F417	K362-E364 WeakPolarHBondContact CE-OE1 3.45Å; K362-E364 IonicContact NZ-OE1 2.77Å; K362-E364 PolarHBondContact NZ-OE1 3.11Å; K362-T381 VanDerWaalsContact CE-CG2 3.48Å; K362-T381 HydrophobicContact CG-CG2 4.35Å; K362-V382 CarbonylContact C-O 3.57Å; K362-V382 WeakPolarHBondContact CA-O 3.35Å; K362-Q383 HydrophobicContact CB-CG 3.98Å; K362-Q383 HydrophobicContact CG-CG 3.97Å; K362-V406 CarbonylContact O-C 3.6Å; K362-V406 WeakPolarHBondContact O-CA 3.38Å; K362-A407 PolarHBondContact N-O 3.28Å; K362-A407 PolarHBondContact O-N 2.89Å; K362-F414 HydrophobicContact CB-CD1 3.89Å; K362-F414 HydrophobicContact CB-CE1 3.63Å; K362-F417 HydrophobicContact CD-CE1 4.39Å; K362-F417 HydrophobicContact CD-CZ 3.93Å; K362-F417 HydrophobicContact CG-CE1 4.38Å; K362-F417 HydrophobicContact CG-CZ 4.4Å
363	L	93.9	Very high	77.8	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	147.6	176	-63.5	91.6	0	0	0	111.5	I346 W348 T381 V382 V384 F391 F393 R405 V406	I346-L363 HydrophobicContact CG2-CD2 4.05Å; W348-L363 HydrophobicContact CH2-CD1 3.85Å; W348-L363 HydrophobicContact CH2-CD2 3.84Å; W348-L363 HydrophobicContact CH2-CG 4.32Å; W348-L363 HydrophobicContact CZ2-CD1 4.15Å; W348-L363 HydrophobicContact CZ3-CD2 3.75Å; L363-T381 CarbonylContact O-C 3.55Å; L363-T381 WeakPolarHBondContact O-CA 3.12Å; L363-V382 PolarHBondContact N-O 2.94Å; L363-V382 PolarHBondContact O-N 3.03Å; L363-V384 HydrophobicContact CD1-CG1 4.29Å; L363-V384 HydrophobicContact CD1-CG2 3.92Å; L363-F391 HydrophobicContact CD2-CB 3.64Å; L363-F391 HydrophobicContact CD2-CD1 4.12Å; L363-F391 HydrophobicContact CD2-CG 4.02Å; L363-F393 HydrophobicContact CB-CZ 4.11Å; L363-F393 HydrophobicContact CD2-CE2 4.24Å; L363-F393 HydrophobicContact CD2-CZ 4.39Å; L363-R405 CarbonylContact C-O 3.57Å; L363-R405 VanDerWaalsContact CA-O 3.22Å; L363-R405 WeakPolarHBondContact CA-O 3.36Å; L363-V406 HydrophobicContact CD2-CG2 4.07Å; L363-V406 HydrophobicContact CG-CG1 4.28Å; L363-V406 HydrophobicContact CG-CG2 4.15Å
364	E	93.7	Very high	77.1	Confident	14 Å²	14	65.6 Å²	65.6	7%	0.065	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142.4	168.1	-56.7	-167.4	162.5	0	0	111.4	K362 H366 R378 K380 T381 R405 F417	K362-E364 WeakPolarHBondContact CE-OE1 3.45Å; K362-E364 IonicContact NZ-OE1 2.77Å; K362-E364 PolarHBondContact NZ-OE1 3.11Å; E364-H366 WeakPolarHBondContact CB-NE2 3.48Å; E364-H366 IonicContact OE2-CE1 3.01Å; E364-H366 PolarHBondContact OE2-CE1 3.11Å; E364-H366 IonicContact OE2-NE2 2.68Å; E364-H366 PolarHBondContact OE2-NE2 3.36Å; E364-R378 HydrophobicContact CB-CG 4.45Å; E364-R378 IonicContact OE1-CZ 3.19Å; E364-R378 IonicContact OE1-NH1 3.86Å; E364-R378 PolarHBondContact OE1-NH1 3.36Å; E364-R378 WeakPolarHBondContact OE2-CD 3.41Å; E364-R378 IonicContact OE2-NH1 2.76Å; E364-K380 VanDerWaalsContact CA-O 3.32Å; E364-K380 WeakPolarHBondContact CA-O 2.98Å; E364-T381 HydrophobicContact CG-CG2 4.07Å; E364-R405 HydrophobicContact CB-CB 4.39Å; E364-R405 PolarHBondContact N-O 3.21Å; E364-R405 PolarHBondContact O-N 3.43Å; E364-F417 HydrophobicContact CG-CE1 4.16Å; E364-F417 HydrophobicContact CG-CZ 4.27Å
365	L	92.4	Very high	76.9	Confident	3 Å²	3	67.2 Å²	67.2	2%	0.016	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.1	171.9	-176.9	75.7	0	0	0	109.2	L344 R378 L379 K380 F393 L396 Y402 I404	L344-L365 HydrophobicContact CD1-CD1 4.44Å; L365-R378 CarbonylContact O-C 3.53Å; L365-R378 WeakPolarHBondContact O-CA 3.34Å; L365-L379 HydrophobicContact CD2-CB 4.3Å; L365-L379 HydrophobicContact CD2-CD1 4.08Å; L365-L379 HydrophobicContact CG-CD1 4.4Å; L365-L379 PolarHBondContact O-N 3.34Å; L365-K380 HydrophobicContact CB-CB 4.3Å; L365-K380 PolarHBondContact N-O 3.47Å; L365-K380 PolarHBondContact O-N 3.37Å; L365-F393 HydrophobicContact CB-CD1 3.81Å; L365-F393 HydrophobicContact CB-CE1 3.64Å; L365-F393 HydrophobicContact CB-CG 4.36Å; L365-F393 HydrophobicContact CB-CZ 4.05Å; L365-F393 HydrophobicContact CD1-CD2 4.39Å; L365-F393 HydrophobicContact CD1-CG 4.28Å; L365-F393 HydrophobicContact CD2-CB 4.14Å; L365-F393 HydrophobicContact CD2-CD1 3.85Å; L365-F393 HydrophobicContact CD2-CG 4.09Å; L365-F393 HydrophobicContact CG-CD1 4.28Å; L365-F393 HydrophobicContact CG-CG 4.48Å; L365-L396 HydrophobicContact CD2-CD1 4.48Å; L365-L396 HydrophobicContact CD2-CD2 3.67Å; L365-Y402 HydrophobicContact CD1-CG 4.48Å; L365-I404 HydrophobicContact CD1-CG1 3.79Å
366	H	90.5	Very high	76.2	Confident	13 Å²	13	67.2 Å²	67.2	6%	0.06	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	161.5	179	-56.8	-116.1	0	0	0	111.1	E364 S376 K377 R378 Y402 I403	E364-H366 WeakPolarHBondContact CB-NE2 3.48Å; E364-H366 IonicContact OE2-CE1 3.01Å; E364-H366 PolarHBondContact OE2-CE1 3.11Å; E364-H366 IonicContact OE2-NE2 2.68Å; E364-H366 PolarHBondContact OE2-NE2 3.36Å; H366-S376 VanDerWaalsContact CB-OG 3.22Å; H366-S376 WeakPolarHBondContact CB-OG 3.46Å; H366-K377 VanDerWaalsContact CA-O 3.28Å; H366-K377 WeakPolarHBondContact CA-O 3.34Å; H366-R378 VanDerWaalsContact CE1-CB 3.48Å; H366-R378 WeakPolarHBondContact CE1-CB 3.35Å; H366-R378 WeakPolarHBondContact ND1-CA 3.42Å; H366-R378 WeakPolarHBondContact ND1-CB 3.49Å; H366-R378 PolarHBondContact ND1-N 3.13Å; H366-Y402 CarbonylContact O-C 3.44Å; H366-Y402 VanDerWaalsContact O-CA 3.28Å; H366-Y402 WeakPolarHBondContact O-CA 3.45Å; H366-Y402 WeakPolarHBondContact O-CB 3.5Å; H366-I403 PolarHBondContact N-O 3.48Å; H366-I403 PolarHBondContact O-N 2.81Å
367	T	85.6	Confident	75.9	Confident	41 Å²	41	73.6 Å²	73.6	25%	0.252	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	140.9	173	56.5	0	0	0	0	112.2	S369 S376 K377 L379	T367-S369 PolarHBondContact O-N 2.83Å; T367-S376 WeakPolarHBondContact O-CB 3.28Å; T367-S376 PolarHBondContact O-OG 2.87Å; T367-K377 PolarHBondContact N-O 2.85Å; T367-K377 VanDerWaalsContact N-O 3.14Å; T367-K377 PolarHBondContact OG1-N 2.84Å; T367-L379 HydrophobicContact CG2-CD1 3.82Å; T367-L379 HydrophobicContact CG2-CD2 3.89Å; T367-L379 HydrophobicContact CG2-CG 4Å
368	C	81.6	Confident	75.8	Confident	21 Å²	21	73.7 Å²	73.7	14%	0.142	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-61.6	138.4	163.6	-54	0	0	0	0	109.7	C401 Y402 E421	C368-C401 HydrophobicContact CB-CB 3.56Å; C368-C401 WeakPolarHBondContact CB-SG 3.44Å; C368-C401 PolarHBondContact N-O 3.08Å; C368-C401 WeakPolarHBondContact SG-CB 3.36Å; C368-C401 PolarHBondContact SG-O 2.86Å; C368-C401 VanDerWaalsContact SG-O 3.35Å; C368-C401 CovalentContact SG-SG 2.04Å; C368-C401 PolarHBondContact SG-SG 2.81Å; C368-Y402 PolarHBondContact SG-N 2.81Å; C368-E421 VanDerWaalsContact SG-CG 3.55Å
369	S	67.1	Low	75.6	Confident	55 Å²	55	75.9 Å²	75.9	39%	0.385	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-82.4	128.3	176.8	-161.5	0	0	0	0	110.5	T367 N371 Q374	T367-S369 PolarHBondContact O-N 2.83Å; S369-N371 PolarHBondContact OG-O 2.97Å; S369-Q374 WeakPolarHBondContact CB-O 3.34Å; S369-Q374 PolarHBondContact OG-O 2.95Å
370	K	56.6	Low	75.6	Confident	176 Å²	176	76.6 Å²	76.6	77%	0.765	40%	0.397	S	S	*	.	S	Bend	trans	-87.1	-4.9	179.1	-80.6	-175.7	176.7	174	0	113.9
371	N	54.2	Low	75.6	Confident	137 Å²	137	78.3 Å²	78.3	73%	0.733	41%	0.405	S	S	*	.	S	Bend	trans	-162.4	141.7	167.1	-95.5	-39.1	0	0	0	109.2	S369 T373 Q374	S369-N371 PolarHBondContact OG-O 2.97Å; N371-T373 PolarHBondContact O-N 2.91Å; N371-Q374 PolarHBondContact O-N 2.89Å
372	D	49.4	Very low	75.6	Confident	165 Å²	165	79.6 Å²	79.6	88%	0.882	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	33.2	-154.3	-151.6	17.3	0	0	0	116.5
373	T	52.4	Low	75.5	Confident	135 Å²	135	83.2 Å²	83.2	83%	0.828	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.5	-12.4	-178	48.2	0	0	0	0	114.3	N371	N371-T373 PolarHBondContact O-N 2.91Å
374	Q	49.2	Very low	75.4	Confident	161 Å²	161	83.8 Å²	83.8	75%	0.752	44%	0.435	S	S	*	.	S	Bend	trans	-97.7	118.4	167.4	-70	-169.2	-3.7	0	0	109.7	S369 N371 S376	S369-Q374 WeakPolarHBondContact CB-O 3.34Å; S369-Q374 PolarHBondContact OG-O 2.95Å; N371-Q374 PolarHBondContact O-N 2.89Å; Q374-S376 PolarHBondContact O-N 3.46Å
375	S	53	Low	75.2	Confident	110 Å²	110	85.9 Å²	85.9	77%	0.769	45%	0.446	S	S	*	.			trans	-56.8	133	178.3	53.9	0	0	0	0	111.1	K377	S375-K377 PolarHBondContact O-N 3.15Å
376	S	64.2	Low	74.9	Confident	38 Å²	38	87.7 Å²	87.7	27%	0.266	46%	0.459	S	S	.	.			trans	-48.1	111.7	174.2	-174.5	0	0	0	0	110.3	H366 T367 Q374 R378	H366-S376 VanDerWaalsContact CB-OG 3.22Å; H366-S376 WeakPolarHBondContact CB-OG 3.46Å; T367-S376 WeakPolarHBondContact O-CB 3.28Å; T367-S376 PolarHBondContact O-OG 2.87Å; Q374-S376 PolarHBondContact O-N 3.46Å; S376-R378 PolarHBondContact O-N 3.24Å
377	K	74.7	Confident	74.7	Confident	146 Å²	146	95 Å²	95	64%	0.635	49%	0.49	S	S	*	.			trans	-83.1	115.8	-167.8	-177.1	-179.1	178.1	-176.6	0	109	H366 T367 S375 L379	H366-K377 VanDerWaalsContact CA-O 3.28Å; H366-K377 WeakPolarHBondContact CA-O 3.34Å; T367-K377 PolarHBondContact N-O 2.85Å; T367-K377 VanDerWaalsContact N-O 3.14Å; T367-K377 PolarHBondContact OG1-N 2.84Å; S375-K377 PolarHBondContact O-N 3.15Å; K377-L379 PolarHBondContact O-N 3.46Å; K377-L379 VanDerWaalsContact O-N 3.14Å
378	R	82.9	Confident	74.8	Confident	139 Å²	139	97.4 Å²	97.4	53%	0.525	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	114.5	172.9	-165	172.9	68	-175.2	-4.5	110.3	E364 L365 H366 S376 T381	E364-R378 HydrophobicContact CB-CG 4.45Å; E364-R378 IonicContact OE1-CZ 3.19Å; E364-R378 IonicContact OE1-NH1 3.86Å; E364-R378 PolarHBondContact OE1-NH1 3.36Å; E364-R378 WeakPolarHBondContact OE2-CD 3.41Å; E364-R378 IonicContact OE2-NH1 2.76Å; L365-R378 CarbonylContact O-C 3.53Å; L365-R378 WeakPolarHBondContact O-CA 3.34Å; H366-R378 VanDerWaalsContact CE1-CB 3.48Å; H366-R378 WeakPolarHBondContact CE1-CB 3.35Å; H366-R378 WeakPolarHBondContact ND1-CA 3.42Å; H366-R378 WeakPolarHBondContact ND1-CB 3.49Å; H366-R378 PolarHBondContact ND1-N 3.13Å; S376-R378 PolarHBondContact O-N 3.24Å; R378-T381 VanDerWaalsContact CD-OG1 3.32Å; R378-T381 WeakPolarHBondContact CD-OG1 3.39Å; R378-T381 PolarHBondContact NE-OG1 3.01Å
379	L	82.4	Confident	75.3	Confident	80 Å²	80	99.8 Å²	99.8	42%	0.419	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-40.1	179.8	-61	-179.7	0	0	0	111.9	L365 T367 K377 Y402	L365-L379 HydrophobicContact CD2-CB 4.3Å; L365-L379 HydrophobicContact CD2-CD1 4.08Å; L365-L379 HydrophobicContact CG-CD1 4.4Å; L365-L379 PolarHBondContact O-N 3.34Å; T367-L379 HydrophobicContact CG2-CD1 3.82Å; T367-L379 HydrophobicContact CG2-CD2 3.89Å; T367-L379 HydrophobicContact CG2-CG 4Å; K377-L379 PolarHBondContact O-N 3.46Å; K377-L379 VanDerWaalsContact O-N 3.14Å; L379-Y402 HydrophobicContact CD1-CD1 3.61Å; L379-Y402 HydrophobicContact CD1-CE1 3.55Å
380	K	86.7	Confident	76.4	Confident	104 Å²	104	103.8 Å²	103.8	45%	0.452	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	150.9	-174.5	-157.3	173.2	-173.6	178.7	0	111.3	E364 L365 V382 F393	E364-K380 VanDerWaalsContact CA-O 3.32Å; E364-K380 WeakPolarHBondContact CA-O 2.98Å; L365-K380 HydrophobicContact CB-CB 4.3Å; L365-K380 PolarHBondContact N-O 3.47Å; L365-K380 PolarHBondContact O-N 3.37Å; K380-V382 HydrophobicContact CD-CG2 4.42Å; K380-V382 HydrophobicContact CG-CG2 4.28Å; K380-F393 HydrophobicContact CB-CD1 4.43Å; K380-F393 HydrophobicContact CB-CE1 4.15Å; K380-F393 HydrophobicContact CD-CD1 3.98Å; K380-F393 HydrophobicContact CD-CE1 4.09Å; K380-F393 HydrophobicContact CG-CE1 4.39Å
381	T	91.3	Very high	78.2	Confident	58 Å²	58	97.3 Å²	97.3	36%	0.356	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	139.5	169.7	-61.5	0	0	0	0	108.4	K362 L363 E364 R378	K362-T381 VanDerWaalsContact CE-CG2 3.48Å; K362-T381 HydrophobicContact CG-CG2 4.35Å; L363-T381 CarbonylContact O-C 3.55Å; L363-T381 WeakPolarHBondContact O-CA 3.12Å; E364-T381 HydrophobicContact CG-CG2 4.07Å; R378-T381 VanDerWaalsContact CD-OG1 3.32Å; R378-T381 WeakPolarHBondContact CD-OG1 3.39Å; R378-T381 PolarHBondContact NE-OG1 3.01Å
382	V	91.7	Very high	80	Confident	31 Å²	31	94.7 Å²	94.7	19%	0.188	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	148.9	180	-171.6	0	0	0	0	108.7	K362 L363 K380 V384 F391 F393	K362-V382 CarbonylContact C-O 3.57Å; K362-V382 WeakPolarHBondContact CA-O 3.35Å; L363-V382 PolarHBondContact N-O 2.94Å; L363-V382 PolarHBondContact O-N 3.03Å; K380-V382 HydrophobicContact CD-CG2 4.42Å; K380-V382 HydrophobicContact CG-CG2 4.28Å; V382-V384 HydrophobicContact CG1-CG1 4.01Å; V382-F391 HydrophobicContact CB-CZ 4.27Å; V382-F391 HydrophobicContact CG1-CE2 3.87Å; V382-F391 HydrophobicContact CG1-CZ 3.97Å; V382-F391 HydrophobicContact CG2-CE1 4.03Å; V382-F391 HydrophobicContact CG2-CE2 4.48Å; V382-F391 HydrophobicContact CG2-CZ 3.75Å; V382-F393 HydrophobicContact CG2-CE1 4.5Å
383	Q	92.2	Very high	82.1	Confident	121 Å²	121	86.9 Å²	86.9	57%	0.565	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123	142	166	-77.3	174.2	-39.9	0	0	108.8	Y361 K362	Y361-Q383 VanDerWaalsContact O-CA 3.27Å; Y361-Q383 WeakPolarHBondContact O-CA 3.08Å; K362-Q383 HydrophobicContact CB-CG 3.98Å; K362-Q383 HydrophobicContact CG-CG 3.97Å
384	V	91	Very high	83.7	Confident	12 Å²	12	82.1 Å²	82.1	7%	0.073	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	156.7	-175.7	-58.6	0	0	0	0	110.8	W348 A360 Y361 L363 V382 E388 F391	W348-V384 HydrophobicContact CH2-CG2 4.38Å; W348-V384 HydrophobicContact CZ2-CG2 3.99Å; A360-V384 WeakPolarHBondContact CA-O 3.37Å; A360-V384 WeakPolarHBondContact CB-O 3.12Å; Y361-V384 HydrophobicContact CD2-CG2 4.49Å; Y361-V384 PolarHBondContact N-O 3.39Å; Y361-V384 PolarHBondContact O-N 3.48Å; L363-V384 HydrophobicContact CD1-CG1 4.29Å; L363-V384 HydrophobicContact CD1-CG2 3.92Å; V382-V384 HydrophobicContact CG1-CG1 4.01Å; V384-E388 HydrophobicContact CB-CB 3.78Å; V384-E388 HydrophobicContact CB-CG 4.37Å; V384-E388 WeakPolarHBondContact CB-OE2 3.38Å; V384-E388 WeakPolarHBondContact CG1-OE2 3.44Å; V384-E388 HydrophobicContact CG2-CB 3.8Å; V384-F391 HydrophobicContact CG1-CD2 4.28Å
385	D	89.5	Confident	85.5	Confident	58 Å²	58	82.2 Å²	82.2	31%	0.31	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	154.8	178.1	-175.5	13.3	0	0	0	110.9	K387 E388	D385-K387 PolarHBondContact O-N 2.81Å; D385-K387 WeakPolarHBondContact OD2-CD 3.5Å; D385-K387 WeakPolarHBondContact OD2-CE 3.39Å; D385-K387 WeakPolarHBondContact OD2-CG 3.48Å; D385-K387 IonicContact OD2-NZ 3.39Å; D385-K387 PolarHBondContact OD2-NZ 2.82Å; D385-E388 PolarHBondContact O-N 3.11Å
386	S	87	Confident	87.2	Confident	41 Å²	41	78 Å²	78	29%	0.287	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.6	-19.7	165.5	59.9	0	0	0	0	115.9	I358 L359	I358-S386 WeakPolarHBondContact O-CB 3.43Å; L359-S386 PolarHBondContact O-N 3.1Å
387	K	87	Confident	88.1	Confident	165 Å²	165	81.1 Å²	81.1	72%	0.717	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-20.2	178.7	-58.8	177.9	-158.3	116.5	0	114.2	D385	D385-K387 PolarHBondContact O-N 2.81Å; D385-K387 WeakPolarHBondContact OD2-CD 3.5Å; D385-K387 WeakPolarHBondContact OD2-CE 3.39Å; D385-K387 WeakPolarHBondContact OD2-CG 3.48Å; D385-K387 IonicContact OD2-NZ 3.39Å; D385-K387 PolarHBondContact OD2-NZ 2.82Å
388	E	87.9	Confident	88.4	Confident	93 Å²	93	79.1 Å²	79.1	44%	0.435	40%	0.4	S	S	.	.			trans	-85.8	118.8	179.5	-74.6	176.6	-124.2	0	0	109.1	W348 Y361 V384 D385	W348-E388 WeakPolarHBondContact CZ2-O 3.36Å; Y361-E388 WeakPolarHBondContact CD2-O 3.35Å; V384-E388 HydrophobicContact CB-CB 3.78Å; V384-E388 HydrophobicContact CB-CG 4.37Å; V384-E388 WeakPolarHBondContact CB-OE2 3.38Å; V384-E388 WeakPolarHBondContact CG1-OE2 3.44Å; V384-E388 HydrophobicContact CG2-CB 3.8Å; D385-E388 PolarHBondContact O-N 3.11Å
389	L	90.2	Very high	88.3	Confident	70 Å²	70	75 Å²	75	37%	0.366	39%	0.388	S	S	.	.			trans	-122.1	9	-175.5	-65.7	179.8	0	0	0	112.9	D347 W348 Y361	D347-L389 CarbonylContact C-O 3.51Å; D347-L389 WeakPolarHBondContact CA-O 3.49Å; W348-L389 PolarHBondContact N-O 3.15Å; Y361-L389 HydrophobicContact CE2-CD2 3.6Å
390	Q	91.3	Very high	88.3	Confident	139 Å²	139	73 Å²	73	65%	0.65	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.1	146.7	179	65.8	-176	30.9	0	0	109.3	I346 D347 W348	I346-Q390 CarbonylContact O-C 3.55Å; I346-Q390 VanDerWaalsContact O-CA 3.29Å; I346-Q390 WeakPolarHBondContact O-CA 3.49Å; D347-Q390 WeakPolarHBondContact OD1-CB 3.28Å; W348-Q390 VanDerWaalsContact CZ3-C 3.5Å
391	F	93.7	Very high	88.4	Confident	40 Å²	40	69.1 Å²	69.1	18%	0.175	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	147.5	176.6	-168.8	-95.4	0	0	0	112.6	S345 I346 W348 L363 V382 V384 F393	S345-F391 WeakPolarHBondContact CA-O 3.12Å; I346-F391 HydrophobicContact CG2-CB 4.46Å; I346-F391 PolarHBondContact N-O 3.38Å; I346-F391 PolarHBondContact O-N 3.17Å; W348-F391 HydrophobicContact CH2-CB 3.89Å; W348-F391 HydrophobicContact CZ3-CB 3.86Å; L363-F391 HydrophobicContact CD2-CB 3.64Å; L363-F391 HydrophobicContact CD2-CD1 4.12Å; L363-F391 HydrophobicContact CD2-CG 4.02Å; V382-F391 HydrophobicContact CB-CZ 4.27Å; V382-F391 HydrophobicContact CG1-CE2 3.87Å; V382-F391 HydrophobicContact CG1-CZ 3.97Å; V382-F391 HydrophobicContact CG2-CE1 4.03Å; V382-F391 HydrophobicContact CG2-CE2 4.48Å; V382-F391 HydrophobicContact CG2-CZ 3.75Å; V384-F391 HydrophobicContact CG1-CD2 4.28Å; F391-F393 HydrophobicContact CD1-CD1 4.47Å; F391-F393 AromaticContact CD1-CD2 3.95Å; F391-F393 HydrophobicContact CD1-CD2 3.95Å; F391-F393 HydrophobicContact CD1-CE1 4.21Å; F391-F393 AromaticContact CD1-CE2 3.68Å; F391-F393 HydrophobicContact CD1-CE2 3.68Å; F391-F393 HydrophobicContact CD1-CG 4.34Å; F391-F393 AromaticContact CD1-CZ 3.82Å; F391-F393 HydrophobicContact CD1-CZ 3.82Å; F391-F393 AromaticContact CE1-CD1 3.97Å; F391-F393 HydrophobicContact CE1-CD1 3.97Å; F391-F393 HydrophobicContact CE1-CD2 4.25Å; F391-F393 AromaticContact CE1-CE1 3.8Å; F391-F393 HydrophobicContact CE1-CE1 3.8Å; F391-F393 HydrophobicContact CE1-CE2 4.1Å; F391-F393 HydrophobicContact CE1-CG 4.19Å; F391-F393 AromaticContact CE1-CZ 3.87Å; F391-F393 HydrophobicContact CE1-CZ 3.87Å
392	V	92.3	Very high	88.4	Confident	82 Å²	82	66.4 Å²	66.4	50%	0.497	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123.7	-178.2	-172.8	0	0	0	0	111.7	L344	L344-V392 WeakPolarHBondContact O-CA 3.29Å
393	F	92.9	Very high	88.4	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.009	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	103.3	167.9	-65.7	-84.7	0	0	0	109.5	S343 L344 L363 L365 K380 V382 F391 L396 I404	S343-F393 CarbonylContact C-O 3.6Å; S343-F393 WeakPolarHBondContact CA-O 3.45Å; S343-F393 WeakPolarHBondContact CB-O 3.36Å; L344-F393 PolarHBondContact N-O 2.77Å; L344-F393 PolarHBondContact O-N 3.44Å; L363-F393 HydrophobicContact CB-CZ 4.11Å; L363-F393 HydrophobicContact CD2-CE2 4.24Å; L363-F393 HydrophobicContact CD2-CZ 4.39Å; L365-F393 HydrophobicContact CB-CD1 3.81Å; L365-F393 HydrophobicContact CB-CE1 3.64Å; L365-F393 HydrophobicContact CB-CG 4.36Å; L365-F393 HydrophobicContact CB-CZ 4.05Å; L365-F393 HydrophobicContact CD1-CD2 4.39Å; L365-F393 HydrophobicContact CD1-CG 4.28Å; L365-F393 HydrophobicContact CD2-CB 4.14Å; L365-F393 HydrophobicContact CD2-CD1 3.85Å; L365-F393 HydrophobicContact CD2-CG 4.09Å; L365-F393 HydrophobicContact CG-CD1 4.28Å; L365-F393 HydrophobicContact CG-CG 4.48Å; K380-F393 HydrophobicContact CB-CD1 4.43Å; K380-F393 HydrophobicContact CB-CE1 4.15Å; K380-F393 HydrophobicContact CD-CD1 3.98Å; K380-F393 HydrophobicContact CD-CE1 4.09Å; K380-F393 HydrophobicContact CG-CE1 4.39Å; V382-F393 HydrophobicContact CG2-CE1 4.5Å; F391-F393 HydrophobicContact CD1-CD1 4.47Å; F391-F393 AromaticContact CD1-CD2 3.95Å; F391-F393 HydrophobicContact CD1-CD2 3.95Å; F391-F393 HydrophobicContact CD1-CE1 4.21Å; F391-F393 AromaticContact CD1-CE2 3.68Å; F391-F393 HydrophobicContact CD1-CE2 3.68Å; F391-F393 HydrophobicContact CD1-CG 4.34Å; F391-F393 AromaticContact CD1-CZ 3.82Å; F391-F393 HydrophobicContact CD1-CZ 3.82Å; F391-F393 AromaticContact CE1-CD1 3.97Å; F391-F393 HydrophobicContact CE1-CD1 3.97Å; F391-F393 HydrophobicContact CE1-CD2 4.25Å; F391-F393 AromaticContact CE1-CE1 3.8Å; F391-F393 HydrophobicContact CE1-CE1 3.8Å; F391-F393 HydrophobicContact CE1-CE2 4.1Å; F391-F393 HydrophobicContact CE1-CG 4.19Å; F391-F393 AromaticContact CE1-CZ 3.87Å; F391-F393 HydrophobicContact CE1-CZ 3.87Å; F393-L396 HydrophobicContact CB-CD1 4.2Å; F393-L396 WeakPolarHBondContact O-CD1 3.35Å; F393-I404 HydrophobicContact CD2-CD1 4.49Å; F393-I404 HydrophobicContact CD2-CG2 4.46Å; F393-I404 HydrophobicContact CE2-CG2 3.76Å
394	G	87.1	Confident	88.4	Confident	35 Å²	35	60.5 Å²	60.5	36%	0.361	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	175.3	171.9	0	0	0	0	0	113.8
395	N	87.4	Confident	88.5	Confident	162 Å²	162	63.2 Å²	63.2	87%	0.866	33%	0.328	S	S	*	.	S	Bend	trans	59.3	53.2	-176.5	-61.4	4.3	0	0	0	112.8	N342	N342-N395 PolarHBondContact O-N 2.83Å; N342-N395 VanDerWaalsContact O-N 3.1Å
396	L	88.8	Confident	88.6	Confident	22 Å²	22	60.4 Å²	60.4	12%	0.115	31%	0.313	C	S	.	.			trans	-107.6	157.7	175.3	-54.7	179.4	0	0	0	110.6	N342 L344 L365 F393 Y402 T424	N342-L396 WeakPolarHBondContact CA-O 3.22Å; N342-L396 PolarHBondContact O-N 3.05Å; L344-L396 HydrophobicContact CB-CD1 4.14Å; L344-L396 HydrophobicContact CD1-CD1 3.84Å; L344-L396 HydrophobicContact CG-CD1 3.65Å; L365-L396 HydrophobicContact CD2-CD1 4.48Å; L365-L396 HydrophobicContact CD2-CD2 3.67Å; F393-L396 HydrophobicContact CB-CD1 4.2Å; F393-L396 WeakPolarHBondContact O-CD1 3.35Å; L396-Y402 HydrophobicContact CB-CE2 3.86Å; L396-Y402 HydrophobicContact CD1-CD2 4.23Å; L396-Y402 HydrophobicContact CD1-CE2 4.2Å; L396-Y402 HydrophobicContact CD2-CE1 4.33Å; L396-Y402 HydrophobicContact CG-CE2 4.43Å; L396-T424 HydrophobicContact CB-CG2 4.14Å; L396-T424 HydrophobicContact CD1-CG2 4.48Å
397	D	82.5	Confident	88.9	Confident	103 Å²	103	58.5 Å²	58.5	55%	0.551	30%	0.3	S	S	*	.			trans	-74.4	141.6	179.8	-46.7	-72.5	0	0	0	110.7	T400 Y402 T424	D397-T400 HydrophobicContact CB-CG2 4.28Å; D397-T400 WeakPolarHBondContact O-CB 3.23Å; D397-Y402 WeakPolarHBondContact CB-OH 3.22Å; D397-Y402 PolarHBondContact N-OH 3.1Å; D397-Y402 PolarHBondContact OD2-OH 3Å; D397-T424 WeakPolarHBondContact O-CB 3.3Å; D397-T424 PolarHBondContact O-OG1 2.89Å
398	H	80.8	Confident	89	Confident	105 Å²	105	50.7 Å²	50.7	49%	0.486	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	149.4	172.8	52.1	-172.8	0	0	0	113.4	S341 T400 E427	S341-H398 WeakPolarHBondContact O-CA 3.39Å; S341-H398 PolarHBondContact O-N 2.77Å; H398-T400 PolarHBondContact O-N 3.06Å; H398-T400 PolarHBondContact O-OG1 3.38Å; H398-E427 IonicContact CE1-OE2 3.92Å; H398-E427 PolarHBondContact CE1-OE2 3.09Å; H398-E427 IonicContact ND1-OE2 3.11Å; H398-E427 PolarHBondContact ND1-OE2 2.95Å
399	N	80.3	Confident	89.1	Confident	52 Å²	52	46.6 Å²	46.6	28%	0.278	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	30.7	-178.3	-170.2	16.6	0	0	0	115.3	R423 T424 K425 F426	N399-R423 PolarHBondContact O-NE 2.8Å; N399-R423 VanDerWaalsContact O-NE 3.17Å; N399-R423 PolarHBondContact O-NH2 2.88Å; N399-R423 VanDerWaalsContact OD1-CZ 3.27Å; N399-R423 PolarHBondContact OD1-NE 3.39Å; N399-R423 PolarHBondContact OD1-NH2 3.36Å; N399-T424 WeakPolarHBondContact CA-O 3.23Å; N399-T424 PolarHBondContact N-OG1 2.98Å; N399-T424 VanDerWaalsContact N-OG1 3.17Å; N399-K425 PolarHBondContact N-O 2.99Å; N399-F426 HydrophobicContact CB-CD1 4.3Å; N399-F426 HydrophobicContact CB-CE1 4.3Å; N399-F426 WeakPolarHBondContact ND2-CE1 3.32Å; N399-F426 WeakPolarHBondContact ND2-CZ 3.43Å
400	T	83.3	Confident	89	Confident	39 Å²	39	43.5 Å²	43.5	24%	0.239	23%	0.232	C	C	.	.			trans	-118	148.8	-171.9	-64.3	0	0	0	0	111.6	D397 H398 Y402 R423 T424	D397-T400 HydrophobicContact CB-CG2 4.28Å; D397-T400 WeakPolarHBondContact O-CB 3.23Å; H398-T400 PolarHBondContact O-N 3.06Å; H398-T400 PolarHBondContact O-OG1 3.38Å; T400-Y402 HydrophobicContact CG2-CE1 4.19Å; T400-Y402 HydrophobicContact CG2-CE2 3.83Å; T400-Y402 WeakPolarHBondContact CG2-OH 3.18Å; T400-R423 WeakPolarHBondContact O-CA 3.45Å; T400-R423 WeakPolarHBondContact O-CG 3.36Å; T400-T424 PolarHBondContact N-OG1 3.27Å; T400-T424 PolarHBondContact O-N 3.33Å; T400-T424 PolarHBondContact O-OG1 3.33Å
401	C	88.2	Confident	88.8	Confident	21 Å²	21	45 Å²	45	14%	0.142	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.9	-169.2	-176.9	0	0	0	0	111	C368 E421 R423	C368-C401 HydrophobicContact CB-CB 3.56Å; C368-C401 WeakPolarHBondContact CB-SG 3.44Å; C368-C401 PolarHBondContact N-O 3.08Å; C368-C401 WeakPolarHBondContact SG-CB 3.36Å; C368-C401 PolarHBondContact SG-O 2.86Å; C368-C401 VanDerWaalsContact SG-O 3.35Å; C368-C401 CovalentContact SG-SG 2.04Å; C368-C401 PolarHBondContact SG-SG 2.81Å; C401-E421 PolarHBondContact SG-OE1 3.09Å; C401-E421 VanDerWaalsContact SG-OE1 3.34Å; C401-R423 HydrophobicContact CB-CG 4.4Å
402	Y	91.1	Very high	88.4	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	158.3	179.6	-53.8	-85.4	0	0	0	111.5	L344 L365 H366 C368 L379 L396 D397 T400 V422 T424	L344-Y402 HydrophobicContact CD1-CD2 3.95Å; L344-Y402 HydrophobicContact CD1-CG 4.27Å; L365-Y402 HydrophobicContact CD1-CG 4.48Å; H366-Y402 CarbonylContact O-C 3.44Å; H366-Y402 VanDerWaalsContact O-CA 3.28Å; H366-Y402 WeakPolarHBondContact O-CA 3.45Å; H366-Y402 WeakPolarHBondContact O-CB 3.5Å; C368-Y402 PolarHBondContact SG-N 2.81Å; L379-Y402 HydrophobicContact CD1-CD1 3.61Å; L379-Y402 HydrophobicContact CD1-CE1 3.55Å; L396-Y402 HydrophobicContact CB-CE2 3.86Å; L396-Y402 HydrophobicContact CD1-CD2 4.23Å; L396-Y402 HydrophobicContact CD1-CE2 4.2Å; L396-Y402 HydrophobicContact CD2-CE1 4.33Å; L396-Y402 HydrophobicContact CG-CE2 4.43Å; D397-Y402 WeakPolarHBondContact CB-OH 3.22Å; D397-Y402 PolarHBondContact N-OH 3.1Å; D397-Y402 PolarHBondContact OD2-OH 3Å; T400-Y402 HydrophobicContact CG2-CE1 4.19Å; T400-Y402 HydrophobicContact CG2-CE2 3.83Å; T400-Y402 WeakPolarHBondContact CG2-OH 3.18Å; Y402-V422 PolarHBondContact N-O 2.8Å; Y402-V422 PolarHBondContact O-N 2.84Å; Y402-V422 VanDerWaalsContact O-O 3.09Å; Y402-T424 HydrophobicContact CD2-CG2 4.4Å; Y402-T424 HydrophobicContact CE2-CG2 4.03Å
403	I	91.5	Very high	88.1	Confident	27 Å²	27	42.9 Å²	42.9	14%	0.138	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.1	174.8	-58	172.2	0	0	0	108.1	H366 R405 E419 I420 E421	H366-I403 PolarHBondContact N-O 3.48Å; H366-I403 PolarHBondContact O-N 2.81Å; I403-R405 HydrophobicContact CG2-CG 4.37Å; I403-E419 HydrophobicContact CG2-CB 4.42Å; I403-I420 CarbonylContact C-O 3.55Å; I403-I420 WeakPolarHBondContact CA-O 3.37Å; I403-E421 HydrophobicContact CG1-CB 4.42Å; I403-E421 HydrophobicContact CG1-CG 4.3Å
404	I	92.3	Very high	87.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	136.8	176	-48.9	172.7	0	0	0	108.9	L344 I346 L365 F393 E419 I420 V422	L344-I404 HydrophobicContact CB-CD1 4.02Å; L344-I404 HydrophobicContact CD1-CD1 4.16Å; L344-I404 HydrophobicContact CD1-CG1 4.45Å; I346-I404 HydrophobicContact CB-CD1 4.23Å; I346-I404 HydrophobicContact CD1-CB 3.99Å; I346-I404 HydrophobicContact CD1-CD1 4.33Å; I346-I404 HydrophobicContact CD1-CG2 3.6Å; I346-I404 HydrophobicContact CG2-CG2 4.11Å; L365-I404 HydrophobicContact CD1-CG1 3.79Å; F393-I404 HydrophobicContact CD2-CD1 4.49Å; F393-I404 HydrophobicContact CD2-CG2 4.46Å; F393-I404 HydrophobicContact CE2-CG2 3.76Å; I404-E419 CarbonylContact O-C 3.52Å; I404-E419 VanDerWaalsContact O-CA 3.24Å; I404-E419 WeakPolarHBondContact O-CA 3.43Å; I404-I420 HydrophobicContact CB-CG2 4.06Å; I404-I420 PolarHBondContact N-O 3.28Å; I404-I420 PolarHBondContact O-N 2.95Å; I404-V422 HydrophobicContact CD1-CG2 4.46Å
405	R	92.9	Very high	87.8	Confident	69 Å²	69	46 Å²	46	26%	0.26	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	138.9	178.5	-61.7	-171.2	158.6	139.1	-6.8	111.2	L363 E364 I403 F417 S418 E419	L363-R405 CarbonylContact C-O 3.57Å; L363-R405 VanDerWaalsContact CA-O 3.22Å; L363-R405 WeakPolarHBondContact CA-O 3.36Å; E364-R405 HydrophobicContact CB-CB 4.39Å; E364-R405 PolarHBondContact N-O 3.21Å; E364-R405 PolarHBondContact O-N 3.43Å; I403-R405 HydrophobicContact CG2-CG 4.37Å; R405-F417 HydrophobicContact CB-CB 4.23Å; R405-F417 HydrophobicContact CB-CD1 3.7Å; R405-F417 HydrophobicContact CB-CE1 4.37Å; R405-F417 HydrophobicContact CB-CG 4.18Å; R405-S418 CarbonylContact C-O 3.6Å; R405-S418 VanDerWaalsContact CA-O 3.25Å; R405-S418 WeakPolarHBondContact CA-O 3.49Å; R405-E419 HydrophobicContact CG-CB 3.81Å; R405-E419 IonicContact CZ-OE2 2.67Å; R405-E419 IonicContact NE-OE2 3.88Å; R405-E419 PolarHBondContact NE-OE2 3.29Å; R405-E419 IonicContact NH2-OE2 3.43Å; R405-E419 PolarHBondContact NH2-OE2 2.84Å
406	V	92.6	Very high	87.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	129.1	178.2	-169.2	0	0	0	0	111.4	P332 I346 W348 K362 L363 F417 S418	P332-V406 WeakPolarHBondContact CD-O 3.23Å; P332-V406 HydrophobicContact CG-CB 4.12Å; P332-V406 HydrophobicContact CG-CG1 3.81Å; P332-V406 VanDerWaalsContact CG-O 3.28Å; P332-V406 WeakPolarHBondContact CG-O 3.35Å; I346-V406 HydrophobicContact CD1-CG2 3.96Å; W348-V406 HydrophobicContact CD2-CG1 3.91Å; W348-V406 HydrophobicContact CE3-CG1 4.4Å; W348-V406 HydrophobicContact CE3-CG2 4.41Å; W348-V406 HydrophobicContact CG-CG1 4.08Å; K362-V406 CarbonylContact O-C 3.6Å; K362-V406 WeakPolarHBondContact O-CA 3.38Å; L363-V406 HydrophobicContact CD2-CG2 4.07Å; L363-V406 HydrophobicContact CG-CG1 4.28Å; L363-V406 HydrophobicContact CG-CG2 4.15Å; V406-F417 CarbonylContact O-C 3.5Å; V406-F417 VanDerWaalsContact O-CA 3.3Å; V406-F417 WeakPolarHBondContact O-CA 3.42Å; V406-S418 PolarHBondContact N-O 2.76Å; V406-S418 PolarHBondContact O-N 2.78Å
407	A	92.1	Very high	88	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	156.5	173.6	0	0	0	0	0	111.5	Y361 K362 F417	Y361-A407 CarbonylContact C-O 3.5Å; Y361-A407 VanDerWaalsContact CA-O 3.23Å; Y361-A407 WeakPolarHBondContact CA-O 3.32Å; K362-A407 PolarHBondContact N-O 3.28Å; K362-A407 PolarHBondContact O-N 2.89Å; A407-F417 HydrophobicContact CB-CB 4.48Å; A407-F417 HydrophobicContact CB-CD1 3.53Å; A407-F417 HydrophobicContact CB-CD2 4.21Å; A407-F417 HydrophobicContact CB-CE1 3.7Å; A407-F417 HydrophobicContact CB-CE2 4.35Å; A407-F417 HydrophobicContact CB-CG 3.81Å; A407-F417 HydrophobicContact CB-CZ 4.12Å
408	S	90.7	Very high	88.4	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.014	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	164.6	178.6	53.2	0	0	0	0	111.6	P329 G330 A360 F414 G415	P329-S408 WeakPolarHBondContact CB-OG 3.28Å; P329-S408 WeakPolarHBondContact CG-O 3.33Å; P329-S408 WeakPolarHBondContact CG-OG 3.46Å; G330-S408 PolarHBondContact O-OG 2.89Å; A360-S408 CarbonylContact O-C 3.56Å; S408-F414 CarbonylContact O-C 3.6Å; S408-F414 VanDerWaalsContact O-CA 3.31Å; S408-F414 WeakPolarHBondContact O-CA 3.23Å; S408-G415 PolarHBondContact O-N 2.84Å
409	A	89.2	Confident	88.8	Confident	6 Å²	6	44.3 Å²	44.3	5%	0.05	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	142.9	173.5	0	0	0	0	0	114.2	I358 L359 A360 G413 F414	I358-A409 CarbonylContact C-O 3.58Å; I358-A409 VanDerWaalsContact CA-O 3.29Å; I358-A409 WeakPolarHBondContact CA-O 3.5Å; L359-A409 PolarHBondContact N-O 2.82Å; A360-A409 PolarHBondContact O-N 3.22Å; A409-G413 VanDerWaalsContact CA-O 3.3Å; A409-G413 WeakPolarHBondContact CA-O 3.35Å; A409-F414 HydrophobicContact CB-CD1 3.61Å; A409-F414 HydrophobicContact CB-CD2 4.14Å; A409-F414 HydrophobicContact CB-CE1 3.53Å; A409-F414 HydrophobicContact CB-CE2 4.07Å; A409-F414 HydrophobicContact CB-CG 3.9Å; A409-F414 HydrophobicContact CB-CZ 3.75Å
410	T	88.7	Confident	89.4	Confident	6 Å²	6	43.6 Å²	43.6	4%	0.037	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-174.5	165.5	62.1	0	0	0	0	109.9	G327 P329 K357 I358 A412 G413	G327-T410 PolarHBondContact O-OG1 2.97Å; P329-T410 HydrophobicContact CB-CG2 3.96Å; P329-T410 HydrophobicContact CG-CG2 4.01Å; K357-T410 WeakPolarHBondContact O-CA 3.45Å; I358-T410 HydrophobicContact CD1-CG2 3.97Å; T410-A412 PolarHBondContact O-N 3.34Å; T410-A412 VanDerWaalsContact O-N 3.13Å; T410-A412 PolarHBondContact OG1-N 3.33Å; T410-G413 PolarHBondContact N-O 2.72Å; T410-G413 PolarHBondContact O-N 3.41Å; T410-G413 VanDerWaalsContact O-N 3.08Å
411	K	86.1	Confident	89.7	Confident	171 Å²	171	47.8 Å²	47.8	74%	0.743	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.4	170.3	-163.6	178.2	-179.2	-176.2	0	113.6	E326	E326-K411 WeakPolarHBondContact OE1-CB 3.06Å; E326-K411 PolarHBondContact OE2-N 3.14Å
412	A	85.7	Confident	89.7	Confident	49 Å²	49	47.2 Å²	47.2	41%	0.405	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-10.6	176.3	0	0	0	0	0	114.1	I328 T410	I328-A412 HydrophobicContact CG1-CB 4.1Å; T410-A412 PolarHBondContact O-N 3.34Å; T410-A412 VanDerWaalsContact O-N 3.13Å; T410-A412 PolarHBondContact OG1-N 3.33Å
413	G	87	Confident	89.5	Confident	28 Å²	28	53.4 Å²	53.4	29%	0.289	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	123.2	-171.4	179.4	0	0	0	0	0	114.3	P329 A409 T410	P329-G413 WeakPolarHBondContact CD-O 3.25Å; A409-G413 VanDerWaalsContact CA-O 3.3Å; A409-G413 WeakPolarHBondContact CA-O 3.35Å; T410-G413 PolarHBondContact N-O 2.72Å; T410-G413 PolarHBondContact O-N 3.41Å; T410-G413 VanDerWaalsContact O-N 3.08Å
414	F	87.8	Confident	89.2	Confident	92 Å²	92	52.3 Å²	52.3	40%	0.404	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	138.6	179	-75.4	-89.6	0	0	0	112.1	I328 K362 S408 A409	I328-F414 WeakPolarHBondContact CG2-O 3.48Å; K362-F414 HydrophobicContact CB-CD1 3.89Å; K362-F414 HydrophobicContact CB-CE1 3.63Å; S408-F414 CarbonylContact O-C 3.6Å; S408-F414 VanDerWaalsContact O-CA 3.31Å; S408-F414 WeakPolarHBondContact O-CA 3.23Å; A409-F414 HydrophobicContact CB-CD1 3.61Å; A409-F414 HydrophobicContact CB-CD2 4.14Å; A409-F414 HydrophobicContact CB-CE1 3.53Å; A409-F414 HydrophobicContact CB-CE2 4.07Å; A409-F414 HydrophobicContact CB-CG 3.9Å; A409-F414 HydrophobicContact CB-CZ 3.75Å
415	G	85.6	Confident	88.5	Confident	11 Å²	11	58.2 Å²	58.2	11%	0.113	28%	0.28	C	S	.	.			trans	-82.2	-173.3	173.7	0	0	0	0	0	114.1	P329 S408	P329-G415 VanDerWaalsContact O-CA 3.27Å; P329-G415 WeakPolarHBondContact O-CA 3.49Å; S408-G415 PolarHBondContact O-N 2.84Å
416	H	88.5	Confident	87.6	Confident	149 Å²	149	60.2 Å²	60.2	69%	0.69	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-71	147.7	175.8	-67.3	83.4	0	0	0	111.5	K331	K331-H416 WeakPolarHBondContact CA-O 3.3Å; K331-H416 HydrophobicContact CB-CB 4.46Å; K331-H416 WeakPolarHBondContact CB-O 3.19Å
417	F	90.8	Very high	86.7	Confident	74 Å²	74	66.1 Å²	66.1	33%	0.325	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-75.3	141.8	173	-68.1	-90	0	0	0	111.6	K362 E364 R405 V406 A407	K362-F417 HydrophobicContact CD-CE1 4.39Å; K362-F417 HydrophobicContact CD-CZ 3.93Å; K362-F417 HydrophobicContact CG-CE1 4.38Å; K362-F417 HydrophobicContact CG-CZ 4.4Å; E364-F417 HydrophobicContact CG-CE1 4.16Å; E364-F417 HydrophobicContact CG-CZ 4.27Å; R405-F417 HydrophobicContact CB-CB 4.23Å; R405-F417 HydrophobicContact CB-CD1 3.7Å; R405-F417 HydrophobicContact CB-CE1 4.37Å; R405-F417 HydrophobicContact CB-CG 4.18Å; V406-F417 CarbonylContact O-C 3.5Å; V406-F417 VanDerWaalsContact O-CA 3.3Å; V406-F417 WeakPolarHBondContact O-CA 3.42Å; A407-F417 HydrophobicContact CB-CB 4.48Å; A407-F417 HydrophobicContact CB-CD1 3.53Å; A407-F417 HydrophobicContact CB-CD2 4.21Å; A407-F417 HydrophobicContact CB-CE1 3.7Å; A407-F417 HydrophobicContact CB-CE2 4.35Å; A407-F417 HydrophobicContact CB-CG 3.81Å; A407-F417 HydrophobicContact CB-CZ 4.12Å
418	S	90.6	Very high	85.6	Confident	16 Å²	16	69.1 Å²	69.1	11%	0.112	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	152.2	150.5	-74.1	0	0	0	0	109.1	K331 P332 R405 V406	K331-S418 WeakPolarHBondContact CB-OG 3.41Å; K331-S418 WeakPolarHBondContact CD-OG 3.37Å; K331-S418 WeakPolarHBondContact CG-OG 3.42Å; P332-S418 WeakPolarHBondContact O-CB 3.39Å; P332-S418 PolarHBondContact O-OG 3.21Å; R405-S418 CarbonylContact C-O 3.6Å; R405-S418 VanDerWaalsContact CA-O 3.25Å; R405-S418 WeakPolarHBondContact CA-O 3.49Å; V406-S418 PolarHBondContact N-O 2.76Å; V406-S418 PolarHBondContact O-N 2.78Å
419	E	90.7	Very high	84.6	Confident	116 Å²	116	70.4 Å²	70.4	54%	0.542	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	155.1	-177.5	69.6	-169.6	165.4	0	0	113.1	I403 I404 R405	I403-E419 HydrophobicContact CG2-CB 4.42Å; I404-E419 CarbonylContact O-C 3.52Å; I404-E419 VanDerWaalsContact O-CA 3.24Å; I404-E419 WeakPolarHBondContact O-CA 3.43Å; R405-E419 HydrophobicContact CG-CB 3.81Å; R405-E419 IonicContact CZ-OE2 2.67Å; R405-E419 IonicContact NE-OE2 3.88Å; R405-E419 PolarHBondContact NE-OE2 3.29Å; R405-E419 IonicContact NH2-OE2 3.43Å; R405-E419 PolarHBondContact NH2-OE2 2.84Å
420	I	91.2	Very high	83.8	Confident	37 Å²	37	72.9 Å²	72.9	19%	0.19	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	139.3	176.6	-167.8	171.5	0	0	0	110.6	I334 F337 I346 I403 I404 V422	I334-I420 HydrophobicContact CD1-CB 3.95Å; I334-I420 HydrophobicContact CD1-CG2 3.9Å; I334-I420 HydrophobicContact CG2-CD1 4.47Å; F337-I420 HydrophobicContact CB-CD1 4.33Å; F337-I420 HydrophobicContact CD1-CD1 3.28Å; F337-I420 HydrophobicContact CE1-CD1 3.62Å; F337-I420 HydrophobicContact CG-CD1 3.82Å; F337-I420 HydrophobicContact CZ-CD1 4.39Å; I346-I420 HydrophobicContact CD1-CG2 3.84Å; I403-I420 CarbonylContact C-O 3.55Å; I403-I420 WeakPolarHBondContact CA-O 3.37Å; I404-I420 HydrophobicContact CB-CG2 4.06Å; I404-I420 PolarHBondContact N-O 3.28Å; I404-I420 PolarHBondContact O-N 2.95Å; I420-V422 HydrophobicContact CD1-CG2 4.39Å; I420-V422 HydrophobicContact CG1-CG2 4.14Å; I420-V422 HydrophobicContact CG2-CG2 4.12Å
421	E	90.2	Very high	83.3	Confident	128 Å²	128	75.4 Å²	75.4	60%	0.598	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	130.6	172.7	-172.3	175.2	125.5	0	0	110	C368 C401 I403	C368-E421 VanDerWaalsContact SG-CG 3.55Å; C401-E421 PolarHBondContact SG-OE1 3.09Å; C401-E421 VanDerWaalsContact SG-OE1 3.34Å; I403-E421 HydrophobicContact CG1-CB 4.42Å; I403-E421 HydrophobicContact CG1-CG 4.3Å
422	V	87.5	Confident	83	Confident	8 Å²	8	67.4 Å²	67.4	5%	0.048	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	141.9	-177.7	-165.7	0	0	0	0	110.7	F337 L344 Y402 I404 I420	F337-V422 HydrophobicContact CB-CG2 4.41Å; F337-V422 HydrophobicContact CD2-CB 4.34Å; F337-V422 HydrophobicContact CD2-CG1 3.59Å; F337-V422 HydrophobicContact CD2-CG2 3.7Å; F337-V422 HydrophobicContact CE2-CG1 3.87Å; F337-V422 HydrophobicContact CE2-CG2 4.2Å; F337-V422 HydrophobicContact CG-CG2 4.13Å; L344-V422 HydrophobicContact CD1-CB 4.22Å; L344-V422 HydrophobicContact CD2-CB 4.05Å; L344-V422 HydrophobicContact CD2-CG1 3.55Å; Y402-V422 PolarHBondContact N-O 2.8Å; Y402-V422 PolarHBondContact O-N 2.84Å; Y402-V422 VanDerWaalsContact O-O 3.09Å; I404-V422 HydrophobicContact CD1-CG2 4.46Å; I420-V422 HydrophobicContact CD1-CG2 4.39Å; I420-V422 HydrophobicContact CG1-CG2 4.14Å; I420-V422 HydrophobicContact CG2-CG2 4.12Å
423	R	87.1	Confident	82.8	Confident	133 Å²	133	69 Å²	69	50%	0.502	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137.2	177	-159.8	179.3	-177.9	130.7	0.2	111.2	S339 N399 T400 C401	S339-R423 VanDerWaalsContact CB-O 3.26Å; S339-R423 WeakPolarHBondContact CB-O 3.26Å; S339-R423 PolarHBondContact OG-O 3.03Å; S339-R423 VanDerWaalsContact OG-O 3.07Å; N399-R423 PolarHBondContact O-NE 2.8Å; N399-R423 VanDerWaalsContact O-NE 3.17Å; N399-R423 PolarHBondContact O-NH2 2.88Å; N399-R423 VanDerWaalsContact OD1-CZ 3.27Å; N399-R423 PolarHBondContact OD1-NE 3.39Å; N399-R423 PolarHBondContact OD1-NH2 3.36Å; T400-R423 WeakPolarHBondContact O-CA 3.45Å; T400-R423 WeakPolarHBondContact O-CG 3.36Å; C401-R423 HydrophobicContact CB-CG 4.4Å
424	T	85.3	Confident	82.5	Confident	4 Å²	4	68 Å²	68	3%	0.025	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-68.7	152.1	168.3	52.2	0	0	0	0	110.7	S340 L344 L396 D397 N399 T400 Y402	S340-T424 CarbonylContact O-C 3.52Å; S340-T424 WeakPolarHBondContact O-CA 3.24Å; S340-T424 WeakPolarHBondContact O-CB 3.33Å; L344-T424 HydrophobicContact CD2-CG2 4.22Å; L344-T424 HydrophobicContact CG-CG2 4.4Å; L396-T424 HydrophobicContact CB-CG2 4.14Å; L396-T424 HydrophobicContact CD1-CG2 4.48Å; D397-T424 WeakPolarHBondContact O-CB 3.3Å; D397-T424 PolarHBondContact O-OG1 2.89Å; N399-T424 WeakPolarHBondContact CA-O 3.23Å; N399-T424 PolarHBondContact N-OG1 2.98Å; N399-T424 VanDerWaalsContact N-OG1 3.17Å; T400-T424 PolarHBondContact N-OG1 3.27Å; T400-T424 PolarHBondContact O-N 3.33Å; T400-T424 PolarHBondContact O-OG1 3.33Å; Y402-T424 HydrophobicContact CD2-CG2 4.4Å; Y402-T424 HydrophobicContact CE2-CG2 4.03Å
425	K	78.8	Confident	82.3	Confident	124 Å²	124	67.4 Å²	67.4	54%	0.539	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-75.6	169.5	-178.3	-68.1	173.9	178.1	157.2	0	111.6	S339 S340 N399	S339-K425 VanDerWaalsContact O-CD 3.32Å; S339-K425 WeakPolarHBondContact O-CD 3.45Å; S339-K425 WeakPolarHBondContact O-CE 3.13Å; S339-K425 PolarHBondContact O-NZ 3.09Å; S340-K425 PolarHBondContact O-N 2.93Å; N399-K425 PolarHBondContact N-O 2.99Å
426	F	74	Confident	82.2	Confident	110 Å²	110	67.2 Å²	67.2	48%	0.482	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-70.6	164.3	165.9	-72.6	-89.8	0	0	0	111.2	N399 I540	N399-F426 HydrophobicContact CB-CD1 4.3Å; N399-F426 HydrophobicContact CB-CE1 4.3Å; N399-F426 WeakPolarHBondContact ND2-CE1 3.32Å; N399-F426 WeakPolarHBondContact ND2-CZ 3.43Å; F426-I540 HydrophobicContact CB-CD1 3.68Å; F426-I540 HydrophobicContact CG-CD1 4.37Å
427	E	72.8	Confident	82	Confident	125 Å²	125	60.7 Å²	60.7	58%	0.584	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-92.3	156.5	174.6	-169.3	160.4	-153.8	0	0	110.9	H398	H398-E427 IonicContact CE1-OE2 3.92Å; H398-E427 PolarHBondContact CE1-OE2 3.09Å; H398-E427 IonicContact ND1-OE2 3.11Å; H398-E427 PolarHBondContact ND1-OE2 2.95Å
428	A	68.6	Low	81.6	Confident	63 Å²	63	62.2 Å²	62.2	52%	0.521	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-92.8	149.1	-174.6	0	0	0	0	0	112.5	I540	A428-I540 HydrophobicContact CB-CG2 4.03Å
429	P	71.1	Confident	81.1	Confident	28 Å²	28	65.5 Å²	65.5	18%	0.182	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-72.3	152.2	177.1	32.2	-37.1	0	0	0	112.9	V527 S542	P429-V527 HydrophobicContact CB-CG2 4.04Å; P429-V527 HydrophobicContact CG-CG2 3.82Å; P429-S542 WeakPolarHBondContact O-CA 3.35Å; P429-S542 WeakPolarHBondContact O-CB 3.35Å
430	S	71.8	Confident	80.6	Confident	58 Å²	58	63 Å²	63	41%	0.406	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-64.2	136.4	177.1	-46.7	0	0	0	0	112.1	S525	S430-S525 PolarHBondContact O-OG 2.8Å
431	P	77.3	Confident	79.7	Confident	59 Å²	59	69.7 Å²	69.7	38%	0.383	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-72.7	146.8	-179.6	29.7	-35.3	0	0	0	113.1	E543	P431-E543 WeakPolarHBondContact CB-O 3.24Å
432	P	79.9	Confident	78.9	Confident	3 Å²	3	68 Å²	68	2%	0.019	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-74.8	157.6	173.4	31.8	-34.6	0	0	0	112	T450 Y464 I523 S545	P432-T450 WeakPolarHBondContact CB-O 3.49Å; P432-Y464 HydrophobicContact CB-CE1 4.25Å; P432-Y464 HydrophobicContact CG-CD1 4.21Å; P432-Y464 HydrophobicContact CG-CE1 4.32Å; P432-I523 HydrophobicContact CG-CB 4.19Å; P432-I523 HydrophobicContact CG-CG2 3.85Å; P432-S545 VanDerWaalsContact O-CA 3.29Å; P432-S545 WeakPolarHBondContact O-CA 3.46Å; P432-S545 WeakPolarHBondContact O-CB 3.14Å
433	V	81.8	Confident	78.1	Confident	84 Å²	84	72.3 Å²	72.3	51%	0.509	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-94.1	125.2	172.4	-175.9	0	0	0	0	109.4	W449 T450 N546	V433-W449 CarbonylContact O-C 3.43Å; V433-W449 WeakPolarHBondContact O-CA 3.24Å; V433-W449 WeakPolarHBondContact O-CB 3.38Å; V433-T450 HydrophobicContact CB-CG2 4.12Å; V433-T450 WeakPolarHBondContact CB-OG1 3.44Å; V433-T450 PolarHBondContact N-OG1 3.22Å; V433-T450 VanDerWaalsContact N-OG1 3.11Å; V433-T450 PolarHBondContact O-N 2.73Å; V433-T450 PolarHBondContact O-OG1 3.31Å; V433-N546 WeakPolarHBondContact CA-OD1 3.36Å; V433-N546 WeakPolarHBondContact CG1-OD1 3.39Å
434	A	81.9	Confident	77.8	Confident	5 Å²	5	67.9 Å²	67.9	4%	0.041	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	128.6	-179.8	0	0	0	0	0	110.5	W449 I523 S545 N546 I548	A434-W449 HydrophobicContact CB-CB 4.47Å; A434-I523 HydrophobicContact CB-CD1 3.95Å; A434-S545 WeakPolarHBondContact CB-OG 3.23Å; A434-N546 PolarHBondContact N-OD1 2.78Å; A434-N546 PolarHBondContact O-ND2 2.86Å; A434-I548 HydrophobicContact CB-CD1 3.38Å; A434-I548 HydrophobicContact CB-CG1 3.77Å
435	V	82.6	Confident	77.7	Confident	81 Å²	81	67.7 Å²	67.7	49%	0.491	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-39.9	-165.1	174.2	0	0	0	0	112.9	N448 T450	V435-N448 PolarHBondContact N-O 3.04Å; V435-T450 HydrophobicContact CG2-CG2 4.06Å
436	G	83.5	Confident	77.9	Confident	6 Å²	6	63.6 Å²	63.6	6%	0.062	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.6	161.9	-173.9	0	0	0	0	0	114.4	I447 N448 I548	G436-I447 WeakPolarHBondContact O-CA 3.47Å; G436-N448 VanDerWaalsContact CA-OD1 3.24Å; G436-N448 WeakPolarHBondContact CA-OD1 3.34Å; G436-N448 PolarHBondContact N-OD1 2.96Å; G436-N448 PolarHBondContact O-N 3.12Å; G436-N448 VanDerWaalsContact O-N 3.1Å; G436-N448 PolarHBondContact O-OD1 2.88Å; G436-I548 WeakPolarHBondContact O-CD1 3.29Å
437	A	83.9	Confident	78.4	Confident	12 Å²	12	58.4 Å²	58.4	10%	0.099	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	126.4	177.2	0	0	0	0	0	109.3	L446 F521 I548	A437-L446 CarbonylContact C-O 3.56Å; A437-L446 WeakPolarHBondContact CA-O 3.07Å; A437-F521 HydrophobicContact CB-CD2 3.82Å; A437-F521 HydrophobicContact CB-CE2 4.09Å; A437-I548 HydrophobicContact CB-CB 4.26Å; A437-I548 HydrophobicContact CB-CG2 3.59Å
438	F	83.7	Confident	79	Confident	107 Å²	107	54.2 Å²	54.2	47%	0.469	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	136.7	-167.5	-51.3	-87.2	0	0	0	110.7	I445 L446	F438-I445 CarbonylContact O-C 3.56Å; F438-I445 WeakPolarHBondContact O-CA 3.46Å; F438-L446 HydrophobicContact CB-CB 4.42Å; F438-L446 HydrophobicContact CD2-CD2 4.17Å; F438-L446 HydrophobicContact CD2-CG 4.37Å; F438-L446 PolarHBondContact N-O 3.36Å; F438-L446 PolarHBondContact O-N 2.84Å
439	L	79.9	Confident	79.7	Confident	85 Å²	85	51.2 Å²	51.2	45%	0.445	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	129.3	170	-165.7	75.2	0	0	0	108.9	I445 L508 L550	L439-I445 HydrophobicContact CD1-CG1 3.94Å; L439-L508 HydrophobicContact CD1-CD1 4.26Å; L439-L508 HydrophobicContact CD1-CD2 4.42Å; L439-L550 HydrophobicContact CB-CD1 4.44Å; L439-L550 HydrophobicContact CB-CD2 4.42Å; L439-L550 HydrophobicContact CD1-CD2 4.36Å
440	L	79	Confident	80.2	Confident	64 Å²	64	51.7 Å²	51.7	34%	0.335	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	151.8	176	-58.3	179.2	0	0	0	110.5	T442 N443 D444 L446 V505	L440-T442 PolarHBondContact O-N 2.92Å; L440-N443 PolarHBondContact O-N 2.8Å; L440-D444 HydrophobicContact CB-CB 4.44Å; L440-D444 HydrophobicContact CD1-CB 4.24Å; L440-D444 PolarHBondContact N-O 3.12Å; L440-L446 HydrophobicContact CD1-CB 4.28Å; L440-L446 HydrophobicContact CD2-CB 4.18Å; L440-L446 HydrophobicContact CG-CB 4.26Å; L440-V505 HydrophobicContact CD1-CG1 4.15Å; L440-V505 HydrophobicContact CD1-CG2 4.49Å
441	D	72.5	Confident	79.9	Confident	176 Å²	176	50.4 Å²	50.4	94%	0.941	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-19.8	179.9	-61.4	-44.7	0	0	0	113.8	N443	D441-N443 PolarHBondContact O-N 3.02Å
442	T	73.2	Confident	79.1	Confident	94 Å²	94	49.4 Å²	49.4	58%	0.577	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-5	175.1	50.2	0	0	0	0	114.4	L440 D444	L440-T442 PolarHBondContact O-N 2.92Å; T442-D444 WeakPolarHBondContact CB-OD2 3.38Å; T442-D444 PolarHBondContact OG1-OD2 2.73Å
443	N	71.6	Confident	77.8	Confident	97 Å²	97	55.5 Å²	55.5	52%	0.519	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	51.3	-161.1	-64.9	-68.6	0	0	0	112.7	L440 D441 L508	L440-N443 PolarHBondContact O-N 2.8Å; D441-N443 PolarHBondContact O-N 3.02Å; N443-L508 HydrophobicContact CB-CB 4.23Å; N443-L508 HydrophobicContact CB-CD2 4.04Å; N443-L508 WeakPolarHBondContact O-CB 3.32Å; N443-L508 PolarHBondContact O-N 3.26Å
444	D	80	Confident	76.6	Confident	40 Å²	40	58.9 Å²	58.9	21%	0.214	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	165	166.8	-58.2	-58	0	0	0	110.3	L440 T442 V505 P507	L440-D444 HydrophobicContact CB-CB 4.44Å; L440-D444 HydrophobicContact CD1-CB 4.24Å; L440-D444 PolarHBondContact N-O 3.12Å; T442-D444 WeakPolarHBondContact CB-OD2 3.38Å; T442-D444 PolarHBondContact OG1-OD2 2.73Å; D444-V505 HydrophobicContact CB-CG1 3.7Å; D444-P507 WeakPolarHBondContact OD1-CA 3.15Å; D444-P507 WeakPolarHBondContact OD1-CB 3.48Å
445	I	83.2	Confident	75.1	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	117.3	177.4	-60	172.7	0	0	0	110.3	F438 L439 I447 V505 I506 L508 F511 I519 F521 L550	F438-I445 CarbonylContact O-C 3.56Å; F438-I445 WeakPolarHBondContact O-CA 3.46Å; L439-I445 HydrophobicContact CD1-CG1 3.94Å; I445-I447 HydrophobicContact CG2-CG1 4.1Å; I445-V505 CarbonylContact O-C 3.58Å; I445-V505 WeakPolarHBondContact O-CA 3.37Å; I445-I506 PolarHBondContact N-O 2.87Å; I445-I506 PolarHBondContact O-N 2.89Å; I445-L508 HydrophobicContact CD1-CD1 3.87Å; I445-L508 HydrophobicContact CG1-CD1 4.33Å; I445-F511 HydrophobicContact CD1-CD2 4.2Å; I445-F511 HydrophobicContact CD1-CE1 4.38Å; I445-F511 HydrophobicContact CD1-CE2 3.76Å; I445-F511 HydrophobicContact CD1-CZ 3.86Å; I445-I519 HydrophobicContact CD1-CD1 3.87Å; I445-F521 HydrophobicContact CD1-CZ 4.11Å; I445-F521 HydrophobicContact CG2-CE2 4.09Å; I445-F521 HydrophobicContact CG2-CZ 3.84Å; I445-L550 HydrophobicContact CB-CD2 4.47Å; I445-L550 HydrophobicContact CD1-CD2 3.5Å; I445-L550 VanDerWaalsContact CD1-CD2 3.5Å; I445-L550 HydrophobicContact CG1-CD2 3.68Å; I445-L550 HydrophobicContact CG2-CD2 3.98Å
446	L	84	Confident	73.3	Confident	39 Å²	39	61.7 Å²	61.7	20%	0.204	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	137.9	169.7	173.4	66.2	0	0	0	110	A437 F438 L440 W503 T504 V505	A437-L446 CarbonylContact C-O 3.56Å; A437-L446 WeakPolarHBondContact CA-O 3.07Å; F438-L446 HydrophobicContact CB-CB 4.42Å; F438-L446 HydrophobicContact CD2-CD2 4.17Å; F438-L446 HydrophobicContact CD2-CG 4.37Å; F438-L446 PolarHBondContact N-O 3.36Å; F438-L446 PolarHBondContact O-N 2.84Å; L440-L446 HydrophobicContact CD1-CB 4.28Å; L440-L446 HydrophobicContact CD2-CB 4.18Å; L440-L446 HydrophobicContact CG-CB 4.26Å; L446-W503 HydrophobicContact CD1-CB 4.48Å; L446-W503 HydrophobicContact CD1-CD2 4.48Å; L446-W503 HydrophobicContact CD1-CE3 3.56Å; L446-W503 HydrophobicContact CD1-CZ3 4.19Å; L446-T504 CarbonylContact C-O 3.52Å; L446-T504 WeakPolarHBondContact CA-O 3.46Å; L446-V505 HydrophobicContact CD1-CG2 3.99Å
447	I	84.7	Confident	71.7	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	141.5	176.8	-52.1	167.1	0	0	0	109.1	G436 I445 I466 W503 T504 I506 F521 I523 I548	G436-I447 WeakPolarHBondContact O-CA 3.47Å; I445-I447 HydrophobicContact CG2-CG1 4.1Å; I447-I466 HydrophobicContact CD1-CG2 3.94Å; I447-W503 CarbonylContact O-C 3.43Å; I447-W503 WeakPolarHBondContact O-CA 3.38Å; I447-W503 WeakPolarHBondContact O-CB 3.26Å; I447-T504 PolarHBondContact N-O 2.81Å; I447-T504 PolarHBondContact O-N 3.49Å; I447-I506 HydrophobicContact CD1-CD1 3.58Å; I447-I506 HydrophobicContact CD1-CG1 4.08Å; I447-F521 HydrophobicContact CD1-CD1 3.42Å; I447-F521 VanDerWaalsContact CD1-CD1 3.42Å; I447-F521 HydrophobicContact CD1-CE1 3.47Å; I447-F521 VanDerWaalsContact CD1-CE1 3.47Å; I447-F521 HydrophobicContact CD1-CG 4.07Å; I447-F521 HydrophobicContact CD1-CZ 4.12Å; I447-F521 HydrophobicContact CG1-CD1 4.31Å; I447-F521 HydrophobicContact CG1-CE1 4.36Å; I447-I523 HydrophobicContact CG2-CD1 4.06Å; I447-I548 HydrophobicContact CG2-CD1 4.46Å
448	N	85.3	Confident	70.2	Confident	38 Å²	38	72.8 Å²	72.8	20%	0.203	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	154.5	177	53.3	-2.7	0	0	0	114.4	V435 G436 Q502 W503	V435-N448 PolarHBondContact N-O 3.04Å; G436-N448 VanDerWaalsContact CA-OD1 3.24Å; G436-N448 WeakPolarHBondContact CA-OD1 3.34Å; G436-N448 PolarHBondContact N-OD1 2.96Å; G436-N448 PolarHBondContact O-N 3.12Å; G436-N448 VanDerWaalsContact O-N 3.1Å; G436-N448 PolarHBondContact O-OD1 2.88Å; N448-Q502 CarbonylContact C-O 3.14Å; N448-Q502 VanDerWaalsContact CA-O 3.27Å; N448-Q502 WeakPolarHBondContact CA-O 3.41Å; N448-Q502 WeakPolarHBondContact CB-O 3.43Å; N448-W503 HydrophobicContact CB-CB 3.79Å
449	W	83.8	Confident	68.7	Low	0 Å²	0	70 Å²	70	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	166.1	-175.1	65.1	99.1	0	0	0	113.4	V433 A434 Y464 I466 T482 F501 Q502 T504 I523	V433-W449 CarbonylContact O-C 3.43Å; V433-W449 WeakPolarHBondContact O-CA 3.24Å; V433-W449 WeakPolarHBondContact O-CB 3.38Å; A434-W449 HydrophobicContact CB-CB 4.47Å; W449-Y464 HydrophobicContact CZ2-CD2 4.22Å; W449-Y464 HydrophobicContact CZ2-CG 4.31Å; W449-Y464 AromaticContact NE1-CD1 3.6Å; W449-Y464 AromaticContact NE1-CD2 3.61Å; W449-Y464 AromaticContact NE1-CE1 3.86Å; W449-Y464 AromaticContact NE1-CE2 3.87Å; W449-Y464 AromaticContact NE1-CG 3.47Å; W449-Y464 AromaticContact NE1-CZ 4Å; W449-I466 HydrophobicContact CH2-CD1 3.54Å; W449-I466 HydrophobicContact CH2-CG1 4.28Å; W449-I466 HydrophobicContact CZ2-CD1 4.33Å; W449-I466 HydrophobicContact CZ3-CD1 3.68Å; W449-I466 HydrophobicContact CZ3-CG1 4.36Å; W449-T482 HydrophobicContact CH2-CG2 4.14Å; W449-T482 HydrophobicContact CZ2-CG2 4.08Å; W449-F501 CarbonylContact O-C 3.48Å; W449-F501 WeakPolarHBondContact O-CA 3.45Å; W449-Q502 HydrophobicContact CD2-CB 4.12Å; W449-Q502 HydrophobicContact CH2-CB 4.2Å; W449-Q502 HydrophobicContact CZ2-CB 3.58Å; W449-Q502 PolarHBondContact N-O 2.86Å; W449-Q502 PolarHBondContact O-N 2.86Å; W449-T504 HydrophobicContact CZ3-CG2 4.44Å; W449-I523 HydrophobicContact CB-CD1 3.64Å; W449-I523 HydrophobicContact CD2-CD1 3.71Å; W449-I523 HydrophobicContact CD2-CG2 4.34Å; W449-I523 HydrophobicContact CE3-CD1 3.55Å; W449-I523 HydrophobicContact CG-CD1 3.78Å; W449-I523 HydrophobicContact CG-CG2 4.27Å; W449-I523 HydrophobicContact CZ3-CD1 4.44Å
450	T	80.2	Confident	67.5	Low	37 Å²	37	76 Å²	76	23%	0.227	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	152.3	-178.8	65	0	0	0	0	113.4	P432 V433 V435 Q500 F501	P432-T450 WeakPolarHBondContact CB-O 3.49Å; V433-T450 HydrophobicContact CB-CG2 4.12Å; V433-T450 WeakPolarHBondContact CB-OG1 3.44Å; V433-T450 PolarHBondContact N-OG1 3.22Å; V433-T450 VanDerWaalsContact N-OG1 3.11Å; V433-T450 PolarHBondContact O-N 2.73Å; V433-T450 PolarHBondContact O-OG1 3.31Å; V435-T450 HydrophobicContact CG2-CG2 4.06Å; T450-Q500 VanDerWaalsContact CA-O 3.31Å; T450-Q500 WeakPolarHBondContact CA-O 3.38Å; T450-F501 HydrophobicContact CG2-CD1 4.49Å
451	C	67.2	Low	66.6	Low	32 Å²	32	78.8 Å²	78.8	22%	0.216	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-97.2	134.4	165.9	-65.5	0	0	0	0	112.3	Y464 Q500	C451-Y464 PolarHBondContact SG-OH 2.04Å; C451-Q500 PolarHBondContact N-O 2.85Å
452	S	59.1	Low	66.1	Low	38 Å²	38	73.6 Å²	73.6	27%	0.266	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-94.7	120.7	177.2	53	0	0	0	0	111.7	E454 S455	S452-E454 VanDerWaalsContact C-N 3.28Å; S452-E454 PolarHBondContact O-N 3.47Å; S452-S455 PolarHBondContact O-OG 3.11Å
453	N	53.8	Low	66.1	Low	130 Å²	130	72.1 Å²	72.1	70%	0.695	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-69.8	-14	-173.4	-81.9	-7.2	0	0	0	115.6	S455 S456	N453-S455 PolarHBondContact O-N 2.75Å; N453-S456 PolarHBondContact O-N 3.13Å; N453-S456 PolarHBondContact O-OG 2.89Å
454	E	55.6	Low	66.4	Low	156 Å²	156	68 Å²	68	73%	0.729	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-67.4	-19.3	-173.2	-61.9	-176.5	138.1	0	0	114.2	S452 S456	S452-E454 VanDerWaalsContact C-N 3.28Å; S452-E454 PolarHBondContact O-N 3.47Å; E454-S456 VanDerWaalsContact C-N 3.35Å; E454-S456 PolarHBondContact O-N 2.79Å
455	S	50.2	Low	66.5	Low	41 Å²	41	67 Å²	67	29%	0.287	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-82.2	-4.9	-177.9	58.3	0	0	0	0	114.9	S452 N453 S457 L459	S452-S455 PolarHBondContact O-OG 3.11Å; N453-S455 PolarHBondContact O-N 2.75Å; S455-S457 PolarHBondContact O-N 2.68Å; S455-S457 VanDerWaalsContact O-N 3.14Å; S455-L459 PolarHBondContact O-N 2.71Å
456	S	45.8	Very low	66.6	Low	103 Å²	103	67 Å²	67	72%	0.72	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-8.5	-166.2	73	0	0	0	0	115.9	N453 E454	N453-S456 PolarHBondContact O-N 3.13Å; N453-S456 PolarHBondContact O-OG 2.89Å; E454-S456 VanDerWaalsContact C-N 3.35Å; E454-S456 PolarHBondContact O-N 2.79Å
457	S	49.1	Very low	66.6	Low	101 Å²	101	65.1 Å²	65.1	71%	0.706	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-19.2	-176.7	56.4	0	0	0	0	114.4	S455	S455-S457 PolarHBondContact O-N 2.68Å; S455-S457 VanDerWaalsContact O-N 3.14Å
458	I	53.2	Low	66.7	Low	150 Å²	150	65.7 Å²	65.7	77%	0.769	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.3	-21.6	-170.6	-67.8	169.9	0	0	0	112.3
459	L	50.3	Low	66.5	Low	49 Å²	49	66.2 Å²	66.2	26%	0.257	36%	0.361	S	S	.	.			trans	-117.4	122.6	-169.3	-79.6	148.4	0	0	0	113.6	S455 V527	S455-L459 PolarHBondContact O-N 2.71Å; L459-V527 HydrophobicContact CD1-CG2 3.5Å; L459-V527 VanDerWaalsContact CD1-CG2 3.5Å; L459-V527 HydrophobicContact CD2-CB 4.18Å; L459-V527 HydrophobicContact CD2-CG1 3.9Å; L459-V527 HydrophobicContact CD2-CG2 3.77Å; L459-V527 HydrophobicContact CG-CG2 4.25Å
460	K	55.4	Low	66.2	Low	210 Å²	210	66.4 Å²	66.4	91%	0.913	36%	0.362	S	S	*	.	S	Bend	trans	-79.3	-20.2	-178.4	-78.7	-172.4	173.4	-178.8	0	115.5
461	N	59.8	Low	65.9	Low	124 Å²	124	69.1 Å²	69.1	66%	0.663	37%	0.372	S	S	*	.	S	Bend	trans	-156.9	115	173.7	-85.2	-44.8	0	0	0	108.1
462	P	63.2	Low	65.8	Low	67 Å²	67	67.7 Å²	67.7	44%	0.435	36%	0.362	S	S	.	.			trans	-73.8	135.3	171.7	30.2	-32.7	0	0	0	110.3	Y464	P462-Y464 HydrophobicContact CB-CE2 4.42Å
463	Q	71.8	Confident	65.9	Low	63 Å²	63	69.8 Å²	69.8	29%	0.294	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	145.1	171.3	-68.5	172.8	-49.8	0	0	109.4	L481 S525 S526	Q463-L481 HydrophobicContact CB-CD1 4.41Å; Q463-S525 CarbonylContact O-C 3.54Å; Q463-S525 WeakPolarHBondContact O-CA 3.38Å; Q463-S526 PolarHBondContact O-N 3Å
464	Y	78.4	Confident	65.9	Low	9 Å²	9	69 Å²	69	4%	0.035	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	142.9	174.3	-60	-79.7	0	0	0	111	P432 W449 C451 P462 T482 I523 R524	P432-Y464 HydrophobicContact CB-CE1 4.25Å; P432-Y464 HydrophobicContact CG-CD1 4.21Å; P432-Y464 HydrophobicContact CG-CE1 4.32Å; W449-Y464 HydrophobicContact CZ2-CD2 4.22Å; W449-Y464 HydrophobicContact CZ2-CG 4.31Å; W449-Y464 AromaticContact NE1-CD1 3.6Å; W449-Y464 AromaticContact NE1-CD2 3.61Å; W449-Y464 AromaticContact NE1-CE1 3.86Å; W449-Y464 AromaticContact NE1-CE2 3.87Å; W449-Y464 AromaticContact NE1-CG 3.47Å; W449-Y464 AromaticContact NE1-CZ 4Å; C451-Y464 PolarHBondContact SG-OH 2.04Å; P462-Y464 HydrophobicContact CB-CE2 4.42Å; Y464-T482 PolarHBondContact N-OG1 3.21Å; Y464-T482 PolarHBondContact O-N 2.8Å; Y464-T482 PolarHBondContact O-OG1 3.15Å; Y464-T482 VanDerWaalsContact O-OG1 3.07Å; Y464-I523 HydrophobicContact CD1-CG2 4.41Å; Y464-R524 CarbonylContact C-O 3.53Å; Y464-R524 VanDerWaalsContact CA-O 3.25Å; Y464-R524 WeakPolarHBondContact CA-O 3.32Å
465	L	82.2	Confident	65.9	Low	20 Å²	20	63 Å²	63	11%	0.105	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	108.4	175.5	-173.2	75.1	0	0	0	108.4	C479 L481 I523 R524	L465-C479 HydrophobicContact CD1-CB 3.79Å; L465-C479 HydrophobicContact CD2-CB 4.06Å; L465-C479 HydrophobicContact CG-CB 3.84Å; L465-L481 HydrophobicContact CB-CD1 4.28Å; L465-L481 HydrophobicContact CD1-CB 4.07Å; L465-L481 HydrophobicContact CD1-CD1 3.92Å; L465-I523 WeakPolarHBondContact O-CA 3.18Å; L465-R524 HydrophobicContact CB-CB 4.36Å; L465-R524 PolarHBondContact N-O 3.09Å; L465-R524 PolarHBondContact O-N 3.45Å
466	I	85.3	Confident	66.5	Low	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	106.2	-179.6	-55.9	168.6	0	0	0	107.6	I447 W449 W468 C479 L480 T482 T504 I506 I523	I447-I466 HydrophobicContact CD1-CG2 3.94Å; W449-I466 HydrophobicContact CH2-CD1 3.54Å; W449-I466 HydrophobicContact CH2-CG1 4.28Å; W449-I466 HydrophobicContact CZ2-CD1 4.33Å; W449-I466 HydrophobicContact CZ3-CD1 3.68Å; W449-I466 HydrophobicContact CZ3-CG1 4.36Å; I466-W468 WeakPolarHBondContact O-CZ3 3.42Å; I466-C479 CarbonylContact O-C 3.57Å; I466-C479 WeakPolarHBondContact O-CA 3.32Å; I466-L480 PolarHBondContact N-O 2.8Å; I466-L480 PolarHBondContact O-N 3.31Å; I466-T482 HydrophobicContact CD1-CG2 3.66Å; I466-T482 HydrophobicContact CG1-CG2 4.05Å; I466-T504 HydrophobicContact CD1-CG2 3.41Å; I466-T504 VanDerWaalsContact CD1-CG2 3.41Å; I466-I506 HydrophobicContact CG2-CD1 4.26Å; I466-I523 HydrophobicContact CG1-CG1 4.3Å; I466-I523 HydrophobicContact CG1-CG2 4.36Å; I466-I523 HydrophobicContact CG2-CG1 4.31Å
467	C	85.2	Confident	67.8	Low	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	142.3	-179.2	-69.2	0	0	0	0	111.1	Q477 K478 C479 F521 T522	C467-Q477 HydrophobicContact CB-CG 3.81Å; C467-K478 CarbonylContact C-O 3.54Å; C467-K478 WeakPolarHBondContact CA-O 3.41Å; C467-C479 HydrophobicContact CB-CB 4.08Å; C467-C479 WeakPolarHBondContact CB-SG 3.48Å; C467-C479 WeakPolarHBondContact SG-CB 3.47Å; C467-C479 CovalentContact SG-SG 2.04Å; C467-C479 PolarHBondContact SG-SG 2.7Å; C467-F521 CarbonylContact O-C 3.6Å; C467-F521 WeakPolarHBondContact O-CA 3.41Å; C467-T522 WeakPolarHBondContact CA-O 3.41Å; C467-T522 WeakPolarHBondContact CB-O 3.39Å; C467-T522 PolarHBondContact N-O 3.48Å; C467-T522 PolarHBondContact O-N 3Å
468	W	85	Confident	69.2	Low	12 Å²	12	65.8 Å²	65.8	5%	0.045	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	151.1	171.4	64.4	92.5	0	0	0	111.8	I466 Q477 K478 L480 I506 V510 F511 I519 I520 F521	I466-W468 WeakPolarHBondContact O-CZ3 3.42Å; W468-Q477 CarbonylContact O-C 3.51Å; W468-Q477 WeakPolarHBondContact O-CA 3.42Å; W468-K478 HydrophobicContact CD2-CB 4.35Å; W468-K478 HydrophobicContact CZ2-CB 3.82Å; W468-K478 PolarHBondContact N-O 3.09Å; W468-K478 PolarHBondContact O-N 3.13Å; W468-L480 HydrophobicContact CH2-CB 4Å; W468-L480 HydrophobicContact CZ3-CB 3.71Å; W468-I506 HydrophobicContact CE3-CD1 3.99Å; W468-I506 HydrophobicContact CH2-CD1 4.39Å; W468-I506 HydrophobicContact CZ3-CD1 3.74Å; W468-V510 HydrophobicContact CH2-CG1 4.28Å; W468-V510 HydrophobicContact CZ2-CG1 3.64Å; W468-F511 AromaticContact CD1-CD1 3.85Å; W468-F511 AromaticContact CD1-CE1 3.35Å; W468-F511 HydrophobicContact CD2-CE1 4.14Å; W468-F511 HydrophobicContact CD2-CZ 4.41Å; W468-F511 AromaticContact CE2-CE1 3.97Å; W468-F511 AromaticContact CG-CE1 3.79Å; W468-F511 HydrophobicContact CG-CE1 3.79Å; W468-F511 HydrophobicContact CG-CZ 4.44Å; W468-F511 AromaticContact NE1-CD1 3.78Å; W468-F511 AromaticContact NE1-CE1 3.43Å; W468-I519 HydrophobicContact CB-CG2 4Å; W468-I520 CarbonylContact C-O 3.54Å; W468-I520 WeakPolarHBondContact CA-O 3.13Å; W468-I520 WeakPolarHBondContact CB-O 3.41Å; W468-F521 HydrophobicContact CB-CD1 3.52Å; W468-F521 HydrophobicContact CB-CE1 3.62Å; W468-F521 HydrophobicContact CB-CG 4.38Å; W468-F521 HydrophobicContact CG-CD1 4.41Å; W468-F521 HydrophobicContact CG-CE1 4.11Å
469	H	81.6	Confident	70.5	Confident	48 Å²	48	61.2 Å²	61.2	22%	0.222	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	159.3	165.3	69.9	102.3	0	0	0	109.7	Q477 I520	H469-Q477 HydrophobicContact CB-CB 4.4Å; H469-Q477 HydrophobicContact CB-CG 4.43Å; H469-I520 PolarHBondContact N-O 2.73Å; H469-I520 PolarHBondContact O-N 2.84Å
470	F	78.7	Confident	71.8	Confident	5 Å²	5	61 Å²	61	2%	0.022	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	136	162.1	-68.1	-75.9	0	0	0	108.4	S472 F473 F511 E513 A514 I519	F470-S472 WeakPolarHBondContact CB-OG 3.44Å; F470-S472 PolarHBondContact O-N 2.78Å; F470-S472 VanDerWaalsContact O-N 3.12Å; F470-F473 HydrophobicContact CB-CB 4.38Å; F470-F473 HydrophobicContact CB-CD2 4.18Å; F470-F473 HydrophobicContact CG-CD2 4.31Å; F470-F511 HydrophobicContact CZ-CB 4.04Å; F470-F511 HydrophobicContact CZ-CD1 4.24Å; F470-E513 HydrophobicContact CD2-CB 4.43Å; F470-E513 HydrophobicContact CE2-CB 3.8Å; F470-E513 HydrophobicContact CZ-CB 4.26Å; F470-A514 HydrophobicContact CE1-CB 3.7Å; F470-A514 HydrophobicContact CZ-CB 3.8Å; F470-I519 HydrophobicContact CD1-CG1 3.86Å; F470-I519 HydrophobicContact CE1-CD1 4.25Å; F470-I519 HydrophobicContact CE1-CG1 3.66Å
471	H	73.4	Confident	72.7	Confident	94 Å²	94	53.2 Å²	53.2	44%	0.435	27%	0.27	S	S	.	.	S	Bend	trans	-68.7	-1.7	173.2	-179.2	71.3	0	0	0	113	R518 I520	H471-R518 HydrophobicContact CB-CB 4.15Å; H471-R518 VanDerWaalsContact CB-O 3.3Å; H471-R518 WeakPolarHBondContact CB-O 3.47Å; H471-R518 PolarHBondContact N-O 2.86Å; H471-I520 HydrophobicContact CB-CD1 3.81Å; H471-I520 HydrophobicContact CB-CG1 4.31Å; H471-I520 WeakPolarHBondContact ND1-CD1 3.32Å
472	S	64.2	Low	73.1	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.007	24%	0.242	C	C	.	.	S	Bend		-132.5	0	-120.2	92	0	0	0	0	124.6	F470 G517 Y559 F560	F470-S472 WeakPolarHBondContact CB-OG 3.44Å; F470-S472 PolarHBondContact O-N 2.78Å; F470-S472 VanDerWaalsContact O-N 3.12Å; S472-G517 WeakPolarHBondContact OG-CA 3.43Å; S472-Y559 CarbonylContact O-C 3.51Å; S472-Y559 WeakPolarHBondContact O-CA 3.2Å; S472-F560 WeakPolarHBondContact O-CB 3.46Å; S472-F560 WeakPolarHBondContact O-CD1 3.41Å; S472-F560 WeakPolarHBondContact O-CD2 3.46Å; S472-F560 WeakPolarHBondContact O-CE1 3.4Å; S472-F560 WeakPolarHBondContact O-CE2 3.42Å; S472-F560 WeakPolarHBondContact O-CG 3.5Å; S472-F560 WeakPolarHBondContact O-CZ 3.25Å; S472-F560 PolarHBondContact O-N 3.21Å; S472-F560 WeakPolarHBondContact OG-CE1 3.31Å; S472-F560 WeakPolarHBondContact OG-CZ 3.5Å
473	F	60.9	Low	72.8	Confident	83 Å²	83	50.4 Å²	50.4	36%	0.364	25%	0.248	S	C	.	.	S	Bend		0	141.2	0	-59.5	-81.2	0	0	0	114.9	F470 S475 E513 F560	F470-F473 HydrophobicContact CB-CB 4.38Å; F470-F473 HydrophobicContact CB-CD2 4.18Å; F470-F473 HydrophobicContact CG-CD2 4.31Å; F473-S475 PolarHBondContact O-N 3Å; F473-E513 WeakPolarHBondContact CE2-O 3.33Å; F473-F560 HydrophobicContact CB-CD1 3.42Å; F473-F560 VanDerWaalsContact CB-CD1 3.42Å; F473-F560 HydrophobicContact CB-CE1 3.96Å; F473-F560 HydrophobicContact CB-CG 4.44Å; F473-F560 AromaticContact CD1-CD1 3.27Å; F473-F560 HydrophobicContact CD1-CD1 3.27Å; F473-F560 AromaticContact CD1-CE1 3.69Å; F473-F560 HydrophobicContact CD1-CE1 3.69Å; F473-F560 AromaticContact CD2-CD1 3.97Å; F473-F560 HydrophobicContact CD2-CD1 3.97Å; F473-F560 AromaticContact CD2-CE1 3.31Å; F473-F560 HydrophobicContact CD2-CE1 3.31Å; F473-F560 HydrophobicContact CE1-CD1 4.01Å; F473-F560 AromaticContact CE1-CE1 4Å; F473-F560 HydrophobicContact CE1-CE1 4Å; F473-F560 AromaticContact CE2-CE1 3.66Å; F473-F560 HydrophobicContact CE2-CE1 3.66Å; F473-F560 AromaticContact CG-CD1 3.21Å; F473-F560 HydrophobicContact CG-CD1 3.21Å; F473-F560 AromaticContact CG-CE1 3.31Å; F473-F560 HydrophobicContact CG-CE1 3.31Å; F473-F560 AromaticContact CZ-CE1 3.98Å; F473-F560 HydrophobicContact CZ-CE1 3.98Å; F473-F560 VanDerWaalsContact N-CD2 3.32Å
474	L	53.9	Low	71.9	Confident	114 Å²	114	53.7 Å²	53.7	60%	0.597	27%	0.272	S	S	*	.			trans	-57.5	61.1	141.4	97	32.5	0	0	0	115.1	H561 T562	L474-H561 PolarHBondContact N-CE1 2.72Å; L474-H561 VanDerWaalsContact N-CE1 3.32Å; L474-H561 PolarHBondContact N-ND1 3.29Å; L474-T562 HydrophobicContact CD1-CG2 3.51Å; L474-T562 WeakPolarHBondContact CD1-OG1 3.39Å
475	S	57	Low	70.5	Confident	29 Å²	29	57.6 Å²	57.6	20%	0.203	30%	0.301	C	S	.	.			trans	-91.7	151.1	168	-166.1	0	0	0	0	110.3	F473 E513	F473-S475 PolarHBondContact O-N 3Å; S475-E513 PolarHBondContact OG-OE2 3.49Å
476	E	61.4	Low	68.6	Low	165 Å²	165	60.9 Å²	60.9	77%	0.771	33%	0.325	S	S	*	.			trans	-58.5	143.3	177	-69	179.3	142.1	0	0	111.1	K478	E476-K478 PolarHBondContact O-N 3.49Å
477	Q	73.4	Confident	66.6	Low	73 Å²	73	68.7 Å²	68.7	34%	0.341	36%	0.359	S	S	.	.			trans	-69.5	105.9	173.8	-170.2	-177.9	44	0	0	108.8	C467 W468 H469 T522	C467-Q477 HydrophobicContact CB-CG 3.81Å; W468-Q477 CarbonylContact O-C 3.51Å; W468-Q477 WeakPolarHBondContact O-CA 3.42Å; H469-Q477 HydrophobicContact CB-CB 4.4Å; H469-Q477 HydrophobicContact CB-CG 4.43Å; Q477-T522 PolarHBondContact NE2-OG1 2.77Å
478	K	79.3	Confident	64.7	Low	66 Å²	66	78.9 Å²	78.9	29%	0.287	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	133	179.4	-71.7	164.9	-175.8	167.2	0	108.3	C467 W468 E476 E513	C467-K478 CarbonylContact C-O 3.54Å; C467-K478 WeakPolarHBondContact CA-O 3.41Å; W468-K478 HydrophobicContact CD2-CB 4.35Å; W468-K478 HydrophobicContact CZ2-CB 3.82Å; W468-K478 PolarHBondContact N-O 3.09Å; W468-K478 PolarHBondContact O-N 3.13Å; E476-K478 PolarHBondContact O-N 3.49Å; K478-E513 IonicContact NZ-OE1 2.85Å; K478-E513 PolarHBondContact NZ-OE1 3.26Å; K478-E513 IonicContact NZ-OE2 2.89Å; K478-E513 PolarHBondContact NZ-OE2 3.04Å
479	C	80	Confident	62.8	Low	53 Å²	53	87.1 Å²	87.1	36%	0.358	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.7	-175.6	-56.4	0	0	0	0	111.6	L465 I466 C467	L465-C479 HydrophobicContact CD1-CB 3.79Å; L465-C479 HydrophobicContact CD2-CB 4.06Å; L465-C479 HydrophobicContact CG-CB 3.84Å; I466-C479 CarbonylContact O-C 3.57Å; I466-C479 WeakPolarHBondContact O-CA 3.32Å; C467-C479 HydrophobicContact CB-CB 4.08Å; C467-C479 WeakPolarHBondContact CB-SG 3.48Å; C467-C479 WeakPolarHBondContact SG-CB 3.47Å; C467-C479 CovalentContact SG-SG 2.04Å; C467-C479 PolarHBondContact SG-SG 2.7Å
480	L	78.4	Confident	61.2	Low	45 Å²	45	88.2 Å²	88.2	24%	0.236	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.5	174.5	-168.2	78.9	0	0	0	108.9	I466 W468 L490 A491	I466-L480 PolarHBondContact N-O 2.8Å; I466-L480 PolarHBondContact O-N 3.31Å; W468-L480 HydrophobicContact CH2-CB 4Å; W468-L480 HydrophobicContact CZ3-CB 3.71Å; L480-L490 HydrophobicContact CD1-CD2 4.06Å; L480-A491 HydrophobicContact CD2-CB 3.95Å
481	L	74	Confident	59.6	Low	47 Å²	47	88.5 Å²	88.5	25%	0.246	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	128.4	173	-168.2	77.4	0	0	0	109.4	Q463 L465 Q483	Q463-L481 HydrophobicContact CB-CD1 4.41Å; L465-L481 HydrophobicContact CB-CD1 4.28Å; L465-L481 HydrophobicContact CD1-CB 4.07Å; L465-L481 HydrophobicContact CD1-CD1 3.92Å; L481-Q483 PolarHBondContact O-N 2.9Å
482	T	67.8	Low	58.4	Low	12 Å²	12	90.9 Å²	90.9	7%	0.074	46%	0.459	C	S	.	.			trans	-69.7	116.9	176.6	60.7	0	0	0	0	110	W449 Y464 I466 C493	W449-T482 HydrophobicContact CH2-CG2 4.14Å; W449-T482 HydrophobicContact CZ2-CG2 4.08Å; Y464-T482 PolarHBondContact N-OG1 3.21Å; Y464-T482 PolarHBondContact O-N 2.8Å; Y464-T482 PolarHBondContact O-OG1 3.15Å; Y464-T482 VanDerWaalsContact O-OG1 3.07Å; I466-T482 HydrophobicContact CD1-CG2 3.66Å; I466-T482 HydrophobicContact CG1-CG2 4.05Å; T482-C493 WeakPolarHBondContact CG2-SG 3.39Å
483	Q	56.7	Low	57.8	Low	119 Å²	119	92.2 Å²	92.2	56%	0.556	47%	0.468	S	S	*	.			trans	-109.4	136	174.6	-68.4	-166.2	-5	0	0	111.5	L481 S485	L481-Q483 PolarHBondContact O-N 2.9Å; Q483-S485 PolarHBondContact O-N 2.81Å
484	T	53.9	Low	57.2	Low	133 Å²	133	96.9 Å²	96.9	82%	0.816	48%	0.484	S	S	*	.	S	Bend	trans	-82.6	35.2	-179.4	55	0	0	0	0	113
485	S	48.8	Very low	57	Low	90 Å²	90	94.9 Å²	94.9	63%	0.629	48%	0.479	S	S	*	.	S	Bend	trans	-150.2	136.9	-174.6	-170.8	0	0	0	0	112.5	Q483	Q483-S485 PolarHBondContact O-N 2.81Å
486	S	41.3	Very low	56.6	Low	89 Å²	89	98 Å²	98	62%	0.622	49%	0.494	S	S	*	.			trans	-86.3	113.2	-164.6	59.1	0	0	0	0	114.4
487	K	43.1	Very low	56.3	Low	165 Å²	165	99.8 Å²	99.8	72%	0.717	50%	0.502	S	S	*	.			trans	-135.7	151.9	156.8	-73	-171.3	179	176.4	0	110.7	E489 L490	K487-E489 VanDerWaalsContact C-N 3.28Å; K487-E489 PolarHBondContact O-N 2.97Å; K487-L490 HydrophobicContact CB-CD1 4.47Å; K487-L490 PolarHBondContact O-N 3.25Å
488	K	45.9	Very low	55.4	Low	214 Å²	214	105 Å²	105	93%	0.93	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	0.4	-150.5	-95.6	-172.8	172.6	-174.1	0	119.6
489	E	44.7	Very low	54.2	Low	184 Å²	184	107.3 Å²	107.3	86%	0.86	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	11.8	-176.6	-61	-174.9	144	0	0	113	K487	K487-E489 VanDerWaalsContact C-N 3.28Å; K487-E489 PolarHBondContact O-N 2.97Å
490	L	49.3	Very low	53.5	Low	71 Å²	71	111.3 Å²	111.3	37%	0.372	55%	0.552	S	S	.	*	S	Bend	trans	-113	144.3	-169.4	-69.8	163.8	0	0	0	112.3	L480 K487	L480-L490 HydrophobicContact CD1-CD2 4.06Å; K487-L490 HydrophobicContact CB-CD1 4.47Å; K487-L490 PolarHBondContact O-N 3.25Å
491	A	44.7	Very low	53	Low	11 Å²	11	113.9 Å²	113.9	9%	0.091	56%	0.561	C	S	.	*			trans	-78.3	127.3	-174.7	0	0	0	0	0	111.4	L480 T504 V505	L480-A491 HydrophobicContact CD2-CB 3.95Å; A491-T504 HydrophobicContact CB-CG2 3.45Å; A491-T504 VanDerWaalsContact CB-CG2 3.45Å; A491-T504 WeakPolarHBondContact CB-OG1 3.21Å; A491-V505 WeakPolarHBondContact CB-O 3.15Å
492	Y	47.1	Very low	52.9	Low	145 Å²	145	112.4 Å²	112.4	57%	0.569	55%	0.553	S	S	*	*			trans	-79.9	140	-175.8	-65.5	-94.9	0	0	0	111.1	T504	Y492-T504 PolarHBondContact O-OG1 3.07Å
493	C	52.3	Low	53.1	Low	28 Å²	28	118.1 Å²	118.1	19%	0.189	57%	0.573	C	S	.	*			trans	-115.4	134.2	165.8	-65.9	0	0	0	0	109.1	T482	T482-C493 WeakPolarHBondContact CG2-SG 3.39Å
494	Y	48.8	Very low	54	Low	181 Å²	181	112.4 Å²	112.4	71%	0.71	55%	0.547	S	S	*	.			trans	-122.6	133.7	168.8	-118.3	-97.2	0	0	0	108
495	C	48.3	Very low	55.1	Low	72 Å²	72	108.2 Å²	108.2	49%	0.486	52%	0.521	S	S	.	.			trans	-126.8	91.4	175.3	-143.9	0	0	0	0	107.7	Q502	C495-Q502 HydrophobicContact CB-CG 4.18Å; C495-Q502 PolarHBondContact SG-NE2 2.89Å
496	D	50.2	Low	56.4	Low	96 Å²	96	104.1 Å²	104.1	51%	0.513	49%	0.492	S	S	.	.			trans	-78.4	142	171.5	-174.1	6.2	0	0	0	109.2	Q498 Q499	D496-Q498 PolarHBondContact O-N 2.88Å; D496-Q499 PolarHBondContact O-N 2.84Å
497	Q	53.8	Low	58.1	Low	202 Å²	202	102 Å²	102	94%	0.944	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-11.5	-176.1	-71.2	-170.4	-23.9	0	0	113.5
498	Q	55.5	Low	59.7	Low	181 Å²	181	96.1 Å²	96.1	85%	0.846	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-3.5	175.3	-61.5	-164	-3.7	0	0	114.9	D496	D496-Q498 PolarHBondContact O-N 2.88Å
499	Q	54.4	Low	60.9	Low	116 Å²	116	90 Å²	90	54%	0.542	44%	0.436	S	S	.	.			trans	-125.1	123.7	179	-63.3	-161.6	8.6	0	0	112.3	D496 F501	D496-Q499 PolarHBondContact O-N 2.84Å; Q499-F501 HydrophobicContact CB-CD2 4.18Å; Q499-F501 PolarHBondContact O-N 2.82Å
500	Q	64.7	Low	62.3	Low	137 Å²	137	84.2 Å²	84.2	64%	0.64	41%	0.413	S	S	*	.	S	Bend	trans	-74.9	12.1	-178.5	-67.4	-174	-25.3	0	0	114.1	T450 C451	T450-Q500 VanDerWaalsContact CA-O 3.31Å; T450-Q500 WeakPolarHBondContact CA-O 3.38Å; C451-Q500 PolarHBondContact N-O 2.85Å
501	F	68.6	Low	63.4	Low	98 Å²	98	81.1 Å²	81.1	43%	0.43	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.8	-168.8	-31.1	-72.2	0	0	0	111.3	W449 T450 Q499	W449-F501 CarbonylContact O-C 3.48Å; W449-F501 WeakPolarHBondContact O-CA 3.45Å; T450-F501 HydrophobicContact CG2-CD1 4.49Å; Q499-F501 HydrophobicContact CB-CD2 4.18Å; Q499-F501 PolarHBondContact O-N 2.82Å
502	Q	72	Confident	64.3	Low	17 Å²	17	89.6 Å²	89.6	8%	0.079	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	161.6	160.6	-72.5	-169.3	12.4	0	0	110.3	N448 W449 C495	N448-Q502 CarbonylContact C-O 3.14Å; N448-Q502 VanDerWaalsContact CA-O 3.27Å; N448-Q502 WeakPolarHBondContact CA-O 3.41Å; N448-Q502 WeakPolarHBondContact CB-O 3.43Å; W449-Q502 HydrophobicContact CD2-CB 4.12Å; W449-Q502 HydrophobicContact CH2-CB 4.2Å; W449-Q502 HydrophobicContact CZ2-CB 3.58Å; W449-Q502 PolarHBondContact N-O 2.86Å; W449-Q502 PolarHBondContact O-N 2.86Å; C495-Q502 HydrophobicContact CB-CG 4.18Å; C495-Q502 PolarHBondContact SG-NE2 2.89Å
503	W	70.1	Confident	65	Low	131 Å²	131	86.3 Å²	86.3	50%	0.496	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	165.5	-178.4	60.5	-76.1	0	0	0	110.8	L446 I447 N448 V505	L446-W503 HydrophobicContact CD1-CB 4.48Å; L446-W503 HydrophobicContact CD1-CD2 4.48Å; L446-W503 HydrophobicContact CD1-CE3 3.56Å; L446-W503 HydrophobicContact CD1-CZ3 4.19Å; I447-W503 CarbonylContact O-C 3.43Å; I447-W503 WeakPolarHBondContact O-CA 3.38Å; I447-W503 WeakPolarHBondContact O-CB 3.26Å; N448-W503 HydrophobicContact CB-CB 3.79Å; W503-V505 HydrophobicContact CE3-CG2 4.47Å; W503-V505 HydrophobicContact CZ3-CG2 4.26Å
504	T	76.1	Confident	65.2	Low	0 Å²	0	86.5 Å²	86.5	0%	0	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	157.9	-179.2	-120.6	0	0	0	0	111.5	L446 I447 W449 I466 A491 Y492 I506	L446-T504 CarbonylContact C-O 3.52Å; L446-T504 WeakPolarHBondContact CA-O 3.46Å; I447-T504 PolarHBondContact N-O 2.81Å; I447-T504 PolarHBondContact O-N 3.49Å; W449-T504 HydrophobicContact CZ3-CG2 4.44Å; I466-T504 HydrophobicContact CD1-CG2 3.41Å; I466-T504 VanDerWaalsContact CD1-CG2 3.41Å; A491-T504 HydrophobicContact CB-CG2 3.45Å; A491-T504 VanDerWaalsContact CB-CG2 3.45Å; A491-T504 WeakPolarHBondContact CB-OG1 3.21Å; Y492-T504 PolarHBondContact O-OG1 3.07Å; T504-I506 HydrophobicContact CG2-CG1 4.02Å
505	V	76.6	Confident	65.5	Low	45 Å²	45	86.8 Å²	86.8	27%	0.273	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127	176.3	-176.9	0	0	0	0	110.4	L440 D444 I445 L446 A491 W503	L440-V505 HydrophobicContact CD1-CG1 4.15Å; L440-V505 HydrophobicContact CD1-CG2 4.49Å; D444-V505 HydrophobicContact CB-CG1 3.7Å; I445-V505 CarbonylContact O-C 3.58Å; I445-V505 WeakPolarHBondContact O-CA 3.37Å; L446-V505 HydrophobicContact CD1-CG2 3.99Å; A491-V505 WeakPolarHBondContact CB-O 3.15Å; W503-V505 HydrophobicContact CE3-CG2 4.47Å; W503-V505 HydrophobicContact CZ3-CG2 4.26Å
506	I	77.5	Confident	65.9	Low	4 Å²	4	85.5 Å²	85.5	2%	0.021	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121.4	178	-49.7	-174.8	0	0	0	109.1	I445 I447 I466 W468 T504 V510 F511	I445-I506 PolarHBondContact N-O 2.87Å; I445-I506 PolarHBondContact O-N 2.89Å; I447-I506 HydrophobicContact CD1-CD1 3.58Å; I447-I506 HydrophobicContact CD1-CG1 4.08Å; I466-I506 HydrophobicContact CG2-CD1 4.26Å; W468-I506 HydrophobicContact CE3-CD1 3.99Å; W468-I506 HydrophobicContact CH2-CD1 4.39Å; W468-I506 HydrophobicContact CZ3-CD1 3.74Å; T504-I506 HydrophobicContact CG2-CG1 4.02Å; I506-V510 HydrophobicContact CG2-CB 4.1Å; I506-V510 HydrophobicContact CG2-CG1 4.27Å; I506-V510 HydrophobicContact CG2-CG2 3.95Å; I506-F511 HydrophobicContact CB-CE2 4.2Å; I506-F511 HydrophobicContact CB-CZ 4.39Å; I506-F511 HydrophobicContact CG2-CE2 3.63Å; I506-F511 HydrophobicContact CG2-CZ 3.93Å
507	P	77.4	Confident	66.7	Low	43 Å²	43	81 Å²	81	28%	0.279	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	142.5	-178.8	-25.5	35.3	0	0	0	114.2	D444 S509 V510 F511	D444-P507 WeakPolarHBondContact OD1-CA 3.15Å; D444-P507 WeakPolarHBondContact OD1-CB 3.48Å; P507-S509 PolarHBondContact O-N 2.66Å; P507-S509 VanDerWaalsContact O-N 3.09Å; P507-V510 HydrophobicContact CB-CG2 4.43Å; P507-V510 VanDerWaalsContact O-CB 3.32Å; P507-V510 WeakPolarHBondContact O-CB 3.44Å; P507-V510 WeakPolarHBondContact O-CG2 3.2Å; P507-V510 PolarHBondContact O-N 3.32Å; P507-F511 WeakPolarHBondContact O-CD2 3.45Å; P507-F511 WeakPolarHBondContact O-CE2 3.39Å
508	L	74.8	Confident	67.9	Low	43 Å²	43	76.5 Å²	76.5	23%	0.225	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-62.8	-21.9	179.4	-166.8	68.3	0	0	0	111.9	L439 N443 I445 V510 F511 L552	L439-L508 HydrophobicContact CD1-CD1 4.26Å; L439-L508 HydrophobicContact CD1-CD2 4.42Å; N443-L508 HydrophobicContact CB-CB 4.23Å; N443-L508 HydrophobicContact CB-CD2 4.04Å; N443-L508 WeakPolarHBondContact O-CB 3.32Å; N443-L508 PolarHBondContact O-N 3.26Å; I445-L508 HydrophobicContact CD1-CD1 3.87Å; I445-L508 HydrophobicContact CG1-CD1 4.33Å; L508-V510 PolarHBondContact O-N 3.44Å; L508-F511 HydrophobicContact CD1-CD2 4.37Å; L508-F511 WeakPolarHBondContact O-CB 3.31Å; L508-F511 PolarHBondContact O-N 3.31Å; L508-L552 HydrophobicContact CD1-CD2 4.27Å
509	S	71.5	Confident	69.2	Low	85 Å²	85	68 Å²	68	59%	0.594	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-64.2	-17.9	173.5	63.7	0	0	0	0	114.8	P507 F511 K512	P507-S509 PolarHBondContact O-N 2.66Å; P507-S509 VanDerWaalsContact O-N 3.09Å; S509-F511 VanDerWaalsContact C-N 3.26Å; S509-K512 WeakPolarHBondContact O-CE 3.43Å; S509-K512 WeakPolarHBondContact O-CG 3.47Å
510	V	74	Confident	70.7	Confident	63 Å²	63	62.6 Å²	62.6	38%	0.382	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-68.3	-29.9	170.3	179.2	0	0	0	0	110.6	W468 I506 P507 L508 K512	W468-V510 HydrophobicContact CH2-CG1 4.28Å; W468-V510 HydrophobicContact CZ2-CG1 3.64Å; I506-V510 HydrophobicContact CG2-CB 4.1Å; I506-V510 HydrophobicContact CG2-CG1 4.27Å; I506-V510 HydrophobicContact CG2-CG2 3.95Å; P507-V510 HydrophobicContact CB-CG2 4.43Å; P507-V510 VanDerWaalsContact O-CB 3.32Å; P507-V510 WeakPolarHBondContact O-CB 3.44Å; P507-V510 WeakPolarHBondContact O-CG2 3.2Å; P507-V510 PolarHBondContact O-N 3.32Å; L508-V510 PolarHBondContact O-N 3.44Å; V510-K512 VanDerWaalsContact C-N 3.29Å; V510-K512 PolarHBondContact O-N 3.27Å; V510-K512 VanDerWaalsContact O-N 3.1Å
511	F	73.5	Confident	71.8	Confident	6 Å²	6	56 Å²	56	3%	0.026	28%	0.277	C	S	.	.			trans	-89.9	48.5	-172.7	-57.8	-97.1	0	0	0	111.8	I445 W468 F470 I506 P507 L508 S509 E513 A514 I519 F521	I445-F511 HydrophobicContact CD1-CD2 4.2Å; I445-F511 HydrophobicContact CD1-CE1 4.38Å; I445-F511 HydrophobicContact CD1-CE2 3.76Å; I445-F511 HydrophobicContact CD1-CZ 3.86Å; W468-F511 AromaticContact CD1-CD1 3.85Å; W468-F511 AromaticContact CD1-CE1 3.35Å; W468-F511 HydrophobicContact CD2-CE1 4.14Å; W468-F511 HydrophobicContact CD2-CZ 4.41Å; W468-F511 AromaticContact CE2-CE1 3.97Å; W468-F511 AromaticContact CG-CE1 3.79Å; W468-F511 HydrophobicContact CG-CE1 3.79Å; W468-F511 HydrophobicContact CG-CZ 4.44Å; W468-F511 AromaticContact NE1-CD1 3.78Å; W468-F511 AromaticContact NE1-CE1 3.43Å; F470-F511 HydrophobicContact CZ-CB 4.04Å; F470-F511 HydrophobicContact CZ-CD1 4.24Å; I506-F511 HydrophobicContact CB-CE2 4.2Å; I506-F511 HydrophobicContact CB-CZ 4.39Å; I506-F511 HydrophobicContact CG2-CE2 3.63Å; I506-F511 HydrophobicContact CG2-CZ 3.93Å; P507-F511 WeakPolarHBondContact O-CD2 3.45Å; P507-F511 WeakPolarHBondContact O-CE2 3.39Å; L508-F511 HydrophobicContact CD1-CD2 4.37Å; L508-F511 WeakPolarHBondContact O-CB 3.31Å; L508-F511 PolarHBondContact O-N 3.31Å; S509-F511 VanDerWaalsContact C-N 3.26Å; F511-E513 PolarHBondContact O-N 2.9Å; F511-A514 HydrophobicContact CB-CB 4.08Å; F511-A514 WeakPolarHBondContact O-CB 3.19Å; F511-A514 PolarHBondContact O-N 2.8Å; F511-I519 HydrophobicContact CD1-CD1 3.45Å; F511-I519 VanDerWaalsContact CD1-CD1 3.45Å; F511-I519 HydrophobicContact CD1-CG1 4.2Å; F511-I519 HydrophobicContact CE1-CD1 3.69Å; F511-I519 HydrophobicContact CE1-CG1 4.43Å; F511-I519 HydrophobicContact CE1-CG2 4.11Å; F511-I519 HydrophobicContact CG-CD1 4.1Å; F511-I519 HydrophobicContact CZ-CD1 4.49Å; F511-F521 HydrophobicContact CE1-CE1 4.09Å; F511-F521 HydrophobicContact CE1-CZ 4.05Å; F511-F521 AromaticContact CZ-CE1 3.95Å; F511-F521 HydrophobicContact CZ-CE1 3.95Å; F511-F521 AromaticContact CZ-CZ 3.96Å; F511-F521 HydrophobicContact CZ-CZ 3.96Å
512	K	63.5	Low	72.7	Confident	189 Å²	189	51.4 Å²	51.4	82%	0.822	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-15.9	-171.8	-62.6	-174	179.1	174.9	0	116.4	S509 V510	S509-K512 WeakPolarHBondContact O-CE 3.43Å; S509-K512 WeakPolarHBondContact O-CG 3.47Å; V510-K512 VanDerWaalsContact C-N 3.29Å; V510-K512 PolarHBondContact O-N 3.27Å; V510-K512 VanDerWaalsContact O-N 3.1Å
513	E	60.9	Low	73.4	Confident	76 Å²	76	50.6 Å²	50.6	36%	0.355	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.2	174.9	-72.7	134.6	-131.7	0	0	113.7	F470 F473 S475 K478 F511 K515	F470-E513 HydrophobicContact CD2-CB 4.43Å; F470-E513 HydrophobicContact CE2-CB 3.8Å; F470-E513 HydrophobicContact CZ-CB 4.26Å; F473-E513 WeakPolarHBondContact CE2-O 3.33Å; S475-E513 PolarHBondContact OG-OE2 3.49Å; K478-E513 IonicContact NZ-OE1 2.85Å; K478-E513 PolarHBondContact NZ-OE1 3.26Å; K478-E513 IonicContact NZ-OE2 2.89Å; K478-E513 PolarHBondContact NZ-OE2 3.04Å; F511-E513 PolarHBondContact O-N 2.9Å; E513-K515 PolarHBondContact O-N 2.97Å
514	A	56.2	Low	74	Confident	32 Å²	32	46.5 Å²	46.5	26%	0.264	24%	0.237	S	C	.	.			trans	-73.1	87.8	-172.8	0	0	0	0	0	113.4	F470 F511 L552	F470-A514 HydrophobicContact CE1-CB 3.7Å; F470-A514 HydrophobicContact CZ-CB 3.8Å; F511-A514 HydrophobicContact CB-CB 4.08Å; F511-A514 WeakPolarHBondContact O-CB 3.19Å; F511-A514 PolarHBondContact O-N 2.8Å; A514-L552 HydrophobicContact CB-CD1 3.64Å
515	K	55.9	Low	74.3	Confident	187 Å²	187	47.1 Å²	47.1	81%	0.813	24%	0.241	S	C	*	.	S	Bend	trans	-106	-19	172	-74.1	-159.3	170.8	-170.5	0	116.7	E513	E513-K515 PolarHBondContact O-N 2.97Å
516	S	56.6	Low	74.2	Confident	44 Å²	44	45 Å²	45	31%	0.308	23%	0.229	S	C	.	.	S	Bend	trans	-171.1	40.1	173.2	49.6	0	0	0	0	113.2	S553	S516-S553 WeakPolarHBondContact O-CB 3.27Å
517	G	67.6	Low	73.9	Confident	2 Å²	2	46 Å²	46	2%	0.021	24%	0.235	C	C	.	.			trans	-106.5	153.9	-168.3	0	0	0	0	0	116.4	S472 L552	S472-G517 WeakPolarHBondContact OG-CA 3.43Å; G517-L552 WeakPolarHBondContact O-CB 3.35Å; G517-L552 WeakPolarHBondContact O-CG 3.46Å; G517-L552 PolarHBondContact O-N 3.14Å
518	R	77.9	Confident	73.3	Confident	108 Å²	108	47.7 Å²	47.7	41%	0.408	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.8	158.4	-175.1	-178.5	-173.4	-164.6	-1.3	107.7	H471 S549 L550 N551	H471-R518 HydrophobicContact CB-CB 4.15Å; H471-R518 VanDerWaalsContact CB-O 3.3Å; H471-R518 WeakPolarHBondContact CB-O 3.47Å; H471-R518 PolarHBondContact N-O 2.86Å; R518-S549 VanDerWaalsContact CZ-OG 3.3Å; R518-S549 PolarHBondContact NE-OG 2.75Å; R518-S549 PolarHBondContact NH2-OG 2.75Å; R518-L550 CarbonylContact C-O 3.47Å; R518-L550 WeakPolarHBondContact CA-O 3.32Å; R518-N551 HydrophobicContact CG-CB 4.42Å
519	I	83	Confident	72.7	Confident	1 Å²	1	49 Å²	49	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	142.3	169.6	-59.1	161.8	0	0	0	107.7	I445 W468 F470 F511 F521 S549 L550 L552	I445-I519 HydrophobicContact CD1-CD1 3.87Å; W468-I519 HydrophobicContact CB-CG2 4Å; F470-I519 HydrophobicContact CD1-CG1 3.86Å; F470-I519 HydrophobicContact CE1-CD1 4.25Å; F470-I519 HydrophobicContact CE1-CG1 3.66Å; F511-I519 HydrophobicContact CD1-CD1 3.45Å; F511-I519 VanDerWaalsContact CD1-CD1 3.45Å; F511-I519 HydrophobicContact CD1-CG1 4.2Å; F511-I519 HydrophobicContact CE1-CD1 3.69Å; F511-I519 HydrophobicContact CE1-CG1 4.43Å; F511-I519 HydrophobicContact CE1-CG2 4.11Å; F511-I519 HydrophobicContact CG-CD1 4.1Å; F511-I519 HydrophobicContact CZ-CD1 4.49Å; I519-F521 HydrophobicContact CB-CE2 4.1Å; I519-F521 HydrophobicContact CB-CZ 4.29Å; I519-F521 HydrophobicContact CG2-CD1 4.42Å; I519-F521 HydrophobicContact CG2-CD2 4.07Å; I519-F521 HydrophobicContact CG2-CE1 3.92Å; I519-F521 HydrophobicContact CG2-CE2 3.55Å; I519-F521 HydrophobicContact CG2-CG 4.47Å; I519-F521 HydrophobicContact CG2-CZ 3.46Å; I519-F521 VanDerWaalsContact CG2-CZ 3.46Å; I519-S549 CarbonylContact O-C 3.56Å; I519-S549 VanDerWaalsContact O-CA 3.23Å; I519-S549 WeakPolarHBondContact O-CA 3.34Å; I519-L550 PolarHBondContact N-O 2.92Å; I519-L550 PolarHBondContact O-N 3.03Å; I519-L552 HydrophobicContact CD1-CD1 3.7Å; I519-L552 HydrophobicContact CD1-CD2 4.44Å; I519-L552 HydrophobicContact CD1-CG 4.19Å; I519-L552 HydrophobicContact CG1-CD1 4.15Å
520	I	85.6	Confident	72.1	Confident	3 Å²	3	51 Å²	51	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.8	169.8	-68.9	170.3	0	0	0	108.1	W468 H469 H471 E547 I548	W468-I520 CarbonylContact C-O 3.54Å; W468-I520 WeakPolarHBondContact CA-O 3.13Å; W468-I520 WeakPolarHBondContact CB-O 3.41Å; H469-I520 PolarHBondContact N-O 2.73Å; H469-I520 PolarHBondContact O-N 2.84Å; H471-I520 HydrophobicContact CB-CD1 3.81Å; H471-I520 HydrophobicContact CB-CG1 4.31Å; H471-I520 WeakPolarHBondContact ND1-CD1 3.32Å; I520-E547 HydrophobicContact CG2-CB 3.84Å; I520-E547 HydrophobicContact CG2-CG 3.66Å; I520-I548 CarbonylContact C-O 3.57Å; I520-I548 WeakPolarHBondContact CA-O 3.48Å
521	F	88.1	Confident	71.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	138.3	179.1	-63.6	-80.4	0	0	0	110.4	A437 I445 I447 C467 W468 F511 I519 E547 I548 L550	A437-F521 HydrophobicContact CB-CD2 3.82Å; A437-F521 HydrophobicContact CB-CE2 4.09Å; I445-F521 HydrophobicContact CD1-CZ 4.11Å; I445-F521 HydrophobicContact CG2-CE2 4.09Å; I445-F521 HydrophobicContact CG2-CZ 3.84Å; I447-F521 HydrophobicContact CD1-CD1 3.42Å; I447-F521 VanDerWaalsContact CD1-CD1 3.42Å; I447-F521 HydrophobicContact CD1-CE1 3.47Å; I447-F521 VanDerWaalsContact CD1-CE1 3.47Å; I447-F521 HydrophobicContact CD1-CG 4.07Å; I447-F521 HydrophobicContact CD1-CZ 4.12Å; I447-F521 HydrophobicContact CG1-CD1 4.31Å; I447-F521 HydrophobicContact CG1-CE1 4.36Å; C467-F521 CarbonylContact O-C 3.6Å; C467-F521 WeakPolarHBondContact O-CA 3.41Å; W468-F521 HydrophobicContact CB-CD1 3.52Å; W468-F521 HydrophobicContact CB-CE1 3.62Å; W468-F521 HydrophobicContact CB-CG 4.38Å; W468-F521 HydrophobicContact CG-CD1 4.41Å; W468-F521 HydrophobicContact CG-CE1 4.11Å; F511-F521 HydrophobicContact CE1-CE1 4.09Å; F511-F521 HydrophobicContact CE1-CZ 4.05Å; F511-F521 AromaticContact CZ-CE1 3.95Å; F511-F521 HydrophobicContact CZ-CE1 3.95Å; F511-F521 AromaticContact CZ-CZ 3.96Å; F511-F521 HydrophobicContact CZ-CZ 3.96Å; I519-F521 HydrophobicContact CB-CE2 4.1Å; I519-F521 HydrophobicContact CB-CZ 4.29Å; I519-F521 HydrophobicContact CG2-CD1 4.42Å; I519-F521 HydrophobicContact CG2-CD2 4.07Å; I519-F521 HydrophobicContact CG2-CE1 3.92Å; I519-F521 HydrophobicContact CG2-CE2 3.55Å; I519-F521 HydrophobicContact CG2-CG 4.47Å; I519-F521 HydrophobicContact CG2-CZ 3.46Å; I519-F521 VanDerWaalsContact CG2-CZ 3.46Å; F521-E547 WeakPolarHBondContact O-CA 3.49Å; F521-I548 PolarHBondContact N-O 2.78Å; F521-I548 PolarHBondContact O-N 3.43Å; F521-L550 HydrophobicContact CE2-CB 4.02Å
522	T	87.6	Confident	70.5	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.006	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	144.1	176.1	54.5	0	0	0	0	109.5	C467 Q477 N544 S545 E547	C467-T522 WeakPolarHBondContact CA-O 3.41Å; C467-T522 WeakPolarHBondContact CB-O 3.39Å; C467-T522 PolarHBondContact N-O 3.48Å; C467-T522 PolarHBondContact O-N 3Å; Q477-T522 PolarHBondContact NE2-OG1 2.77Å; T522-N544 HydrophobicContact CG2-CB 4.02Å; T522-S545 WeakPolarHBondContact CA-OG 3.24Å; T522-E547 HydrophobicContact CG2-CG 3.8Å
523	I	86.1	Confident	70.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135	-171.8	-56.4	167.6	0	0	0	109.2	P432 A434 I447 W449 Y464 L465 I466 S545	P432-I523 HydrophobicContact CG-CB 4.19Å; P432-I523 HydrophobicContact CG-CG2 3.85Å; A434-I523 HydrophobicContact CB-CD1 3.95Å; I447-I523 HydrophobicContact CG2-CD1 4.06Å; W449-I523 HydrophobicContact CB-CD1 3.64Å; W449-I523 HydrophobicContact CD2-CD1 3.71Å; W449-I523 HydrophobicContact CD2-CG2 4.34Å; W449-I523 HydrophobicContact CE3-CD1 3.55Å; W449-I523 HydrophobicContact CG-CD1 3.78Å; W449-I523 HydrophobicContact CG-CG2 4.27Å; W449-I523 HydrophobicContact CZ3-CD1 4.44Å; Y464-I523 HydrophobicContact CD1-CG2 4.41Å; L465-I523 WeakPolarHBondContact O-CA 3.18Å; I466-I523 HydrophobicContact CG1-CG1 4.3Å; I466-I523 HydrophobicContact CG1-CG2 4.36Å; I466-I523 HydrophobicContact CG2-CG1 4.31Å; I523-S545 PolarHBondContact N-OG 3.34Å; I523-S545 WeakPolarHBondContact O-CB 3.11Å; I523-S545 PolarHBondContact O-N 2.9Å
524	R	84.4	Confident	69.7	Low	45 Å²	45	56.5 Å²	56.5	17%	0.17	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	150.3	175.3	-52.3	-178.1	-172.8	130.2	14.9	110.2	Y464 L465 S542 N544	Y464-R524 CarbonylContact C-O 3.53Å; Y464-R524 VanDerWaalsContact CA-O 3.25Å; Y464-R524 WeakPolarHBondContact CA-O 3.32Å; L465-R524 HydrophobicContact CB-CB 4.36Å; L465-R524 PolarHBondContact N-O 3.09Å; L465-R524 PolarHBondContact O-N 3.45Å; R524-S542 VanDerWaalsContact CA-OG 3.3Å; R524-S542 WeakPolarHBondContact CA-OG 3.21Å; R524-S542 WeakPolarHBondContact CB-OG 3.39Å; R524-S542 WeakPolarHBondContact CD-O 3.3Å; R524-N544 VanDerWaalsContact CZ-OD1 3.3Å; R524-N544 PolarHBondContact NE-OD1 3.16Å; R524-N544 PolarHBondContact NH2-OD1 2.67Å
525	S	80.5	Confident	69.5	Low	12 Å²	12	66.1 Å²	66.1	8%	0.084	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	142.3	160.5	59	0	0	0	0	109.9	S430 Q463 Q541 S542	S430-S525 PolarHBondContact O-OG 2.8Å; Q463-S525 CarbonylContact O-C 3.54Å; Q463-S525 WeakPolarHBondContact O-CA 3.38Å; S525-Q541 CarbonylContact O-C 3.58Å; S525-Q541 WeakPolarHBondContact O-CA 3.46Å; S525-S542 PolarHBondContact N-OG 2.85Å; S525-S542 PolarHBondContact O-N 2.72Å; S525-S542 WeakPolarHBondContact OG-CB 3.43Å; S525-S542 PolarHBondContact OG-OG 2.92Å
526	S	75.6	Confident	69.5	Low	2 Å²	2	63 Å²	63	1%	0.014	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	146.2	178.4	-159.9	0	0	0	0	112.8	Q463 E539 Q541	Q463-S526 PolarHBondContact O-N 3Å; S526-E539 WeakPolarHBondContact CB-OE2 3.47Å; S526-E539 WeakPolarHBondContact OG-CB 3.39Å; S526-E539 PolarHBondContact OG-OE2 2.73Å; S526-Q541 WeakPolarHBondContact OG-CG 3.34Å
527	V	70.6	Confident	69.6	Low	25 Å²	25	67.6 Å²	67.6	15%	0.152	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	111.3	-171.4	164.2	0	0	0	0	110.5	P429 L459 E539 I540	P429-V527 HydrophobicContact CB-CG2 4.04Å; P429-V527 HydrophobicContact CG-CG2 3.82Å; L459-V527 HydrophobicContact CD1-CG2 3.5Å; L459-V527 VanDerWaalsContact CD1-CG2 3.5Å; L459-V527 HydrophobicContact CD2-CB 4.18Å; L459-V527 HydrophobicContact CD2-CG1 3.9Å; L459-V527 HydrophobicContact CD2-CG2 3.77Å; L459-V527 HydrophobicContact CG-CG2 4.25Å; V527-E539 CarbonylContact O-C 3.45Å; V527-E539 WeakPolarHBondContact O-CA 3.41Å; V527-I540 HydrophobicContact CB-CB 4.3Å; V527-I540 WeakPolarHBondContact CB-O 3.46Å; V527-I540 PolarHBondContact N-O 2.85Å; V527-I540 PolarHBondContact O-N 3.04Å
528	S	65.3	Low	69.4	Low	77 Å²	77	68.6 Å²	68.6	54%	0.538	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	127	175.1	-175.3	0	0	0	0	112
529	Q	63	Low	68.9	Low	70 Å²	70	67.2 Å²	67.2	33%	0.327	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-80.3	120.2	173.6	-66.3	-174.7	10.9	0	0	111.9	C532 C538 I540	Q529-C532 HydrophobicContact CB-CB 4.07Å; Q529-C538 PolarHBondContact N-O 2.92Å; Q529-I540 HydrophobicContact CG-CD1 3.99Å; Q529-I540 HydrophobicContact CG-CG1 3.92Å; Q529-I540 VanDerWaalsContact NE2-CG1 3.32Å
530	T	58.7	Low	68.4	Low	128 Å²	128	68.7 Å²	68.7	79%	0.785	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	139.5	163.7	54.1	0	0	0	0	110.8
531	N	57.4	Low	67.9	Low	164 Å²	164	71.8 Å²	71.8	88%	0.877	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	14.1	-175.2	-57.3	-6.9	0	0	0	116.4
532	C	57	Low	67.5	Low	42 Å²	42	72.1 Å²	72.1	28%	0.284	39%	0.386	S	S	.	.			trans	-74.8	122.9	166.4	173.3	0	0	0	0	110.7	Q529 C538	Q529-C532 HydrophobicContact CB-CB 4.07Å; C532-C538 HydrophobicContact CB-CB 3.55Å; C532-C538 WeakPolarHBondContact CB-SG 3.5Å; C532-C538 WeakPolarHBondContact SG-CA 3.32Å; C532-C538 WeakPolarHBondContact SG-CB 3.39Å; C532-C538 CovalentContact SG-SG 2.04Å; C532-C538 PolarHBondContact SG-SG 2.79Å
533	T	55.9	Low	67.2	Low	124 Å²	124	79.7 Å²	79.7	76%	0.761	42%	0.421	S	S	*	.			trans	-92.5	-23.3	-175.8	49.1	0	0	0	0	114.3
534	D	50.7	Low	67	Low	120 Å²	120	82.8 Å²	82.8	64%	0.642	44%	0.438	S	S	*	.	S	Bend	trans	-92.6	100.4	176.8	-92.2	-48.4	0	0	0	110.5	V536 N537 C538	D534-V536 PolarHBondContact O-N 3.11Å; D534-N537 PolarHBondContact O-N 2.84Å; D534-C538 PolarHBondContact O-SG 2.84Å
535	Y	52.9	Low	67	Low	233 Å²	233	81.1 Å²	81.1	91%	0.914	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-0.6	-177.5	-79.5	-92.1	0	0	0	117.1
536	V	55.7	Low	67.2	Low	123 Å²	123	84.1 Å²	84.1	75%	0.745	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-29.7	-171.9	-175.7	0	0	0	0	113.2	D534	D534-V536 PolarHBondContact O-N 3.11Å
537	N	57.2	Low	67.7	Low	139 Å²	139	90 Å²	90	74%	0.743	48%	0.475	S	S	*	.	S	Bend	trans	-132.7	27.9	-168.3	-80.2	-35.2	0	0	0	114.1	D534 E539	D534-N537 PolarHBondContact O-N 2.84Å; N537-E539 VanDerWaalsContact C-N 3.27Å; N537-E539 PolarHBondContact O-N 3.16Å
538	C	64.3	Low	68.4	Low	24 Å²	24	89.9 Å²	89.9	16%	0.162	47%	0.474	C	S	.	.			trans	-80.1	5.7	-175.4	-57.5	0	0	0	0	115.7	Q529 C532 D534	Q529-C538 PolarHBondContact N-O 2.92Å; C532-C538 HydrophobicContact CB-CB 3.55Å; C532-C538 WeakPolarHBondContact CB-SG 3.5Å; C532-C538 WeakPolarHBondContact SG-CA 3.32Å; C532-C538 WeakPolarHBondContact SG-CB 3.39Å; C532-C538 CovalentContact SG-SG 2.04Å; C532-C538 PolarHBondContact SG-SG 2.79Å; D534-C538 PolarHBondContact O-SG 2.84Å
539	E	67.9	Low	69.2	Low	79 Å²	79	88.3 Å²	88.3	37%	0.369	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.8	-176.5	-82.3	-177	-147.7	0	0	112	S526 V527 N537	S526-E539 WeakPolarHBondContact CB-OE2 3.47Å; S526-E539 WeakPolarHBondContact OG-CB 3.39Å; S526-E539 PolarHBondContact OG-OE2 2.73Å; V527-E539 CarbonylContact O-C 3.45Å; V527-E539 WeakPolarHBondContact O-CA 3.41Å; N537-E539 VanDerWaalsContact C-N 3.27Å; N537-E539 PolarHBondContact O-N 3.16Å
540	I	71.2	Confident	70.2	Confident	32 Å²	32	86 Å²	86	16%	0.164	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	119.7	166.4	-44.6	175.6	0	0	0	107.6	F426 A428 V527 Q529	F426-I540 HydrophobicContact CB-CD1 3.68Å; F426-I540 HydrophobicContact CG-CD1 4.37Å; A428-I540 HydrophobicContact CB-CG2 4.03Å; V527-I540 HydrophobicContact CB-CB 4.3Å; V527-I540 WeakPolarHBondContact CB-O 3.46Å; V527-I540 PolarHBondContact N-O 2.85Å; V527-I540 PolarHBondContact O-N 3.04Å; Q529-I540 HydrophobicContact CG-CD1 3.99Å; Q529-I540 HydrophobicContact CG-CG1 3.92Å; Q529-I540 VanDerWaalsContact NE2-CG1 3.32Å
541	Q	76.7	Confident	70.9	Confident	67 Å²	67	84.6 Å²	84.6	31%	0.313	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	150.8	177.4	-66.2	-179.4	8.6	0	0	110.9	S525 S526	S525-Q541 CarbonylContact O-C 3.58Å; S525-Q541 WeakPolarHBondContact O-CA 3.46Å; S526-Q541 WeakPolarHBondContact OG-CG 3.34Å
542	S	79.1	Confident	71.6	Confident	8 Å²	8	78.4 Å²	78.4	6%	0.056	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-69.4	172.6	167	67.6	0	0	0	0	111.3	P429 R524 S525	P429-S542 WeakPolarHBondContact O-CA 3.35Å; P429-S542 WeakPolarHBondContact O-CB 3.35Å; R524-S542 VanDerWaalsContact CA-OG 3.3Å; R524-S542 WeakPolarHBondContact CA-OG 3.21Å; R524-S542 WeakPolarHBondContact CB-OG 3.39Å; R524-S542 WeakPolarHBondContact CD-O 3.3Å; S525-S542 PolarHBondContact N-OG 2.85Å; S525-S542 PolarHBondContact O-N 2.72Å; S525-S542 WeakPolarHBondContact OG-CB 3.43Å; S525-S542 PolarHBondContact OG-OG 2.92Å
543	E	80.6	Confident	71.7	Confident	159 Å²	159	78.8 Å²	78.8	74%	0.743	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-60.3	173	157.5	-61	-163.1	149.7	0	0	111.6	P431	P431-E543 WeakPolarHBondContact CB-O 3.24Å
544	N	83.2	Confident	71.5	Confident	65 Å²	65	78.9 Å²	78.9	35%	0.348	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-63.7	145.1	170.5	-70.7	-19.5	0	0	0	110.8	T522 R524	T522-N544 HydrophobicContact CG2-CB 4.02Å; R524-N544 VanDerWaalsContact CZ-OD1 3.3Å; R524-N544 PolarHBondContact NE-OD1 3.16Å; R524-N544 PolarHBondContact NH2-OD1 2.67Å
545	S	83.3	Confident	71.2	Confident	10 Å²	10	76.1 Å²	76.1	7%	0.07	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-54.2	169.6	155	71.5	0	0	0	0	111.6	P432 A434 T522 I523	P432-S545 VanDerWaalsContact O-CA 3.29Å; P432-S545 WeakPolarHBondContact O-CA 3.46Å; P432-S545 WeakPolarHBondContact O-CB 3.14Å; A434-S545 WeakPolarHBondContact CB-OG 3.23Å; T522-S545 WeakPolarHBondContact CA-OG 3.24Å; I523-S545 PolarHBondContact N-OG 3.34Å; I523-S545 WeakPolarHBondContact O-CB 3.11Å; I523-S545 PolarHBondContact O-N 2.9Å
546	N	85.7	Confident	70.4	Confident	75 Å²	75	70.6 Å²	70.6	40%	0.401	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-50.6	145.3	158.5	62.1	-72.3	0	0	0	111.2	V433 A434	V433-N546 WeakPolarHBondContact CA-OD1 3.36Å; V433-N546 WeakPolarHBondContact CG1-OD1 3.39Å; A434-N546 PolarHBondContact N-OD1 2.78Å; A434-N546 PolarHBondContact O-ND2 2.86Å
547	E	85.3	Confident	69.5	Low	125 Å²	125	72 Å²	72	58%	0.584	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-72.2	133.5	177	-71.2	-177.6	-171.7	0	0	111.3	I520 F521 T522	I520-E547 HydrophobicContact CG2-CB 3.84Å; I520-E547 HydrophobicContact CG2-CG 3.66Å; F521-E547 WeakPolarHBondContact O-CA 3.49Å; T522-E547 HydrophobicContact CG2-CG 3.8Å
548	I	85.6	Confident	68.2	Low	23 Å²	23	75 Å²	75	12%	0.118	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.4	162.5	-48.1	155.2	0	0	0	108.4	A434 G436 A437 I447 I520 F521	A434-I548 HydrophobicContact CB-CD1 3.38Å; A434-I548 HydrophobicContact CB-CG1 3.77Å; G436-I548 WeakPolarHBondContact O-CD1 3.29Å; A437-I548 HydrophobicContact CB-CB 4.26Å; A437-I548 HydrophobicContact CB-CG2 3.59Å; I447-I548 HydrophobicContact CG2-CD1 4.46Å; I520-I548 CarbonylContact C-O 3.57Å; I520-I548 WeakPolarHBondContact CA-O 3.48Å; F521-I548 PolarHBondContact N-O 2.78Å; F521-I548 PolarHBondContact O-N 3.43Å
549	S	81.9	Confident	66.7	Low	45 Å²	45	82.3 Å²	82.3	32%	0.315	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.4	179.4	77.5	0	0	0	0	113.5	R518 I519	R518-S549 VanDerWaalsContact CZ-OG 3.3Å; R518-S549 PolarHBondContact NE-OG 2.75Å; R518-S549 PolarHBondContact NH2-OG 2.75Å; I519-S549 CarbonylContact O-C 3.56Å; I519-S549 VanDerWaalsContact O-CA 3.23Å; I519-S549 WeakPolarHBondContact O-CA 3.34Å
550	L	83.1	Confident	64.9	Low	21 Å²	21	82 Å²	82	11%	0.11	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.2	168.8	-172.4	74.3	0	0	0	109.2	L439 I445 R518 I519 F521 L552	L439-L550 HydrophobicContact CB-CD1 4.44Å; L439-L550 HydrophobicContact CB-CD2 4.42Å; L439-L550 HydrophobicContact CD1-CD2 4.36Å; I445-L550 HydrophobicContact CB-CD2 4.47Å; I445-L550 HydrophobicContact CD1-CD2 3.5Å; I445-L550 VanDerWaalsContact CD1-CD2 3.5Å; I445-L550 HydrophobicContact CG1-CD2 3.68Å; I445-L550 HydrophobicContact CG2-CD2 3.98Å; R518-L550 CarbonylContact C-O 3.47Å; R518-L550 WeakPolarHBondContact CA-O 3.32Å; I519-L550 PolarHBondContact N-O 2.92Å; I519-L550 PolarHBondContact O-N 3.03Å; F521-L550 HydrophobicContact CE2-CB 4.02Å; L550-L552 HydrophobicContact CD2-CD2 4.09Å; L550-L552 HydrophobicContact CG-CD2 4.47Å
551	N	74.9	Confident	63.2	Low	98 Å²	98	86.6 Å²	86.6	52%	0.524	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	110.7	-178.3	-171.4	15.3	0	0	0	111.8	R518 S553	R518-N551 HydrophobicContact CG-CB 4.42Å; N551-S553 VanDerWaalsContact C-N 3.34Å; N551-S553 PolarHBondContact ND2-OG 2.97Å; N551-S553 WeakPolarHBondContact OD1-CB 3.13Å; N551-S553 PolarHBondContact OD1-N 2.83Å; N551-S553 VanDerWaalsContact OD1-N 3.1Å; N551-S553 PolarHBondContact OD1-OG 3.42Å
552	L	71.8	Confident	61.2	Low	34 Å²	34	87.2 Å²	87.2	18%	0.178	45%	0.448	C	S	.	.			trans	-86	-4.3	176.7	-48.9	173.7	0	0	0	113.1	L508 A514 G517 I519 L550 S554	L508-L552 HydrophobicContact CD1-CD2 4.27Å; A514-L552 HydrophobicContact CB-CD1 3.64Å; G517-L552 WeakPolarHBondContact O-CB 3.35Å; G517-L552 WeakPolarHBondContact O-CG 3.46Å; G517-L552 PolarHBondContact O-N 3.14Å; I519-L552 HydrophobicContact CD1-CD1 3.7Å; I519-L552 HydrophobicContact CD1-CD2 4.44Å; I519-L552 HydrophobicContact CD1-CG 4.19Å; I519-L552 HydrophobicContact CG1-CD1 4.15Å; L550-L552 HydrophobicContact CD2-CD2 4.09Å; L550-L552 HydrophobicContact CG-CD2 4.47Å; L552-S554 VanDerWaalsContact C-N 3.27Å; L552-S554 PolarHBondContact O-N 2.99Å
553	S	57.8	Low	59	Low	50 Å²	50	92.3 Å²	92.3	35%	0.35	48%	0.479	S	S	.	.			trans	-84	49.7	-167.2	65.5	0	0	0	0	115.2	S516 N551 S555	S516-S553 WeakPolarHBondContact O-CB 3.27Å; N551-S553 VanDerWaalsContact C-N 3.34Å; N551-S553 PolarHBondContact ND2-OG 2.97Å; N551-S553 WeakPolarHBondContact OD1-CB 3.13Å; N551-S553 PolarHBondContact OD1-N 2.83Å; N551-S553 VanDerWaalsContact OD1-N 3.1Å; N551-S553 PolarHBondContact OD1-OG 3.42Å; S553-S555 PolarHBondContact O-N 3.08Å; S553-S555 VanDerWaalsContact O-N 3.12Å
554	S	52.8	Low	56.6	Low	127 Å²	127	90.4 Å²	90.4	89%	0.888	47%	0.473	S	S	*	.			trans	-76.4	24.5	162.1	58.1	0	0	0	0	113.1	L552	L552-S554 VanDerWaalsContact C-N 3.27Å; L552-S554 PolarHBondContact O-N 2.99Å
555	S	45.2	Very low	54.1	Low	61 Å²	61	94.3 Å²	94.3	43%	0.427	49%	0.487	S	S	.	.	S	Bend	trans	-149.1	76.4	175.6	52.1	0	0	0	0	111.3	S553	S553-S555 PolarHBondContact O-N 3.08Å; S553-S555 VanDerWaalsContact O-N 3.12Å
556	T	35.4	Very low	51.7	Low	117 Å²	117	102.1 Å²	102.1	72%	0.718	52%	0.516	S	S	*	.			trans	30	109.8	154.4	54.5	0	0	0	0	120.2
557	Q	37	Very low	49.1	Very low	152 Å²	152	105.8 Å²	105.8	71%	0.71	53%	0.53	S	S	*	.			trans	68.9	144.8	143.5	-57.5	177.3	-5	0	0	119.4
558	R	30.1	Very low	46.3	Very low	202 Å²	202	107.4 Å²	107.4	76%	0.762	54%	0.543	S	S	*	.			cis	-165.5	119.9	-27.4	-116.7	-173	-167	165.3	3.8	109
559	Y	32.8	Very low	43.7	Very low	179 Å²	179	114.7 Å²	114.7	70%	0.702	57%	0.573	S	S	*	*			trans	69.9	162.4	157.7	-65	-71.5	0	0	0	122.1	S472	S472-Y559 CarbonylContact O-C 3.51Å; S472-Y559 WeakPolarHBondContact O-CA 3.2Å
560	F	30.4	Very low	41.5	Very low	72 Å²	72	119.7 Å²	119.7	32%	0.316	60%	0.596	S	S	.	*			trans	-103.7	-178.8	-162.5	-58.1	-63.3	0	0	0	110.9	S472 F473	S472-F560 WeakPolarHBondContact O-CB 3.46Å; S472-F560 WeakPolarHBondContact O-CD1 3.41Å; S472-F560 WeakPolarHBondContact O-CD2 3.46Å; S472-F560 WeakPolarHBondContact O-CE1 3.4Å; S472-F560 WeakPolarHBondContact O-CE2 3.42Å; S472-F560 WeakPolarHBondContact O-CG 3.5Å; S472-F560 WeakPolarHBondContact O-CZ 3.25Å; S472-F560 PolarHBondContact O-N 3.21Å; S472-F560 WeakPolarHBondContact OG-CE1 3.31Å; S472-F560 WeakPolarHBondContact OG-CZ 3.5Å; F473-F560 HydrophobicContact CB-CD1 3.42Å; F473-F560 VanDerWaalsContact CB-CD1 3.42Å; F473-F560 HydrophobicContact CB-CE1 3.96Å; F473-F560 HydrophobicContact CB-CG 4.44Å; F473-F560 AromaticContact CD1-CD1 3.27Å; F473-F560 HydrophobicContact CD1-CD1 3.27Å; F473-F560 AromaticContact CD1-CE1 3.69Å; F473-F560 HydrophobicContact CD1-CE1 3.69Å; F473-F560 AromaticContact CD2-CD1 3.97Å; F473-F560 HydrophobicContact CD2-CD1 3.97Å; F473-F560 AromaticContact CD2-CE1 3.31Å; F473-F560 HydrophobicContact CD2-CE1 3.31Å; F473-F560 HydrophobicContact CE1-CD1 4.01Å; F473-F560 AromaticContact CE1-CE1 4Å; F473-F560 HydrophobicContact CE1-CE1 4Å; F473-F560 AromaticContact CE2-CE1 3.66Å; F473-F560 HydrophobicContact CE2-CE1 3.66Å; F473-F560 AromaticContact CG-CD1 3.21Å; F473-F560 HydrophobicContact CG-CD1 3.21Å; F473-F560 AromaticContact CG-CE1 3.31Å; F473-F560 HydrophobicContact CG-CE1 3.31Å; F473-F560 AromaticContact CZ-CE1 3.98Å; F473-F560 HydrophobicContact CZ-CE1 3.98Å; F473-F560 VanDerWaalsContact N-CD2 3.32Å
561	H	35.6	Very low	39.7	Very low	128 Å²	128	124.1 Å²	124.1	59%	0.593	62%	0.62	S	S	*	*			cis	-158	144.4	42.7	-108.8	-67.8	0	0	0	116.4	L474	L474-H561 PolarHBondContact N-CE1 2.72Å; L474-H561 VanDerWaalsContact N-CE1 3.32Å; L474-H561 PolarHBondContact N-ND1 3.29Å
562	T	33.5	Very low	38.7	Very low	80 Å²	80	126.3 Å²	126.3	49%	0.491	63%	0.631	S	S	.	*			trans	52.1	135.2	146.4	-10	0	0	0	0	123	L474	L474-T562 HydrophobicContact CD1-CG2 3.51Å; L474-T562 WeakPolarHBondContact CD1-OG1 3.39Å
563	T	32.5	Very low	38	Very low	115 Å²	115	131.3 Å²	131.3	71%	0.706	66%	0.657	S	S	*	*			trans	-80.5	-170.8	154.8	48.9	0	0	0	0	110
564	L	31.4	Very low	37.9	Very low	120 Å²	120	132.4 Å²	132.4	63%	0.628	67%	0.669	S	S	*	*			cis	-155.2	140.9	12.2	-166.4	70.7	0	0	0	111.5
565	K	30.6	Very low	38.3	Very low	146 Å²	146	132.1 Å²	132.1	64%	0.635	66%	0.656	S	S	*	*			trans	10.1	151.8	146.4	-49.8	172.9	-172.3	173.5	0	119.6
566	Y	31.7	Very low	39.2	Very low	174 Å²	174	133.9 Å²	133.9	68%	0.682	66%	0.664	S	S	*	*			cis	-151.9	143.3	49.9	-94.3	-97	0	0	0	115.9
567	H	31.3	Very low	40.7	Very low	152 Å²	152	129.9 Å²	129.9	70%	0.704	65%	0.646	S	S	*	*			trans	29.9	141	142.1	-68	-119.8	0	0	0	120.4
568	L	27.7	Very low	42.2	Very low	160 Å²	160	128.1 Å²	128.1	84%	0.838	64%	0.64	S	S	*	*			cis	-139	177.5	29.3	-157.2	65.4	0	0	0	112.6
569	K	31.4	Very low	44.3	Very low	175 Å²	175	122 Å²	122	76%	0.761	63%	0.626	S	S	*	*			trans	-138.5	172.1	-169.1	-152.9	-173	-177.7	-169.2	0	111.6
570	L	35.4	Very low	46.1	Very low	150 Å²	150	116.6 Å²	116.6	79%	0.785	61%	0.614	S	S	*	*			trans	87.9	145.8	177.6	-75.4	60.2	0	0	0	116.3
571	D	45.6	Very low	48.4	Very low	115 Å²	115	118.6 Å²	118.6	62%	0.615	63%	0.626	S	S	*	*			cis	-162.8	126.8	-41.5	-118.2	-46.4	0	0	0	110.3	I573	D571-I573 PolarHBondContact O-N 3.2Å; D571-I573 VanDerWaalsContact O-N 3.11Å
572	N	52.4	Low	50.3	Low	144 Å²	144	116.4 Å²	116.4	77%	0.77	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	31.7	-158.6	-80.4	-30.5	0	0	0	116.2
573	I	57.8	Low	52.5	Low	139 Å²	139	117.3 Å²	117.3	71%	0.713	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-31.9	-170	-62.5	176.4	0	0	0	113.5	D571	D571-I573 PolarHBondContact O-N 3.2Å; D571-I573 VanDerWaalsContact O-N 3.11Å
574	A	56.4	Low	54.9	Low	73 Å²	73	117.3 Å²	117.3	60%	0.603	62%	0.619	S	S	*	*	H	α-helix	trans	-70.4	-37.9	-173.8	0	0	0	0	0	114.5	G577 I578	A574-G577 PolarHBondContact O-N 2.94Å; A574-I578 PolarHBondContact O-N 2.9Å
575	I	60.2	Low	57.3	Low	121 Å²	121	115.5 Å²	115.5	62%	0.621	61%	0.613	S	S	*	*	H	α-helix	trans	-68.1	-40.9	-171.4	-61.1	175.5	0	0	0	111.4	G577 I578 V579	I575-G577 VanDerWaalsContact C-N 3.29Å; I575-G577 PolarHBondContact O-N 3.01Å; I575-I578 PolarHBondContact O-N 3.37Å; I575-V579 HydrophobicContact CG2-CG2 4.33Å; I575-V579 WeakPolarHBondContact O-CG2 3.2Å; I575-V579 PolarHBondContact O-N 2.79Å
576	V	63.3	Low	59.6	Low	97 Å²	97	114.8 Å²	114.8	59%	0.588	61%	0.61	S	S	*	*	H	α-helix	trans	-62.3	-37.2	-179.9	-176.9	0	0	0	0	111.4	S580	V576-S580 VanDerWaalsContact O-CB 3.32Å; V576-S580 WeakPolarHBondContact O-CB 3.33Å; V576-S580 PolarHBondContact O-N 2.95Å; V576-S580 PolarHBondContact O-OG 2.61Å
577	G	66.9	Low	61.9	Low	34 Å²	34	112.7 Å²	112.7	35%	0.351	60%	0.604	S	S	.	*	H	α-helix	trans	-63.7	-47.2	175.7	0	0	0	0	0	112.9	A574 I575 S580 I581	A574-G577 PolarHBondContact O-N 2.94Å; I575-G577 VanDerWaalsContact C-N 3.29Å; I575-G577 PolarHBondContact O-N 3.01Å; G577-S580 PolarHBondContact O-N 3.12Å; G577-I581 VanDerWaalsContact O-CG1 3.32Å; G577-I581 WeakPolarHBondContact O-CG1 3.1Å; G577-I581 PolarHBondContact O-N 3.15Å
578	I	70.3	Confident	64.4	Low	114 Å²	114	109 Å²	109	59%	0.585	60%	0.595	S	S	*	*	H	α-helix	trans	-66.1	-41.6	-178.9	-63.5	170.2	0	0	0	111.2	A574 I575 I581 T582	A574-I578 PolarHBondContact O-N 2.9Å; I575-I578 PolarHBondContact O-N 3.37Å; I578-I581 PolarHBondContact O-N 3.31Å; I578-T582 WeakPolarHBondContact O-CB 3.38Å; I578-T582 WeakPolarHBondContact O-CG2 3.22Å; I578-T582 PolarHBondContact O-N 3Å; I578-T582 PolarHBondContact O-OG1 2.92Å
579	V	72.7	Confident	66.9	Low	75 Å²	75	105.9 Å²	105.9	46%	0.455	58%	0.582	S	S	.	*	H	α-helix	trans	-64.4	-40.8	175.8	173.8	0	0	0	0	111.1	I575 T582 L583	I575-V579 HydrophobicContact CG2-CG2 4.33Å; I575-V579 WeakPolarHBondContact O-CG2 3.2Å; I575-V579 PolarHBondContact O-N 2.79Å; V579-T582 PolarHBondContact O-OG1 3.18Å; V579-T582 VanDerWaalsContact O-OG1 3.13Å; V579-L583 HydrophobicContact CG1-CD1 4.18Å; V579-L583 WeakPolarHBondContact O-CB 3.42Å; V579-L583 PolarHBondContact O-N 2.76Å; V579-L583 VanDerWaalsContact O-N 3.09Å
580	S	71.6	Confident	69.2	Low	65 Å²	65	101.3 Å²	101.3	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-66	-44.7	178	-58	0	0	0	0	112.3	V576 G577 L584	V576-S580 VanDerWaalsContact O-CB 3.32Å; V576-S580 WeakPolarHBondContact O-CB 3.33Å; V576-S580 PolarHBondContact O-N 2.95Å; V576-S580 PolarHBondContact O-OG 2.61Å; G577-S580 PolarHBondContact O-N 3.12Å; S580-L584 WeakPolarHBondContact O-CB 3.04Å; S580-L584 PolarHBondContact O-N 2.69Å
581	I	79.3	Confident	71.3	Confident	113 Å²	113	98.8 Å²	98.8	58%	0.579	55%	0.551	S	S	*	*	H	α-helix	trans	-66.4	-42.4	179.6	-69	167	0	0	0	111	G577 I578 L584 V585	G577-I581 VanDerWaalsContact O-CG1 3.32Å; G577-I581 WeakPolarHBondContact O-CG1 3.1Å; G577-I581 PolarHBondContact O-N 3.15Å; I578-I581 PolarHBondContact O-N 3.31Å; I581-L584 PolarHBondContact O-N 3.24Å; I581-V585 HydrophobicContact CG2-CG2 4.41Å; I581-V585 WeakPolarHBondContact O-CG2 3.3Å; I581-V585 PolarHBondContact O-N 2.68Å
582	T	75.4	Confident	72.8	Confident	82 Å²	82	95.1 Å²	95.1	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-66.9	-39.7	179.3	47.9	0	0	0	0	112.5	I578 V579 F586	I578-T582 WeakPolarHBondContact O-CB 3.38Å; I578-T582 WeakPolarHBondContact O-CG2 3.22Å; I578-T582 PolarHBondContact O-N 3Å; I578-T582 PolarHBondContact O-OG1 2.92Å; V579-T582 PolarHBondContact O-OG1 3.18Å; V579-T582 VanDerWaalsContact O-OG1 3.13Å; T582-F586 WeakPolarHBondContact O-CB 3.1Å; T582-F586 PolarHBondContact O-N 2.64Å
583	L	78.4	Confident	73.8	Confident	100 Å²	100	90.6 Å²	90.6	52%	0.524	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-41.8	171.3	-87.8	166	0	0	0	112.8	V579 F586 F587	V579-L583 HydrophobicContact CG1-CD1 4.18Å; V579-L583 WeakPolarHBondContact O-CB 3.42Å; V579-L583 PolarHBondContact O-N 2.76Å; V579-L583 VanDerWaalsContact O-N 3.09Å; L583-F586 PolarHBondContact O-N 2.83Å; L583-F587 PolarHBondContact O-N 2.96Å
584	L	82.4	Confident	74.5	Confident	114 Å²	114	87.4 Å²	87.4	60%	0.597	51%	0.513	S	S	*	.	H	α-helix	trans	-69.1	-41.7	-178.7	-159.7	157.3	0	0	0	111.3	S580 I581 F586 F587 C588	S580-L584 WeakPolarHBondContact O-CB 3.04Å; S580-L584 PolarHBondContact O-N 2.69Å; I581-L584 PolarHBondContact O-N 3.24Å; L584-F586 PolarHBondContact O-N 2.95Å; L584-F587 PolarHBondContact O-N 3.47Å; L584-C588 WeakPolarHBondContact O-CB 3.44Å; L584-C588 PolarHBondContact O-N 3.29Å; L584-C588 PolarHBondContact O-SG 2.91Å; L584-C588 VanDerWaalsContact O-SG 3.4Å
585	V	82.4	Confident	75.3	Confident	83 Å²	83	90.7 Å²	90.7	50%	0.503	51%	0.514	S	S	.	.	H	α-helix	trans	-61.1	-43.4	171.9	171.1	0	0	0	0	111.1	I581 F587 C588 V589	I581-V585 HydrophobicContact CG2-CG2 4.41Å; I581-V585 WeakPolarHBondContact O-CG2 3.3Å; I581-V585 PolarHBondContact O-N 2.68Å; V585-F587 PolarHBondContact O-N 2.91Å; V585-C588 PolarHBondContact O-N 2.99Å; V585-V589 HydrophobicContact CG1-CG2 4.49Å; V585-V589 WeakPolarHBondContact O-CG2 3.12Å; V585-V589 PolarHBondContact O-N 3.42Å
586	F	79.4	Confident	75.7	Confident	130 Å²	130	87.8 Å²	87.8	57%	0.57	51%	0.508	S	S	*	.	H	α-helix	trans	-61.7	-42.9	177.3	-170.6	-104.9	0	0	0	112.2	T582 L583 L584 V589 I590	T582-F586 WeakPolarHBondContact O-CB 3.1Å; T582-F586 PolarHBondContact O-N 2.64Å; L583-F586 PolarHBondContact O-N 2.83Å; L584-F586 PolarHBondContact O-N 2.95Å; F586-V589 PolarHBondContact O-N 2.96Å; F586-I590 HydrophobicContact CD1-CD1 3.84Å; F586-I590 HydrophobicContact CE1-CD1 3.4Å; F586-I590 VanDerWaalsContact CE1-CD1 3.4Å; F586-I590 HydrophobicContact CE1-CG1 4.47Å; F586-I590 HydrophobicContact CZ-CD1 3.85Å; F586-I590 PolarHBondContact O-N 3.48Å
587	F	80.7	Confident	75.6	Confident	130 Å²	130	89 Å²	89	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-63.4	-42.6	173.7	-110.6	-82.4	0	0	0	112.7	L583 L584 V585 V589 I590 I591	L583-F587 PolarHBondContact O-N 2.96Å; L584-F587 PolarHBondContact O-N 3.47Å; V585-F587 PolarHBondContact O-N 2.91Å; F587-V589 VanDerWaalsContact C-N 3.34Å; F587-V589 PolarHBondContact O-N 3.38Å; F587-I590 PolarHBondContact O-N 2.67Å; F587-I591 HydrophobicContact CD1-CD1 4.17Å; F587-I591 WeakPolarHBondContact O-CB 3.38Å; F587-I591 VanDerWaalsContact O-CG1 3.3Å; F587-I591 WeakPolarHBondContact O-CG1 3.47Å; F587-I591 PolarHBondContact O-N 3.06Å
588	C	82.3	Confident	75.4	Confident	75 Å²	75	96.9 Å²	96.9	51%	0.507	53%	0.53	S	S	.	.	H	α-helix	trans	-62.9	-38	175.8	-75.4	0	0	0	0	112.5	L584 V585 G592	L584-C588 WeakPolarHBondContact O-CB 3.44Å; L584-C588 PolarHBondContact O-N 3.29Å; L584-C588 PolarHBondContact O-SG 2.91Å; L584-C588 VanDerWaalsContact O-SG 3.4Å; V585-C588 PolarHBondContact O-N 2.99Å; C588-G592 PolarHBondContact O-N 3.16Å
589	V	81	Confident	75	Confident	95 Å²	95	94.6 Å²	94.6	58%	0.576	52%	0.521	S	S	*	.	H	α-helix	trans	-67.1	-42.6	174.8	170.9	0	0	0	0	111.4	V585 F586 F587 G592 A593	V585-V589 HydrophobicContact CG1-CG2 4.49Å; V585-V589 WeakPolarHBondContact O-CG2 3.12Å; V585-V589 PolarHBondContact O-N 3.42Å; F586-V589 PolarHBondContact O-N 2.96Å; F587-V589 VanDerWaalsContact C-N 3.34Å; F587-V589 PolarHBondContact O-N 3.38Å; V589-G592 PolarHBondContact O-N 3.35Å; V589-A593 WeakPolarHBondContact O-CB 3.13Å; V589-A593 PolarHBondContact O-N 2.89Å
590	I	78.5	Confident	74.2	Confident	78 Å²	78	97.1 Å²	97.1	40%	0.4	53%	0.528	S	S	.	.	H	α-helix	trans	-64.5	-47.2	175.7	-72.5	177	0	0	0	111.2	F586 F587 G592 A593 C594	F586-I590 HydrophobicContact CD1-CD1 3.84Å; F586-I590 HydrophobicContact CE1-CD1 3.4Å; F586-I590 VanDerWaalsContact CE1-CD1 3.4Å; F586-I590 HydrophobicContact CE1-CG1 4.47Å; F586-I590 HydrophobicContact CZ-CD1 3.85Å; F586-I590 PolarHBondContact O-N 3.48Å; F587-I590 PolarHBondContact O-N 2.67Å; I590-G592 VanDerWaalsContact C-N 3.32Å; I590-G592 PolarHBondContact O-N 2.85Å; I590-A593 PolarHBondContact O-N 2.85Å; I590-C594 WeakPolarHBondContact O-CB 3.32Å; I590-C594 PolarHBondContact O-N 3.04Å; I590-C594 PolarHBondContact O-SG 3.24Å; I590-C594 VanDerWaalsContact O-SG 3.35Å
591	I	79.7	Confident	73.2	Confident	97 Å²	97	97.8 Å²	97.8	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-60.9	-44.1	177.1	-69.3	168.4	0	0	0	110.1	F587 C594 F595	F587-I591 HydrophobicContact CD1-CD1 4.17Å; F587-I591 WeakPolarHBondContact O-CB 3.38Å; F587-I591 VanDerWaalsContact O-CG1 3.3Å; F587-I591 WeakPolarHBondContact O-CG1 3.47Å; F587-I591 PolarHBondContact O-N 3.06Å; I591-C594 PolarHBondContact O-N 3.25Å; I591-F595 WeakPolarHBondContact O-CB 3.4Å; I591-F595 PolarHBondContact O-N 3.21Å
592	G	77.6	Confident	71.8	Confident	38 Å²	38	99.4 Å²	99.4	39%	0.392	54%	0.535	S	S	.	.	H	α-helix	trans	-58.9	-45.6	175.1	0	0	0	0	0	113	C588 V589 I590 F595 A596	C588-G592 PolarHBondContact O-N 3.16Å; V589-G592 PolarHBondContact O-N 3.35Å; I590-G592 VanDerWaalsContact C-N 3.32Å; I590-G592 PolarHBondContact O-N 2.85Å; G592-F595 PolarHBondContact O-N 2.82Å; G592-A596 VanDerWaalsContact O-CB 3.28Å; G592-A596 WeakPolarHBondContact O-CB 3.46Å; G592-A596 PolarHBondContact O-N 3.32Å
593	A	74.5	Confident	70.7	Confident	50 Å²	50	101.3 Å²	101.3	41%	0.413	54%	0.541	S	S	.	.	H	α-helix	trans	-65.6	-39.4	176.1	0	0	0	0	0	112.6	V589 I590 N597	V589-A593 WeakPolarHBondContact O-CB 3.13Å; V589-A593 PolarHBondContact O-N 2.89Å; I590-A593 PolarHBondContact O-N 2.85Å; A593-N597 WeakPolarHBondContact O-CB 3.5Å; A593-N597 PolarHBondContact O-N 3.28Å
594	C	72.6	Confident	69.4	Low	72 Å²	72	102.3 Å²	102.3	49%	0.486	55%	0.546	S	S	.	.	H	α-helix	trans	-66.5	-38.6	174.1	-72.7	0	0	0	0	112.4	I590 I591 R598	I590-C594 WeakPolarHBondContact O-CB 3.32Å; I590-C594 PolarHBondContact O-N 3.04Å; I590-C594 PolarHBondContact O-SG 3.24Å; I590-C594 VanDerWaalsContact O-SG 3.35Å; I591-C594 PolarHBondContact O-N 3.25Å; C594-R598 WeakPolarHBondContact O-CG 3.42Å; C594-R598 PolarHBondContact O-N 2.94Å
595	F	73.1	Confident	67.7	Low	142 Å²	142	104.3 Å²	104.3	62%	0.623	55%	0.554	S	S	*	*	H	α-helix	trans	-71.3	-42.4	176.4	-128.9	-85.8	0	0	0	111.5	I591 G592 N597 R598 V599	I591-F595 WeakPolarHBondContact O-CB 3.4Å; I591-F595 PolarHBondContact O-N 3.21Å; G592-F595 PolarHBondContact O-N 2.82Å; F595-N597 PolarHBondContact O-N 3.32Å; F595-R598 PolarHBondContact O-N 2.83Å; F595-V599 HydrophobicContact CD1-CG2 3.86Å; F595-V599 HydrophobicContact CE1-CG2 4.21Å; F595-V599 WeakPolarHBondContact O-CB 3.42Å; F595-V599 WeakPolarHBondContact O-CG2 3.49Å; F595-V599 PolarHBondContact O-N 2.94Å
596	A	68.6	Low	65.9	Low	59 Å²	59	104.5 Å²	104.5	49%	0.488	56%	0.558	S	S	.	*	H	α-helix	trans	-58.5	-47.9	174	0	0	0	0	0	111.4	G592 R598 V599 H600	G592-A596 VanDerWaalsContact O-CB 3.28Å; G592-A596 WeakPolarHBondContact O-CB 3.46Å; G592-A596 PolarHBondContact O-N 3.32Å; A596-R598 VanDerWaalsContact C-N 3.34Å; A596-R598 PolarHBondContact O-N 3.07Å; A596-V599 PolarHBondContact O-N 2.83Å; A596-H600 WeakPolarHBondContact O-CB 3.39Å; A596-H600 PolarHBondContact O-N 2.91Å
597	N	59.8	Low	63.8	Low	122 Å²	122	108.9 Å²	108.9	65%	0.652	57%	0.571	S	S	*	*	H	α-helix	trans	-63.6	-35.6	175.7	-88.4	-36	0	0	0	113	A593 F595 C601	A593-N597 WeakPolarHBondContact O-CB 3.5Å; A593-N597 PolarHBondContact O-N 3.28Å; F595-N597 PolarHBondContact O-N 3.32Å; N597-C601 VanDerWaalsContact O-CB 3.22Å; N597-C601 WeakPolarHBondContact O-CB 3.42Å; N597-C601 PolarHBondContact O-N 3.09Å; N597-C601 VanDerWaalsContact O-N 3.13Å
598	R	63.9	Low	61.7	Low	201 Å²	201	112 Å²	112	76%	0.758	59%	0.587	S	S	*	*	H	α-helix	trans	-69.6	-44.6	174.6	-79.2	-173.9	172.4	-166.5	-1.5	112.6	C594 F595 A596 C601 F602	C594-R598 WeakPolarHBondContact O-CG 3.42Å; C594-R598 PolarHBondContact O-N 2.94Å; F595-R598 PolarHBondContact O-N 2.83Å; A596-R598 VanDerWaalsContact C-N 3.34Å; A596-R598 PolarHBondContact O-N 3.07Å; R598-C601 PolarHBondContact O-N 2.98Å; R598-F602 WeakPolarHBondContact O-CB 3.31Å; R598-F602 PolarHBondContact O-N 3.32Å
599	V	61.1	Low	59.3	Low	66 Å²	66	115.5 Å²	115.5	40%	0.4	61%	0.607	S	S	.	*	H	α-helix	trans	-69.9	-39.6	180	173.1	0	0	0	0	111.5	F595 A596 C601 F602 L603	F595-V599 HydrophobicContact CD1-CG2 3.86Å; F595-V599 HydrophobicContact CE1-CG2 4.21Å; F595-V599 WeakPolarHBondContact O-CB 3.42Å; F595-V599 WeakPolarHBondContact O-CG2 3.49Å; F595-V599 PolarHBondContact O-N 2.94Å; A596-V599 PolarHBondContact O-N 2.83Å; V599-C601 VanDerWaalsContact C-N 3.3Å; V599-C601 PolarHBondContact O-N 3.08Å; V599-F602 PolarHBondContact O-N 2.98Å; V599-L603 HydrophobicContact CG1-CD1 3.71Å; V599-L603 HydrophobicContact CG1-CG 4.19Å; V599-L603 WeakPolarHBondContact O-CB 3.34Å; V599-L603 WeakPolarHBondContact O-CG 3.33Å; V599-L603 PolarHBondContact O-N 2.8Å
600	H	56.5	Low	57	Low	127 Å²	127	114.2 Å²	114.2	59%	0.588	61%	0.612	S	S	*	*	H	α-helix	trans	-67.7	-29.6	175.8	-162.4	-39.7	0	0	0	112.3	A596 I604	A596-H600 WeakPolarHBondContact O-CB 3.39Å; A596-H600 PolarHBondContact O-N 2.91Å; H600-I604 WeakPolarHBondContact O-CD1 3.4Å; H600-I604 WeakPolarHBondContact O-CG1 3.49Å
601	C	50.9	Low	54.7	Low	79 Å²	79	116.1 Å²	116.1	53%	0.534	63%	0.633	S	S	.	*	H	α-helix	trans	-75.9	-39.5	171.9	-164.2	0	0	0	0	111.9	N597 R598 V599	N597-C601 VanDerWaalsContact O-CB 3.22Å; N597-C601 WeakPolarHBondContact O-CB 3.42Å; N597-C601 PolarHBondContact O-N 3.09Å; N597-C601 VanDerWaalsContact O-N 3.13Å; R598-C601 PolarHBondContact O-N 2.98Å; V599-C601 VanDerWaalsContact C-N 3.3Å; V599-C601 PolarHBondContact O-N 3.08Å
602	F	49.6	Very low	52.4	Low	147 Å²	147	117.6 Å²	117.6	65%	0.645	65%	0.65	S	S	*	*	H	α-helix	trans	-69.2	-43	179.4	-160.1	-99.6	0	0	0	112.8	R598 V599 I604 M605	R598-F602 WeakPolarHBondContact O-CB 3.31Å; R598-F602 PolarHBondContact O-N 3.32Å; V599-F602 PolarHBondContact O-N 2.98Å; F602-I604 VanDerWaalsContact C-N 3.28Å; F602-I604 PolarHBondContact O-N 2.96Å; F602-M605 PolarHBondContact O-N 2.88Å
603	L	51.9	Low	50	Low	122 Å²	122	126.9 Å²	126.9	64%	0.639	68%	0.675	S	S	*	*	H	α-helix	trans	-68.8	-23	179.4	-72.2	173.6	0	0	0	113.7	V599	V599-L603 HydrophobicContact CG1-CD1 3.71Å; V599-L603 HydrophobicContact CG1-CG 4.19Å; V599-L603 WeakPolarHBondContact O-CB 3.34Å; V599-L603 WeakPolarHBondContact O-CG 3.33Å; V599-L603 PolarHBondContact O-N 2.8Å
604	I	51.2	Low	47.9	Very low	122 Å²	122	135.1 Å²	135.1	63%	0.626	70%	0.695	S	S	*	*	H	α-helix	trans	-74.8	-25.7	171.3	-74	176.6	0	0	0	111.6	H600 F602	H600-I604 WeakPolarHBondContact O-CD1 3.4Å; H600-I604 WeakPolarHBondContact O-CG1 3.49Å; F602-I604 VanDerWaalsContact C-N 3.28Å; F602-I604 PolarHBondContact O-N 2.96Å
605	M	46.5	Very low	45.8	Very low	155 Å²	155	140.9 Å²	140.9	76%	0.764	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-5.4	-177.2	-79.5	-159.6	65.4	0	0	115.6	F602	F602-M605 PolarHBondContact O-N 2.88Å
606	C	44.2	Very low	43.8	Very low	87 Å²	87	139.5 Å²	139.5	59%	0.588	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	18.6	-171.9	-65.2	0	0	0	0	115.3
607	R	36.2	Very low	41.9	Very low	223 Å²	223	144.2 Å²	144.2	84%	0.842	73%	0.732	S	S	*	*	S	Bend	trans	-139.3	56.5	-173.8	-160.6	-175.4	169.8	158.4	-1.5	115.6
608	E	35.5	Very low	40.6	Very low	194 Å²	194	144.2 Å²	144.2	91%	0.907	73%	0.731	S	S	*	*			trans	-159.9	42.9	153.4	-122.6	165	-135.6	0	0	115.4	G610	E608-G610 PolarHBondContact O-N 3.44Å; E608-G610 VanDerWaalsContact O-N 3.15Å
609	T	32.8	Very low	39.2	Very low	150 Å²	150	137.9 Å²	137.9	92%	0.92	72%	0.718	S	S	*	*			trans	-81.1	86	167.7	50.8	0	0	0	0	110.5
610	G	32.4	Very low	37.9	Very low	67 Å²	67	140.1 Å²	140.1	69%	0.691	73%	0.731	S	S	*	*			trans	-154.4	60.9	-167.6	0	0	0	0	0	117.1	E608	E608-G610 PolarHBondContact O-N 3.44Å; E608-G610 VanDerWaalsContact O-N 3.15Å
611	S	29.5	Very low	37	Very low	119 Å²	119	141.9 Å²	141.9	83%	0.832	74%	0.738	S	S	*	*			trans	36.2	99.3	154.9	176.2	0	0	0	0	119.2
612	C	30.8	Very low	36.8	Very low	128 Å²	128	141.7 Å²	141.7	87%	0.865	73%	0.726	S	S	*	*			trans	-153.4	90.5	145	-140.3	0	0	0	0	113.1	R614	C612-R614 PolarHBondContact O-N 3.28Å
613	Y	28	Very low	36.4	Very low	232 Å²	232	144.2 Å²	144.2	91%	0.91	74%	0.737	S	S	*	*			trans	-86.4	102.2	179.1	-164.5	-93.9	0	0	0	110.4
614	R	31.5	Very low	35.6	Very low	224 Å²	224	149.3 Å²	149.3	85%	0.845	75%	0.747	S	S	*	*			trans	-143.6	119.5	175.5	-133	173	-170.3	166.4	3.9	113.4	C612	C612-R614 PolarHBondContact O-N 3.28Å
615	K	27.9	Very low	34.9	Very low	193 Å²	193	148.9 Å²	148.9	84%	0.839	75%	0.746	S	S	*	*			trans	-63	134.2	167.8	-68.9	174.5	172.3	178.2	0	110.2
616	T	30.9	Very low	34.5	Very low	113 Å²	113	145 Å²	145	69%	0.693	74%	0.738	S	S	*	*			trans	-145.2	125.8	163.1	36.6	0	0	0	0	111.1	I618	T616-I618 PolarHBondContact O-N 2.83Å
617	D	29	Very low	34.4	Very low	158 Å²	158	144.4 Å²	144.4	85%	0.845	73%	0.733	S	S	*	*			trans	-75.5	113.5	-178.2	-63.8	-86.6	0	0	0	112.7
618	I	32.9	Very low	34.8	Very low	121 Å²	121	137 Å²	137	62%	0.621	71%	0.707	S	S	*	*			trans	-120.3	-19.4	178.3	-59.2	-178.4	0	0	0	113	T616 T620 K621	T616-I618 PolarHBondContact O-N 2.83Å; I618-T620 PolarHBondContact O-N 3.48Å; I618-K621 PolarHBondContact O-N 2.93Å
619	S	33.1	Very low	35.4	Very low	69 Å²	69	133 Å²	133	48%	0.483	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.5	-0.2	-173.5	-175.7	0	0	0	0	116.5
620	T	33.9	Very low	36.3	Very low	112 Å²	112	127 Å²	127	69%	0.687	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.2	-10.5	-174.7	52.9	0	0	0	0	114.9	I618	I618-T620 PolarHBondContact O-N 3.48Å
621	K	38.4	Very low	36.8	Very low	165 Å²	165	128.6 Å²	128.6	72%	0.717	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-88.9	-19.4	-160.9	-113.5	177.9	-179.8	177.5	0	118	I618 K623 R624	I618-K621 PolarHBondContact O-N 2.93Å; K621-K623 PolarHBondContact O-N 3.35Å; K621-R624 PolarHBondContact O-N 3Å
622	Y	47.1	Very low	37.8	Very low	74 Å²	74	131.7 Å²	131.7	29%	0.29	65%	0.649	S	S	.	*	G	3₁₀ helix	trans	-65.7	-6	-179.7	-138.6	-91.1	0	0	0	114.2	H697	Y622-H697 WeakPolarHBondContact CE2-O 3.45Å
623	K	40.7	Very low	39	Very low	200 Å²	200	127.6 Å²	127.6	87%	0.87	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-90.2	1.8	178.2	-74.5	-168.2	172.7	-172.4	0	115.7	K621	K621-K623 PolarHBondContact O-N 3.35Å
624	R	34.3	Very low	40.4	Very low	229 Å²	229	123.1 Å²	123.1	86%	0.864	62%	0.616	S	S	*	*			trans	-136.7	60.4	-175.9	-65.6	-165.9	-171.7	179.3	4.1	114.8	K621	K621-R624 PolarHBondContact O-N 3Å
625	I	37.3	Very low	42.4	Very low	114 Å²	114	115.9 Å²	115.9	59%	0.585	59%	0.589	S	S	*	*	S	Bend	trans	-132.3	141	161	-49.8	176.8	0	0	0	106.8	R723	I625-R723 VanDerWaalsContact O-CD 3.28Å; I625-R723 WeakPolarHBondContact O-CD 3.4Å; I625-R723 PolarHBondContact O-NE 3.42Å
626	A	37.8	Very low	44.7	Very low	73 Å²	73	114.6 Å²	114.6	60%	0.603	58%	0.583	S	S	*	*			trans	-58.5	154.1	-180	0	0	0	0	0	112	F628 R723	A626-F628 PolarHBondContact O-N 3.35Å; A626-R723 VanDerWaalsContact O-CZ 3.26Å; A626-R723 PolarHBondContact O-NE 3.45Å; A626-R723 PolarHBondContact O-NH2 3.02Å
627	P	41.9	Very low	47.4	Very low	75 Å²	75	111.2 Å²	111.2	49%	0.487	57%	0.566	S	S	.	*			trans	-51.4	140.5	173.7	-24.8	34.4	0	0	0	111.3	H629	P627-H629 PolarHBondContact O-N 3.4Å; P627-H629 VanDerWaalsContact O-N 3.09Å
628	F	45.2	Very low	50.5	Low	66 Å²	66	105.5 Å²	105.5	29%	0.289	54%	0.536	S	S	.	.			trans	-74.3	103.2	175.2	-174.3	-99.2	0	0	0	109.3	A626 L630 N633 H891	A626-F628 PolarHBondContact O-N 3.35Å; F628-L630 HydrophobicContact CD1-CD1 4.17Å; F628-L630 HydrophobicContact CD1-CG 4.37Å; F628-L630 HydrophobicContact CE1-CG 4.29Å; F628-L630 PolarHBondContact O-N 3.35Å; F628-N633 WeakPolarHBondContact CZ-OD1 3.33Å; F628-H891 AromaticContact CD1-CE1 3.97Å; F628-H891 AromaticContact CD1-CG 3.98Å; F628-H891 AromaticContact CD1-ND1 3.66Å; F628-H891 AromaticContact CD2-ND1 3.93Å; F628-H891 HydrophobicContact CE1-CB 4.31Å; F628-H891 AromaticContact CE1-ND1 3.89Å; F628-H891 AromaticContact CG-CE1 3.66Å; F628-H891 AromaticContact CG-ND1 3.68Å
629	H	47.5	Very low	53.5	Low	111 Å²	111	101.3 Å²	101.3	51%	0.514	52%	0.517	S	S	.	.			trans	-69.1	113.6	167.8	-102.7	-94.4	0	0	0	108.8	P627 S631 K632	P627-H629 PolarHBondContact O-N 3.4Å; P627-H629 VanDerWaalsContact O-N 3.09Å; H629-S631 PolarHBondContact ND1-OG 3.5Å; H629-S631 PolarHBondContact O-N 3.39Å; H629-S631 VanDerWaalsContact O-N 3.08Å; H629-K632 PolarHBondContact O-N 3.3Å
630	L	52.8	Low	56.3	Low	25 Å²	25	99.2 Å²	99.2	13%	0.131	50%	0.502	C	S	.	.	G	3₁₀ helix	trans	-60.8	-16.8	173.6	-85.2	84.3	0	0	0	112.6	F628 K632 N633 F888	F628-L630 HydrophobicContact CD1-CD1 4.17Å; F628-L630 HydrophobicContact CD1-CG 4.37Å; F628-L630 HydrophobicContact CE1-CG 4.29Å; F628-L630 PolarHBondContact O-N 3.35Å; L630-K632 PolarHBondContact O-N 3.06Å; L630-N633 WeakPolarHBondContact O-CB 3.36Å; L630-N633 PolarHBondContact O-N 2.92Å; L630-F888 HydrophobicContact CD2-CB 4.16Å
631	S	43.5	Very low	59.1	Low	99 Å²	99	103.2 Å²	103.2	69%	0.692	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-65.8	11.4	174.3	67.9	0	0	0	0	115.2	H629	H629-S631 PolarHBondContact ND1-OG 3.5Å; H629-S631 PolarHBondContact O-N 3.39Å; H629-S631 VanDerWaalsContact O-N 3.08Å
632	K	49.9	Very low	61.8	Low	185 Å²	185	99.6 Å²	99.6	80%	0.804	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-108.1	-4.7	165.8	-76.5	-163.7	171.7	-168.2	0	114.2	H629 L630	H629-K632 PolarHBondContact O-N 3.3Å; L630-K632 PolarHBondContact O-N 3.06Å
633	N	55.1	Low	64	Low	42 Å²	42	96 Å²	96	23%	0.225	48%	0.482	C	S	.	.	S	Bend	trans	-79	147.2	176.4	-74.4	-5.6	0	0	0	111.4	F628 L630 Y635 G887	F628-N633 WeakPolarHBondContact CZ-OD1 3.33Å; L630-N633 WeakPolarHBondContact O-CB 3.36Å; L630-N633 PolarHBondContact O-N 2.92Å; N633-Y635 PolarHBondContact O-N 3.06Å; N633-G887 VanDerWaalsContact ND2-CA 3.34Å; N633-G887 WeakPolarHBondContact ND2-CA 3.17Å; N633-G887 PolarHBondContact ND2-O 3.43Å
634	T	58.8	Low	66.5	Low	138 Å²	138	91.5 Å²	91.5	85%	0.847	46%	0.459	S	S	*	.	S	Bend	trans	-68.2	-13.9	179.4	-3	0	0	0	0	114.2
635	Y	71.6	Confident	69.2	Low	72 Å²	72	83.9 Å²	83.9	28%	0.282	45%	0.445	S	S	.	.	S	Bend	trans	-98.6	112.7	-170.7	-53.5	-77.9	0	0	0	111.6	N633 A637 S884 R886 E890	N633-Y635 PolarHBondContact O-N 3.06Å; Y635-A637 PolarHBondContact O-N 3.16Å; Y635-S884 PolarHBondContact O-OG 2.95Å; Y635-R886 PolarHBondContact OH-NE 3.46Å; Y635-R886 PolarHBondContact OH-NH2 2.86Å; Y635-R886 VanDerWaalsContact OH-NH2 3.13Å; Y635-E890 WeakPolarHBondContact CE2-OE2 3.45Å
636	K	78.1	Confident	71.9	Confident	166 Å²	166	80.7 Å²	80.7	72%	0.722	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-50	130	177.6	-173.6	-164.8	169.8	-161.5	0	110.6	E642	K636-E642 IonicContact NZ-OE1 3.73Å
637	A	87.7	Confident	74.5	Confident	41 Å²	41	77.2 Å²	77.2	34%	0.339	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-69.7	138.9	170.7	0	0	0	0	0	110.8	Y635 A882 V883	Y635-A637 PolarHBondContact O-N 3.16Å; A637-A882 HydrophobicContact CB-CB 4.1Å; A637-V883 CarbonylContact C-O 3.59Å; A637-V883 VanDerWaalsContact CA-O 3.3Å; A637-V883 WeakPolarHBondContact CA-O 3.18Å
638	I	92.9	Very high	76.8	Confident	38 Å²	38	77.3 Å²	77.3	20%	0.195	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	127.8	179.8	-58	151.6	0	0	0	107.8	E642 F643 H646 A882 V883	I638-E642 HydrophobicContact CG2-CB 4.09Å; I638-F643 HydrophobicContact CB-CD2 4.21Å; I638-F643 HydrophobicContact CG2-CB 4.24Å; I638-F643 HydrophobicContact CG2-CD2 3.83Å; I638-H646 WeakPolarHBondContact CD1-NE2 3.31Å; I638-H646 HydrophobicContact CG2-CB 4.35Å; I638-A882 CarbonylContact O-C 3.51Å; I638-A882 WeakPolarHBondContact O-CA 3.4Å; I638-A882 WeakPolarHBondContact O-CB 3.22Å; I638-V883 PolarHBondContact N-O 3.13Å; I638-V883 PolarHBondContact O-N 3.22Å
639	S	95.2	Very high	79	Confident	34 Å²	34	77.2 Å²	77.2	24%	0.238	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	154.4	179	71.7	0	0	0	0	112	K641 E642 F643	S639-K641 PolarHBondContact O-N 2.95Å; S639-K641 VanDerWaalsContact O-N 3.12Å; S639-E642 VanDerWaalsContact CB-OE2 3.25Å; S639-E642 WeakPolarHBondContact CB-OE2 3.34Å; S639-E642 PolarHBondContact N-OE2 2.9Å; S639-E642 VanDerWaalsContact N-OE2 3.14Å; S639-E642 PolarHBondContact O-N 3.47Å; S639-E642 VanDerWaalsContact OG-CD 3.3Å; S639-E642 WeakPolarHBondContact OG-CG 3.33Å; S639-E642 PolarHBondContact OG-N 2.99Å; S639-E642 PolarHBondContact OG-OE2 3.49Å; S639-F643 PolarHBondContact O-N 3.2Å
640	S	93.5	Very high	81	Confident	24 Å²	24	72.5 Å²	72.5	17%	0.168	39%	0.386	C	S	.	.	H	α-helix	trans	-56.7	-28	176.7	57.5	0	0	0	0	113.1	Q881 I917	S640-Q881 PolarHBondContact N-O 2.89Å; S640-Q881 PolarHBondContact OG-O 3.12Å; S640-Q881 PolarHBondContact OG-OE1 3.34Å; S640-I917 WeakPolarHBondContact O-CG2 3.39Å
641	K	92.5	Very high	82.7	Confident	196 Å²	196	72.2 Å²	72.2	85%	0.852	38%	0.384	S	S	*	.	H	α-helix	trans	-72.9	-40	175	-62	-175.6	-179.6	-177.5	0	113.3	S639	S639-K641 PolarHBondContact O-N 2.95Å; S639-K641 VanDerWaalsContact O-N 3.12Å
642	E	94.2	Very high	84.7	Confident	89 Å²	89	70.3 Å²	70.3	42%	0.416	38%	0.375	S	S	.	.	H	α-helix	trans	-79.9	-23.8	-180	-67.3	160.3	127.1	0	0	112.1	K636 I638 S639 R644 A645 H646	K636-E642 IonicContact NZ-OE1 3.73Å; I638-E642 HydrophobicContact CG2-CB 4.09Å; S639-E642 VanDerWaalsContact CB-OE2 3.25Å; S639-E642 WeakPolarHBondContact CB-OE2 3.34Å; S639-E642 PolarHBondContact N-OE2 2.9Å; S639-E642 VanDerWaalsContact N-OE2 3.14Å; S639-E642 PolarHBondContact O-N 3.47Å; S639-E642 VanDerWaalsContact OG-CD 3.3Å; S639-E642 WeakPolarHBondContact OG-CG 3.33Å; S639-E642 PolarHBondContact OG-N 2.99Å; S639-E642 PolarHBondContact OG-OE2 3.49Å; E642-R644 PolarHBondContact O-N 3.46Å; E642-A645 WeakPolarHBondContact O-CB 3.46Å; E642-A645 PolarHBondContact O-N 2.92Å; E642-H646 PolarHBondContact O-N 2.86Å
643	F	94.6	Very high	86.2	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-57.6	-43.7	-167.2	-161.1	-97	0	0	0	114.1	I638 S639 A645 H646 V647 V883 V885 H910 L913 R914 I917	I638-F643 HydrophobicContact CB-CD2 4.21Å; I638-F643 HydrophobicContact CG2-CB 4.24Å; I638-F643 HydrophobicContact CG2-CD2 3.83Å; S639-F643 PolarHBondContact O-N 3.2Å; F643-A645 VanDerWaalsContact C-N 3.3Å; F643-A645 PolarHBondContact O-N 3.38Å; F643-H646 PolarHBondContact O-N 3.32Å; F643-V647 HydrophobicContact CD1-CG2 3.81Å; F643-V647 HydrophobicContact CE1-CG2 3.5Å; F643-V647 HydrophobicContact CG-CG2 4.46Å; F643-V647 HydrophobicContact CZ-CG2 3.92Å; F643-V647 WeakPolarHBondContact O-CG2 3.39Å; F643-V647 PolarHBondContact O-N 2.93Å; F643-V883 HydrophobicContact CD2-CG2 3.65Å; F643-V883 HydrophobicContact CE2-CG2 3.46Å; F643-V883 VanDerWaalsContact CE2-CG2 3.46Å; F643-V883 HydrophobicContact CZ-CG2 4.35Å; F643-V885 HydrophobicContact CE2-CG2 4.21Å; F643-V885 HydrophobicContact CZ-CG2 4.42Å; F643-H910 WeakPolarHBondContact CE1-O 3.34Å; F643-H910 HydrophobicContact CZ-CB 4.29Å; F643-H910 AromaticContact CZ-CD2 3.67Å; F643-L913 HydrophobicContact CE1-CB 3.58Å; F643-L913 HydrophobicContact CZ-CB 3.7Å; F643-L913 HydrophobicContact CZ-CD1 4.13Å; F643-R914 HydrophobicContact CD1-CB 4.38Å; F643-R914 HydrophobicContact CE1-CB 4.31Å; F643-I917 HydrophobicContact CB-CD1 3.75Å; F643-I917 HydrophobicContact CD1-CD1 3.54Å; F643-I917 HydrophobicContact CD2-CD1 4.47Å; F643-I917 HydrophobicContact CE1-CD1 4.26Å; F643-I917 HydrophobicContact CG-CD1 3.66Å
644	R	91.3	Very high	87.4	Confident	105 Å²	105	73.5 Å²	73.5	40%	0.396	40%	0.4	S	S	.	.	H	α-helix	trans	-59.7	-40.3	177	-168.5	-170.2	-170.8	-164.6	1.6	111.8	E642 N648 R914 D956	E642-R644 PolarHBondContact O-N 3.46Å; R644-N648 VanDerWaalsContact O-CB 3.31Å; R644-N648 WeakPolarHBondContact O-CB 3.24Å; R644-N648 PolarHBondContact O-N 3.08Å; R644-N648 PolarHBondContact O-OD1 3.14Å; R644-N648 VanDerWaalsContact O-OD1 3.14Å; R644-R914 HydrophobicContact CG-CG 4.3Å; R644-D956 IonicContact CZ-OD2 2.77Å; R644-D956 IonicContact NE-OD2 2.72Å; R644-D956 IonicContact NH2-OD1 2.85Å; R644-D956 IonicContact NH2-OD2 3.11Å; R644-D956 PolarHBondContact NH2-OD2 3.26Å
645	A	92	Very high	88.7	Confident	69 Å²	69	68.8 Å²	68.8	57%	0.57	37%	0.37	S	S	*	.	H	α-helix	trans	-70	-40.9	179.4	0	0	0	0	0	111.9	E642 F643 A649	E642-A645 WeakPolarHBondContact O-CB 3.46Å; E642-A645 PolarHBondContact O-N 2.92Å; F643-A645 VanDerWaalsContact C-N 3.3Å; F643-A645 PolarHBondContact O-N 3.38Å; A645-A649 WeakPolarHBondContact O-CB 3.34Å; A645-A649 PolarHBondContact O-N 3.39Å
646	H	92.9	Very high	89.5	Confident	47 Å²	47	67.9 Å²	67.9	22%	0.218	38%	0.377	C	S	.	.	H	α-helix	trans	-59.8	-49.8	173.7	161.7	67.5	0	0	0	111.9	I638 E642 F643 N648 A649 C650 H910	I638-H646 WeakPolarHBondContact CD1-NE2 3.31Å; I638-H646 HydrophobicContact CG2-CB 4.35Å; E642-H646 PolarHBondContact O-N 2.86Å; F643-H646 PolarHBondContact O-N 3.32Å; H646-N648 PolarHBondContact O-N 3.19Å; H646-A649 WeakPolarHBondContact O-CB 3.42Å; H646-A649 PolarHBondContact O-N 3.17Å; H646-A649 VanDerWaalsContact O-N 3.16Å; H646-C650 VanDerWaalsContact CE1-SG 3.51Å; H646-C650 PolarHBondContact O-N 3.47Å; H646-C650 PolarHBondContact O-SG 3.14Å; H646-C650 VanDerWaalsContact O-SG 3.37Å; H646-H910 AromaticContact NE2-CD2 3.86Å
647	V	92.8	Very high	90	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-64.1	-42.8	179.8	176.3	0	0	0	0	111.5	F643 A649 C650 H651 F658 H910	F643-V647 HydrophobicContact CD1-CG2 3.81Å; F643-V647 HydrophobicContact CE1-CG2 3.5Å; F643-V647 HydrophobicContact CG-CG2 4.46Å; F643-V647 HydrophobicContact CZ-CG2 3.92Å; F643-V647 WeakPolarHBondContact O-CG2 3.39Å; F643-V647 PolarHBondContact O-N 2.93Å; V647-A649 VanDerWaalsContact C-N 3.26Å; V647-A649 PolarHBondContact O-N 3.09Å; V647-C650 PolarHBondContact O-N 3.31Å; V647-H651 PolarHBondContact O-CD2 2.98Å; V647-H651 PolarHBondContact O-N 3.09Å; V647-H651 VanDerWaalsContact O-N 3.15Å; V647-F658 HydrophobicContact CG1-CZ 4.26Å; V647-H910 HydrophobicContact CG1-CB 4.28Å; V647-H910 HydrophobicContact CG2-CB 3.76Å
648	N	90.7	Very high	90.3	Very high	77 Å²	77	59.6 Å²	59.6	41%	0.412	34%	0.343	S	S	.	.	H	α-helix	trans	-62.3	-32.3	175.5	-73.6	17.1	0	0	0	112.8	R644 H646 A652	R644-N648 VanDerWaalsContact O-CB 3.31Å; R644-N648 WeakPolarHBondContact O-CB 3.24Å; R644-N648 PolarHBondContact O-N 3.08Å; R644-N648 PolarHBondContact O-OD1 3.14Å; R644-N648 VanDerWaalsContact O-OD1 3.14Å; H646-N648 PolarHBondContact O-N 3.19Å; N648-A652 PolarHBondContact O-N 2.91Å
649	A	90.8	Very high	90.2	Very high	64 Å²	64	60.9 Å²	60.9	53%	0.529	35%	0.348	S	S	.	.	H	α-helix	trans	-73.6	-36.4	175.1	0	0	0	0	0	112.6	A645 H646 V647 H651 A652	A645-A649 WeakPolarHBondContact O-CB 3.34Å; A645-A649 PolarHBondContact O-N 3.39Å; H646-A649 WeakPolarHBondContact O-CB 3.42Å; H646-A649 PolarHBondContact O-N 3.17Å; H646-A649 VanDerWaalsContact O-N 3.16Å; V647-A649 VanDerWaalsContact C-N 3.26Å; V647-A649 PolarHBondContact O-N 3.09Å; A649-H651 VanDerWaalsContact C-N 3.31Å; A649-H651 PolarHBondContact O-N 3.11Å; A649-A652 VanDerWaalsContact O-CB 3.22Å; A649-A652 WeakPolarHBondContact O-CB 3.33Å; A649-A652 PolarHBondContact O-N 3.18Å
650	C	89.8	Confident	90.1	Very high	12 Å²	12	62.2 Å²	62.2	8%	0.081	36%	0.361	C	S	.	.	H	α-helix	trans	-65.1	-35.2	175.2	-66.9	0	0	0	0	112.5	H646 V647 A652 D655 G657 F658	H646-C650 VanDerWaalsContact CE1-SG 3.51Å; H646-C650 PolarHBondContact O-N 3.47Å; H646-C650 PolarHBondContact O-SG 3.14Å; H646-C650 VanDerWaalsContact O-SG 3.37Å; V647-C650 PolarHBondContact O-N 3.31Å; C650-A652 VanDerWaalsContact C-N 3.32Å; C650-A652 PolarHBondContact O-N 2.96Å; C650-D655 CarbonylContact O-C 3.48Å; C650-D655 WeakPolarHBondContact O-CA 3.29Å; C650-G657 PolarHBondContact O-N 2.9Å; C650-F658 HydrophobicContact CB-CD1 3.94Å; C650-F658 HydrophobicContact CB-CD2 3.72Å; C650-F658 HydrophobicContact CB-CE1 3.65Å; C650-F658 HydrophobicContact CB-CE2 3.42Å; C650-F658 VanDerWaalsContact CB-CE2 3.42Å; C650-F658 HydrophobicContact CB-CG 3.96Å; C650-F658 HydrophobicContact CB-CZ 3.39Å
651	H	88.7	Confident	90	Very high	18 Å²	18	63 Å²	63	8%	0.083	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	11.6	173.1	-60.3	-72.3	0	0	0	114.6	V647 A649 D655 F658 D911 R914 R958	V647-H651 PolarHBondContact O-CD2 2.98Å; V647-H651 PolarHBondContact O-N 3.09Å; V647-H651 VanDerWaalsContact O-N 3.15Å; A649-H651 VanDerWaalsContact C-N 3.31Å; A649-H651 PolarHBondContact O-N 3.11Å; H651-D655 WeakPolarHBondContact CA-OD1 3.47Å; H651-D655 IonicContact CE1-OD1 3.98Å; H651-D655 IonicContact CG-OD1 2.83Å; H651-D655 IonicContact ND1-OD1 3.48Å; H651-D655 PolarHBondContact ND1-OD1 3.37Å; H651-D655 IonicContact ND1-OD2 2.68Å; H651-F658 AromaticContact CE1-CE2 3.59Å; H651-F658 AromaticContact CG-CE2 3.94Å; H651-F658 AromaticContact ND1-CE2 3.67Å; H651-F658 AromaticContact NE2-CE2 3.8Å; H651-D911 IonicContact CE1-OD1 2.65Å; H651-D911 IonicContact CE1-OD2 3.85Å; H651-D911 IonicContact NE2-OD1 2.87Å; H651-D911 PolarHBondContact NE2-OD1 2.99Å; H651-D911 IonicContact NE2-OD2 3.73Å; H651-R914 PolarHBondContact NE2-NH1 3.24Å; H651-R958 VanDerWaalsContact O-CZ 3.31Å; H651-R958 PolarHBondContact O-NH1 3.17Å; H651-R958 PolarHBondContact O-NH2 2.97Å
652	A	85.1	Confident	90	Very high	60 Å²	60	54.5 Å²	54.5	50%	0.496	33%	0.325	S	S	.	.	S	Bend	trans	-71.5	-42.4	-173.7	0	0	0	0	0	112.8	N648 A649 C650	N648-A652 PolarHBondContact O-N 2.91Å; A649-A652 VanDerWaalsContact O-CB 3.22Å; A649-A652 WeakPolarHBondContact O-CB 3.33Å; A649-A652 PolarHBondContact O-N 3.18Å; C650-A652 VanDerWaalsContact C-N 3.32Å; C650-A652 PolarHBondContact O-N 2.96Å
653	D	81	Confident	90	Very high	128 Å²	128	54.7 Å²	54.7	68%	0.684	33%	0.326	S	S	*	.	S	Bend	trans	-123.6	73.1	-172	-59.1	-62.2	0	0	0	110.3	D655 A656	D653-D655 PolarHBondContact O-N 2.84Å; D653-A656 HydrophobicContact CB-CB 4.44Å; D653-A656 WeakPolarHBondContact O-CB 3.19Å; D653-A656 PolarHBondContact O-N 3.45Å
654	D	80.7	Confident	89.8	Confident	165 Å²	165	56.4 Å²	56.4	88%	0.882	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	52.9	179.1	-157.8	31.1	0	0	0	113.4	A656	D654-A656 PolarHBondContact O-N 2.96Å
655	D	87.5	Confident	89.7	Confident	40 Å²	40	51.4 Å²	51.4	21%	0.214	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	12.6	-176.8	-75.4	9.9	0	0	0	116.7	C650 H651 D653 G657 F658 Q659	C650-D655 CarbonylContact O-C 3.48Å; C650-D655 WeakPolarHBondContact O-CA 3.29Å; H651-D655 WeakPolarHBondContact CA-OD1 3.47Å; H651-D655 IonicContact CE1-OD1 3.98Å; H651-D655 IonicContact CG-OD1 2.83Å; H651-D655 IonicContact ND1-OD1 3.48Å; H651-D655 PolarHBondContact ND1-OD1 3.37Å; H651-D655 IonicContact ND1-OD2 2.68Å; D653-D655 PolarHBondContact O-N 2.84Å; D655-G657 PolarHBondContact O-N 3Å; D655-F658 HydrophobicContact CB-CD2 4.41Å; D655-F658 WeakPolarHBondContact O-CA 3.43Å; D655-F658 WeakPolarHBondContact O-CB 3.3Å; D655-F658 PolarHBondContact O-N 3.21Å; D655-Q659 PolarHBondContact O-N 3.45Å; D655-Q659 VanDerWaalsContact O-N 3.09Å
656	A	86.7	Confident	89.5	Confident	52 Å²	52	50.8 Å²	50.8	43%	0.43	31%	0.305	S	S	.	.	H	α-helix	trans	-53.6	-27.3	-177.5	0	0	0	0	0	115.1	D653 D654 A660	D653-A656 HydrophobicContact CB-CB 4.44Å; D653-A656 WeakPolarHBondContact O-CB 3.19Å; D653-A656 PolarHBondContact O-N 3.45Å; D654-A656 PolarHBondContact O-N 2.96Å; A656-A660 WeakPolarHBondContact O-CB 3.48Å; A656-A660 PolarHBondContact O-N 3.23Å
657	G	89.2	Confident	89.2	Confident	33 Å²	33	55.5 Å²	55.5	34%	0.34	33%	0.327	S	S	.	.	H	α-helix	trans	-67.2	-37.5	172.8	0	0	0	0	0	113.2	C650 D655 E661	C650-G657 PolarHBondContact O-N 2.9Å; D655-G657 PolarHBondContact O-N 3Å; G657-E661 PolarHBondContact O-N 3.18Å
658	F	93.5	Very high	88.8	Confident	0 Å²	0	60 Å²	60	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-74.4	-40.4	173.4	-69.7	-54.5	0	0	0	112.1	V647 C650 H651 D655 E661 F662 E903 Y906 A907 H910	V647-F658 HydrophobicContact CG1-CZ 4.26Å; C650-F658 HydrophobicContact CB-CD1 3.94Å; C650-F658 HydrophobicContact CB-CD2 3.72Å; C650-F658 HydrophobicContact CB-CE1 3.65Å; C650-F658 HydrophobicContact CB-CE2 3.42Å; C650-F658 VanDerWaalsContact CB-CE2 3.42Å; C650-F658 HydrophobicContact CB-CG 3.96Å; C650-F658 HydrophobicContact CB-CZ 3.39Å; H651-F658 AromaticContact CE1-CE2 3.59Å; H651-F658 AromaticContact CG-CE2 3.94Å; H651-F658 AromaticContact ND1-CE2 3.67Å; H651-F658 AromaticContact NE2-CE2 3.8Å; D655-F658 HydrophobicContact CB-CD2 4.41Å; D655-F658 WeakPolarHBondContact O-CA 3.43Å; D655-F658 WeakPolarHBondContact O-CB 3.3Å; D655-F658 PolarHBondContact O-N 3.21Å; F658-E661 PolarHBondContact O-N 3.36Å; F658-F662 VanDerWaalsContact O-CB 3.26Å; F658-F662 WeakPolarHBondContact O-CB 3.19Å; F658-F662 PolarHBondContact O-N 3.29Å; F658-E903 HydrophobicContact CB-CG 4.4Å; F658-Y906 HydrophobicContact CD1-CD1 4.24Å; F658-A907 HydrophobicContact CB-CB 4.44Å; F658-A907 HydrophobicContact CD2-CB 3.58Å; F658-A907 HydrophobicContact CE2-CB 3.9Å; F658-A907 HydrophobicContact CG-CB 3.95Å; F658-H910 HydrophobicContact CE1-CB 3.88Å; F658-H910 AromaticContact CE1-CD2 3.95Å; F658-H910 AromaticContact CE1-CE1 3.86Å; F658-H910 AromaticContact CE1-CG 3.5Å; F658-H910 VanDerWaalsContact CE1-CG 3.5Å; F658-H910 AromaticContact CE1-ND1 3.44Å; F658-H910 WeakPolarHBondContact CE1-ND1 3.38Å; F658-H910 HydrophobicContact CZ-CB 3.71Å; F658-H910 AromaticContact CZ-CG 3.88Å
659	Q	91.7	Very high	88.5	Confident	65 Å²	65	57 Å²	57	30%	0.304	34%	0.335	S	S	.	.	H	α-helix	trans	-57.9	-51.7	175.3	-178.1	61.4	-5	0	0	111.7	D655 E661 F662 E663 E903	D655-Q659 PolarHBondContact O-N 3.45Å; D655-Q659 VanDerWaalsContact O-N 3.09Å; Q659-E661 VanDerWaalsContact C-N 3.28Å; Q659-E661 PolarHBondContact O-N 3.41Å; Q659-F662 PolarHBondContact O-N 3.38Å; Q659-E663 HydrophobicContact CG-CG 4.32Å; Q659-E663 PolarHBondContact NE2-OE1 3.4Å; Q659-E663 WeakPolarHBondContact O-CB 3.49Å; Q659-E663 WeakPolarHBondContact O-CG 3.42Å; Q659-E663 PolarHBondContact O-N 2.9Å; Q659-E903 WeakPolarHBondContact CA-OE1 3.27Å; Q659-E903 WeakPolarHBondContact CB-OE1 3.3Å; Q659-E903 PolarHBondContact N-OE1 3.12Å; Q659-E903 VanDerWaalsContact OE1-CD 3.3Å
660	A	91.9	Very high	88.1	Confident	62 Å²	62	58.2 Å²	58.2	51%	0.512	33%	0.33	S	S	.	.	H	α-helix	trans	-60	-38	-179.9	0	0	0	0	0	112.3	A656 S664	A656-A660 WeakPolarHBondContact O-CB 3.48Å; A656-A660 PolarHBondContact O-N 3.23Å; A660-S664 VanDerWaalsContact O-CB 3.23Å; A660-S664 WeakPolarHBondContact O-CB 3.36Å; A660-S664 PolarHBondContact O-N 3.41Å
661	E	92	Very high	87.6	Confident	41 Å²	41	62.1 Å²	62.1	19%	0.192	35%	0.354	C	S	.	.	H	α-helix	trans	-71.2	-43.9	176.5	-162.2	-178.5	140.2	0	0	112	G657 F658 Q659 S664 L665 R886 Y906	G657-E661 PolarHBondContact O-N 3.18Å; F658-E661 PolarHBondContact O-N 3.36Å; Q659-E661 VanDerWaalsContact C-N 3.28Å; Q659-E661 PolarHBondContact O-N 3.41Å; E661-S664 PolarHBondContact O-N 2.78Å; E661-L665 PolarHBondContact O-N 3.03Å; E661-R886 HydrophobicContact CG-CG 4.44Å; E661-R886 PolarHBondContact O-NH1 3.33Å; E661-R886 VanDerWaalsContact OE1-CB 3.28Å; E661-R886 WeakPolarHBondContact OE1-CB 3.28Å; E661-R886 WeakPolarHBondContact OE1-CG 3.35Å; E661-Y906 HydrophobicContact CB-CE1 4.32Å; E661-Y906 HydrophobicContact CG-CE1 4.16Å; E661-Y906 PolarHBondContact OE1-OH 3.48Å
662	F	93.6	Very high	87.5	Confident	17 Å²	17	67.2 Å²	67.2	8%	0.075	38%	0.382	C	S	.	.	H	α-helix	trans	-69.4	-42.6	-177.6	-171.4	-103	0	0	0	112.5	F658 Q659 S664 L665 E666 V900 E903 Y906	F658-F662 VanDerWaalsContact O-CB 3.26Å; F658-F662 WeakPolarHBondContact O-CB 3.19Å; F658-F662 PolarHBondContact O-N 3.29Å; Q659-F662 PolarHBondContact O-N 3.38Å; F662-S664 VanDerWaalsContact C-N 3.34Å; F662-S664 PolarHBondContact O-N 3.38Å; F662-L665 PolarHBondContact O-N 2.94Å; F662-L665 VanDerWaalsContact O-N 3.13Å; F662-E666 HydrophobicContact CD1-CG 4.44Å; F662-E666 HydrophobicContact CE1-CG 4.13Å; F662-E666 HydrophobicContact CZ-CG 4.49Å; F662-E666 PolarHBondContact O-N 3.44Å; F662-V900 HydrophobicContact CE2-CG1 4.31Å; F662-E903 HydrophobicContact CB-CB 4.47Å; F662-E903 HydrophobicContact CB-CG 4.44Å; F662-E903 HydrophobicContact CD1-CB 3.93Å; F662-E903 HydrophobicContact CE1-CB 4.45Å; F662-E903 HydrophobicContact CG-CB 4.24Å; F662-Y906 HydrophobicContact CB-CD1 4.33Å; F662-Y906 HydrophobicContact CD2-CD1 4.3Å; F662-Y906 HydrophobicContact CD2-CD2 4.34Å; F662-Y906 AromaticContact CD2-CG 3.87Å; F662-Y906 HydrophobicContact CD2-CG 3.87Å
663	E	92.9	Very high	87.8	Confident	93 Å²	93	68.4 Å²	68.4	44%	0.435	37%	0.374	S	S	.	.	H	α-helix	trans	-57.8	-47	171.1	-75.2	-171.4	177	0	0	111.4	Q659 L665 E666 Q667	Q659-E663 HydrophobicContact CG-CG 4.32Å; Q659-E663 PolarHBondContact NE2-OE1 3.4Å; Q659-E663 WeakPolarHBondContact O-CB 3.49Å; Q659-E663 WeakPolarHBondContact O-CG 3.42Å; Q659-E663 PolarHBondContact O-N 2.9Å; E663-L665 PolarHBondContact O-N 3.14Å; E663-E666 PolarHBondContact O-N 2.99Å; E663-Q667 WeakPolarHBondContact O-CG 3.44Å; E663-Q667 PolarHBondContact O-N 3.18Å
664	S	89.9	Confident	88.5	Confident	37 Å²	37	65.5 Å²	65.5	26%	0.259	36%	0.363	S	S	.	.	H	α-helix	trans	-60.5	-33.2	176.7	178.4	0	0	0	0	112.1	A660 E661 F662 N668 R886	A660-S664 VanDerWaalsContact O-CB 3.23Å; A660-S664 WeakPolarHBondContact O-CB 3.36Å; A660-S664 PolarHBondContact O-N 3.41Å; E661-S664 PolarHBondContact O-N 2.78Å; F662-S664 VanDerWaalsContact C-N 3.34Å; F662-S664 PolarHBondContact O-N 3.38Å; S664-N668 WeakPolarHBondContact O-CB 3.33Å; S664-N668 PolarHBondContact O-N 2.97Å; S664-N668 PolarHBondContact O-ND2 3.17Å; S664-R886 PolarHBondContact OG-NH2 2.99Å
665	L	89.5	Confident	89.2	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-74	-40	176.3	-167.5	155.8	0	0	0	111.6	E661 F662 E663 Q667 N668 V669 R886 L889	E661-L665 PolarHBondContact O-N 3.03Å; F662-L665 PolarHBondContact O-N 2.94Å; F662-L665 VanDerWaalsContact O-N 3.13Å; E663-L665 PolarHBondContact O-N 3.14Å; L665-Q667 VanDerWaalsContact C-N 3.29Å; L665-Q667 PolarHBondContact O-N 3.33Å; L665-N668 PolarHBondContact O-N 3.14Å; L665-V669 HydrophobicContact CD2-CG2 3.75Å; L665-V669 HydrophobicContact CG-CG2 4.33Å; L665-V669 WeakPolarHBondContact O-CB 3.43Å; L665-V669 VanDerWaalsContact O-CG2 3.26Å; L665-V669 WeakPolarHBondContact O-CG2 3.48Å; L665-V669 PolarHBondContact O-N 3.49Å; L665-R886 HydrophobicContact CD1-CG 3.83Å; L665-L889 HydrophobicContact CD1-CB 4.14Å; L665-L889 HydrophobicContact CD1-CD2 3.91Å; L665-L889 HydrophobicContact CD1-CG 4.05Å; L665-L889 HydrophobicContact CD2-CD2 4.34Å; L665-L889 HydrophobicContact CD2-CG 4.32Å
666	E	88.6	Confident	89.6	Confident	55 Å²	55	60 Å²	60	26%	0.257	34%	0.34	S	S	.	.	H	α-helix	trans	-60.1	-36.3	172.3	-77	-67	151.7	0	0	112.9	F662 E663 R893 K898	F662-E666 HydrophobicContact CD1-CG 4.44Å; F662-E666 HydrophobicContact CE1-CG 4.13Å; F662-E666 HydrophobicContact CZ-CG 4.49Å; F662-E666 PolarHBondContact O-N 3.44Å; E663-E666 PolarHBondContact O-N 2.99Å; E666-R893 VanDerWaalsContact CD-NH1 3.3Å; E666-R893 IonicContact OE1-CZ 2.69Å; E666-R893 IonicContact OE1-NH1 3.3Å; E666-R893 PolarHBondContact OE1-NH1 2.83Å; E666-R893 IonicContact OE1-NH2 3.74Å; E666-R893 PolarHBondContact OE1-NH2 3.2Å; E666-R893 IonicContact OE2-NH1 2.85Å; E666-K898 IonicContact OE1-NZ 2.71Å; E666-K898 IonicContact OE2-NZ 2.75Å; E666-K898 PolarHBondContact OE2-NZ 3.45Å
667	Q	87.3	Confident	90	Very high	147 Å²	147	59.1 Å²	59.1	69%	0.687	33%	0.329	S	S	*	.	H	α-helix	trans	-74.6	-36.1	179.3	-69.1	171	21.2	0	0	113.8	E663 L665	E663-Q667 WeakPolarHBondContact O-CG 3.44Å; E663-Q667 PolarHBondContact O-N 3.18Å; L665-Q667 VanDerWaalsContact C-N 3.29Å; L665-Q667 PolarHBondContact O-N 3.33Å
668	N	83.8	Confident	90.3	Very high	94 Å²	94	57.5 Å²	57.5	50%	0.503	31%	0.313	S	S	.	.	H	α-helix	trans	-93.3	-20.1	-172	-74.5	-74.6	0	0	0	114.6	S664 L665 Q670	S664-N668 WeakPolarHBondContact O-CB 3.33Å; S664-N668 PolarHBondContact O-N 2.97Å; S664-N668 PolarHBondContact O-ND2 3.17Å; L665-N668 PolarHBondContact O-N 3.14Å; N668-Q670 PolarHBondContact O-N 3.08Å
669	V	83.9	Confident	90.4	Very high	13 Å²	13	64.7 Å²	64.7	8%	0.079	34%	0.34	C	S	.	.	S	Bend	trans	-64.8	121.2	179.8	160.3	0	0	0	0	111.6	L665 T671 E890 R893	L665-V669 HydrophobicContact CD2-CG2 3.75Å; L665-V669 HydrophobicContact CG-CG2 4.33Å; L665-V669 WeakPolarHBondContact O-CB 3.43Å; L665-V669 VanDerWaalsContact O-CG2 3.26Å; L665-V669 WeakPolarHBondContact O-CG2 3.48Å; L665-V669 PolarHBondContact O-N 3.49Å; V669-T671 HydrophobicContact CG1-CG2 4.31Å; V669-T671 PolarHBondContact O-N 3.36Å; V669-E890 HydrophobicContact CG2-CB 4.49Å; V669-E890 HydrophobicContact CG2-CG 4.05Å; V669-R893 HydrophobicContact CG1-CB 4.01Å; V669-R893 HydrophobicContact CG2-CB 4.3Å
670	Q	82.7	Confident	90.6	Very high	90 Å²	90	63.2 Å²	63.2	42%	0.421	34%	0.337	S	S	.	.			trans	-59.2	119.3	169.8	176.3	-177.5	-5.5	0	0	111.1	N668 N672 Q894	N668-Q670 PolarHBondContact O-N 3.08Å; Q670-N672 WeakPolarHBondContact CG-OD1 3.45Å; Q670-N672 PolarHBondContact NE2-OD1 3.01Å; Q670-Q894 PolarHBondContact O-OE1 3.33Å
671	T	79.8	Confident	90.7	Very high	95 Å²	95	65.8 Å²	65.8	58%	0.583	35%	0.351	S	S	*	.			trans	-112.5	-5.1	-175.8	47.1	0	0	0	0	114.7	V669 W673	V669-T671 HydrophobicContact CG1-CG2 4.31Å; V669-T671 PolarHBondContact O-N 3.36Å; T671-W673 PolarHBondContact O-N 2.99Å
672	N	85.5	Confident	90.7	Very high	125 Å²	125	69.1 Å²	69.1	67%	0.668	37%	0.367	S	S	*	.			trans	-78.7	20.2	-171.4	69	-3.9	0	0	0	115.3	Q670	Q670-N672 WeakPolarHBondContact CG-OD1 3.45Å; Q670-N672 PolarHBondContact NE2-OD1 3.01Å
673	W	91.9	Very high	90.8	Very high	85 Å²	85	68.3 Å²	68.3	32%	0.322	36%	0.363	S	S	.	.			trans	-71.5	137.4	179	-64.5	107.3	0	0	0	111.9	T671 Y695 H697	T671-W673 PolarHBondContact O-N 2.99Å; W673-Y695 HydrophobicContact CB-CD1 3.58Å; W673-Y695 HydrophobicContact CB-CD2 4.1Å; W673-Y695 HydrophobicContact CB-CE1 3.74Å; W673-Y695 HydrophobicContact CB-CE2 4.23Å; W673-Y695 HydrophobicContact CB-CG 3.77Å; W673-Y695 AromaticContact CD1-CE2 3.83Å; W673-Y695 AromaticContact CD1-CZ 3.96Å; W673-Y695 HydrophobicContact CG-CD2 4.34Å; W673-Y695 HydrophobicContact CG-CE2 4.3Å; W673-Y695 HydrophobicContact CG-CG 4.47Å; W673-H697 AromaticContact CD2-CE1 3.55Å; W673-H697 AromaticContact CD2-ND1 3.66Å; W673-H697 AromaticContact CE3-CE1 3.74Å; W673-H697 AromaticContact CE3-ND1 3.42Å; W673-H697 AromaticContact CG-CE1 3.79Å; W673-H697 AromaticContact CG-ND1 3.98Å
674	S	95.1	Very high	90.9	Very high	66 Å²	66	68.8 Å²	68.8	46%	0.462	37%	0.367	S	S	.	.			trans	-60	142.2	-178.8	-174.1	0	0	0	0	112.6	S676 Y695 D696	S674-S676 PolarHBondContact OG-N 2.83Å; S674-Y695 CarbonylContact O-C 3.6Å; S674-Y695 WeakPolarHBondContact O-CA 3.16Å; S674-D696 VanDerWaalsContact C-OD2 3.28Å; S674-D696 WeakPolarHBondContact CB-OD2 3.32Å; S674-D696 PolarHBondContact O-N 2.72Å; S674-D696 PolarHBondContact OG-OD2 2.95Å
675	T	95.4	Very high	91.2	Very high	16 Å²	16	70.6 Å²	70.6	10%	0.098	39%	0.385	C	S	.	.			trans	-130.7	27.1	176.5	47.3	0	0	0	0	110.9	V677 A678 R679 L693 Y695 D696 M897	T675-V677 PolarHBondContact O-N 3.35Å; T675-A678 PolarHBondContact O-N 2.7Å; T675-R679 VanDerWaalsContact O-CG 3.29Å; T675-R679 WeakPolarHBondContact O-CG 3.47Å; T675-R679 PolarHBondContact O-N 2.87Å; T675-R679 VanDerWaalsContact O-N 3.14Å; T675-R679 PolarHBondContact OG1-NE 2.04Å; T675-L693 HydrophobicContact CG2-CB 3.97Å; T675-Y695 HydrophobicContact CG2-CD1 3.78Å; T675-Y695 HydrophobicContact CG2-CE1 4.38Å; T675-D696 PolarHBondContact N-OD2 3.39Å; T675-M897 HydrophobicContact CG2-CE 3.86Å
676	S	95.6	Very high	91.5	Very high	73 Å²	73	71.8 Å²	71.8	51%	0.51	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-42.8	-172	65.3	0	0	0	0	112.8	S674 A678 R679 S680 D696	S674-S676 PolarHBondContact OG-N 2.83Å; S676-A678 VanDerWaalsContact C-N 3.34Å; S676-A678 PolarHBondContact O-N 2.87Å; S676-R679 PolarHBondContact O-N 3.12Å; S676-S680 PolarHBondContact O-N 2.74Å; S676-S680 VanDerWaalsContact O-N 3.16Å; S676-D696 WeakPolarHBondContact CB-OD2 3.47Å; S676-D696 PolarHBondContact N-OD1 2.95Å; S676-D696 PolarHBondContact N-OD2 3.05Å; S676-D696 PolarHBondContact OG-OD2 3Å
677	V	96.1	Very high	91.9	Very high	34 Å²	34	70.1 Å²	70.1	21%	0.206	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-70.4	-35.7	-179.5	-173.1	0	0	0	0	110.6	T675 R679 S680 N683 D696 Y711	T675-V677 PolarHBondContact O-N 3.35Å; V677-R679 PolarHBondContact O-N 3.01Å; V677-S680 PolarHBondContact O-N 2.85Å; V677-S680 PolarHBondContact O-OG 3.5Å; V677-N683 WeakPolarHBondContact O-CB 3.3Å; V677-N683 PolarHBondContact O-ND2 2.85Å; V677-D696 WeakPolarHBondContact CB-OD1 3.35Å; V677-D696 PolarHBondContact N-OD1 2.96Å; V677-Y711 HydrophobicContact CB-CD2 4.39Å; V677-Y711 HydrophobicContact CG1-CD2 3.8Å; V677-Y711 HydrophobicContact CG1-CG 4.35Å
678	A	96.2	Very high	92.2	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-68.6	-20.5	175.5	0	0	0	0	0	113.6	T675 S676 N687 L693 Y711	T675-A678 PolarHBondContact O-N 2.7Å; S676-A678 VanDerWaalsContact C-N 3.34Å; S676-A678 PolarHBondContact O-N 2.87Å; A678-N687 PolarHBondContact O-ND2 3.5Å; A678-L693 HydrophobicContact CB-CB 3.88Å; A678-L693 HydrophobicContact CB-CD1 4.45Å; A678-L693 HydrophobicContact CB-CD2 4.23Å; A678-L693 HydrophobicContact CB-CG 4.41Å; A678-Y711 HydrophobicContact CB-CE2 3.77Å; A678-Y711 WeakPolarHBondContact CB-OH 3.5Å
679	R	95.8	Very high	92.7	Very high	151 Å²	151	64.3 Å²	64.3	57%	0.57	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-101.4	-3.5	-179.5	-68.3	174.8	-174.6	-87.8	1.6	113.9	T675 S676 V677 L693	T675-R679 VanDerWaalsContact O-CG 3.29Å; T675-R679 WeakPolarHBondContact O-CG 3.47Å; T675-R679 PolarHBondContact O-N 2.87Å; T675-R679 VanDerWaalsContact O-N 3.14Å; T675-R679 PolarHBondContact OG1-NE 2.04Å; S676-R679 PolarHBondContact O-N 3.12Å; V677-R679 PolarHBondContact O-N 3.01Å; R679-L693 HydrophobicContact CG-CD1 3.71Å
680	S	94.9	Very high	93.1	Very high	34 Å²	34	68.7 Å²	68.7	24%	0.238	38%	0.38	C	S	.	.	S	Bend	trans	-64.1	148.3	176.2	66.2	0	0	0	0	110.9	S676 V677 E682 N683 I684	S676-S680 PolarHBondContact O-N 2.74Å; S676-S680 VanDerWaalsContact O-N 3.16Å; V677-S680 PolarHBondContact O-N 2.85Å; V677-S680 PolarHBondContact O-OG 3.5Å; S680-E682 PolarHBondContact O-N 3.45Å; S680-E682 VanDerWaalsContact O-N 3.17Å; S680-E682 WeakPolarHBondContact OG-CG 3.33Å; S680-N683 PolarHBondContact O-N 3.33Å; S680-N683 PolarHBondContact OG-ND2 2.9Å; S680-I684 WeakPolarHBondContact O-CG1 3.32Å; S680-I684 PolarHBondContact O-N 3.27Å
681	S	93.2	Very high	93.6	Very high	115 Å²	115	69.8 Å²	69.8	80%	0.804	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-32.9	-174.4	47.7	0	0	0	0	113.7	N683	S681-N683 VanDerWaalsContact C-N 3.33Å; S681-N683 PolarHBondContact O-N 3.42Å
682	E	93.1	Very high	94.4	Very high	112 Å²	112	65.8 Å²	65.8	52%	0.523	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.9	173.3	51.2	163.9	-149	0	0	114.5	S680 S709	S680-E682 PolarHBondContact O-N 3.45Å; S680-E682 VanDerWaalsContact O-N 3.17Å; S680-E682 WeakPolarHBondContact OG-CG 3.33Å; E682-S709 VanDerWaalsContact CD-CB 3.44Å; E682-S709 VanDerWaalsContact CD-OG 3.27Å; E682-S709 VanDerWaalsContact OE1-CB 3.24Å; E682-S709 WeakPolarHBondContact OE1-CB 3.36Å; E682-S709 PolarHBondContact OE1-OG 3.18Å; E682-S709 WeakPolarHBondContact OE2-CB 3.4Å
683	N	96	Very high	94.9	Very high	0 Å²	0	60 Å²	60	0%	0	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-15	-169.7	-71.5	-36.7	0	0	0	114.9	V677 S680 S681 A685 K686 N687 S709 Y711	V677-N683 WeakPolarHBondContact O-CB 3.3Å; V677-N683 PolarHBondContact O-ND2 2.85Å; S680-N683 PolarHBondContact O-N 3.33Å; S680-N683 PolarHBondContact OG-ND2 2.9Å; S681-N683 VanDerWaalsContact C-N 3.33Å; S681-N683 PolarHBondContact O-N 3.42Å; N683-A685 PolarHBondContact O-N 3.31Å; N683-K686 WeakPolarHBondContact O-CB 3.15Å; N683-K686 PolarHBondContact O-N 2.88Å; N683-N687 PolarHBondContact O-ND2 2.96Å; N683-S709 PolarHBondContact ND2-OG 2.85Å; N683-S709 WeakPolarHBondContact OD1-CB 3.43Å; N683-S709 PolarHBondContact OD1-OG 2.87Å; N683-Y711 HydrophobicContact CB-CD1 3.74Å; N683-Y711 HydrophobicContact CB-CE1 4.33Å; N683-Y711 HydrophobicContact CB-CG 4.13Å; N683-Y711 VanDerWaalsContact CG-CB 3.45Å; N683-Y711 VanDerWaalsContact ND2-CB 3.33Å; N683-Y711 WeakPolarHBondContact ND2-CB 3.03Å; N683-Y711 WeakPolarHBondContact OD1-CB 3.45Å
684	I	95.2	Very high	95.2	Very high	102 Å²	102	56 Å²	56	52%	0.523	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-50.5	-44.6	173.9	-71.6	166.7	0	0	0	110.8	S680 K686 N687	S680-I684 WeakPolarHBondContact O-CG1 3.32Å; S680-I684 PolarHBondContact O-N 3.27Å; I684-K686 PolarHBondContact O-N 3.43Å; I684-N687 PolarHBondContact O-N 2.92Å; I684-N687 VanDerWaalsContact O-N 3.16Å; I684-N687 PolarHBondContact O-ND2 3.44Å
685	A	94.9	Very high	95.2	Very high	76 Å²	76	53.1 Å²	53.1	63%	0.628	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-72.9	-5.9	179.3	0	0	0	0	0	115	N683 I733	N683-A685 PolarHBondContact O-N 3.31Å; A685-I733 WeakPolarHBondContact O-CD1 3.42Å
686	K	96.3	Very high	95.3	Very high	24 Å²	24	53.8 Å²	53.8	10%	0.104	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-87.9	-9.2	170.1	-61.4	-161.1	-171	-166.7	0	112.6	N683 I684 S709 Y711 Q730 T736 D739	N683-K686 WeakPolarHBondContact O-CB 3.15Å; N683-K686 PolarHBondContact O-N 2.88Å; I684-K686 PolarHBondContact O-N 3.43Å; K686-S709 PolarHBondContact NZ-O 3.26Å; K686-Y711 HydrophobicContact CB-CD1 4.23Å; K686-Y711 HydrophobicContact CB-CE1 4.42Å; K686-Y711 HydrophobicContact CD-CD1 4.2Å; K686-Y711 VanDerWaalsContact CD-O 3.32Å; K686-Y711 WeakPolarHBondContact CD-O 3.4Å; K686-Y711 PolarHBondContact NZ-O 3.25Å; K686-Q730 PolarHBondContact O-NE2 3.32Å; K686-T736 HydrophobicContact CB-CG2 3.85Å; K686-T736 HydrophobicContact CD-CG2 4.36Å; K686-T736 HydrophobicContact CG-CG2 4.08Å; K686-D739 WeakPolarHBondContact CE-OD2 3.39Å; K686-D739 IonicContact NZ-OD2 2.68Å; K686-D739 PolarHBondContact NZ-OD2 2.87Å
687	N	96.5	Very high	95.2	Very high	21 Å²	21	54 Å²	54	11%	0.112	29%	0.292	C	S	.	.			trans	-93	127.2	-179.4	-58.9	-55.8	0	0	0	111.5	A678 N683 I684 Y689 L693 Y711 N713	A678-N687 PolarHBondContact O-ND2 3.5Å; N683-N687 PolarHBondContact O-ND2 2.96Å; I684-N687 PolarHBondContact O-N 2.92Å; I684-N687 VanDerWaalsContact O-N 3.16Å; I684-N687 PolarHBondContact O-ND2 3.44Å; N687-Y689 VanDerWaalsContact C-N 3.28Å; N687-Y689 PolarHBondContact O-N 3.46Å; N687-L693 HydrophobicContact CB-CD2 4.34Å; N687-Y711 PolarHBondContact OD1-OH 2.89Å; N687-N713 PolarHBondContact OD1-ND2 3.37Å
688	R	94.6	Very high	95.2	Very high	46 Å²	46	52.5 Å²	52.5	17%	0.174	28%	0.283	C	S	.	.	S	Bend	trans	-67.7	-29.5	172.4	-175.4	-179.6	-69.7	-86.9	2.9	112.1	G731 P732 I733 K765 D767	R688-G731 VanDerWaalsContact CZ-O 3.29Å; R688-G731 PolarHBondContact NE-O 2.87Å; R688-G731 PolarHBondContact NH2-O 2.74Å; R688-P732 VanDerWaalsContact NH2-C 3.33Å; R688-P732 PolarHBondContact NH2-O 3.08Å; R688-I733 HydrophobicContact CB-CG2 4.03Å; R688-I733 HydrophobicContact CG-CG2 4.15Å; R688-I733 VanDerWaalsContact CZ-CG2 3.43Å; R688-K765 PolarHBondContact NE-O 3.27Å; R688-K765 PolarHBondContact NH1-O 2.78Å; R688-D767 IonicContact CZ-OD2 2.76Å; R688-D767 IonicContact NH1-OD2 3.87Å; R688-D767 PolarHBondContact NH1-OD2 3.1Å; R688-D767 IonicContact NH2-OD2 3.72Å; R688-D767 PolarHBondContact NH2-OD2 2.86Å
689	Y	94.1	Very high	95.3	Very high	72 Å²	72	53.8 Å²	53.8	28%	0.282	29%	0.287	S	S	.	.			trans	-135	124.8	-178.5	-66.5	-78.4	0	0	0	110.2	N687 N691 I692 S858 A859	N687-Y689 VanDerWaalsContact C-N 3.28Å; N687-Y689 PolarHBondContact O-N 3.46Å; Y689-N691 PolarHBondContact O-N 3.2Å; Y689-I692 PolarHBondContact O-N 3.47Å; Y689-S858 WeakPolarHBondContact CE2-OG 3.31Å; Y689-S858 PolarHBondContact OH-OG 2.82Å; Y689-A859 HydrophobicContact CD2-CB 3.59Å; Y689-A859 HydrophobicContact CE2-CB 3.67Å
690	S	93	Very high	95.4	Very high	106 Å²	106	46.6 Å²	46.6	74%	0.741	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.9	-178.2	52.4	0	0	0	0	114.2
691	N	92.8	Very high	95.5	Very high	112 Å²	112	47.2 Å²	47.2	60%	0.599	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-3.6	178.8	67.4	-33.8	0	0	0	114.4	Y689	Y689-N691 PolarHBondContact O-N 3.2Å
692	I	95.5	Very high	95.7	Very high	11 Å²	11	42 Å²	42	6%	0.056	22%	0.223	C	C	.	.			trans	-118.8	97.3	177.1	-54.3	-64	0	0	0	109	Y689 N713 A859 V861	Y689-I692 PolarHBondContact O-N 3.47Å; I692-N713 PolarHBondContact O-ND2 3.08Å; I692-A859 HydrophobicContact CG1-CB 4.24Å; I692-A859 HydrophobicContact CG2-CB 4.31Å; I692-V861 HydrophobicContact CD1-CG2 4.26Å; I692-V861 HydrophobicContact CG1-CG2 4.46Å; I692-V861 HydrophobicContact CG2-CG1 3.76Å; I692-V861 HydrophobicContact CG2-CG2 3.97Å
693	L	96.6	Very high	95.6	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.021	23%	0.227	C	C	.	.			trans	-117.1	149	-171.3	-56.7	179.7	0	0	0	111	T675 A678 R679 N687 M897	T675-L693 HydrophobicContact CG2-CB 3.97Å; A678-L693 HydrophobicContact CB-CB 3.88Å; A678-L693 HydrophobicContact CB-CD1 4.45Å; A678-L693 HydrophobicContact CB-CD2 4.23Å; A678-L693 HydrophobicContact CB-CG 4.41Å; R679-L693 HydrophobicContact CG-CD1 3.71Å; N687-L693 HydrophobicContact CB-CD2 4.34Å; L693-M897 HydrophobicContact CB-CE 4.09Å; L693-M897 PolarHBondContact N-SD 2.68Å; L693-M897 WeakPolarHBondContact O-CE 3.3Å
694	A	97.2	Very high	95	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.244	C	C	.	.			trans	-73.7	129.9	171.1	0	0	0	0	0	111.2	R699 Y711 N715	A694-R699 HydrophobicContact CB-CB 4.19Å; A694-Y711 HydrophobicContact CB-CE2 4.11Å; A694-Y711 WeakPolarHBondContact CB-OH 3.41Å; A694-Y711 PolarHBondContact N-OH 3.45Å; A694-N715 VanDerWaalsContact CA-OD1 3.25Å; A694-N715 WeakPolarHBondContact CA-OD1 3.43Å; A694-N715 VanDerWaalsContact CB-OD1 3.3Å; A694-N715 WeakPolarHBondContact CB-OD1 3.37Å
695	Y	96.9	Very high	94.2	Very high	6 Å²	6	43.1 Å²	43.1	2%	0.024	23%	0.226	C	C	.	.			trans	-66.2	136.1	171	-65.6	-37.7	0	0	0	111.5	W673 S674 T675 H697 S698 R699 N715 Q894 M897	W673-Y695 HydrophobicContact CB-CD1 3.58Å; W673-Y695 HydrophobicContact CB-CD2 4.1Å; W673-Y695 HydrophobicContact CB-CE1 3.74Å; W673-Y695 HydrophobicContact CB-CE2 4.23Å; W673-Y695 HydrophobicContact CB-CG 3.77Å; W673-Y695 AromaticContact CD1-CE2 3.83Å; W673-Y695 AromaticContact CD1-CZ 3.96Å; W673-Y695 HydrophobicContact CG-CD2 4.34Å; W673-Y695 HydrophobicContact CG-CE2 4.3Å; W673-Y695 HydrophobicContact CG-CG 4.47Å; S674-Y695 CarbonylContact O-C 3.6Å; S674-Y695 WeakPolarHBondContact O-CA 3.16Å; T675-Y695 HydrophobicContact CG2-CD1 3.78Å; T675-Y695 HydrophobicContact CG2-CE1 4.38Å; Y695-H697 VanDerWaalsContact C-N 3.28Å; Y695-H697 PolarHBondContact O-N 2.71Å; Y695-S698 PolarHBondContact O-N 3.49Å; Y695-S698 PolarHBondContact O-OG 2.95Å; Y695-R699 WeakPolarHBondContact O-CB 3.29Å; Y695-R699 PolarHBondContact O-N 3.49Å; Y695-N715 PolarHBondContact N-ND2 2.77Å; Y695-N715 VanDerWaalsContact N-ND2 3.18Å; Y695-N715 PolarHBondContact O-ND2 3.32Å; Y695-N715 VanDerWaalsContact O-ND2 3.13Å; Y695-Q894 VanDerWaalsContact CD2-O 3.26Å; Y695-Q894 WeakPolarHBondContact CD2-O 3.16Å; Y695-Q894 WeakPolarHBondContact CE2-O 3.48Å; Y695-M897 HydrophobicContact CD1-CE 4.04Å; Y695-M897 HydrophobicContact CE1-CB 3.98Å; Y695-M897 HydrophobicContact CE1-CE 3.62Å; Y695-M897 HydrophobicContact CE2-CB 4.25Å
696	D	96.4	Very high	93.4	Very high	31 Å²	31	43.1 Å²	43.1	17%	0.166	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-29.8	-171.1	-65	-30.1	0	0	0	113.6	S674 T675 S676 V677	S674-D696 VanDerWaalsContact C-OD2 3.28Å; S674-D696 WeakPolarHBondContact CB-OD2 3.32Å; S674-D696 PolarHBondContact O-N 2.72Å; S674-D696 PolarHBondContact OG-OD2 2.95Å; T675-D696 PolarHBondContact N-OD2 3.39Å; S676-D696 WeakPolarHBondContact CB-OD2 3.47Å; S676-D696 PolarHBondContact N-OD1 2.95Å; S676-D696 PolarHBondContact N-OD2 3.05Å; S676-D696 PolarHBondContact OG-OD2 3Å; V677-D696 WeakPolarHBondContact CB-OD1 3.35Å; V677-D696 PolarHBondContact N-OD1 2.96Å
697	H	94.8	Very high	92.6	Very high	78 Å²	78	48.2 Å²	48.2	36%	0.361	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-22	-174.5	76.2	-100.4	0	0	0	114	Y622 W673 Y695 Q894	Y622-H697 WeakPolarHBondContact CE2-O 3.45Å; W673-H697 AromaticContact CD2-CE1 3.55Å; W673-H697 AromaticContact CD2-ND1 3.66Å; W673-H697 AromaticContact CE3-CE1 3.74Å; W673-H697 AromaticContact CE3-ND1 3.42Å; W673-H697 AromaticContact CG-CE1 3.79Å; W673-H697 AromaticContact CG-ND1 3.98Å; Y695-H697 VanDerWaalsContact C-N 3.28Å; Y695-H697 PolarHBondContact O-N 2.71Å; H697-Q894 PolarHBondContact CE1-O 2.94Å; H697-Q894 PolarHBondContact NE2-O 3.43Å
698	S	96.1	Very high	92.1	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.007	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-1.7	-174.3	60	0	0	0	0	112.8	Y695 N715 Y716 Q895	Y695-S698 PolarHBondContact O-N 3.49Å; Y695-S698 PolarHBondContact O-OG 2.95Å; S698-N715 CarbonylContact O-C 3.59Å; S698-N715 WeakPolarHBondContact O-CA 3.16Å; S698-N715 PolarHBondContact OG-ND2 3Å; S698-Y716 WeakPolarHBondContact O-CD2 3.33Å; S698-Y716 PolarHBondContact O-N 2.86Å; S698-Q895 WeakPolarHBondContact CB-O 3.21Å; S698-Q895 PolarHBondContact OG-O 3.41Å
699	R	97.3	Very high	91.9	Very high	27 Å²	27	51.1 Å²	51.1	10%	0.102	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	150.5	179.9	72.6	-177.1	-175.1	97.7	-7.2	111.5	A694 Y695 I701 D710 A714 N715	A694-R699 HydrophobicContact CB-CB 4.19Å; Y695-R699 WeakPolarHBondContact O-CB 3.29Å; Y695-R699 PolarHBondContact O-N 3.49Å; R699-I701 HydrophobicContact CG-CG1 4.17Å; R699-D710 IonicContact CZ-OD1 3.78Å; R699-D710 VanDerWaalsContact CZ-OD1 3.3Å; R699-D710 IonicContact CZ-OD2 2.67Å; R699-D710 VanDerWaalsContact NH1-CG 3.31Å; R699-D710 IonicContact NH1-OD1 3.68Å; R699-D710 PolarHBondContact NH1-OD1 3.08Å; R699-D710 IonicContact NH1-OD2 3.95Å; R699-D710 PolarHBondContact NH1-OD2 2.81Å; R699-D710 VanDerWaalsContact NH2-CG 3.31Å; R699-D710 IonicContact NH2-OD1 3.42Å; R699-D710 PolarHBondContact NH2-OD1 3.49Å; R699-D710 IonicContact NH2-OD2 2.61Å; R699-D710 PolarHBondContact NH2-OD2 3.25Å; R699-A714 WeakPolarHBondContact CA-O 3.38Å; R699-N715 PolarHBondContact N-ND2 3.42Å
700	V	97.9	Very high	92	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	136.5	166.6	-171	0	0	0	0	108.8	I712 A714 Y716 I727 M743 Q747	V700-I712 HydrophobicContact CB-CG2 4.15Å; V700-A714 HydrophobicContact CB-CB 4.45Å; V700-A714 HydrophobicContact CG2-CB 4.01Å; V700-A714 PolarHBondContact N-O 3.13Å; V700-Y716 HydrophobicContact CB-CE2 4.46Å; V700-Y716 HydrophobicContact CG2-CD1 4.44Å; V700-Y716 HydrophobicContact CG2-CD2 4.35Å; V700-Y716 HydrophobicContact CG2-CE1 4.25Å; V700-Y716 HydrophobicContact CG2-CE2 4.15Å; V700-I727 HydrophobicContact CG2-CD1 3.92Å; V700-I727 HydrophobicContact CG2-CG1 3.94Å; V700-I727 HydrophobicContact CG2-CG2 3.8Å; V700-M743 HydrophobicContact CB-SD 4.22Å; V700-M743 HydrophobicContact CG1-CG 3.88Å; V700-M743 HydrophobicContact CG1-SD 4.12Å; V700-M743 HydrophobicContact CG2-SD 4.17Å; V700-Q747 HydrophobicContact CG1-CG 4.13Å
701	I	97.3	Very high	92.2	Very high	47 Å²	47	45 Å²	45	24%	0.241	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	119.3	-179.2	-57.3	-180	0	0	0	107.7	R699 D710	R699-I701 HydrophobicContact CG-CG1 4.17Å; I701-D710 HydrophobicContact CG2-CB 4.19Å
702	L	96.2	Very high	92.5	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.026	22%	0.224	C	C	.	.			trans	-83.2	151.6	177	-57.7	177.3	0	0	0	111	T705 D710 I712 D739 L742 M743 E746	L702-T705 HydrophobicContact CB-CG2 3.44Å; L702-T705 VanDerWaalsContact CB-CG2 3.44Å; L702-T705 HydrophobicContact CD1-CG2 4.19Å; L702-T705 HydrophobicContact CG-CG2 4.47Å; L702-D710 WeakPolarHBondContact CB-O 3.47Å; L702-D710 PolarHBondContact N-O 3.07Å; L702-I712 HydrophobicContact CD1-CB 4.23Å; L702-I712 HydrophobicContact CD1-CG2 4.28Å; L702-I712 HydrophobicContact CD2-CG2 4.23Å; L702-I712 HydrophobicContact CG-CG2 4.16Å; L702-D739 HydrophobicContact CD1-CB 3.8Å; L702-L742 HydrophobicContact CB-CD2 4.4Å; L702-L742 HydrophobicContact CD2-CG 4.5Å; L702-M743 HydrophobicContact CD2-CB 3.87Å; L702-M743 HydrophobicContact CD2-CG 4.47Å; L702-E746 WeakPolarHBondContact CA-OE2 3.43Å
703	K	91.6	Very high	92.6	Very high	138 Å²	138	39.4 Å²	39.4	60%	0.6	22%	0.222	S	C	*	.	S	Bend	trans	-118.4	-41.3	-172.3	-62.2	178.4	-179	178.1	0	114.3	T705 E746	K703-T705 VanDerWaalsContact C-N 3.26Å; K703-T705 PolarHBondContact O-N 3.27Å; K703-E746 WeakPolarHBondContact CA-OE1 3.38Å; K703-E746 VanDerWaalsContact N-CD 3.32Å; K703-E746 PolarHBondContact N-OE1 2.85Å; K703-E746 PolarHBondContact N-OE2 3.13Å
704	E	83.6	Confident	92.7	Very high	74 Å²	74	39.2 Å²	39.2	35%	0.346	22%	0.221	S	C	.	.	S	Bend	trans	-89.9	35.2	-179.1	-65	-158.2	-133.1	0	0	113.7	L742 E746 H803 K805	E704-L742 HydrophobicContact CB-CD1 4.17Å; E704-L742 HydrophobicContact CB-CD2 4.45Å; E704-E746 PolarHBondContact N-OE1 2.97Å; E704-H803 VanDerWaalsContact CD-CE1 3.45Å; E704-H803 IonicContact OE1-CE1 3.5Å; E704-H803 PolarHBondContact OE1-CE1 3.11Å; E704-H803 IonicContact OE1-ND1 3.94Å; E704-H803 IonicContact OE1-NE2 3.51Å; E704-H803 IonicContact OE2-CE1 2.75Å; E704-H803 PolarHBondContact OE2-CE1 3.29Å; E704-H803 IonicContact OE2-NE2 3.88Å; E704-K805 IonicContact OE2-NZ 3.8Å; E704-K805 PolarHBondContact OE2-NZ 3.24Å
705	T	78.3	Confident	92.8	Very high	26 Å²	26	39.2 Å²	39.2	16%	0.16	22%	0.221	C	C	.	.			trans	-79.1	-18.3	-177.1	63.9	0	0	0	0	114.3	L702 K703 S707 K708 L742	L702-T705 HydrophobicContact CB-CG2 3.44Å; L702-T705 VanDerWaalsContact CB-CG2 3.44Å; L702-T705 HydrophobicContact CD1-CG2 4.19Å; L702-T705 HydrophobicContact CG-CG2 4.47Å; K703-T705 VanDerWaalsContact C-N 3.26Å; K703-T705 PolarHBondContact O-N 3.27Å; T705-S707 PolarHBondContact O-N 2.87Å; T705-K708 WeakPolarHBondContact CB-O 3.38Å; T705-K708 WeakPolarHBondContact O-CB 3.47Å; T705-K708 PolarHBondContact O-N 3.29Å; T705-K708 VanDerWaalsContact O-N 3.09Å; T705-K708 PolarHBondContact OG1-O 2.86Å; T705-L742 HydrophobicContact CG2-CD2 4.27Å
706	G	79.1	Confident	92.8	Very high	77 Å²	77	40.6 Å²	40.6	79%	0.794	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.4	-111.5	-179.6	0	0	0	0	0	111.6
707	S	79.6	Confident	92.8	Very high	131 Å²	131	39.1 Å²	39.1	92%	0.916	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.2	0.5	173.3	62.4	0	0	0	0	113.8	T705	T705-S707 PolarHBondContact O-N 2.87Å
708	K	85.6	Confident	92.9	Very high	110 Å²	110	35.6 Å²	35.6	48%	0.478	20%	0.202	S	C	.	.	S	Bend	trans	-82.1	149.8	171.2	-59.9	-178.2	-179.8	-176.5	0	110.1	T705 D738	T705-K708 WeakPolarHBondContact CB-O 3.38Å; T705-K708 WeakPolarHBondContact O-CB 3.47Å; T705-K708 PolarHBondContact O-N 3.29Å; T705-K708 VanDerWaalsContact O-N 3.09Å; T705-K708 PolarHBondContact OG1-O 2.86Å; K708-D738 IonicContact NZ-OD2 3.56Å; K708-D738 PolarHBondContact NZ-OD2 3.08Å
709	S	90.8	Very high	92.7	Very high	18 Å²	18	36 Å²	36	13%	0.126	21%	0.206	C	C	.	.			trans	-57.4	145.5	174.6	-168.9	0	0	0	0	112.9	E682 N683 K686 Y711	E682-S709 VanDerWaalsContact CD-CB 3.44Å; E682-S709 VanDerWaalsContact CD-OG 3.27Å; E682-S709 VanDerWaalsContact OE1-CB 3.24Å; E682-S709 WeakPolarHBondContact OE1-CB 3.36Å; E682-S709 PolarHBondContact OE1-OG 3.18Å; E682-S709 WeakPolarHBondContact OE2-CB 3.4Å; N683-S709 PolarHBondContact ND2-OG 2.85Å; N683-S709 WeakPolarHBondContact OD1-CB 3.43Å; N683-S709 PolarHBondContact OD1-OG 2.87Å; K686-S709 PolarHBondContact NZ-O 3.26Å; S709-Y711 PolarHBondContact O-N 2.89Å; S709-Y711 VanDerWaalsContact O-N 3.13Å
710	D	95.8	Very high	92.4	Very high	48 Å²	48	35.5 Å²	35.5	26%	0.257	20%	0.204	S	C	.	.	S	Bend	trans	-69.3	-3.4	-178.3	78.2	-2	0	0	0	114.4	R699 I701 L702	R699-D710 IonicContact CZ-OD1 3.78Å; R699-D710 VanDerWaalsContact CZ-OD1 3.3Å; R699-D710 IonicContact CZ-OD2 2.67Å; R699-D710 VanDerWaalsContact NH1-CG 3.31Å; R699-D710 IonicContact NH1-OD1 3.68Å; R699-D710 PolarHBondContact NH1-OD1 3.08Å; R699-D710 IonicContact NH1-OD2 3.95Å; R699-D710 PolarHBondContact NH1-OD2 2.81Å; R699-D710 VanDerWaalsContact NH2-CG 3.31Å; R699-D710 IonicContact NH2-OD1 3.42Å; R699-D710 PolarHBondContact NH2-OD1 3.49Å; R699-D710 IonicContact NH2-OD2 2.61Å; R699-D710 PolarHBondContact NH2-OD2 3.25Å; I701-D710 HydrophobicContact CG2-CB 4.19Å; L702-D710 WeakPolarHBondContact CB-O 3.47Å; L702-D710 PolarHBondContact N-O 3.07Å
711	Y	97.6	Very high	91.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	138.3	-166.7	-177	-99.6	0	0	0	113.9	V677 A678 N683 K686 N687 A694 S709 N713	V677-Y711 HydrophobicContact CB-CD2 4.39Å; V677-Y711 HydrophobicContact CG1-CD2 3.8Å; V677-Y711 HydrophobicContact CG1-CG 4.35Å; A678-Y711 HydrophobicContact CB-CE2 3.77Å; A678-Y711 WeakPolarHBondContact CB-OH 3.5Å; N683-Y711 HydrophobicContact CB-CD1 3.74Å; N683-Y711 HydrophobicContact CB-CE1 4.33Å; N683-Y711 HydrophobicContact CB-CG 4.13Å; N683-Y711 VanDerWaalsContact CG-CB 3.45Å; N683-Y711 VanDerWaalsContact ND2-CB 3.33Å; N683-Y711 WeakPolarHBondContact ND2-CB 3.03Å; N683-Y711 WeakPolarHBondContact OD1-CB 3.45Å; K686-Y711 HydrophobicContact CB-CD1 4.23Å; K686-Y711 HydrophobicContact CB-CE1 4.42Å; K686-Y711 HydrophobicContact CD-CD1 4.2Å; K686-Y711 VanDerWaalsContact CD-O 3.32Å; K686-Y711 WeakPolarHBondContact CD-O 3.4Å; K686-Y711 PolarHBondContact NZ-O 3.25Å; N687-Y711 PolarHBondContact OD1-OH 2.89Å; A694-Y711 HydrophobicContact CB-CE2 4.11Å; A694-Y711 WeakPolarHBondContact CB-OH 3.41Å; A694-Y711 PolarHBondContact N-OH 3.45Å; S709-Y711 PolarHBondContact O-N 2.89Å; S709-Y711 VanDerWaalsContact O-N 3.13Å; Y711-N713 HydrophobicContact CE1-CB 4.1Å
712	I	97.8	Very high	91.2	Very high	5 Å²	5	39.2 Å²	39.2	3%	0.026	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144.7	158.8	-177.9	165	0	0	0	108.1	V700 L702 A714 D739 F740 M743	V700-I712 HydrophobicContact CB-CG2 4.15Å; L702-I712 HydrophobicContact CD1-CB 4.23Å; L702-I712 HydrophobicContact CD1-CG2 4.28Å; L702-I712 HydrophobicContact CD2-CG2 4.23Å; L702-I712 HydrophobicContact CG-CG2 4.16Å; I712-A714 HydrophobicContact CG2-CB 4.29Å; I712-A714 PolarHBondContact O-N 3.11Å; I712-D739 HydrophobicContact CD1-CB 4.19Å; I712-F740 HydrophobicContact CD1-CB 4.16Å; I712-F740 HydrophobicContact CD1-CD2 4.46Å; I712-M743 HydrophobicContact CD1-CB 4.33Å; I712-M743 HydrophobicContact CD1-CE 4.26Å; I712-M743 HydrophobicContact CD1-SD 4Å; I712-M743 HydrophobicContact CG2-SD 3.98Å
713	N	98	Very high	90.9	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	78.4	176.1	-170.8	-41.1	0	0	0	110.6	N687 I692 Y711 Q730 R896	N687-N713 PolarHBondContact OD1-ND2 3.37Å; I692-N713 PolarHBondContact O-ND2 3.08Å; Y711-N713 HydrophobicContact CE1-CB 4.1Å; N713-Q730 HydrophobicContact CB-CG 4.17Å; N713-Q730 PolarHBondContact O-N 2.83Å; N713-Q730 VanDerWaalsContact O-N 3.15Å; N713-R896 PolarHBondContact OD1-NH1 3.43Å; N713-R896 PolarHBondContact OD1-NH2 2.91Å
714	A	98.5	Very high	90.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	147	176.9	0	0	0	0	0	110.5	R699 V700 I712 I727 A728 A729 M743	R699-A714 WeakPolarHBondContact CA-O 3.38Å; V700-A714 HydrophobicContact CB-CB 4.45Å; V700-A714 HydrophobicContact CG2-CB 4.01Å; V700-A714 PolarHBondContact N-O 3.13Å; I712-A714 HydrophobicContact CG2-CB 4.29Å; I712-A714 PolarHBondContact O-N 3.11Å; A714-I727 HydrophobicContact CB-CG2 3.69Å; A714-A728 VanDerWaalsContact CA-O 3.3Å; A714-A728 WeakPolarHBondContact CA-O 3.41Å; A714-A729 HydrophobicContact CB-CB 3.62Å; A714-M743 HydrophobicContact CB-CE 4.48Å; A714-M743 HydrophobicContact CB-SD 3.76Å
715	N	98.6	Very high	91.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	145.8	176.3	-62.1	89.6	0	0	0	110.5	A694 Y695 S698 R699 I727 A728 Q895 R896	A694-N715 VanDerWaalsContact CA-OD1 3.25Å; A694-N715 WeakPolarHBondContact CA-OD1 3.43Å; A694-N715 VanDerWaalsContact CB-OD1 3.3Å; A694-N715 WeakPolarHBondContact CB-OD1 3.37Å; Y695-N715 PolarHBondContact N-ND2 2.77Å; Y695-N715 VanDerWaalsContact N-ND2 3.18Å; Y695-N715 PolarHBondContact O-ND2 3.32Å; Y695-N715 VanDerWaalsContact O-ND2 3.13Å; S698-N715 CarbonylContact O-C 3.59Å; S698-N715 WeakPolarHBondContact O-CA 3.16Å; S698-N715 PolarHBondContact OG-ND2 3Å; R699-N715 PolarHBondContact N-ND2 3.42Å; N715-I727 CarbonylContact O-C 3.58Å; N715-I727 VanDerWaalsContact O-CA 3.31Å; N715-I727 WeakPolarHBondContact O-CA 3.28Å; N715-A728 PolarHBondContact N-O 3.38Å; N715-A728 PolarHBondContact O-N 2.94Å; N715-Q895 WeakPolarHBondContact CB-O 3.38Å; N715-R896 HydrophobicContact CB-CB 3.99Å; N715-R896 HydrophobicContact CB-CG 4.31Å; N715-R896 WeakPolarHBondContact OD1-CG 3.41Å; N715-R896 PolarHBondContact OD1-NH1 3.39Å
716	Y	98.3	Very high	92.4	Very high	36 Å²	36	32.1 Å²	32.1	14%	0.141	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	136.6	162.7	-60.5	-74.8	0	0	0	109.6	S698 V700 A724 Y726 I727 Q747	S698-Y716 WeakPolarHBondContact O-CD2 3.33Å; S698-Y716 PolarHBondContact O-N 2.86Å; V700-Y716 HydrophobicContact CB-CE2 4.46Å; V700-Y716 HydrophobicContact CG2-CD1 4.44Å; V700-Y716 HydrophobicContact CG2-CD2 4.35Å; V700-Y716 HydrophobicContact CG2-CE1 4.25Å; V700-Y716 HydrophobicContact CG2-CE2 4.15Å; Y716-A724 HydrophobicContact CD1-CB 3.85Å; Y716-A724 HydrophobicContact CG-CB 4.17Å; Y716-Y726 WeakPolarHBondContact CA-O 3.27Å; Y716-I727 HydrophobicContact CD1-CD1 4.27Å; Y716-I727 HydrophobicContact CD1-CG1 3.76Å; Y716-I727 HydrophobicContact CE1-CD1 3.99Å; Y716-I727 HydrophobicContact CE1-CG1 4.02Å; Y716-Q747 PolarHBondContact OH-NE2 3.18Å; Y716-Q747 PolarHBondContact OH-OE1 2.68Å
717	V	96.8	Very high	93.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	135.7	173.8	-178.5	0	0	0	0	108.8	A725 Y726 A728 I868 I892 R896 L899	V717-A725 PolarHBondContact O-N 3.31Å; V717-A725 VanDerWaalsContact O-N 3.14Å; V717-Y726 PolarHBondContact N-O 2.82Å; V717-Y726 PolarHBondContact O-N 3.37Å; V717-A728 HydrophobicContact CG2-CB 3.74Å; V717-I868 HydrophobicContact CB-CD1 4.42Å; V717-I868 HydrophobicContact CG1-CD1 4.42Å; V717-I868 HydrophobicContact CG1-CG2 4.02Å; V717-I892 HydrophobicContact CG1-CB 3.68Å; V717-I892 HydrophobicContact CG1-CG2 3.62Å; V717-R896 HydrophobicContact CG2-CB 4.39Å; V717-L899 HydrophobicContact CG1-CD1 4.16Å; V717-L899 HydrophobicContact CG2-CD1 4.11Å
718	D	95.4	Very high	94.2	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.021	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	149.1	177.9	-64.9	-21.5	0	0	0	110.8	R723 A724 H891 Q895	D718-R723 WeakPolarHBondContact OD1-CA 3.17Å; D718-R723 IonicContact OD2-NH1 3.19Å; D718-R723 PolarHBondContact OD2-NH1 3.13Å; D718-A724 PolarHBondContact OD1-N 2.95Å; D718-H891 IonicContact OD2-CE1 3.74Å; D718-H891 IonicContact OD2-NE2 3.84Å; D718-H891 PolarHBondContact OD2-NE2 3.28Å; D718-H891 VanDerWaalsContact OD2-NE2 3.15Å; D718-Q895 VanDerWaalsContact CG-NE2 3.26Å; D718-Q895 PolarHBondContact OD2-NE2 2.72Å
719	G	92.9	Very high	94.8	Very high	8 Å²	8	17 Å²	17	8%	0.082	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	173.3	165.8	0	0	0	0	0	110.2	H721 R722 S872	G719-H721 PolarHBondContact O-N 2.87Å; G719-H721 VanDerWaalsContact O-N 3.14Å; G719-R722 PolarHBondContact N-O 3.1Å; G719-R722 PolarHBondContact O-N 2.78Å; G719-S872 WeakPolarHBondContact CA-OG 3.34Å
720	Y	90.1	Very high	95.1	Very high	17 Å²	17	16.5 Å²	16.5	7%	0.067	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	122	177.9	175.7	-100.6	0	0	0	111.8	R722 S872 R875 Q876 V879 E880	Y720-R722 PolarHBondContact O-N 3.24Å; Y720-S872 WeakPolarHBondContact CB-O 3.47Å; Y720-R875 HydrophobicContact CD1-CB 3.78Å; Y720-R875 HydrophobicContact CG-CB 4.28Å; Y720-Q876 HydrophobicContact CD1-CB 4.49Å; Y720-Q876 HydrophobicContact CD2-CB 3.65Å; Y720-Q876 HydrophobicContact CD2-CG 3.79Å; Y720-Q876 HydrophobicContact CE2-CB 3.86Å; Y720-Q876 HydrophobicContact CE2-CG 3.56Å; Y720-Q876 HydrophobicContact CG-CB 3.99Å; Y720-V879 HydrophobicContact CE1-CB 4Å; Y720-V879 HydrophobicContact CE1-CG1 4.45Å; Y720-V879 HydrophobicContact CE1-CG2 4Å; Y720-V879 WeakPolarHBondContact OH-CG1 3.32Å; Y720-E880 WeakPolarHBondContact CE2-OE1 3.32Å; Y720-E880 VanDerWaalsContact CZ-OE1 3.28Å; Y720-E880 VanDerWaalsContact OH-CD 3.25Å; Y720-E880 WeakPolarHBondContact OH-CG 3.45Å; Y720-E880 PolarHBondContact OH-OE1 3.46Å
721	H	84.4	Confident	95.1	Very high	86 Å²	86	14.2 Å²	14.2	40%	0.398	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	16.4	-171.7	-73.5	137.1	0	0	0	117.2	G719 E880	G719-H721 PolarHBondContact O-N 2.87Å; G719-H721 VanDerWaalsContact O-N 3.14Å; H721-E880 IonicContact CE1-OE1 3.51Å
722	R	86.5	Confident	95.1	Very high	40 Å²	40	14.3 Å²	14.3	15%	0.151	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	109.3	176.4	-177	178.9	173.2	155.7	5.8	111.9	G719 Y720 A725 W846 T847 R850	G719-R722 PolarHBondContact N-O 3.1Å; G719-R722 PolarHBondContact O-N 2.78Å; Y720-R722 PolarHBondContact O-N 3.24Å; R722-A725 HydrophobicContact CB-CB 4.05Å; R722-A725 HydrophobicContact CG-CB 3.88Å; R722-A725 PolarHBondContact O-N 3.09Å; R722-W846 VanDerWaalsContact NH1-CH2 3.34Å; R722-T847 PolarHBondContact NH1-O 2.78Å; R722-R850 PolarHBondContact NH2-O 3.5Å
723	R	88.7	Confident	95	Very high	69 Å²	69	15.1 Å²	15.1	26%	0.26	7%	0.071	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	140	170	-75.3	-172.6	168.1	-77.1	-0.7	111.8	I625 A626 D718 A725	I625-R723 VanDerWaalsContact O-CD 3.28Å; I625-R723 WeakPolarHBondContact O-CD 3.4Å; I625-R723 PolarHBondContact O-NE 3.42Å; A626-R723 VanDerWaalsContact O-CZ 3.26Å; A626-R723 PolarHBondContact O-NE 3.45Å; A626-R723 PolarHBondContact O-NH2 3.02Å; D718-R723 WeakPolarHBondContact OD1-CA 3.17Å; D718-R723 IonicContact OD2-NH1 3.19Å; D718-R723 PolarHBondContact OD2-NH1 3.13Å; R723-A725 PolarHBondContact O-N 3.24Å
724	A	92.7	Very high	94.9	Very high	22 Å²	22	19 Å²	19	18%	0.182	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	44.9	50.7	-175.4	0	0	0	0	0	111.8	Y716 D718	Y716-A724 HydrophobicContact CD1-CB 3.85Å; Y716-A724 HydrophobicContact CG-CB 4.17Å; D718-A724 PolarHBondContact OD1-N 2.95Å
725	A	94.5	Very high	94.7	Very high	2 Å²	2	22.8 Å²	22.8	2%	0.017	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	-28.6	171.9	0	0	0	0	0	111.4	V717 R722 R723 W846 P852 I853	V717-A725 PolarHBondContact O-N 3.31Å; V717-A725 VanDerWaalsContact O-N 3.14Å; R722-A725 HydrophobicContact CB-CB 4.05Å; R722-A725 HydrophobicContact CG-CB 3.88Å; R722-A725 PolarHBondContact O-N 3.09Å; R723-A725 PolarHBondContact O-N 3.24Å; A725-W846 HydrophobicContact CB-CH2 4.3Å; A725-W846 HydrophobicContact CB-CZ2 4.49Å; A725-P852 CarbonylContact O-C 3.55Å; A725-P852 WeakPolarHBondContact O-CA 3.44Å; A725-I853 PolarHBondContact O-N 2.87Å
726	Y	97.8	Very high	94.6	Very high	1 Å²	1	22.9 Å²	22.9	0%	0.004	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	156.9	-174.8	-57.7	-75	0	0	0	111.7	Y716 V717 I853 V855 Y867 I868 E871 S872	Y716-Y726 WeakPolarHBondContact CA-O 3.27Å; V717-Y726 PolarHBondContact N-O 2.82Å; V717-Y726 PolarHBondContact O-N 3.37Å; Y726-I853 CarbonylContact C-O 3.53Å; Y726-I853 VanDerWaalsContact CA-O 3.29Å; Y726-I853 WeakPolarHBondContact CA-O 3.38Å; Y726-I853 HydrophobicContact CD1-CB 3.94Å; Y726-I853 HydrophobicContact CE1-CB 4.19Å; Y726-I853 HydrophobicContact CE1-CD1 4.13Å; Y726-V855 HydrophobicContact CD1-CG2 3.76Å; Y726-V855 HydrophobicContact CE1-CG2 4.42Å; Y726-Y867 HydrophobicContact CE1-CE1 4.09Å; Y726-I868 HydrophobicContact CD1-CD1 4.45Å; Y726-I868 HydrophobicContact CD1-CG1 3.92Å; Y726-I868 HydrophobicContact CD2-CB 4.42Å; Y726-I868 HydrophobicContact CD2-CD1 4.44Å; Y726-I868 HydrophobicContact CD2-CG1 4.04Å; Y726-I868 HydrophobicContact CD2-CG2 3.73Å; Y726-I868 HydrophobicContact CE1-CG1 4.3Å; Y726-I868 HydrophobicContact CE2-CG1 4.42Å; Y726-I868 HydrophobicContact CE2-CG2 3.89Å; Y726-I868 HydrophobicContact CG-CD1 4.02Å; Y726-I868 HydrophobicContact CG-CG1 3.78Å; Y726-I868 HydrophobicContact CG-CG2 4.34Å; Y726-E871 WeakPolarHBondContact OH-CB 3.47Å; Y726-E871 WeakPolarHBondContact OH-CG 3.37Å; Y726-E871 PolarHBondContact OH-OE2 3.23Å; Y726-S872 WeakPolarHBondContact CE2-OG 3.26Å
727	I	98.5	Very high	94.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	114.2	155.2	-72.1	169.3	0	0	0	106.7	V700 A714 N715 Y716 A729 M743 Q747 P852 I853 V854 V855	V700-I727 HydrophobicContact CG2-CD1 3.92Å; V700-I727 HydrophobicContact CG2-CG1 3.94Å; V700-I727 HydrophobicContact CG2-CG2 3.8Å; A714-I727 HydrophobicContact CB-CG2 3.69Å; N715-I727 CarbonylContact O-C 3.58Å; N715-I727 VanDerWaalsContact O-CA 3.31Å; N715-I727 WeakPolarHBondContact O-CA 3.28Å; Y716-I727 HydrophobicContact CD1-CD1 4.27Å; Y716-I727 HydrophobicContact CD1-CG1 3.76Å; Y716-I727 HydrophobicContact CE1-CD1 3.99Å; Y716-I727 HydrophobicContact CE1-CG1 4.02Å; I727-A729 HydrophobicContact CG2-CB 4.34Å; I727-M743 HydrophobicContact CD1-CG 4.41Å; I727-M743 HydrophobicContact CD1-SD 4.4Å; I727-M743 HydrophobicContact CG2-CE 4.02Å; I727-M743 HydrophobicContact CG2-SD 3.83Å; I727-Q747 HydrophobicContact CD1-CB 4.02Å; I727-Q747 HydrophobicContact CD1-CG 3.77Å; I727-P852 HydrophobicContact CD1-CB 4.26Å; I727-P852 HydrophobicContact CD1-CG 3.42Å; I727-P852 VanDerWaalsContact CD1-CG 3.42Å; I727-P852 HydrophobicContact CG1-CB 3.92Å; I727-P852 HydrophobicContact CG1-CG 3.6Å; I727-I853 PolarHBondContact N-O 2.99Å; I727-V854 HydrophobicContact CB-CG2 4.31Å; I727-V854 HydrophobicContact CD1-CG2 4.45Å; I727-V855 PolarHBondContact O-N 3.48Å
728	A	98.6	Very high	94.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	110.8	172.1	0	0	0	0	0	108.7	A714 N715 V717 V855 T864 I868 R896 L899	A714-A728 VanDerWaalsContact CA-O 3.3Å; A714-A728 WeakPolarHBondContact CA-O 3.41Å; N715-A728 PolarHBondContact N-O 3.38Å; N715-A728 PolarHBondContact O-N 2.94Å; V717-A728 HydrophobicContact CG2-CB 3.74Å; A728-V855 WeakPolarHBondContact CA-O 3.25Å; A728-T864 HydrophobicContact CB-CG2 3.73Å; A728-I868 HydrophobicContact CB-CD1 4.12Å; A728-R896 WeakPolarHBondContact O-CD 3.43Å; A728-L899 HydrophobicContact CB-CD2 4.25Å
729	A	98.3	Very high	94.5	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.008	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	153.1	-173.9	0	0	0	0	0	111.7	A714 I727 M743 V855 H856 G860	A714-A729 HydrophobicContact CB-CB 3.62Å; I727-A729 HydrophobicContact CG2-CB 4.34Å; A729-M743 HydrophobicContact CB-CE 4.28Å; A729-V855 PolarHBondContact N-O 3.2Å; A729-H856 HydrophobicContact CB-CB 4.46Å; A729-H856 VanDerWaalsContact O-CA 3.32Å; A729-H856 WeakPolarHBondContact O-CA 3.49Å; A729-H856 WeakPolarHBondContact O-CB 3.37Å; A729-G860 WeakPolarHBondContact O-CA 3.42Å
730	Q	97.4	Very high	94.8	Very high	7 Å²	7	25 Å²	25	3%	0.033	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-64.2	158.6	166	72.5	179.7	15.7	0	0	111.2	K686 N713 P732	K686-Q730 PolarHBondContact O-NE2 3.32Å; N713-Q730 HydrophobicContact CB-CG 4.17Å; N713-Q730 PolarHBondContact O-N 2.83Å; N713-Q730 VanDerWaalsContact O-N 3.15Å; Q730-P732 WeakPolarHBondContact O-CD 3.09Å
731	G	96.7	Very high	95.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-60.3	122.2	165.1	0	0	0	0	0	109.9	R688 I733 C857 S858	R688-G731 VanDerWaalsContact CZ-O 3.29Å; R688-G731 PolarHBondContact NE-O 2.87Å; R688-G731 PolarHBondContact NH2-O 2.74Å; G731-I733 PolarHBondContact O-N 2.92Å; G731-C857 VanDerWaalsContact CA-O 3.22Å; G731-C857 WeakPolarHBondContact CA-O 3.37Å; G731-C857 PolarHBondContact N-O 3.06Å; G731-S858 PolarHBondContact N-O 3.39Å
732	P	97.1	Very high	95.7	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.006	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-56.9	135	-173.1	-28.7	37.3	0	0	0	112.6	R688 Q730 F737 F740 Y769	R688-P732 VanDerWaalsContact NH2-C 3.33Å; R688-P732 PolarHBondContact NH2-O 3.08Å; Q730-P732 WeakPolarHBondContact O-CD 3.09Å; P732-F737 HydrophobicContact CB-CD1 3.91Å; P732-F737 HydrophobicContact CB-CE1 4.1Å; P732-F740 HydrophobicContact CB-CB 4.25Å; P732-F740 HydrophobicContact CB-CD2 4.47Å; P732-F740 HydrophobicContact CB-CG 4.27Å; P732-F740 HydrophobicContact CG-CB 4Å; P732-F740 HydrophobicContact CG-CD1 3.95Å; P732-F740 HydrophobicContact CG-CD2 3.41Å; P732-F740 VanDerWaalsContact CG-CD2 3.41Å; P732-F740 HydrophobicContact CG-CE1 4.28Å; P732-F740 HydrophobicContact CG-CE2 3.75Å; P732-F740 HydrophobicContact CG-CG 3.5Å; P732-F740 VanDerWaalsContact CG-CG 3.5Å; P732-F740 HydrophobicContact CG-CZ 4.17Å; P732-Y769 HydrophobicContact CB-CD1 4.05Å; P732-Y769 HydrophobicContact CB-CG 4.31Å; P732-Y769 HydrophobicContact CG-CD1 3.65Å; P732-Y769 HydrophobicContact CG-CE1 3.91Å; P732-Y769 HydrophobicContact CG-CG 4.08Å
733	I	95.4	Very high	96.2	Very high	22 Å²	22	18.8 Å²	18.8	11%	0.113	11%	0.107	C	C	.	.	P	Polyproline II helix	trans	-94.6	159.5	171	52.9	175	0	0	0	109.3	A685 R688 G731 S735 T736 F737	A685-I733 WeakPolarHBondContact O-CD1 3.42Å; R688-I733 HydrophobicContact CB-CG2 4.03Å; R688-I733 HydrophobicContact CG-CG2 4.15Å; R688-I733 VanDerWaalsContact CZ-CG2 3.43Å; G731-I733 PolarHBondContact O-N 2.92Å; I733-S735 VanDerWaalsContact CD1-OG 3.3Å; I733-S735 WeakPolarHBondContact CD1-OG 3.28Å; I733-S735 WeakPolarHBondContact CG1-OG 3.17Å; I733-S735 PolarHBondContact O-N 3.36Å; I733-S735 VanDerWaalsContact O-N 3.09Å; I733-T736 HydrophobicContact CD1-CG2 4.11Å; I733-T736 HydrophobicContact CG1-CG2 3.72Å; I733-T736 WeakPolarHBondContact CG1-OG1 3.35Å; I733-T736 PolarHBondContact N-OG1 2.87Å; I733-T736 CarbonylContact O-C 3.59Å; I733-T736 PolarHBondContact O-N 2.74Å; I733-T736 PolarHBondContact O-OG1 3.02Å; I733-F737 WeakPolarHBondContact O-CD1 3.25Å; I733-F737 WeakPolarHBondContact O-CE1 3.35Å; I733-F737 PolarHBondContact O-N 2.9Å
734	P	95.3	Very high	96.6	Very high	82 Å²	82	15.6 Å²	15.6	53%	0.532	10%	0.096	S	C	.	.	G	3₁₀ helix	trans	-54.8	-33.1	-175.1	-29.6	36.9	0	0	0	114.9	T736 F737	P734-T736 VanDerWaalsContact C-N 3.27Å; P734-T736 PolarHBondContact O-N 2.92Å; P734-F737 HydrophobicContact CG-CZ 4.39Å
735	S	94.2	Very high	96.7	Very high	80 Å²	80	15.9 Å²	15.9	56%	0.559	9%	0.092	S	C	*	.	G	3₁₀ helix	trans	-70.7	-15	175.3	49.6	0	0	0	0	114.6	I733	I733-S735 VanDerWaalsContact CD1-OG 3.3Å; I733-S735 WeakPolarHBondContact CD1-OG 3.28Å; I733-S735 WeakPolarHBondContact CG1-OG 3.17Å; I733-S735 PolarHBondContact O-N 3.36Å; I733-S735 VanDerWaalsContact O-N 3.09Å
736	T	96.4	Very high	96.8	Very high	2 Å²	2	17.9 Å²	17.9	1%	0.012	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-118.4	16	-177	70.8	0	0	0	0	113.3	K686 I733 P734 D739 F740	K686-T736 HydrophobicContact CB-CG2 3.85Å; K686-T736 HydrophobicContact CD-CG2 4.36Å; K686-T736 HydrophobicContact CG-CG2 4.08Å; I733-T736 HydrophobicContact CD1-CG2 4.11Å; I733-T736 HydrophobicContact CG1-CG2 3.72Å; I733-T736 WeakPolarHBondContact CG1-OG1 3.35Å; I733-T736 PolarHBondContact N-OG1 2.87Å; I733-T736 CarbonylContact O-C 3.59Å; I733-T736 PolarHBondContact O-N 2.74Å; I733-T736 PolarHBondContact O-OG1 3.02Å; P734-T736 VanDerWaalsContact C-N 3.27Å; P734-T736 PolarHBondContact O-N 2.92Å; T736-D739 PolarHBondContact O-N 2.81Å; T736-F740 WeakPolarHBondContact O-CB 3.46Å; T736-F740 PolarHBondContact O-N 2.83Å
737	F	97.2	Very high	96.6	Very high	32 Å²	32	19.5 Å²	19.5	14%	0.14	11%	0.108	C	C	.	.	H	α-helix	trans	-65.8	-44.1	176.7	-73.6	-0.8	0	0	0	112	P732 I733 P734 F740 W741 D767 Y778	P732-F737 HydrophobicContact CB-CD1 3.91Å; P732-F737 HydrophobicContact CB-CE1 4.1Å; I733-F737 WeakPolarHBondContact O-CD1 3.25Å; I733-F737 WeakPolarHBondContact O-CE1 3.35Å; I733-F737 PolarHBondContact O-N 2.9Å; P734-F737 HydrophobicContact CG-CZ 4.39Å; F737-F740 PolarHBondContact O-N 3.48Å; F737-W741 PolarHBondContact O-N 3.05Å; F737-W741 VanDerWaalsContact O-N 3.14Å; F737-D767 HydrophobicContact CE1-CB 3.97Å; F737-D767 HydrophobicContact CZ-CB 3.81Å; F737-Y778 HydrophobicContact CB-CD1 3.95Å; F737-Y778 HydrophobicContact CB-CE1 4.49Å; F737-Y778 HydrophobicContact CD2-CD1 4.4Å; F737-Y778 HydrophobicContact CD2-CE1 4.17Å
738	D	95.8	Very high	96.4	Very high	52 Å²	52	22.3 Å²	22.3	28%	0.278	12%	0.124	S	C	.	.	H	α-helix	trans	-53.1	-53.5	171.2	-72	4.2	0	0	0	110.9	K708 F740 W741 L742 G779	K708-D738 IonicContact NZ-OD2 3.56Å; K708-D738 PolarHBondContact NZ-OD2 3.08Å; D738-F740 VanDerWaalsContact C-N 3.32Å; D738-F740 PolarHBondContact O-N 2.87Å; D738-W741 PolarHBondContact O-N 2.7Å; D738-L742 VanDerWaalsContact O-CB 3.3Å; D738-L742 WeakPolarHBondContact O-CB 3.42Å; D738-L742 PolarHBondContact O-N 3.31Å; D738-G779 PolarHBondContact OD1-N 3.48Å
739	D	96.7	Very high	96.3	Very high	7 Å²	7	22.5 Å²	22.5	4%	0.037	13%	0.125	C	C	.	.	H	α-helix	trans	-62.2	-38.6	-175.7	-65.8	-8.2	0	0	0	111.6	K686 L702 I712 T736 M743	K686-D739 WeakPolarHBondContact CE-OD2 3.39Å; K686-D739 IonicContact NZ-OD2 2.68Å; K686-D739 PolarHBondContact NZ-OD2 2.87Å; L702-D739 HydrophobicContact CD1-CB 3.8Å; I712-D739 HydrophobicContact CD1-CB 4.19Å; T736-D739 PolarHBondContact O-N 2.81Å; D739-M743 WeakPolarHBondContact O-CB 3.34Å; D739-M743 PolarHBondContact O-N 3.3Å
740	F	98	Very high	96.1	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.009	13%	0.128	C	C	.	.	H	α-helix	trans	-69.5	-44.5	178.7	-178.8	-93.1	0	0	0	112.6	I712 P732 T736 F737 D738 M743 V744 I752 Y769 V854	I712-F740 HydrophobicContact CD1-CB 4.16Å; I712-F740 HydrophobicContact CD1-CD2 4.46Å; P732-F740 HydrophobicContact CB-CB 4.25Å; P732-F740 HydrophobicContact CB-CD2 4.47Å; P732-F740 HydrophobicContact CB-CG 4.27Å; P732-F740 HydrophobicContact CG-CB 4Å; P732-F740 HydrophobicContact CG-CD1 3.95Å; P732-F740 HydrophobicContact CG-CD2 3.41Å; P732-F740 VanDerWaalsContact CG-CD2 3.41Å; P732-F740 HydrophobicContact CG-CE1 4.28Å; P732-F740 HydrophobicContact CG-CE2 3.75Å; P732-F740 HydrophobicContact CG-CG 3.5Å; P732-F740 VanDerWaalsContact CG-CG 3.5Å; P732-F740 HydrophobicContact CG-CZ 4.17Å; T736-F740 WeakPolarHBondContact O-CB 3.46Å; T736-F740 PolarHBondContact O-N 2.83Å; F737-F740 PolarHBondContact O-N 3.48Å; D738-F740 VanDerWaalsContact C-N 3.32Å; D738-F740 PolarHBondContact O-N 2.87Å; F740-M743 HydrophobicContact CD2-CE 3.74Å; F740-M743 HydrophobicContact CE2-CE 3.86Å; F740-M743 WeakPolarHBondContact O-CB 3.46Å; F740-M743 PolarHBondContact O-N 3.43Å; F740-V744 HydrophobicContact CD1-CG2 4.32Å; F740-V744 HydrophobicContact CE1-CG2 3.95Å; F740-V744 HydrophobicContact CZ-CG2 4.27Å; F740-V744 WeakPolarHBondContact O-CG2 3.43Å; F740-V744 PolarHBondContact O-N 3.45Å; F740-I752 HydrophobicContact CE1-CD1 4.16Å; F740-I752 HydrophobicContact CZ-CD1 4.43Å; F740-I752 HydrophobicContact CZ-CG2 4.15Å; F740-Y769 AromaticContact CD1-CD2 3.95Å; F740-Y769 HydrophobicContact CD1-CD2 3.95Å; F740-Y769 AromaticContact CD1-CE2 3.98Å; F740-Y769 HydrophobicContact CD1-CE2 3.98Å; F740-Y769 AromaticContact CE1-CD2 3.79Å; F740-Y769 HydrophobicContact CE1-CD2 3.79Å; F740-Y769 AromaticContact CE1-CE2 3.32Å; F740-Y769 HydrophobicContact CE1-CE2 3.32Å; F740-Y769 AromaticContact CE1-CZ 3.71Å; F740-Y769 HydrophobicContact CZ-CE2 4.04Å; F740-Y769 AromaticContact CZ-CZ 3.94Å; F740-V854 HydrophobicContact CE2-CG1 3.71Å; F740-V854 HydrophobicContact CZ-CG1 3.87Å
741	W	97.5	Very high	96.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-72.2	-31.2	176.6	-77.3	112	0	0	0	112.7	F737 D738 V744 W745 I752 Y769 W770 Y778 V781 V783 F799 V801	F737-W741 PolarHBondContact O-N 3.05Å; F737-W741 VanDerWaalsContact O-N 3.14Å; D738-W741 PolarHBondContact O-N 2.7Å; W741-V744 HydrophobicContact CE3-CB 4.19Å; W741-V744 HydrophobicContact CE3-CG1 4.19Å; W741-V744 HydrophobicContact CE3-CG2 4.4Å; W741-V744 HydrophobicContact CZ3-CG1 4.18Å; W741-V744 PolarHBondContact O-N 3.46Å; W741-W745 WeakPolarHBondContact O-CB 3.45Å; W741-W745 PolarHBondContact O-N 2.99Å; W741-I752 HydrophobicContact CH2-CD1 3.93Å; W741-I752 HydrophobicContact CZ3-CD1 3.95Å; W741-Y769 AromaticContact CE2-CD2 3.9Å; W741-Y769 AromaticContact CZ2-CD2 3.79Å; W741-Y769 HydrophobicContact CZ2-CD2 3.79Å; W741-Y769 AromaticContact CZ2-CE2 3.91Å; W741-Y769 HydrophobicContact CZ2-CE2 3.91Å; W741-Y769 AromaticContact NE1-CD2 3.74Å; W741-Y769 PolarHBondContact NE1-O 2.74Å; W741-W770 HydrophobicContact CZ2-CB 4.31Å; W741-Y778 AromaticContact CD1-CD2 3.21Å; W741-Y778 AromaticContact CD1-CE2 3.79Å; W741-Y778 AromaticContact CD1-CG 3.47Å; W741-Y778 VanDerWaalsContact CD1-CG 3.47Å; W741-Y778 AromaticContact CG-CD2 3.91Å; W741-Y778 HydrophobicContact CG-CD2 3.91Å; W741-Y778 HydrophobicContact CG-CG 4.31Å; W741-Y778 AromaticContact NE1-CD2 3.46Å; W741-Y778 AromaticContact NE1-CE2 3.5Å; W741-V781 HydrophobicContact CB-CB 4.13Å; W741-V781 HydrophobicContact CB-CG1 4.15Å; W741-V783 HydrophobicContact CD2-CG2 3.53Å; W741-V783 HydrophobicContact CE3-CG2 3.72Å; W741-V783 HydrophobicContact CG-CG2 3.96Å; W741-V783 HydrophobicContact CH2-CG1 3.88Å; W741-V783 HydrophobicContact CH2-CG2 4.29Å; W741-V783 HydrophobicContact CZ2-CG1 3.86Å; W741-V783 HydrophobicContact CZ2-CG2 4.13Å; W741-V783 HydrophobicContact CZ3-CG1 4.33Å; W741-V783 HydrophobicContact CZ3-CG2 4.1Å; W741-F799 AromaticContact CH2-CD2 3.91Å; W741-F799 HydrophobicContact CH2-CD2 3.91Å; W741-F799 HydrophobicContact CH2-CE2 4.27Å; W741-F799 HydrophobicContact CH2-CG 4.36Å; W741-V801 HydrophobicContact CZ3-CG2 4.06Å
742	L	96.2	Very high	96.2	Very high	12 Å²	12	22.8 Å²	22.8	6%	0.063	13%	0.126	C	C	.	.	H	α-helix	trans	-62.2	-44.2	168.5	-175.7	61.6	0	0	0	111	L702 E704 T705 D738 W745 E746	L702-L742 HydrophobicContact CB-CD2 4.4Å; L702-L742 HydrophobicContact CD2-CG 4.5Å; E704-L742 HydrophobicContact CB-CD1 4.17Å; E704-L742 HydrophobicContact CB-CD2 4.45Å; T705-L742 HydrophobicContact CG2-CD2 4.27Å; D738-L742 VanDerWaalsContact O-CB 3.3Å; D738-L742 WeakPolarHBondContact O-CB 3.42Å; D738-L742 PolarHBondContact O-N 3.31Å; L742-W745 PolarHBondContact O-N 2.99Å; L742-E746 HydrophobicContact CD1-CG 3.92Å; L742-E746 WeakPolarHBondContact CD1-OE1 3.33Å; L742-E746 HydrophobicContact CG-CG 4.17Å; L742-E746 WeakPolarHBondContact CG-OE1 3.42Å; L742-E746 WeakPolarHBondContact O-CB 3.39Å; L742-E746 WeakPolarHBondContact O-CG 3.23Å; L742-E746 PolarHBondContact O-N 3.3Å
743	M	97.5	Very high	96.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-56.1	-52.4	173.9	-174.3	-179.4	68.4	0	0	111.9	V700 L702 I712 A714 I727 A729 D739 F740 W745 E746 Q747 V854	V700-M743 HydrophobicContact CB-SD 4.22Å; V700-M743 HydrophobicContact CG1-CG 3.88Å; V700-M743 HydrophobicContact CG1-SD 4.12Å; V700-M743 HydrophobicContact CG2-SD 4.17Å; L702-M743 HydrophobicContact CD2-CB 3.87Å; L702-M743 HydrophobicContact CD2-CG 4.47Å; I712-M743 HydrophobicContact CD1-CB 4.33Å; I712-M743 HydrophobicContact CD1-CE 4.26Å; I712-M743 HydrophobicContact CD1-SD 4Å; I712-M743 HydrophobicContact CG2-SD 3.98Å; A714-M743 HydrophobicContact CB-CE 4.48Å; A714-M743 HydrophobicContact CB-SD 3.76Å; I727-M743 HydrophobicContact CD1-CG 4.41Å; I727-M743 HydrophobicContact CD1-SD 4.4Å; I727-M743 HydrophobicContact CG2-CE 4.02Å; I727-M743 HydrophobicContact CG2-SD 3.83Å; A729-M743 HydrophobicContact CB-CE 4.28Å; D739-M743 WeakPolarHBondContact O-CB 3.34Å; D739-M743 PolarHBondContact O-N 3.3Å; F740-M743 HydrophobicContact CD2-CE 3.74Å; F740-M743 HydrophobicContact CE2-CE 3.86Å; F740-M743 WeakPolarHBondContact O-CB 3.46Å; F740-M743 PolarHBondContact O-N 3.43Å; M743-W745 VanDerWaalsContact C-N 3.25Å; M743-W745 PolarHBondContact O-N 3.03Å; M743-E746 PolarHBondContact O-N 2.83Å; M743-Q747 HydrophobicContact CG-CG 4.16Å; M743-Q747 WeakPolarHBondContact O-CB 3.39Å; M743-Q747 WeakPolarHBondContact O-CG 3.48Å; M743-Q747 PolarHBondContact O-N 2.89Å; M743-V854 HydrophobicContact CE-CG1 3.82Å; M743-V854 HydrophobicContact CE-CG2 4.23Å
744	V	97.2	Very high	96.4	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.012	12%	0.121	C	C	.	.	H	α-helix	trans	-56.3	-41.4	178.7	171.9	0	0	0	0	111.2	F740 W741 N748 S749 I752 V815 V854	F740-V744 HydrophobicContact CD1-CG2 4.32Å; F740-V744 HydrophobicContact CE1-CG2 3.95Å; F740-V744 HydrophobicContact CZ-CG2 4.27Å; F740-V744 WeakPolarHBondContact O-CG2 3.43Å; F740-V744 PolarHBondContact O-N 3.45Å; W741-V744 HydrophobicContact CE3-CB 4.19Å; W741-V744 HydrophobicContact CE3-CG1 4.19Å; W741-V744 HydrophobicContact CE3-CG2 4.4Å; W741-V744 HydrophobicContact CZ3-CG1 4.18Å; W741-V744 PolarHBondContact O-N 3.46Å; V744-N748 PolarHBondContact O-N 2.81Å; V744-S749 PolarHBondContact O-N 3.35Å; V744-S749 VanDerWaalsContact O-N 3.16Å; V744-I752 HydrophobicContact CG1-CD1 4.32Å; V744-I752 HydrophobicContact CG2-CD1 3.91Å; V744-I752 HydrophobicContact CG2-CG1 4.31Å; V744-V815 HydrophobicContact CG1-CG1 4.21Å; V744-V815 HydrophobicContact CG1-CG2 4.15Å; V744-V854 HydrophobicContact CG2-CG2 4.3Å
745	W	95.1	Very high	96.4	Very high	29 Å²	29	17.8 Å²	17.8	11%	0.11	10%	0.095	C	C	.	.	H	α-helix	trans	-70.1	-50.8	177.7	178.3	-95.9	0	0	0	113.5	W741 L742 M743 Q747 N748 V781 V801 H803 T806 R813	W741-W745 WeakPolarHBondContact O-CB 3.45Å; W741-W745 PolarHBondContact O-N 2.99Å; L742-W745 PolarHBondContact O-N 2.99Å; M743-W745 VanDerWaalsContact C-N 3.25Å; M743-W745 PolarHBondContact O-N 3.03Å; W745-Q747 VanDerWaalsContact C-N 3.33Å; W745-Q747 PolarHBondContact O-N 3.35Å; W745-N748 PolarHBondContact O-N 2.83Å; W745-V781 HydrophobicContact CB-CG2 4.15Å; W745-V801 HydrophobicContact CE3-CG1 4.19Å; W745-H803 HydrophobicContact CD2-CB 3.74Å; W745-H803 HydrophobicContact CE3-CB 4.28Å; W745-H803 HydrophobicContact CG-CB 4.23Å; W745-H803 HydrophobicContact CH2-CB 4Å; W745-H803 HydrophobicContact CZ2-CB 3.42Å; W745-H803 VanDerWaalsContact CZ2-CB 3.42Å; W745-H803 HydrophobicContact CZ3-CB 4.38Å; W745-H803 AromaticContact NE1-CG 3.78Å; W745-T806 HydrophobicContact CH2-CG2 4.34Å; W745-T806 HydrophobicContact CZ2-CG2 3.92Å; W745-R813 HydrophobicContact CE3-CG 4.46Å; W745-R813 HydrophobicContact CH2-CG 4.36Å; W745-R813 HydrophobicContact CZ3-CB 4.45Å; W745-R813 HydrophobicContact CZ3-CG 3.78Å; W745-R813 PolarHBondContact O-NH1 2.95Å
746	E	95.1	Very high	96.2	Very high	43 Å²	43	14 Å²	14	20%	0.201	7%	0.069	C	C	.	.	H	α-helix	trans	-64.4	-37.2	-177.2	-74.3	-172.7	-174	0	0	112.3	L702 K703 E704 L742 M743 N748	L702-E746 WeakPolarHBondContact CA-OE2 3.43Å; K703-E746 WeakPolarHBondContact CA-OE1 3.38Å; K703-E746 VanDerWaalsContact N-CD 3.32Å; K703-E746 PolarHBondContact N-OE1 2.85Å; K703-E746 PolarHBondContact N-OE2 3.13Å; E704-E746 PolarHBondContact N-OE1 2.97Å; L742-E746 HydrophobicContact CD1-CG 3.92Å; L742-E746 WeakPolarHBondContact CD1-OE1 3.33Å; L742-E746 HydrophobicContact CG-CG 4.17Å; L742-E746 WeakPolarHBondContact CG-OE1 3.42Å; L742-E746 WeakPolarHBondContact O-CB 3.39Å; L742-E746 WeakPolarHBondContact O-CG 3.23Å; L742-E746 PolarHBondContact O-N 3.3Å; M743-E746 PolarHBondContact O-N 2.83Å; E746-N748 VanDerWaalsContact C-N 3.3Å; E746-N748 PolarHBondContact O-N 2.93Å
747	Q	95.1	Very high	95.8	Very high	35 Å²	35	16.3 Å²	16.3	16%	0.164	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.5	-178.1	-54.8	-56.9	-39.5	0	0	113.3	V700 Y716 I727 M743 W745 S749 G851 P852	V700-Q747 HydrophobicContact CG1-CG 4.13Å; Y716-Q747 PolarHBondContact OH-NE2 3.18Å; Y716-Q747 PolarHBondContact OH-OE1 2.68Å; I727-Q747 HydrophobicContact CD1-CB 4.02Å; I727-Q747 HydrophobicContact CD1-CG 3.77Å; M743-Q747 HydrophobicContact CG-CG 4.16Å; M743-Q747 WeakPolarHBondContact O-CB 3.39Å; M743-Q747 WeakPolarHBondContact O-CG 3.48Å; M743-Q747 PolarHBondContact O-N 2.89Å; W745-Q747 VanDerWaalsContact C-N 3.33Å; W745-Q747 PolarHBondContact O-N 3.35Å; Q747-S749 PolarHBondContact O-N 3.19Å; Q747-G851 VanDerWaalsContact O-CA 3.27Å; Q747-G851 WeakPolarHBondContact O-CA 3.47Å; Q747-P852 HydrophobicContact CB-CG 4.33Å
748	N	94.3	Very high	95.4	Very high	59 Å²	59	18.2 Å²	18.2	32%	0.316	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	33	-176.5	-166.6	42.8	0	0	0	113.8	V744 W745 E746 N750 R813 G851	V744-N748 PolarHBondContact O-N 2.81Å; W745-N748 PolarHBondContact O-N 2.83Å; E746-N748 VanDerWaalsContact C-N 3.3Å; E746-N748 PolarHBondContact O-N 2.93Å; N748-N750 PolarHBondContact O-N 3Å; N748-R813 PolarHBondContact OD1-NH1 2.85Å; N748-R813 VanDerWaalsContact OD1-NH1 3.13Å; N748-G851 WeakPolarHBondContact O-CA 3.29Å; N748-G851 PolarHBondContact O-N 3.15Å
749	S	95.4	Very high	94.9	Very high	4 Å²	4	19.9 Å²	19.9	3%	0.028	10%	0.101	C	C	.	.			trans	-72.7	119.2	177.7	-66.6	0	0	0	0	110.2	V744 Q747 P852	V744-S749 PolarHBondContact O-N 3.35Å; V744-S749 VanDerWaalsContact O-N 3.16Å; Q747-S749 PolarHBondContact O-N 3.19Å; S749-P852 VanDerWaalsContact CB-O 3.22Å; S749-P852 WeakPolarHBondContact CB-O 3.41Å; S749-P852 PolarHBondContact OG-O 2.96Å
750	N	95.6	Very high	94.1	Very high	14 Å²	14	20.1 Å²	20.1	8%	0.075	10%	0.102	C	C	.	.			trans	-103.3	-2.9	178.1	80	-57.4	0	0	0	113.6	N748 V815 Y816 H845 R850	N748-N750 PolarHBondContact O-N 3Å; N750-V815 WeakPolarHBondContact O-CA 3.35Å; N750-Y816 PolarHBondContact O-N 3.03Å; N750-H845 PolarHBondContact ND2-O 2.94Å; N750-R850 HydrophobicContact CB-CG 4.47Å; N750-R850 VanDerWaalsContact OD1-CB 3.23Å; N750-R850 WeakPolarHBondContact OD1-CB 3.42Å; N750-R850 WeakPolarHBondContact OD1-CG 3.36Å
751	V	97.6	Very high	92.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.6	174.6	-177.9	0	0	0	0	109.6	V753 Y816 Y818 H845 W846 I853 V854	V751-V753 HydrophobicContact CG1-CG2 4.09Å; V751-Y816 CarbonylContact C-O 3.54Å; V751-Y816 WeakPolarHBondContact CA-O 3.27Å; V751-Y818 HydrophobicContact CG1-CD2 3.88Å; V751-Y818 HydrophobicContact CG1-CE2 3.95Å; V751-H845 HydrophobicContact CG2-CB 4.49Å; V751-W846 HydrophobicContact CG2-CB 3.97Å; V751-I853 HydrophobicContact CB-CG1 4.43Å; V751-I853 HydrophobicContact CB-CG2 4.28Å; V751-I853 HydrophobicContact CG1-CG2 4Å; V751-V854 PolarHBondContact O-N 3.04Å; V751-V854 VanDerWaalsContact O-N 3.08Å
752	I	98.3	Very high	91.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.4	170.2	-54.5	170.9	0	0	0	107.8	F740 W741 V744 Y769 V815 Y816 H817 Y818 V854	F740-I752 HydrophobicContact CE1-CD1 4.16Å; F740-I752 HydrophobicContact CZ-CD1 4.43Å; F740-I752 HydrophobicContact CZ-CG2 4.15Å; W741-I752 HydrophobicContact CH2-CD1 3.93Å; W741-I752 HydrophobicContact CZ3-CD1 3.95Å; V744-I752 HydrophobicContact CG1-CD1 4.32Å; V744-I752 HydrophobicContact CG2-CD1 3.91Å; V744-I752 HydrophobicContact CG2-CG1 4.31Å; I752-Y769 WeakPolarHBondContact CG2-OH 3.12Å; I752-V815 HydrophobicContact CD1-CG1 3.66Å; I752-V815 HydrophobicContact CG1-CG1 3.81Å; I752-Y816 PolarHBondContact N-O 2.81Å; I752-H817 HydrophobicContact CB-CB 4.38Å; I752-H817 WeakPolarHBondContact O-CA 3.34Å; I752-Y818 PolarHBondContact O-N 3.42Å; I752-V854 CarbonylContact C-O 3.59Å; I752-V854 WeakPolarHBondContact CA-O 3.48Å; I752-V854 HydrophobicContact CG1-CB 4.4Å; I752-V854 HydrophobicContact CG2-CB 4.49Å
753	V	98.3	Very high	91.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	112	-179.3	177.2	0	0	0	0	108.2	V751 I755 Y818 F838 I853 V854 V855 H856 Y867	V751-V753 HydrophobicContact CG1-CG2 4.09Å; V753-I755 HydrophobicContact CG1-CD1 4Å; V753-I755 HydrophobicContact CG1-CG1 3.85Å; V753-Y818 WeakPolarHBondContact CA-O 3.4Å; V753-F838 HydrophobicContact CG1-CE1 3.57Å; V753-F838 HydrophobicContact CG1-CZ 3.79Å; V753-I853 HydrophobicContact CB-CG2 4.41Å; V753-I853 HydrophobicContact CG2-CG2 3.59Å; V753-V854 PolarHBondContact N-O 3.46Å; V753-V855 HydrophobicContact CB-CB 4.45Å; V753-V855 HydrophobicContact CB-CG1 4.21Å; V753-V855 HydrophobicContact CB-CG2 4.23Å; V753-V855 HydrophobicContact CG1-CG1 4.08Å; V753-V855 CarbonylContact O-C 3.56Å; V753-V855 WeakPolarHBondContact O-CA 3.41Å; V753-H856 PolarHBondContact O-N 3.08Å; V753-Y867 HydrophobicContact CG1-CD1 4.43Å; V753-Y867 HydrophobicContact CG1-CD2 4.07Å; V753-Y867 HydrophobicContact CG1-CE1 4.26Å; V753-Y867 HydrophobicContact CG1-CE2 3.85Å; V753-Y867 HydrophobicContact CG1-CG 4.37Å; V753-Y867 HydrophobicContact CG2-CE1 4.36Å; V753-Y867 HydrophobicContact CG2-CE2 4.45Å
754	M	97.6	Very high	90.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	121.6	177.8	175.4	166.2	174.4	0	0	109	S756 F758 C766 Y769 W770 Y818 Q819 Y820 H856	M754-S756 VanDerWaalsContact CE-O 3.27Å; M754-S756 WeakPolarHBondContact CE-O 3.42Å; M754-F758 HydrophobicContact CE-CD1 4.24Å; M754-F758 HydrophobicContact CE-CE1 3.98Å; M754-C766 HydrophobicContact CE-CB 3.79Å; M754-Y769 HydrophobicContact SD-CE1 4.47Å; M754-W770 HydrophobicContact CE-CH2 4.14Å; M754-W770 HydrophobicContact CE-CZ3 4.46Å; M754-W770 HydrophobicContact SD-CH2 3.64Å; M754-W770 HydrophobicContact SD-CZ3 3.73Å; M754-Y818 PolarHBondContact N-O 3.2Å; M754-Q819 HydrophobicContact CB-CB 4.32Å; M754-Q819 HydrophobicContact CB-CG 4.34Å; M754-Q819 HydrophobicContact CG-CG 4.02Å; M754-Q819 CarbonylContact O-C 3.52Å; M754-Q819 VanDerWaalsContact O-CA 3.27Å; M754-Q819 WeakPolarHBondContact O-CA 3.24Å; M754-Q819 HydrophobicContact SD-CG 4.22Å; M754-Y820 PolarHBondContact O-N 3.35Å; M754-H856 WeakPolarHBondContact CA-O 2.97Å; M754-H856 WeakPolarHBondContact CB-NE2 3.33Å; M754-H856 WeakPolarHBondContact CG-CE1 3Å
755	I	95.1	Very high	90.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	65.5	-178.6	-41.4	180	0	0	0	108.8	V753 W823 F838 V855 H856 C857 R863 Y867	V753-I755 HydrophobicContact CG1-CD1 4Å; V753-I755 HydrophobicContact CG1-CG1 3.85Å; I755-W823 HydrophobicContact CG2-CB 4.37Å; I755-W823 HydrophobicContact CG2-CD2 3.91Å; I755-W823 HydrophobicContact CG2-CE3 3.44Å; I755-W823 VanDerWaalsContact CG2-CE3 3.44Å; I755-W823 HydrophobicContact CG2-CG 4.34Å; I755-W823 HydrophobicContact CG2-CZ3 4.04Å; I755-F838 HydrophobicContact CD1-CE1 4.42Å; I755-F838 HydrophobicContact CG1-CE1 4.22Å; I755-V855 HydrophobicContact CD1-CG1 4.28Å; I755-H856 PolarHBondContact N-O 2.88Å; I755-C857 HydrophobicContact CB-CB 4.49Å; I755-C857 WeakPolarHBondContact O-CB 3.26Å; I755-R863 HydrophobicContact CB-CB 4.2Å; I755-R863 HydrophobicContact CG2-CB 3.91Å; I755-R863 PolarHBondContact O-NE 2.9Å; I755-R863 PolarHBondContact O-NH1 2.89Å; I755-Y867 VanDerWaalsContact CD1-CB 3.42Å; I755-Y867 HydrophobicContact CD1-CD2 4Å; I755-Y867 HydrophobicContact CD1-CG 3.81Å
756	S	90.2	Very high	90.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.226	C	C	.	.			trans	-171	154.9	178.8	-150	0	0	0	0	110.8	M754 E760 K765 Q819 R863	M754-S756 VanDerWaalsContact CE-O 3.27Å; M754-S756 WeakPolarHBondContact CE-O 3.42Å; S756-E760 WeakPolarHBondContact CA-OE1 3.34Å; S756-E760 PolarHBondContact OG-OE1 3.06Å; S756-K765 WeakPolarHBondContact OG-CB 3.39Å; S756-Q819 PolarHBondContact O-NE2 3.16Å; S756-Q819 VanDerWaalsContact O-NE2 3.14Å; S756-R863 PolarHBondContact OG-NH2 3.01Å
757	N	87.3	Confident	90.1	Very high	52 Å²	52	45.6 Å²	45.6	28%	0.278	22%	0.219	S	C	.	.			trans	-90.4	169.5	160.1	-69.7	-30.9	0	0	0	110.6	V759 E760 T821	N757-V759 VanDerWaalsContact C-N 3.35Å; N757-E760 HydrophobicContact CB-CG 4.03Å; N757-E760 PolarHBondContact N-OE1 3.17Å; N757-T821 PolarHBondContact ND2-O 3.36Å; N757-T821 PolarHBondContact OD1-O 3.12Å
758	F	89.3	Confident	90.1	Very high	72 Å²	72	47.8 Å²	47.8	32%	0.316	23%	0.228	S	C	.	.	S	Bend	trans	-67.4	-38.2	178.4	-56	-62.3	0	0	0	112	M754 R764 K765 C766 K768 W770	M754-F758 HydrophobicContact CE-CD1 4.24Å; M754-F758 HydrophobicContact CE-CE1 3.98Å; F758-R764 CarbonylContact O-C 3.54Å; F758-R764 WeakPolarHBondContact O-CA 3.16Å; F758-K765 PolarHBondContact O-N 2.93Å; F758-C766 WeakPolarHBondContact CA-O 3.5Å; F758-K768 HydrophobicContact CD1-CB 4.45Å; F758-K768 HydrophobicContact CE1-CB 3.72Å; F758-K768 HydrophobicContact CE1-CG 4.24Å; F758-K768 HydrophobicContact CZ-CB 3.89Å; F758-K768 HydrophobicContact CZ-CD 4.35Å; F758-K768 HydrophobicContact CZ-CG 4.01Å; F758-W770 AromaticContact CE1-CH2 3.57Å; F758-W770 HydrophobicContact CE1-CH2 3.57Å; F758-W770 HydrophobicContact CE1-CZ2 4.23Å; F758-W770 HydrophobicContact CE1-CZ3 4.12Å; F758-W770 AromaticContact CZ-CH2 3.44Å; F758-W770 HydrophobicContact CZ-CH2 3.44Å; F758-W770 VanDerWaalsContact CZ-CH2 3.44Å; F758-W770 AromaticContact CZ-CZ2 3.65Å; F758-W770 HydrophobicContact CZ-CZ2 3.65Å; F758-W770 HydrophobicContact CZ-CZ3 4.36Å
759	V	84.7	Confident	90.2	Very high	86 Å²	86	45 Å²	45	52%	0.521	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.6	177.8	-177.4	0	0	0	0	108.3	N757 R763	N757-V759 VanDerWaalsContact C-N 3.35Å; V759-R763 WeakPolarHBondContact CA-O 3.47Å
760	E	80.8	Confident	90.2	Very high	13 Å²	13	45 Å²	45	6%	0.061	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	124.2	177.5	-63.8	170.7	-161.9	0	0	108.4	S756 N757 G762 R763 K765 D825 R863	S756-E760 WeakPolarHBondContact CA-OE1 3.34Å; S756-E760 PolarHBondContact OG-OE1 3.06Å; N757-E760 HydrophobicContact CB-CG 4.03Å; N757-E760 PolarHBondContact N-OE1 3.17Å; E760-G762 VanDerWaalsContact C-N 3.3Å; E760-G762 PolarHBondContact O-N 3.42Å; E760-R763 PolarHBondContact N-O 2.95Å; E760-R763 PolarHBondContact O-N 3.35Å; E760-K765 HydrophobicContact CB-CG 3.91Å; E760-K765 HydrophobicContact CG-CG 3.87Å; E760-D825 WeakPolarHBondContact OE2-CB 3.35Å; E760-D825 PolarHBondContact OE2-N 2.88Å; E760-R863 IonicContact OE1-CZ 3.99Å; E760-R863 IonicContact OE1-NH1 3.16Å; E760-R863 PolarHBondContact OE1-NH1 2.68Å; E760-R863 IonicContact OE1-NH2 2.67Å; E760-R863 PolarHBondContact OE1-NH2 2.88Å; E760-R863 VanDerWaalsContact OE1-NH2 3.14Å; E760-R863 IonicContact OE2-CZ 3.2Å; E760-R863 IonicContact OE2-NH1 3.51Å; E760-R863 PolarHBondContact OE2-NH1 3.4Å; E760-R863 IonicContact OE2-NH2 2.76Å; E760-R863 PolarHBondContact OE2-NH2 3.24Å
761	R	71.9	Confident	90.2	Very high	169 Å²	169	44.6 Å²	44.6	64%	0.638	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.9	50.5	-171.6	-54.6	-171.8	-166	170.8	9.2	112.4	R763 D827	R761-R763 PolarHBondContact O-N 3.13Å; R761-D827 IonicContact NH2-OD2 2.67Å; R761-D827 PolarHBondContact NH2-OD2 2.91Å
762	G	76.2	Confident	89.7	Confident	72 Å²	72	48.4 Å²	48.4	74%	0.742	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.2	-5.6	-177.5	0	0	0	0	0	116.3	E760	E760-G762 VanDerWaalsContact C-N 3.3Å; E760-G762 PolarHBondContact O-N 3.42Å
763	R	81.1	Confident	89.2	Confident	185 Å²	185	52.9 Å²	52.9	70%	0.698	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	126	-177	-66.1	178	177.7	169.2	-0	111.3	V759 E760 R761 K765	V759-R763 WeakPolarHBondContact CA-O 3.47Å; E760-R763 PolarHBondContact N-O 2.95Å; E760-R763 PolarHBondContact O-N 3.35Å; R761-R763 PolarHBondContact O-N 3.13Å; R763-K765 PolarHBondContact O-N 2.98Å
764	R	87.4	Confident	88.8	Confident	169 Å²	169	55 Å²	55	64%	0.638	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	120.9	174.2	-167.9	175.4	-175.6	152.9	-1.9	110.3	F758 D767	F758-R764 CarbonylContact O-C 3.54Å; F758-R764 WeakPolarHBondContact O-CA 3.16Å; R764-D767 IonicContact CZ-OD1 3.84Å; R764-D767 IonicContact NE-OD1 3.8Å; R764-D767 PolarHBondContact NE-OD1 3.45Å; R764-D767 IonicContact NH2-OD1 2.69Å; R764-D767 PolarHBondContact NH2-OD1 2.88Å
765	K	90.5	Very high	88.4	Confident	17 Å²	17	61.3 Å²	61.3	7%	0.074	32%	0.32	C	S	.	.			trans	-107.4	-46.3	-176.9	-60.1	-59.6	-172.7	169.7	0	112.4	R688 S756 F758 E760 R763 D825 S858	R688-K765 PolarHBondContact NE-O 3.27Å; R688-K765 PolarHBondContact NH1-O 2.78Å; S756-K765 WeakPolarHBondContact OG-CB 3.39Å; F758-K765 PolarHBondContact O-N 2.93Å; E760-K765 HydrophobicContact CB-CG 3.91Å; E760-K765 HydrophobicContact CG-CG 3.87Å; R763-K765 PolarHBondContact O-N 2.98Å; K765-D825 HydrophobicContact CD-CB 4.37Å; K765-D825 WeakPolarHBondContact CE-OD2 3.33Å; K765-D825 IonicContact NZ-OD2 2.76Å; K765-D825 PolarHBondContact NZ-OD2 3.05Å; K765-S858 PolarHBondContact O-OG 3.4Å; K765-S858 VanDerWaalsContact O-OG 3.08Å
766	C	92.2	Very high	88.4	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.007	34%	0.34	C	S	.	.			trans	-136.3	162.6	-179.5	-160.2	0	0	0	0	110	M754 F758 H856	M754-C766 HydrophobicContact CE-CB 3.79Å; F758-C766 WeakPolarHBondContact CA-O 3.5Å; C766-H856 VanDerWaalsContact SG-CE1 3.57Å
767	D	93.4	Very high	88.7	Confident	9 Å²	9	69 Å²	69	5%	0.048	36%	0.361	C	S	.	.			trans	-118.1	148.2	179.2	-64.9	-86.8	0	0	0	109.8	R688 F737 R764 Y769	R688-D767 IonicContact CZ-OD2 2.76Å; R688-D767 IonicContact NH1-OD2 3.87Å; R688-D767 PolarHBondContact NH1-OD2 3.1Å; R688-D767 IonicContact NH2-OD2 3.72Å; R688-D767 PolarHBondContact NH2-OD2 2.86Å; F737-D767 HydrophobicContact CE1-CB 3.97Å; F737-D767 HydrophobicContact CZ-CB 3.81Å; R764-D767 IonicContact CZ-OD1 3.84Å; R764-D767 IonicContact NE-OD1 3.8Å; R764-D767 PolarHBondContact NE-OD1 3.45Å; R764-D767 IonicContact NH2-OD1 2.69Å; R764-D767 PolarHBondContact NH2-OD1 2.88Å; D767-Y769 WeakPolarHBondContact O-CD1 3.42Å; D767-Y769 PolarHBondContact O-N 2.83Å
768	K	95.3	Very high	89	Confident	81 Å²	81	66.9 Å²	66.9	35%	0.352	35%	0.349	S	S	.	.			trans	-74.9	98.2	179.7	-168.7	177.9	-173.8	172.7	0	110.4	F758 W770 S772	F758-K768 HydrophobicContact CD1-CB 4.45Å; F758-K768 HydrophobicContact CE1-CB 3.72Å; F758-K768 HydrophobicContact CE1-CG 4.24Å; F758-K768 HydrophobicContact CZ-CB 3.89Å; F758-K768 HydrophobicContact CZ-CD 4.35Å; F758-K768 HydrophobicContact CZ-CG 4.01Å; K768-W770 VanDerWaalsContact C-N 3.33Å; K768-W770 VanDerWaalsContact CE-NE1 3.29Å; K768-W770 WeakPolarHBondContact CE-O 3.28Å; K768-W770 HydrophobicContact CG-CD2 3.91Å; K768-W770 HydrophobicContact CG-CE3 4.19Å; K768-W770 HydrophobicContact CG-CG 4.37Å; K768-W770 HydrophobicContact CG-CH2 4.4Å; K768-W770 HydrophobicContact CG-CZ2 4.11Å; K768-W770 HydrophobicContact CG-CZ3 4.43Å; K768-S772 PolarHBondContact NZ-OG 3.11Å
769	Y	96.3	Very high	89.1	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.352	C	S	.	.			trans	-90.6	14.9	-179.4	60.9	-97.9	0	0	0	114	P732 F740 W741 I752 M754 D767 Y778 H817 H856	P732-Y769 HydrophobicContact CB-CD1 4.05Å; P732-Y769 HydrophobicContact CB-CG 4.31Å; P732-Y769 HydrophobicContact CG-CD1 3.65Å; P732-Y769 HydrophobicContact CG-CE1 3.91Å; P732-Y769 HydrophobicContact CG-CG 4.08Å; F740-Y769 AromaticContact CD1-CD2 3.95Å; F740-Y769 HydrophobicContact CD1-CD2 3.95Å; F740-Y769 AromaticContact CD1-CE2 3.98Å; F740-Y769 HydrophobicContact CD1-CE2 3.98Å; F740-Y769 AromaticContact CE1-CD2 3.79Å; F740-Y769 HydrophobicContact CE1-CD2 3.79Å; F740-Y769 AromaticContact CE1-CE2 3.32Å; F740-Y769 HydrophobicContact CE1-CE2 3.32Å; F740-Y769 AromaticContact CE1-CZ 3.71Å; F740-Y769 HydrophobicContact CZ-CE2 4.04Å; F740-Y769 AromaticContact CZ-CZ 3.94Å; W741-Y769 AromaticContact CE2-CD2 3.9Å; W741-Y769 AromaticContact CZ2-CD2 3.79Å; W741-Y769 HydrophobicContact CZ2-CD2 3.79Å; W741-Y769 AromaticContact CZ2-CE2 3.91Å; W741-Y769 HydrophobicContact CZ2-CE2 3.91Å; W741-Y769 AromaticContact NE1-CD2 3.74Å; W741-Y769 PolarHBondContact NE1-O 2.74Å; I752-Y769 WeakPolarHBondContact CG2-OH 3.12Å; M754-Y769 HydrophobicContact SD-CE1 4.47Å; D767-Y769 WeakPolarHBondContact O-CD1 3.42Å; D767-Y769 PolarHBondContact O-N 2.83Å; Y769-Y778 PolarHBondContact O-OH 3.09Å; Y769-H817 AromaticContact CZ-NE2 3.74Å; Y769-H817 PolarHBondContact OH-CD2 3.27Å; Y769-H817 VanDerWaalsContact OH-CD2 3.28Å; Y769-H817 PolarHBondContact OH-NE2 2.82Å; Y769-H817 VanDerWaalsContact OH-NE2 3.11Å; Y769-H856 AromaticContact CE1-CE1 3.74Å; Y769-H856 AromaticContact CE1-NE2 3.45Å; Y769-H856 WeakPolarHBondContact CE1-NE2 3.42Å; Y769-H856 AromaticContact CZ-NE2 3.55Å; Y769-H856 PolarHBondContact OH-NE2 3.27Å
770	W	96.2	Very high	89.5	Confident	5 Å²	5	63.7 Å²	63.7	2%	0.019	34%	0.341	C	S	.	.	S	Bend	trans	-136.4	151.7	-177.8	66.9	91.5	0	0	0	112.3	W741 M754 F758 K768 Y778 R797 F799 H817	W741-W770 HydrophobicContact CZ2-CB 4.31Å; M754-W770 HydrophobicContact CE-CH2 4.14Å; M754-W770 HydrophobicContact CE-CZ3 4.46Å; M754-W770 HydrophobicContact SD-CH2 3.64Å; M754-W770 HydrophobicContact SD-CZ3 3.73Å; F758-W770 AromaticContact CE1-CH2 3.57Å; F758-W770 HydrophobicContact CE1-CH2 3.57Å; F758-W770 HydrophobicContact CE1-CZ2 4.23Å; F758-W770 HydrophobicContact CE1-CZ3 4.12Å; F758-W770 AromaticContact CZ-CH2 3.44Å; F758-W770 HydrophobicContact CZ-CH2 3.44Å; F758-W770 VanDerWaalsContact CZ-CH2 3.44Å; F758-W770 AromaticContact CZ-CZ2 3.65Å; F758-W770 HydrophobicContact CZ-CZ2 3.65Å; F758-W770 HydrophobicContact CZ-CZ3 4.36Å; K768-W770 VanDerWaalsContact C-N 3.33Å; K768-W770 VanDerWaalsContact CE-NE1 3.29Å; K768-W770 WeakPolarHBondContact CE-O 3.28Å; K768-W770 HydrophobicContact CG-CD2 3.91Å; K768-W770 HydrophobicContact CG-CE3 4.19Å; K768-W770 HydrophobicContact CG-CG 4.37Å; K768-W770 HydrophobicContact CG-CH2 4.4Å; K768-W770 HydrophobicContact CG-CZ2 4.11Å; K768-W770 HydrophobicContact CG-CZ3 4.43Å; W770-Y778 VanDerWaalsContact C-OH 3.3Å; W770-Y778 WeakPolarHBondContact CA-OH 3.33Å; W770-Y778 PolarHBondContact N-OH 2.97Å; W770-R797 VanDerWaalsContact CZ2-CZ 3.47Å; W770-F799 HydrophobicContact CB-CE1 3.85Å; W770-F799 HydrophobicContact CB-CE2 4.3Å; W770-F799 HydrophobicContact CB-CZ 3.53Å; W770-F799 AromaticContact CD1-CE1 3.9Å; W770-F799 AromaticContact CD1-CZ 3.54Å; W770-F799 HydrophobicContact CD2-CZ 4.34Å; W770-F799 HydrophobicContact CG-CE1 4.1Å; W770-F799 HydrophobicContact CG-CE2 4.45Å; W770-F799 AromaticContact CG-CZ 3.53Å; W770-F799 HydrophobicContact CG-CZ 3.53Å; W770-H817 AromaticContact CZ3-NE2 3.77Å
771	P	94	Very high	90.1	Very high	6 Å²	6	63.1 Å²	63.1	4%	0.039	34%	0.338	C	S	.	.			trans	-66.5	142	179.9	26.3	-34.3	0	0	0	112	S773 Q776 Y778 M785	P771-S773 VanDerWaalsContact C-N 3.31Å; P771-Q776 HydrophobicContact CB-CB 3.93Å; P771-Q776 HydrophobicContact CG-CB 4.2Å; P771-Y778 WeakPolarHBondContact CD-OH 3.26Å; P771-M785 WeakPolarHBondContact O-CE 3.5Å
772	S	88.8	Confident	91.2	Very high	80 Å²	80	56.2 Å²	56.2	56%	0.559	32%	0.316	S	S	*	.	S	Bend	trans	-69.1	-28.3	170.5	-57.3	0	0	0	0	113	K768	K768-S772 PolarHBondContact NZ-OG 3.11Å
773	S	86.8	Confident	92.2	Very high	93 Å²	93	52.8 Å²	52.8	65%	0.65	28%	0.281	S	S	*	.	S	Bend	trans	-160.5	162.2	179.2	63.8	0	0	0	0	109.8	P771 H775	P771-S773 VanDerWaalsContact C-N 3.31Å; S773-H775 PolarHBondContact O-N 3.27Å
774	G	89.3	Confident	92.9	Very high	45 Å²	45	50.8 Å²	50.8	46%	0.464	27%	0.273	S	S	.	.	S	Bend	trans	64	-129.8	178.8	0	0	0	0	0	113	R784 M785	G774-R784 WeakPolarHBondContact O-CA 3.48Å; G774-R784 WeakPolarHBondContact O-CG 3.43Å; G774-M785 PolarHBondContact O-N 3.25Å
775	H	90.4	Very high	93.3	Very high	132 Å²	132	44 Å²	44	61%	0.611	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140	152.8	-178.9	76.6	-55.3	0	0	0	111.8	S773 V783 R784	S773-H775 PolarHBondContact O-N 3.27Å; H775-V783 CarbonylContact C-O 3.52Å; H775-V783 VanDerWaalsContact CA-O 3.24Å; H775-V783 WeakPolarHBondContact CA-O 3.32Å; H775-R784 HydrophobicContact CB-CB 3.83Å; H775-R784 HydrophobicContact CB-CG 4.12Å
776	Q	95.2	Very high	93.5	Very high	89 Å²	89	46.6 Å²	46.6	42%	0.416	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	148.8	174.9	-178.4	169.9	-1.3	0	0	109.6	P771 Y778 V783	P771-Q776 HydrophobicContact CB-CB 3.93Å; P771-Q776 HydrophobicContact CG-CB 4.2Å; Q776-Y778 HydrophobicContact CB-CE2 4.19Å; Q776-Y778 VanDerWaalsContact CD-CZ 3.49Å; Q776-Y778 HydrophobicContact CG-CE1 3.91Å; Q776-Y778 HydrophobicContact CG-CE2 4.14Å; Q776-Y778 PolarHBondContact OE1-OH 3.14Å; Q776-V783 PolarHBondContact N-O 2.61Å; Q776-V783 PolarHBondContact O-N 3Å
777	T	95	Very high	93.5	Very high	73 Å²	73	48.1 Å²	48.1	45%	0.448	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	135.5	176.7	-67.2	0	0	0	0	110.3	G779 I804	T777-G779 VanDerWaalsContact CG2-O 3.27Å; T777-G779 WeakPolarHBondContact CG2-O 3.41Å; T777-I804 HydrophobicContact CG2-CD1 3.52Å
778	Y	94.7	Very high	93.4	Very high	8 Å²	8	51.5 Å²	51.5	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	111.3	171.7	-51.3	-79.3	0	0	0	107.5	F737 W741 Y769 W770 P771 Q776 N780 V781 V783	F737-Y778 HydrophobicContact CB-CD1 3.95Å; F737-Y778 HydrophobicContact CB-CE1 4.49Å; F737-Y778 HydrophobicContact CD2-CD1 4.4Å; F737-Y778 HydrophobicContact CD2-CE1 4.17Å; W741-Y778 AromaticContact CD1-CD2 3.21Å; W741-Y778 AromaticContact CD1-CE2 3.79Å; W741-Y778 AromaticContact CD1-CG 3.47Å; W741-Y778 VanDerWaalsContact CD1-CG 3.47Å; W741-Y778 AromaticContact CG-CD2 3.91Å; W741-Y778 HydrophobicContact CG-CD2 3.91Å; W741-Y778 HydrophobicContact CG-CG 4.31Å; W741-Y778 AromaticContact NE1-CD2 3.46Å; W741-Y778 AromaticContact NE1-CE2 3.5Å; Y769-Y778 PolarHBondContact O-OH 3.09Å; W770-Y778 VanDerWaalsContact C-OH 3.3Å; W770-Y778 WeakPolarHBondContact CA-OH 3.33Å; W770-Y778 PolarHBondContact N-OH 2.97Å; P771-Y778 WeakPolarHBondContact CD-OH 3.26Å; Q776-Y778 HydrophobicContact CB-CE2 4.19Å; Q776-Y778 VanDerWaalsContact CD-CZ 3.49Å; Q776-Y778 HydrophobicContact CG-CE1 3.91Å; Q776-Y778 HydrophobicContact CG-CE2 4.14Å; Q776-Y778 PolarHBondContact OE1-OH 3.14Å; Y778-N780 PolarHBondContact O-N 3.38Å; Y778-V781 PolarHBondContact N-O 3.37Å; Y778-V781 PolarHBondContact O-N 2.98Å; Y778-V783 HydrophobicContact CD2-CB 4.21Å; Y778-V783 HydrophobicContact CD2-CG2 3.78Å; Y778-V783 HydrophobicContact CE2-CB 3.98Å; Y778-V783 HydrophobicContact CE2-CG2 4Å
779	G	92	Very high	93.1	Very high	36 Å²	36	49.9 Å²	49.9	37%	0.371	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	-119.9	-170.4	0	0	0	0	0	112.5	D738 T777	D738-G779 PolarHBondContact OD1-N 3.48Å; T777-G779 VanDerWaalsContact CG2-O 3.27Å; T777-G779 WeakPolarHBondContact CG2-O 3.41Å
780	N	91.8	Very high	92.7	Very high	55 Å²	55	53.4 Å²	53.4	29%	0.294	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	4.8	177.4	-62.6	-60.1	0	0	0	114	Y778 H803 I804 K805	Y778-N780 PolarHBondContact O-N 3.38Å; N780-H803 VanDerWaalsContact CB-CD2 3.42Å; N780-H803 WeakPolarHBondContact CB-CD2 3.27Å; N780-H803 WeakPolarHBondContact CB-NE2 3.4Å; N780-H803 CarbonylContact O-C 3.56Å; N780-H803 WeakPolarHBondContact O-CA 3.32Å; N780-H803 PolarHBondContact O-CD2 3.44Å; N780-I804 WeakPolarHBondContact O-CG1 3.41Å; N780-I804 PolarHBondContact O-N 3.08Å; N780-K805 VanDerWaalsContact CG-CE 3.47Å; N780-K805 PolarHBondContact ND2-NZ 3.07Å; N780-K805 VanDerWaalsContact OD1-CE 3.23Å; N780-K805 WeakPolarHBondContact OD1-CE 3.4Å
781	V	94.5	Very high	92.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.8	-171.9	-176.3	0	0	0	0	111.2	W741 W745 Y778 V783 V801	W741-V781 HydrophobicContact CB-CB 4.13Å; W741-V781 HydrophobicContact CB-CG1 4.15Å; W745-V781 HydrophobicContact CB-CG2 4.15Å; Y778-V781 PolarHBondContact N-O 3.37Å; Y778-V781 PolarHBondContact O-N 2.98Å; V781-V783 HydrophobicContact CG1-CG2 4.15Å; V781-V801 HydrophobicContact CG1-CG1 3.44Å; V781-V801 VanDerWaalsContact CG1-CG1 3.44Å
782	S	94.7	Very high	91.9	Very high	25 Å²	25	54.3 Å²	54.3	18%	0.175	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	128.7	170.2	170.9	0	0	0	0	109.9	V801 R802	S782-V801 WeakPolarHBondContact O-CA 3.44Å; S782-R802 PolarHBondContact N-O 2.9Å; S782-R802 PolarHBondContact O-N 3.4Å
783	V	97	Very high	91.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.7	179.3	-179.5	0	0	0	0	109	W741 H775 Q776 Y778 V781 F799 V801	W741-V783 HydrophobicContact CD2-CG2 3.53Å; W741-V783 HydrophobicContact CE3-CG2 3.72Å; W741-V783 HydrophobicContact CG-CG2 3.96Å; W741-V783 HydrophobicContact CH2-CG1 3.88Å; W741-V783 HydrophobicContact CH2-CG2 4.29Å; W741-V783 HydrophobicContact CZ2-CG1 3.86Å; W741-V783 HydrophobicContact CZ2-CG2 4.13Å; W741-V783 HydrophobicContact CZ3-CG1 4.33Å; W741-V783 HydrophobicContact CZ3-CG2 4.1Å; H775-V783 CarbonylContact C-O 3.52Å; H775-V783 VanDerWaalsContact CA-O 3.24Å; H775-V783 WeakPolarHBondContact CA-O 3.32Å; Q776-V783 PolarHBondContact N-O 2.61Å; Q776-V783 PolarHBondContact O-N 3Å; Y778-V783 HydrophobicContact CD2-CB 4.21Å; Y778-V783 HydrophobicContact CD2-CG2 3.78Å; Y778-V783 HydrophobicContact CE2-CB 3.98Å; Y778-V783 HydrophobicContact CE2-CG2 4Å; V781-V783 HydrophobicContact CG1-CG2 4.15Å; V783-F799 HydrophobicContact CG1-CB 4.1Å; V783-F799 HydrophobicContact CG1-CD1 3.89Å; V783-F799 HydrophobicContact CG1-CG 4.03Å; V783-V801 HydrophobicContact CG1-CG2 4.49Å; V783-V801 HydrophobicContact CG2-CG1 4.45Å; V783-V801 HydrophobicContact CG2-CG2 4.45Å
784	R	95.6	Very high	92.2	Very high	142 Å²	142	48.2 Å²	48.2	54%	0.536	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.3	-178.9	177.1	-178.3	177.2	172.7	0.9	110.5	G774 H775 I786 F799 S800	G774-R784 WeakPolarHBondContact O-CA 3.48Å; G774-R784 WeakPolarHBondContact O-CG 3.43Å; H775-R784 HydrophobicContact CB-CB 3.83Å; H775-R784 HydrophobicContact CB-CG 4.12Å; R784-I786 HydrophobicContact CG-CD1 4.19Å; R784-F799 CarbonylContact O-C 3.55Å; R784-F799 VanDerWaalsContact O-CA 3.28Å; R784-F799 WeakPolarHBondContact O-CA 3.35Å; R784-S800 PolarHBondContact N-O 2.67Å; R784-S800 PolarHBondContact O-N 2.7Å
785	M	95.1	Very high	92.3	Very high	27 Å²	27	46.5 Å²	46.5	13%	0.133	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	132.9	171.9	-176.1	175.6	-86.5	0	0	110.4	P771 G774 E788 R797 F799	P771-M785 WeakPolarHBondContact O-CE 3.5Å; G774-M785 PolarHBondContact O-N 3.25Å; M785-E788 HydrophobicContact CE-CB 4.48Å; M785-E788 HydrophobicContact SD-CB 4.34Å; M785-R797 HydrophobicContact CE-CG 4.34Å; M785-F799 HydrophobicContact CB-CD1 4.35Å; M785-F799 HydrophobicContact CB-CE1 4.27Å; M785-F799 HydrophobicContact CE-CE1 4.02Å; M785-F799 HydrophobicContact CE-CZ 4.46Å; M785-F799 HydrophobicContact CG-CE1 4.5Å
786	I	94.3	Very high	92.5	Very high	71 Å²	71	42.1 Å²	42.1	36%	0.364	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-49	178.5	-58.2	-59	0	0	0	110.3	R784 V798 R1249	R784-I786 HydrophobicContact CG-CD1 4.19Å; I786-V798 HydrophobicContact CB-CB 4.41Å; I786-V798 HydrophobicContact CB-CG1 4.4Å; I786-V798 WeakPolarHBondContact CB-O 3.29Å; I786-V798 PolarHBondContact N-O 3.01Å; I786-R1249 PolarHBondContact O-NH1 3.38Å
787	S	93.1	Very high	92.5	Very high	34 Å²	34	38.6 Å²	38.6	24%	0.238	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	157.2	175.8	54	0	0	0	0	111.5	R797 V798	S787-R797 WeakPolarHBondContact O-CA 3.47Å; S787-V798 PolarHBondContact O-N 2.75Å; S787-V798 WeakPolarHBondContact OG-CB 3.43Å; S787-V798 WeakPolarHBondContact OG-CG2 3.08Å
788	E	92.1	Very high	92.6	Very high	79 Å²	79	36 Å²	36	37%	0.369	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	136.9	169.5	178.1	161.5	32	0	0	106.1	M785 T795 I796 R797	M785-E788 HydrophobicContact CE-CB 4.48Å; M785-E788 HydrophobicContact SD-CB 4.34Å; E788-T795 HydrophobicContact CG-CG2 3.77Å; E788-I796 CarbonylContact C-O 3.6Å; E788-I796 WeakPolarHBondContact CA-O 3.17Å; E788-R797 HydrophobicContact CB-CG 4.26Å; E788-R797 HydrophobicContact CG-CG 4.01Å; E788-R797 IonicContact OE2-CZ 3.12Å; E788-R797 IonicContact OE2-NE 2.67Å; E788-R797 PolarHBondContact OE2-NE 2.9Å; E788-R797 IonicContact OE2-NH2 3.12Å; E788-R797 PolarHBondContact OE2-NH2 3.11Å
789	V	88.8	Confident	92.7	Very high	47 Å²	47	35.6 Å²	35.6	29%	0.285	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	117.1	-176.7	179	0	0	0	0	107.3	T795 I796	V789-T795 CarbonylContact O-C 3.51Å; V789-T795 WeakPolarHBondContact O-CA 3.34Å; V789-T795 WeakPolarHBondContact O-CG2 3.45Å; V789-I796 HydrophobicContact CB-CB 4.47Å; V789-I796 PolarHBondContact N-O 2.84Å; V789-I796 PolarHBondContact O-N 2.91Å
790	V	87.2	Confident	92.8	Very high	75 Å²	75	34.6 Å²	34.6	46%	0.455	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	142.3	179.4	-176.5	0	0	0	0	109.7	T795	V790-T795 HydrophobicContact CG2-CG2 4.08Å
791	R	87.5	Confident	93	Very high	24 Å²	24	32 Å²	32	9%	0.091	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	160.1	165.7	-58.4	-74.3	176.3	-101.3	5.6	106	F793 F794 F997 L998 D1159	R791-F793 PolarHBondContact O-N 3.15Å; R791-F794 HydrophobicContact CB-CD2 4.45Å; R791-F794 HydrophobicContact CB-CE2 4.36Å; R791-F794 WeakPolarHBondContact CB-O 3.37Å; R791-F794 HydrophobicContact CG-CE2 4.08Å; R791-F794 HydrophobicContact CG-CZ 4.49Å; R791-F794 PolarHBondContact N-O 2.93Å; R791-F794 PolarHBondContact O-N 3.17Å; R791-F997 WeakPolarHBondContact CA-O 3.48Å; R791-F997 VanDerWaalsContact CD-CZ 3.43Å; R791-L998 CarbonylContact C-O 3.44Å; R791-L998 VanDerWaalsContact C-O 3.23Å; R791-D1159 IonicContact CZ-OD1 2.74Å; R791-D1159 IonicContact CZ-OD2 3.32Å; R791-D1159 IonicContact NE-OD1 3.16Å; R791-D1159 IonicContact NE-OD2 3.33Å; R791-D1159 PolarHBondContact NE-OD2 2.91Å; R791-D1159 VanDerWaalsContact NH2-CG 3.3Å; R791-D1159 IonicContact NH2-OD1 2.74Å; R791-D1159 PolarHBondContact NH2-OD1 3Å; R791-D1159 IonicContact NH2-OD2 2.7Å; R791-D1159 PolarHBondContact NH2-OD2 3.3Å
792	A	86.3	Confident	92.9	Very high	6 Å²	6	37.6 Å²	37.6	5%	0.05	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48	-55.8	-176.5	0	0	0	0	0	113.1	T821 F997 L998 N999 V1000	A792-T821 PolarHBondContact O-OG1 3.45Å; A792-F997 PolarHBondContact N-O 3.48Å; A792-F997 VanDerWaalsContact N-O 3.11Å; A792-L998 WeakPolarHBondContact CA-O 3.28Å; A792-L998 PolarHBondContact N-O 2.99Å; A792-L998 VanDerWaalsContact N-O 3.08Å; A792-N999 WeakPolarHBondContact CB-O 3.45Å; A792-V1000 HydrophobicContact CB-CG2 4.27Å; A792-V1000 WeakPolarHBondContact O-CG2 3.39Å
793	F	89.4	Confident	92.8	Very high	18 Å²	18	36.8 Å²	36.8	8%	0.079	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-13.9	-173.3	-55.6	-78.2	0	0	0	115	R791 Y820 T821 D822 P834 H995 F1166 M1170	R791-F793 PolarHBondContact O-N 3.15Å; F793-Y820 HydrophobicContact CB-CE2 4.34Å; F793-T821 PolarHBondContact O-N 3.18Å; F793-T821 PolarHBondContact O-OG1 2.77Å; F793-T821 VanDerWaalsContact O-OG1 3.09Å; F793-D822 HydrophobicContact CD1-CB 4.18Å; F793-P834 HydrophobicContact CB-CB 3.91Å; F793-P834 HydrophobicContact CD1-CB 3.74Å; F793-P834 HydrophobicContact CD1-CG 3.91Å; F793-P834 HydrophobicContact CD2-CB 3.84Å; F793-P834 HydrophobicContact CD2-CG 4.12Å; F793-P834 HydrophobicContact CE1-CB 4.22Å; F793-P834 HydrophobicContact CE1-CG 3.86Å; F793-P834 HydrophobicContact CE2-CB 4.32Å; F793-P834 HydrophobicContact CE2-CG 4.08Å; F793-P834 HydrophobicContact CG-CB 3.54Å; F793-P834 HydrophobicContact CG-CG 4.05Å; F793-P834 HydrophobicContact CZ-CG 3.96Å; F793-H995 AromaticContact CE1-CD2 3.78Å; F793-H995 HydrophobicContact CZ-CB 4.23Å; F793-H995 AromaticContact CZ-CD2 3.85Å; F793-F1166 HydrophobicContact CD2-CZ 4.28Å; F793-F1166 HydrophobicContact CE2-CE1 4.46Å; F793-F1166 HydrophobicContact CE2-CZ 4.01Å; F793-M1170 HydrophobicContact CE1-CE 4.32Å; F793-M1170 HydrophobicContact CZ-CE 3.81Å
794	F	92.1	Very high	92.4	Very high	27 Å²	27	41.1 Å²	41.1	12%	0.118	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	152.6	-178.6	57.5	-98.5	0	0	0	114.9	R791 I796 Q819 T821 K837 F838 A841	R791-F794 HydrophobicContact CB-CD2 4.45Å; R791-F794 HydrophobicContact CB-CE2 4.36Å; R791-F794 WeakPolarHBondContact CB-O 3.37Å; R791-F794 HydrophobicContact CG-CE2 4.08Å; R791-F794 HydrophobicContact CG-CZ 4.49Å; R791-F794 PolarHBondContact N-O 2.93Å; R791-F794 PolarHBondContact O-N 3.17Å; F794-I796 HydrophobicContact CD2-CG1 4.05Å; F794-I796 HydrophobicContact CE2-CD1 4.09Å; F794-I796 HydrophobicContact CE2-CG1 4.09Å; F794-Q819 CarbonylContact C-O 3.59Å; F794-Q819 WeakPolarHBondContact CA-O 3.31Å; F794-Q819 WeakPolarHBondContact CB-O 3.38Å; F794-T821 PolarHBondContact N-OG1 2.8Å; F794-K837 HydrophobicContact CE1-CB 4.49Å; F794-F838 HydrophobicContact CB-CD2 3.63Å; F794-F838 HydrophobicContact CB-CE2 3.91Å; F794-F838 HydrophobicContact CD1-CB 4.19Å; F794-F838 AromaticContact CD1-CD2 3.96Å; F794-F838 HydrophobicContact CD1-CD2 3.96Å; F794-F838 HydrophobicContact CD2-CD2 4.46Å; F794-F838 AromaticContact CG-CD2 3.79Å; F794-F838 HydrophobicContact CG-CD2 3.79Å; F794-F838 HydrophobicContact CG-CE2 4.45Å; F794-A841 HydrophobicContact CE2-CB 4.38Å; F794-A841 HydrophobicContact CZ-CB 4.25Å
795	T	92.2	Very high	91.9	Very high	9 Å²	9	40.1 Å²	40.1	6%	0.055	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.9	171.3	-53	0	0	0	0	111.3	E788 V789 V790 R797 Q819	E788-T795 HydrophobicContact CG-CG2 3.77Å; V789-T795 CarbonylContact O-C 3.51Å; V789-T795 WeakPolarHBondContact O-CA 3.34Å; V789-T795 WeakPolarHBondContact O-CG2 3.45Å; V790-T795 HydrophobicContact CG2-CG2 4.08Å; T795-R797 HydrophobicContact CG2-CG 4.32Å; T795-Q819 PolarHBondContact N-O 3.06Å; T795-Q819 PolarHBondContact O-N 3.04Å
796	I	94.1	Very high	91.2	Very high	39 Å²	39	41 Å²	41	20%	0.2	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131	171.4	-49.6	175.7	0	0	0	109	E788 V789 F794 Y818	E788-I796 CarbonylContact C-O 3.6Å; E788-I796 WeakPolarHBondContact CA-O 3.17Å; V789-I796 HydrophobicContact CB-CB 4.47Å; V789-I796 PolarHBondContact N-O 2.84Å; V789-I796 PolarHBondContact O-N 2.91Å; F794-I796 HydrophobicContact CD2-CG1 4.05Å; F794-I796 HydrophobicContact CE2-CD1 4.09Å; F794-I796 HydrophobicContact CE2-CG1 4.09Å; I796-Y818 HydrophobicContact CD1-CD1 4.36Å; I796-Y818 HydrophobicContact CD1-CE1 3.97Å; I796-Y818 HydrophobicContact CG1-CD1 3.88Å; I796-Y818 HydrophobicContact CG1-CE1 3.94Å; I796-Y818 HydrophobicContact CG2-CD1 4.28Å; I796-Y818 HydrophobicContact CG2-CE1 4.02Å
797	R	95.7	Very high	90.3	Very high	15 Å²	15	46.4 Å²	46.4	6%	0.057	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	144.7	172	-62.5	174	-176.2	95.9	18.7	110.4	W770 M785 S787 E788 T795 F799 Y816 H817	W770-R797 VanDerWaalsContact CZ2-CZ 3.47Å; M785-R797 HydrophobicContact CE-CG 4.34Å; S787-R797 WeakPolarHBondContact O-CA 3.47Å; E788-R797 HydrophobicContact CB-CG 4.26Å; E788-R797 HydrophobicContact CG-CG 4.01Å; E788-R797 IonicContact OE2-CZ 3.12Å; E788-R797 IonicContact OE2-NE 2.67Å; E788-R797 PolarHBondContact OE2-NE 2.9Å; E788-R797 IonicContact OE2-NH2 3.12Å; E788-R797 PolarHBondContact OE2-NH2 3.11Å; T795-R797 HydrophobicContact CG2-CG 4.32Å; R797-F799 HydrophobicContact CB-CE2 4.06Å; R797-F799 HydrophobicContact CB-CZ 3.94Å; R797-Y816 WeakPolarHBondContact O-CA 3.46Å; R797-H817 HydrophobicContact CB-CB 4.21Å; R797-H817 PolarHBondContact N-O 3.47Å; R797-H817 PolarHBondContact NH1-CE1 2.88Å; R797-H817 PolarHBondContact O-N 3Å
798	V	96.1	Very high	89.1	Confident	19 Å²	19	57.3 Å²	57.3	12%	0.115	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.2	172.3	-174	0	0	0	0	109.2	I786 S787 L814 Y816	I786-V798 HydrophobicContact CB-CB 4.41Å; I786-V798 HydrophobicContact CB-CG1 4.4Å; I786-V798 WeakPolarHBondContact CB-O 3.29Å; I786-V798 PolarHBondContact N-O 3.01Å; S787-V798 PolarHBondContact O-N 2.75Å; S787-V798 WeakPolarHBondContact OG-CB 3.43Å; S787-V798 WeakPolarHBondContact OG-CG2 3.08Å; V798-L814 HydrophobicContact CG1-CD2 4.22Å; V798-Y816 HydrophobicContact CG1-CE1 4.3Å; V798-Y816 HydrophobicContact CG2-CD1 3.79Å; V798-Y816 HydrophobicContact CG2-CE1 3.81Å
799	F	96.7	Very high	87.8	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	140.6	175.5	-59.7	-64.2	0	0	0	111.3	W741 W770 V783 R784 M785 R797 V801 L814 V815 H817	W741-F799 AromaticContact CH2-CD2 3.91Å; W741-F799 HydrophobicContact CH2-CD2 3.91Å; W741-F799 HydrophobicContact CH2-CE2 4.27Å; W741-F799 HydrophobicContact CH2-CG 4.36Å; W770-F799 HydrophobicContact CB-CE1 3.85Å; W770-F799 HydrophobicContact CB-CE2 4.3Å; W770-F799 HydrophobicContact CB-CZ 3.53Å; W770-F799 AromaticContact CD1-CE1 3.9Å; W770-F799 AromaticContact CD1-CZ 3.54Å; W770-F799 HydrophobicContact CD2-CZ 4.34Å; W770-F799 HydrophobicContact CG-CE1 4.1Å; W770-F799 HydrophobicContact CG-CE2 4.45Å; W770-F799 AromaticContact CG-CZ 3.53Å; W770-F799 HydrophobicContact CG-CZ 3.53Å; V783-F799 HydrophobicContact CG1-CB 4.1Å; V783-F799 HydrophobicContact CG1-CD1 3.89Å; V783-F799 HydrophobicContact CG1-CG 4.03Å; R784-F799 CarbonylContact O-C 3.55Å; R784-F799 VanDerWaalsContact O-CA 3.28Å; R784-F799 WeakPolarHBondContact O-CA 3.35Å; M785-F799 HydrophobicContact CB-CD1 4.35Å; M785-F799 HydrophobicContact CB-CE1 4.27Å; M785-F799 HydrophobicContact CE-CE1 4.02Å; M785-F799 HydrophobicContact CE-CZ 4.46Å; M785-F799 HydrophobicContact CG-CE1 4.5Å; R797-F799 HydrophobicContact CB-CE2 4.06Å; R797-F799 HydrophobicContact CB-CZ 3.94Å; F799-V801 HydrophobicContact CB-CG2 4.04Å; F799-L814 CarbonylContact O-C 3.59Å; F799-L814 WeakPolarHBondContact O-CA 3.17Å; F799-V815 HydrophobicContact CB-CB 4.48Å; F799-V815 PolarHBondContact N-O 2.59Å; F799-V815 PolarHBondContact O-N 2.93Å; F799-H817 HydrophobicContact CD2-CB 3.97Å; F799-H817 HydrophobicContact CE2-CB 3.51Å; F799-H817 AromaticContact CE2-CG 3.9Å
800	S	95.3	Very high	87.2	Confident	14 Å²	14	57.6 Å²	57.6	10%	0.098	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	122.1	163.3	172.8	0	0	0	0	108.1	R784 D812	R784-S800 PolarHBondContact N-O 2.67Å; R784-S800 PolarHBondContact O-N 2.7Å; S800-D812 VanDerWaalsContact OG-CB 3.31Å; S800-D812 WeakPolarHBondContact OG-CB 3.23Å; S800-D812 PolarHBondContact OG-OD2 3.06Å
801	V	95.4	Very high	86.8	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	129	-170.4	-175.1	0	0	0	0	110.2	W741 W745 V781 S782 V783 F799 R813 V815	W741-V801 HydrophobicContact CZ3-CG2 4.06Å; W745-V801 HydrophobicContact CE3-CG1 4.19Å; V781-V801 HydrophobicContact CG1-CG1 3.44Å; V781-V801 VanDerWaalsContact CG1-CG1 3.44Å; S782-V801 WeakPolarHBondContact O-CA 3.44Å; V783-V801 HydrophobicContact CG1-CG2 4.49Å; V783-V801 HydrophobicContact CG2-CG1 4.45Å; V783-V801 HydrophobicContact CG2-CG2 4.45Å; F799-V801 HydrophobicContact CB-CG2 4.04Å; V801-R813 PolarHBondContact N-O 3.14Å; V801-R813 PolarHBondContact O-N 3.23Å; V801-V815 HydrophobicContact CB-CG2 4.2Å; V801-V815 HydrophobicContact CG2-CB 4.06Å; V801-V815 HydrophobicContact CG2-CG2 3.63Å
802	R	93.2	Very high	86.9	Confident	117 Å²	117	65.1 Å²	65.1	44%	0.442	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	130.1	-179.8	-177.6	-173	-62.2	167.6	7.8	110.9	S782 D812	S782-R802 PolarHBondContact N-O 2.9Å; S782-R802 PolarHBondContact O-N 3.4Å; R802-D812 IonicContact CZ-OD1 3.12Å; R802-D812 IonicContact CZ-OD2 2.93Å; R802-D812 IonicContact NE-OD1 3.43Å; R802-D812 PolarHBondContact NE-OD1 3.4Å; R802-D812 VanDerWaalsContact NH2-CG 3.25Å; R802-D812 IonicContact NH2-OD1 2.72Å; R802-D812 PolarHBondContact NH2-OD1 3.14Å; R802-D812 IonicContact NH2-OD2 2.7Å; R802-D812 PolarHBondContact NH2-OD2 3.29Å
803	H	92.2	Very high	87.2	Confident	8 Å²	8	68.4 Å²	68.4	4%	0.037	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	126.6	167.3	-178.7	-121.1	0	0	0	110.8	E704 W745 N780 K805 T806	E704-H803 VanDerWaalsContact CD-CE1 3.45Å; E704-H803 IonicContact OE1-CE1 3.5Å; E704-H803 PolarHBondContact OE1-CE1 3.11Å; E704-H803 IonicContact OE1-ND1 3.94Å; E704-H803 IonicContact OE1-NE2 3.51Å; E704-H803 IonicContact OE2-CE1 2.75Å; E704-H803 PolarHBondContact OE2-CE1 3.29Å; E704-H803 IonicContact OE2-NE2 3.88Å; W745-H803 HydrophobicContact CD2-CB 3.74Å; W745-H803 HydrophobicContact CE3-CB 4.28Å; W745-H803 HydrophobicContact CG-CB 4.23Å; W745-H803 HydrophobicContact CH2-CB 4Å; W745-H803 HydrophobicContact CZ2-CB 3.42Å; W745-H803 VanDerWaalsContact CZ2-CB 3.42Å; W745-H803 HydrophobicContact CZ3-CB 4.38Å; W745-H803 AromaticContact NE1-CG 3.78Å; N780-H803 VanDerWaalsContact CB-CD2 3.42Å; N780-H803 WeakPolarHBondContact CB-CD2 3.27Å; N780-H803 WeakPolarHBondContact CB-NE2 3.4Å; N780-H803 CarbonylContact O-C 3.56Å; N780-H803 WeakPolarHBondContact O-CA 3.32Å; N780-H803 PolarHBondContact O-CD2 3.44Å; H803-K805 VanDerWaalsContact C-N 3.28Å; H803-K805 PolarHBondContact O-N 3.14Å; H803-T806 HydrophobicContact CB-CG2 4.05Å; H803-T806 WeakPolarHBondContact O-CB 3.33Å; H803-T806 WeakPolarHBondContact O-CG2 3.07Å; H803-T806 PolarHBondContact O-N 2.73Å; H803-T806 PolarHBondContact O-OG1 2.82Å
804	I	87.9	Confident	87.5	Confident	92 Å²	92	71.7 Å²	71.7	47%	0.472	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-32.3	-166.4	-65.6	167.7	0	0	0	112.5	T777 N780 T806	T777-I804 HydrophobicContact CG2-CD1 3.52Å; N780-I804 WeakPolarHBondContact O-CG1 3.41Å; N780-I804 PolarHBondContact O-N 3.08Å; I804-T806 PolarHBondContact O-N 3.3Å
805	K	84.8	Confident	87.7	Confident	121 Å²	121	70.6 Å²	70.6	53%	0.526	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-3.7	178	-50.8	179.4	-162.3	156.8	0	113.9	E704 N780 H803	E704-K805 IonicContact OE2-NZ 3.8Å; E704-K805 PolarHBondContact OE2-NZ 3.24Å; N780-K805 VanDerWaalsContact CG-CE 3.47Å; N780-K805 PolarHBondContact ND2-NZ 3.07Å; N780-K805 VanDerWaalsContact OD1-CE 3.23Å; N780-K805 WeakPolarHBondContact OD1-CE 3.4Å; H803-K805 VanDerWaalsContact C-N 3.28Å; H803-K805 PolarHBondContact O-N 3.14Å
806	T	80.6	Confident	87.9	Confident	44 Å²	44	72.2 Å²	72.2	27%	0.27	35%	0.349	S	S	.	.	S	Bend	trans	-71.5	143.5	178.6	57.3	0	0	0	0	111.9	W745 H803 I804 R808	W745-T806 HydrophobicContact CH2-CG2 4.34Å; W745-T806 HydrophobicContact CZ2-CG2 3.92Å; H803-T806 HydrophobicContact CB-CG2 4.05Å; H803-T806 WeakPolarHBondContact O-CB 3.33Å; H803-T806 WeakPolarHBondContact O-CG2 3.07Å; H803-T806 PolarHBondContact O-N 2.73Å; H803-T806 PolarHBondContact O-OG1 2.82Å; I804-T806 PolarHBondContact O-N 3.3Å; T806-R808 PolarHBondContact O-N 2.69Å
807	K	75.7	Confident	88.1	Confident	185 Å²	185	70.4 Å²	70.4	80%	0.804	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-57.8	137.3	180	-66.9	-176.3	176.3	-177.5	0	110.3	G809 S810	K807-G809 PolarHBondContact O-N 3.43Å; K807-S810 PolarHBondContact N-OG 3.26Å; K807-S810 VanDerWaalsContact O-CB 3.27Å; K807-S810 WeakPolarHBondContact O-CB 3.49Å; K807-S810 PolarHBondContact O-N 2.67Å; K807-S810 PolarHBondContact O-OG 3.47Å
808	R	67	Low	88.2	Confident	263 Å²	263	69.8 Å²	69.8	99%	0.992	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	126.7	170.3	-72.8	-177	174.7	-177.8	-1.4	109.2	T806	T806-R808 PolarHBondContact O-N 2.69Å
809	G	65.8	Low	88.2	Confident	82 Å²	82	69.2 Å²	69.2	85%	0.845	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.7	-11.7	-172.1	0	0	0	0	0	115.2	K807 K811	K807-G809 PolarHBondContact O-N 3.43Å; G809-K811 PolarHBondContact O-N 3.3Å
810	S	75.1	Confident	88.1	Confident	51 Å²	51	69.3 Å²	69.3	36%	0.357	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-63	132.1	169.7	-55.2	0	0	0	0	110.4	K807	K807-S810 PolarHBondContact N-OG 3.26Å; K807-S810 VanDerWaalsContact O-CB 3.27Å; K807-S810 WeakPolarHBondContact O-CB 3.49Å; K807-S810 PolarHBondContact O-N 2.67Å; K807-S810 PolarHBondContact O-OG 3.47Å
811	K	79.9	Confident	87.7	Confident	195 Å²	195	70.1 Å²	70.1	85%	0.848	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-71.3	139.7	-179.6	-66.9	-172.4	179.4	-176.9	0	111.7	G809	G809-K811 PolarHBondContact O-N 3.3Å
812	D	90	Very high	87.2	Confident	62 Å²	62	71.3 Å²	71.3	33%	0.332	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-68	149.4	172.1	-58.7	-23.3	0	0	0	110.8	S800 R802	S800-D812 VanDerWaalsContact OG-CB 3.31Å; S800-D812 WeakPolarHBondContact OG-CB 3.23Å; S800-D812 PolarHBondContact OG-OD2 3.06Å; R802-D812 IonicContact CZ-OD1 3.12Å; R802-D812 IonicContact CZ-OD2 2.93Å; R802-D812 IonicContact NE-OD1 3.43Å; R802-D812 PolarHBondContact NE-OD1 3.4Å; R802-D812 VanDerWaalsContact NH2-CG 3.25Å; R802-D812 IonicContact NH2-OD1 2.72Å; R802-D812 PolarHBondContact NH2-OD1 3.14Å; R802-D812 IonicContact NH2-OD2 2.7Å; R802-D812 PolarHBondContact NH2-OD2 3.29Å
813	R	92.6	Very high	86.8	Confident	75 Å²	75	65.9 Å²	65.9	28%	0.283	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.7	172.7	-58	-172.6	-162.9	169	13.6	109.2	W745 N748 V801	W745-R813 HydrophobicContact CE3-CG 4.46Å; W745-R813 HydrophobicContact CH2-CG 4.36Å; W745-R813 HydrophobicContact CZ3-CB 4.45Å; W745-R813 HydrophobicContact CZ3-CG 3.78Å; W745-R813 PolarHBondContact O-NH1 2.95Å; N748-R813 PolarHBondContact OD1-NH1 2.85Å; N748-R813 VanDerWaalsContact OD1-NH1 3.13Å; V801-R813 PolarHBondContact N-O 3.14Å; V801-R813 PolarHBondContact O-N 3.23Å
814	L	94.8	Very high	85.9	Confident	87 Å²	87	67.7 Å²	67.7	46%	0.455	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	130	167.3	-64.2	179.9	0	0	0	109.2	V798 F799 Y816	V798-L814 HydrophobicContact CG1-CD2 4.22Å; F799-L814 CarbonylContact O-C 3.59Å; F799-L814 WeakPolarHBondContact O-CA 3.17Å; L814-Y816 HydrophobicContact CB-CE2 4.2Å
815	V	96.4	Very high	85	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.018	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	120.3	174.5	-179.2	0	0	0	0	108	V744 N750 I752 F799 V801	V744-V815 HydrophobicContact CG1-CG1 4.21Å; V744-V815 HydrophobicContact CG1-CG2 4.15Å; N750-V815 WeakPolarHBondContact O-CA 3.35Å; I752-V815 HydrophobicContact CD1-CG1 3.66Å; I752-V815 HydrophobicContact CG1-CG1 3.81Å; F799-V815 HydrophobicContact CB-CB 4.48Å; F799-V815 PolarHBondContact N-O 2.59Å; F799-V815 PolarHBondContact O-N 2.93Å; V801-V815 HydrophobicContact CB-CG2 4.2Å; V801-V815 HydrophobicContact CG2-CB 4.06Å; V801-V815 HydrophobicContact CG2-CG2 3.63Å
816	Y	97.3	Very high	84.2	Confident	44 Å²	44	64 Å²	64	17%	0.173	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	131.1	177.3	-62.1	-96.3	0	0	0	108.8	N750 V751 I752 R797 V798 L814 H845	N750-Y816 PolarHBondContact O-N 3.03Å; V751-Y816 CarbonylContact C-O 3.54Å; V751-Y816 WeakPolarHBondContact CA-O 3.27Å; I752-Y816 PolarHBondContact N-O 2.81Å; R797-Y816 WeakPolarHBondContact O-CA 3.46Å; V798-Y816 HydrophobicContact CG1-CE1 4.3Å; V798-Y816 HydrophobicContact CG2-CD1 3.79Å; V798-Y816 HydrophobicContact CG2-CE1 3.81Å; L814-Y816 HydrophobicContact CB-CE2 4.2Å; Y816-H845 HydrophobicContact CD1-CB 4.31Å; Y816-H845 AromaticContact CD1-CE1 3.88Å; Y816-H845 AromaticContact CD1-CG 3.77Å; Y816-H845 AromaticContact CD1-ND1 3.52Å; Y816-H845 HydrophobicContact CD2-CB 3.67Å; Y816-H845 AromaticContact CD2-CG 3.95Å; Y816-H845 HydrophobicContact CE1-CB 4.46Å; Y816-H845 AromaticContact CE1-CD2 3.68Å; Y816-H845 AromaticContact CE1-CE1 3.64Å; Y816-H845 AromaticContact CE1-CG 3.68Å; Y816-H845 AromaticContact CE1-ND1 3.65Å; Y816-H845 AromaticContact CE1-NE2 3.66Å; Y816-H845 HydrophobicContact CE2-CB 3.85Å; Y816-H845 AromaticContact CE2-CD2 3.98Å; Y816-H845 AromaticContact CE2-CG 3.86Å; Y816-H845 HydrophobicContact CG-CB 3.93Å; Y816-H845 AromaticContact CG-CG 3.92Å; Y816-H845 AromaticContact CG-ND1 3.97Å; Y816-H845 AromaticContact CZ-CD2 3.53Å; Y816-H845 AromaticContact CZ-CG 3.73Å; Y816-H845 AromaticContact CZ-NE2 3.91Å
817	H	97.4	Very high	84.2	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	113.1	-178	170	-64.9	0	0	0	109.5	I752 Y769 W770 R797 F799	I752-H817 HydrophobicContact CB-CB 4.38Å; I752-H817 WeakPolarHBondContact O-CA 3.34Å; Y769-H817 AromaticContact CZ-NE2 3.74Å; Y769-H817 PolarHBondContact OH-CD2 3.27Å; Y769-H817 VanDerWaalsContact OH-CD2 3.28Å; Y769-H817 PolarHBondContact OH-NE2 2.82Å; Y769-H817 VanDerWaalsContact OH-NE2 3.11Å; W770-H817 AromaticContact CZ3-NE2 3.77Å; R797-H817 HydrophobicContact CB-CB 4.21Å; R797-H817 PolarHBondContact N-O 3.47Å; R797-H817 PolarHBondContact NH1-CE1 2.88Å; R797-H817 PolarHBondContact O-N 3Å; F799-H817 HydrophobicContact CD2-CB 3.97Å; F799-H817 HydrophobicContact CE2-CB 3.51Å; F799-H817 AromaticContact CE2-CG 3.9Å
818	Y	97.5	Very high	84.8	Confident	3 Å²	3	56.6 Å²	56.6	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	115.6	-178.5	-64.6	-99.2	0	0	0	108.8	V751 I752 V753 M754 I796 A841 H845	V751-Y818 HydrophobicContact CG1-CD2 3.88Å; V751-Y818 HydrophobicContact CG1-CE2 3.95Å; I752-Y818 PolarHBondContact O-N 3.42Å; V753-Y818 WeakPolarHBondContact CA-O 3.4Å; M754-Y818 PolarHBondContact N-O 3.2Å; I796-Y818 HydrophobicContact CD1-CD1 4.36Å; I796-Y818 HydrophobicContact CD1-CE1 3.97Å; I796-Y818 HydrophobicContact CG1-CD1 3.88Å; I796-Y818 HydrophobicContact CG1-CE1 3.94Å; I796-Y818 HydrophobicContact CG2-CD1 4.28Å; I796-Y818 HydrophobicContact CG2-CE1 4.02Å; Y818-A841 HydrophobicContact CD1-CB 4.49Å; Y818-A841 VanDerWaalsContact CE1-C 3.45Å; Y818-A841 HydrophobicContact CE1-CB 4.11Å; Y818-A841 WeakPolarHBondContact CE1-O 3.47Å; Y818-A841 PolarHBondContact OH-O 3.15Å; Y818-H845 PolarHBondContact OH-ND1 3.04Å
819	Q	96.4	Very high	85.8	Confident	6 Å²	6	44.3 Å²	44.3	3%	0.028	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	115.7	174	-177.3	178	-2.8	0	0	110	M754 S756 F794 T795 T821	M754-Q819 HydrophobicContact CB-CB 4.32Å; M754-Q819 HydrophobicContact CB-CG 4.34Å; M754-Q819 HydrophobicContact CG-CG 4.02Å; M754-Q819 CarbonylContact O-C 3.52Å; M754-Q819 VanDerWaalsContact O-CA 3.27Å; M754-Q819 WeakPolarHBondContact O-CA 3.24Å; M754-Q819 HydrophobicContact SD-CG 4.22Å; S756-Q819 PolarHBondContact O-NE2 3.16Å; S756-Q819 VanDerWaalsContact O-NE2 3.14Å; F794-Q819 CarbonylContact C-O 3.59Å; F794-Q819 WeakPolarHBondContact CA-O 3.31Å; F794-Q819 WeakPolarHBondContact CB-O 3.38Å; T795-Q819 PolarHBondContact N-O 3.06Å; T795-Q819 PolarHBondContact O-N 3.04Å; Q819-T821 HydrophobicContact CG-CG2 4.09Å
820	Y	94.5	Very high	86.5	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.008	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	128.4	165.6	-162.5	-86.2	0	0	0	109.2	M754 F793 D822 W823 P829 P834 V835 F838	M754-Y820 PolarHBondContact O-N 3.35Å; F793-Y820 HydrophobicContact CB-CE2 4.34Å; Y820-D822 VanDerWaalsContact CE1-C 3.43Å; Y820-D822 HydrophobicContact CE1-CB 4.3Å; Y820-D822 WeakPolarHBondContact CE1-O 3.5Å; Y820-W823 HydrophobicContact CD1-CB 3.57Å; Y820-W823 HydrophobicContact CD1-CE3 4.22Å; Y820-W823 HydrophobicContact CE1-CB 3.66Å; Y820-W823 HydrophobicContact CE1-CE3 4.26Å; Y820-P829 HydrophobicContact CE1-CG 4.36Å; Y820-P834 HydrophobicContact CE2-CB 4.41Å; Y820-V835 HydrophobicContact CE2-CG2 4.07Å; Y820-F838 HydrophobicContact CD2-CB 3.67Å; Y820-F838 AromaticContact CD2-CD1 3.92Å; Y820-F838 HydrophobicContact CD2-CD1 3.92Å; Y820-F838 AromaticContact CD2-CD2 3.79Å; Y820-F838 HydrophobicContact CD2-CD2 3.79Å; Y820-F838 HydrophobicContact CD2-CE1 4.45Å; Y820-F838 HydrophobicContact CD2-CE2 4.33Å; Y820-F838 AromaticContact CD2-CG 3.54Å; Y820-F838 HydrophobicContact CD2-CG 3.54Å; Y820-F838 HydrophobicContact CE2-CB 3.97Å; Y820-F838 HydrophobicContact CE2-CG 4.34Å; Y820-F838 HydrophobicContact CG-CD2 4.49Å; Y820-F838 HydrophobicContact CG-CG 4.43Å
821	T	87.6	Confident	87.1	Confident	32 Å²	32	40.7 Å²	40.7	20%	0.196	20%	0.196	C	C	.	.			trans	-107.3	-17.9	-168.7	40.3	0	0	0	0	114.2	N757 A792 F793 F794 Q819	N757-T821 PolarHBondContact ND2-O 3.36Å; N757-T821 PolarHBondContact OD1-O 3.12Å; A792-T821 PolarHBondContact O-OG1 3.45Å; F793-T821 PolarHBondContact O-N 3.18Å; F793-T821 PolarHBondContact O-OG1 2.77Å; F793-T821 VanDerWaalsContact O-OG1 3.09Å; F794-T821 PolarHBondContact N-OG1 2.8Å; Q819-T821 HydrophobicContact CG-CG2 4.09Å
822	D	83.3	Confident	87.7	Confident	25 Å²	25	32.1 Å²	32.1	13%	0.134	16%	0.16	C	C	.	.	S	Bend	trans	-113.8	45.9	-175.8	-170.6	34.6	0	0	0	113.7	F793 Y820	F793-D822 HydrophobicContact CD1-CB 4.18Å; Y820-D822 VanDerWaalsContact CE1-C 3.43Å; Y820-D822 HydrophobicContact CE1-CB 4.3Å; Y820-D822 WeakPolarHBondContact CE1-O 3.5Å
823	W	85.2	Confident	87.8	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.015	15%	0.145	C	C	.	.			trans	-133.2	125.5	174.2	-164	-19	0	0	0	107.8	I755 Y820 D827 P829 V835 R863 T866 F908	I755-W823 HydrophobicContact CG2-CB 4.37Å; I755-W823 HydrophobicContact CG2-CD2 3.91Å; I755-W823 HydrophobicContact CG2-CE3 3.44Å; I755-W823 VanDerWaalsContact CG2-CE3 3.44Å; I755-W823 HydrophobicContact CG2-CG 4.34Å; I755-W823 HydrophobicContact CG2-CZ3 4.04Å; Y820-W823 HydrophobicContact CD1-CB 3.57Å; Y820-W823 HydrophobicContact CD1-CE3 4.22Å; Y820-W823 HydrophobicContact CE1-CB 3.66Å; Y820-W823 HydrophobicContact CE1-CE3 4.26Å; W823-D827 PolarHBondContact NE1-O 2.92Å; W823-P829 HydrophobicContact CB-CG 4.2Å; W823-P829 HydrophobicContact CD2-CG 3.5Å; W823-P829 HydrophobicContact CE3-CG 3.76Å; W823-P829 HydrophobicContact CG-CG 3.7Å; W823-P829 HydrophobicContact CZ2-CG 4.4Å; W823-P829 HydrophobicContact CZ3-CG 4.31Å; W823-V835 HydrophobicContact CE3-CG2 4.18Å; W823-V835 HydrophobicContact CZ3-CG1 4.02Å; W823-V835 HydrophobicContact CZ3-CG2 3.86Å; W823-R863 VanDerWaalsContact CD1-CD 3.48Å; W823-R863 HydrophobicContact CD2-CG 4.11Å; W823-R863 HydrophobicContact CG-CG 4.25Å; W823-R863 HydrophobicContact CZ2-CB 4.37Å; W823-R863 HydrophobicContact CZ2-CG 4.18Å; W823-R863 PolarHBondContact O-NH1 2.84Å; W823-T866 HydrophobicContact CH2-CG2 3.66Å; W823-T866 HydrophobicContact CZ2-CG2 3.85Å; W823-F908 HydrophobicContact CH2-CD1 4.49Å; W823-F908 HydrophobicContact CH2-CE1 4.16Å; W823-F908 HydrophobicContact CZ2-CE1 4.49Å
824	R	74.9	Confident	87.8	Confident	45 Å²	45	25.9 Å²	25.9	17%	0.17	13%	0.132	C	C	.	.			trans	-96.1	157.8	177.3	-66.3	-176.2	-63.6	-102.6	-18.1	112.5	D827 T975	R824-D827 HydrophobicContact CB-CB 3.72Å; R824-D827 IonicContact CZ-OD2 2.92Å; R824-D827 VanDerWaalsContact CZ-OD2 3.29Å; R824-D827 IonicContact NE-OD2 3.29Å; R824-D827 PolarHBondContact NE-OD2 2.92Å; R824-D827 IonicContact NH2-OD2 3.16Å; R824-D827 PolarHBondContact NH2-OD2 2.72Å; R824-D827 WeakPolarHBondContact O-CB 3.44Å; R824-D827 PolarHBondContact O-N 2.67Å; R824-T975 PolarHBondContact NH1-O 2.7Å; R824-T975 PolarHBondContact NH1-OG1 2.83Å
825	D	68.5	Low	87.8	Confident	19 Å²	19	21.7 Å²	21.7	10%	0.102	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	137.2	177.3	-135.1	25.3	0	0	0	113	E760 K765 D827 R863	E760-D825 WeakPolarHBondContact OE2-CB 3.35Å; E760-D825 PolarHBondContact OE2-N 2.88Å; K765-D825 HydrophobicContact CD-CB 4.37Å; K765-D825 WeakPolarHBondContact CE-OD2 3.33Å; K765-D825 IonicContact NZ-OD2 2.76Å; K765-D825 PolarHBondContact NZ-OD2 3.05Å; D825-D827 PolarHBondContact O-N 3.43Å; D825-D827 VanDerWaalsContact O-N 3.08Å; D825-R863 VanDerWaalsContact CA-NH2 3.35Å; D825-R863 VanDerWaalsContact CB-NH2 3.28Å; D825-R863 IonicContact OD1-CZ 3.32Å; D825-R863 IonicContact OD1-NE 3.39Å; D825-R863 PolarHBondContact OD1-NE 3.38Å; D825-R863 IonicContact OD1-NH2 3.06Å; D825-R863 PolarHBondContact OD1-NH2 2.81Å
826	F	68.6	Low	87.7	Confident	117 Å²	117	22.3 Å²	22.3	51%	0.513	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	2.3	-173	-48.5	-81.6	0	0	0	115.2	T902	F826-T902 HydrophobicContact CB-CG2 4.46Å; F826-T902 HydrophobicContact CD1-CG2 4.24Å
827	D	80	Confident	87.4	Confident	34 Å²	34	21.6 Å²	21.6	18%	0.182	11%	0.111	C	C	.	.			trans	-98	171.7	177.4	-129.2	-27.9	0	0	0	110	R761 W823 R824 D825	R761-D827 IonicContact NH2-OD2 2.67Å; R761-D827 PolarHBondContact NH2-OD2 2.91Å; W823-D827 PolarHBondContact NE1-O 2.92Å; R824-D827 HydrophobicContact CB-CB 3.72Å; R824-D827 IonicContact CZ-OD2 2.92Å; R824-D827 VanDerWaalsContact CZ-OD2 3.29Å; R824-D827 IonicContact NE-OD2 3.29Å; R824-D827 PolarHBondContact NE-OD2 2.92Å; R824-D827 IonicContact NH2-OD2 3.16Å; R824-D827 PolarHBondContact NH2-OD2 2.72Å; R824-D827 WeakPolarHBondContact O-CB 3.44Å; R824-D827 PolarHBondContact O-N 2.67Å; D825-D827 PolarHBondContact O-N 3.43Å; D825-D827 VanDerWaalsContact O-N 3.08Å
828	V	87.9	Confident	87.3	Confident	40 Å²	40	21.6 Å²	21.6	24%	0.242	11%	0.112	C	C	.	.			trans	-123.9	154.2	165.3	-65.4	0	0	0	0	110.4	Q904 Q905 F908	V828-Q904 HydrophobicContact CG1-CB 4.23Å; V828-Q904 WeakPolarHBondContact CG1-O 3.37Å; V828-Q905 HydrophobicContact CG1-CG 3.9Å; V828-F908 HydrophobicContact CB-CB 4.1Å; V828-F908 HydrophobicContact CB-CD2 3.97Å; V828-F908 HydrophobicContact CB-CG 4Å; V828-F908 HydrophobicContact CG1-CB 3.77Å; V828-F908 HydrophobicContact CG1-CG 4.1Å; V828-F908 HydrophobicContact CG2-CD2 4.35Å
829	P	88.1	Confident	87.2	Confident	5 Å²	5	21.9 Å²	21.9	3%	0.032	11%	0.113	C	C	.	.			trans	-67.4	146.3	174.6	-21.8	37.9	0	0	0	110.4	Y820 W823 S831 V835 F908	Y820-P829 HydrophobicContact CE1-CG 4.36Å; W823-P829 HydrophobicContact CB-CG 4.2Å; W823-P829 HydrophobicContact CD2-CG 3.5Å; W823-P829 HydrophobicContact CE3-CG 3.76Å; W823-P829 HydrophobicContact CG-CG 3.7Å; W823-P829 HydrophobicContact CZ2-CG 4.4Å; W823-P829 HydrophobicContact CZ3-CG 4.31Å; P829-S831 PolarHBondContact O-N 3.32Å; P829-S831 VanDerWaalsContact O-N 3.08Å; P829-V835 HydrophobicContact CB-CG2 4.18Å; P829-V835 HydrophobicContact CG-CG2 3.69Å; P829-F908 HydrophobicContact CB-CE2 4.36Å; P829-F908 HydrophobicContact CB-CZ 4.16Å; P829-F908 HydrophobicContact CG-CE1 4.48Å; P829-F908 HydrophobicContact CG-CZ 4.03Å; P829-F908 VanDerWaalsContact O-CE2 3.25Å; P829-F908 WeakPolarHBondContact O-CE2 3.16Å
830	P	80.2	Confident	87	Confident	51 Å²	51	25.9 Å²	25.9	33%	0.331	13%	0.132	S	C	.	.	S	Bend	trans	-72.2	-2.1	-175.6	29.2	-34.8	0	0	0	114	L977	P830-L977 HydrophobicContact CB-CB 3.79Å; P830-L977 HydrophobicContact CG-CB 3.65Å
831	S	87.9	Confident	86.8	Confident	5 Å²	5	26.8 Å²	26.8	4%	0.035	14%	0.14	C	C	.	.			trans	-148.6	140.6	173.4	177.6	0	0	0	0	110.1	P829 L833 P834 M1170	P829-S831 PolarHBondContact O-N 3.32Å; P829-S831 VanDerWaalsContact O-N 3.08Å; S831-L833 VanDerWaalsContact C-N 3.26Å; S831-L833 PolarHBondContact O-N 2.87Å; S831-L833 PolarHBondContact OG-N 3.46Å; S831-P834 WeakPolarHBondContact O-CD 3.32Å; S831-M1170 PolarHBondContact OG-SD 3.02Å; S831-M1170 VanDerWaalsContact OG-SD 3.42Å
832	P	92.5	Very high	87.1	Confident	16 Å²	16	25.3 Å²	25.3	10%	0.104	13%	0.131	C	C	.	.	H	α-helix	trans	-67.5	-25.3	170.5	25.9	-32.6	0	0	0	113.2	V835 L836 F908 A912 E915	P832-V835 PolarHBondContact O-N 3.21Å; P832-V835 VanDerWaalsContact O-N 3.11Å; P832-L836 WeakPolarHBondContact O-CG 3.25Å; P832-L836 PolarHBondContact O-N 2.95Å; P832-F908 HydrophobicContact CB-CE2 4.43Å; P832-F908 HydrophobicContact CB-CZ 4.42Å; P832-A912 HydrophobicContact CB-CB 3.99Å; P832-E915 HydrophobicContact CB-CB 4.19Å; P832-E915 HydrophobicContact CG-CB 3.74Å; P832-E915 HydrophobicContact CG-CG 3.91Å
833	L	92.2	Very high	87.6	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-57.1	-48.5	-170.9	-79.7	174.3	0	0	0	114	S831 V835 L836 K837 E915 Y1165 F1166 K1169 M1170	S831-L833 VanDerWaalsContact C-N 3.26Å; S831-L833 PolarHBondContact O-N 2.87Å; S831-L833 PolarHBondContact OG-N 3.46Å; L833-V835 VanDerWaalsContact C-N 3.29Å; L833-V835 PolarHBondContact O-N 3.31Å; L833-L836 PolarHBondContact O-N 3.27Å; L833-K837 PolarHBondContact O-N 3.27Å; L833-E915 HydrophobicContact CD2-CG 3.96Å; L833-E915 HydrophobicContact CG-CG 4.24Å; L833-Y1165 HydrophobicContact CD2-CD1 4.43Å; L833-Y1165 HydrophobicContact CD2-CE1 4.04Å; L833-F1166 HydrophobicContact CB-CD2 3.82Å; L833-F1166 HydrophobicContact CB-CE2 3.9Å; L833-F1166 HydrophobicContact CD2-CD2 4.46Å; L833-K1169 HydrophobicContact CD1-CB 3.91Å; L833-K1169 HydrophobicContact CD1-CD 3.93Å; L833-K1169 HydrophobicContact CD1-CG 3.94Å; L833-M1170 HydrophobicContact CB-SD 4.18Å; L833-M1170 HydrophobicContact CD1-CG 4.26Å; L833-M1170 HydrophobicContact CD1-SD 4.34Å
834	P	92.4	Very high	87.8	Confident	4 Å²	4	28.9 Å²	28.9	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-68.2	-27.6	178.9	-20.2	34.4	0	0	0	113.3	F793 Y820 S831 F838 F1166 M1170	F793-P834 HydrophobicContact CB-CB 3.91Å; F793-P834 HydrophobicContact CD1-CB 3.74Å; F793-P834 HydrophobicContact CD1-CG 3.91Å; F793-P834 HydrophobicContact CD2-CB 3.84Å; F793-P834 HydrophobicContact CD2-CG 4.12Å; F793-P834 HydrophobicContact CE1-CB 4.22Å; F793-P834 HydrophobicContact CE1-CG 3.86Å; F793-P834 HydrophobicContact CE2-CB 4.32Å; F793-P834 HydrophobicContact CE2-CG 4.08Å; F793-P834 HydrophobicContact CG-CB 3.54Å; F793-P834 HydrophobicContact CG-CG 4.05Å; F793-P834 HydrophobicContact CZ-CG 3.96Å; Y820-P834 HydrophobicContact CE2-CB 4.41Å; S831-P834 WeakPolarHBondContact O-CD 3.32Å; P834-F838 WeakPolarHBondContact O-CB 3.43Å; P834-F838 PolarHBondContact O-N 3.1Å; P834-F1166 HydrophobicContact CB-CE2 4.41Å; P834-F1166 HydrophobicContact CB-CZ 4.46Å; P834-F1166 HydrophobicContact CG-CE2 4.14Å; P834-F1166 HydrophobicContact CG-CZ 4.15Å; P834-M1170 HydrophobicContact CG-CE 4Å; P834-M1170 HydrophobicContact CG-SD 3.98Å
835	V	94.3	Very high	88.4	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-71.1	-42.4	173.2	179.5	0	0	0	0	111	Y820 W823 P829 P832 L833 K837 F838 V839 I870 F908	Y820-V835 HydrophobicContact CE2-CG2 4.07Å; W823-V835 HydrophobicContact CE3-CG2 4.18Å; W823-V835 HydrophobicContact CZ3-CG1 4.02Å; W823-V835 HydrophobicContact CZ3-CG2 3.86Å; P829-V835 HydrophobicContact CB-CG2 4.18Å; P829-V835 HydrophobicContact CG-CG2 3.69Å; P832-V835 PolarHBondContact O-N 3.21Å; P832-V835 VanDerWaalsContact O-N 3.11Å; L833-V835 VanDerWaalsContact C-N 3.29Å; L833-V835 PolarHBondContact O-N 3.31Å; V835-K837 VanDerWaalsContact C-N 3.31Å; V835-K837 PolarHBondContact O-N 3.14Å; V835-F838 PolarHBondContact O-N 3.14Å; V835-V839 HydrophobicContact CG1-CG2 4.42Å; V835-V839 VanDerWaalsContact O-CG2 3.32Å; V835-V839 WeakPolarHBondContact O-CG2 3.25Å; V835-V839 PolarHBondContact O-N 2.81Å; V835-I870 HydrophobicContact CG1-CD1 4Å; V835-F908 HydrophobicContact CB-CE1 4.26Å; V835-F908 HydrophobicContact CB-CZ 4.19Å; V835-F908 HydrophobicContact CG1-CE1 4.28Å; V835-F908 HydrophobicContact CG2-CE1 3.92Å; V835-F908 HydrophobicContact CG2-CZ 3.71Å
836	L	94.7	Very high	89.5	Confident	15 Å²	15	28.8 Å²	28.8	8%	0.079	16%	0.155	C	C	.	.	H	α-helix	trans	-59.6	-42.4	173.9	-69.1	176.1	0	0	0	111.2	P832 L833 V839 E840 I870 I874 A912 E915	P832-L836 WeakPolarHBondContact O-CG 3.25Å; P832-L836 PolarHBondContact O-N 2.95Å; L833-L836 PolarHBondContact O-N 3.27Å; L836-V839 PolarHBondContact O-N 3.24Å; L836-E840 PolarHBondContact O-N 3.49Å; L836-I870 HydrophobicContact CD2-CG2 4.18Å; L836-I874 HydrophobicContact CD2-CD1 3.62Å; L836-A912 HydrophobicContact CD2-CB 4.35Å; L836-E915 HydrophobicContact CD1-CB 3.98Å; L836-E915 HydrophobicContact CD1-CG 3.94Å
837	K	92	Very high	90	Very high	29 Å²	29	25.1 Å²	25.1	13%	0.126	14%	0.142	C	C	.	.	H	α-helix	trans	-63.5	-41.2	172.5	-74.8	-47	-161.9	-159.5	0	113.8	F794 L833 V835 V839 E840 A841 H922 S923 D1163 F1166	F794-K837 HydrophobicContact CE1-CB 4.49Å; L833-K837 PolarHBondContact O-N 3.27Å; V835-K837 VanDerWaalsContact C-N 3.31Å; V835-K837 PolarHBondContact O-N 3.14Å; K837-V839 VanDerWaalsContact C-N 3.33Å; K837-V839 PolarHBondContact O-N 3.39Å; K837-E840 WeakPolarHBondContact CD-OE2 3.37Å; K837-E840 IonicContact NZ-OE2 3.01Å; K837-E840 PolarHBondContact NZ-OE2 3.44Å; K837-E840 PolarHBondContact O-N 2.92Å; K837-A841 VanDerWaalsContact O-CB 3.28Å; K837-A841 WeakPolarHBondContact O-CB 3.47Å; K837-A841 PolarHBondContact O-N 3.19Å; K837-H922 PolarHBondContact NZ-CE1 3.3Å; K837-H922 VanDerWaalsContact NZ-CE1 3.35Å; K837-S923 PolarHBondContact NZ-OG 2.75Å; K837-D1163 WeakPolarHBondContact CE-OD2 3.42Å; K837-D1163 IonicContact NZ-OD2 2.83Å; K837-D1163 PolarHBondContact NZ-OD2 2.71Å; K837-F1166 HydrophobicContact CB-CE2 4.44Å; K837-F1166 HydrophobicContact CG-CD2 3.74Å; K837-F1166 HydrophobicContact CG-CE2 3.7Å
838	F	94.6	Very high	89.7	Confident	1 Å²	1	30 Å²	30	0%	0.004	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-39.1	175.6	-179.6	-107.7	0	0	0	112.4	V753 I755 F794 Y820 P834 V835 A841 S842 Y867	V753-F838 HydrophobicContact CG1-CE1 3.57Å; V753-F838 HydrophobicContact CG1-CZ 3.79Å; I755-F838 HydrophobicContact CD1-CE1 4.42Å; I755-F838 HydrophobicContact CG1-CE1 4.22Å; F794-F838 HydrophobicContact CB-CD2 3.63Å; F794-F838 HydrophobicContact CB-CE2 3.91Å; F794-F838 HydrophobicContact CD1-CB 4.19Å; F794-F838 AromaticContact CD1-CD2 3.96Å; F794-F838 HydrophobicContact CD1-CD2 3.96Å; F794-F838 HydrophobicContact CD2-CD2 4.46Å; F794-F838 AromaticContact CG-CD2 3.79Å; F794-F838 HydrophobicContact CG-CD2 3.79Å; F794-F838 HydrophobicContact CG-CE2 4.45Å; Y820-F838 HydrophobicContact CD2-CB 3.67Å; Y820-F838 AromaticContact CD2-CD1 3.92Å; Y820-F838 HydrophobicContact CD2-CD1 3.92Å; Y820-F838 AromaticContact CD2-CD2 3.79Å; Y820-F838 HydrophobicContact CD2-CD2 3.79Å; Y820-F838 HydrophobicContact CD2-CE1 4.45Å; Y820-F838 HydrophobicContact CD2-CE2 4.33Å; Y820-F838 AromaticContact CD2-CG 3.54Å; Y820-F838 HydrophobicContact CD2-CG 3.54Å; Y820-F838 HydrophobicContact CE2-CB 3.97Å; Y820-F838 HydrophobicContact CE2-CG 4.34Å; Y820-F838 HydrophobicContact CG-CD2 4.49Å; Y820-F838 HydrophobicContact CG-CG 4.43Å; P834-F838 WeakPolarHBondContact O-CB 3.43Å; P834-F838 PolarHBondContact O-N 3.1Å; V835-F838 PolarHBondContact O-N 3.14Å; F838-A841 PolarHBondContact O-N 3.45Å; F838-S842 VanDerWaalsContact O-CB 3.27Å; F838-S842 WeakPolarHBondContact O-CB 3.4Å; F838-S842 PolarHBondContact O-N 3.22Å; F838-S842 PolarHBondContact O-OG 3.33Å; F838-S842 VanDerWaalsContact O-OG 3.13Å; F838-Y867 HydrophobicContact CD1-CD2 4.17Å; F838-Y867 HydrophobicContact CD1-CE2 4.1Å; F838-Y867 HydrophobicContact CE1-CD2 4.09Å; F838-Y867 HydrophobicContact CE1-CE2 4.04Å
839	V	94.8	Very high	89.4	Confident	8 Å²	8	33 Å²	33	5%	0.048	18%	0.176	C	C	.	.	H	α-helix	trans	-66.9	-41.7	174.5	171.8	0	0	0	0	111.5	V835 L836 K837 S842 V843 Y867 I870 E871	V835-V839 HydrophobicContact CG1-CG2 4.42Å; V835-V839 VanDerWaalsContact O-CG2 3.32Å; V835-V839 WeakPolarHBondContact O-CG2 3.25Å; V835-V839 PolarHBondContact O-N 2.81Å; L836-V839 PolarHBondContact O-N 3.24Å; K837-V839 VanDerWaalsContact C-N 3.33Å; K837-V839 PolarHBondContact O-N 3.39Å; V839-S842 PolarHBondContact O-OG 3.16Å; V839-S842 VanDerWaalsContact O-OG 3.11Å; V839-V843 WeakPolarHBondContact O-CG1 3.28Å; V839-V843 WeakPolarHBondContact O-CG2 3.47Å; V839-V843 PolarHBondContact O-N 3.04Å; V839-Y867 HydrophobicContact CG2-CD2 3.8Å; V839-Y867 HydrophobicContact CG2-CE2 3.73Å; V839-I870 HydrophobicContact CG2-CG2 4.21Å; V839-E871 HydrophobicContact CG1-CB 4Å; V839-E871 HydrophobicContact CG1-CG 3.82Å
840	E	92.1	Very high	89.3	Confident	90 Å²	90	37.7 Å²	37.7	42%	0.421	19%	0.194	S	C	.	.	H	α-helix	trans	-60.6	-47.9	173.1	-176	178.7	-153.4	0	0	111.2	L836 K837 T844 S923	L836-E840 PolarHBondContact O-N 3.49Å; K837-E840 WeakPolarHBondContact CD-OE2 3.37Å; K837-E840 IonicContact NZ-OE2 3.01Å; K837-E840 PolarHBondContact NZ-OE2 3.44Å; K837-E840 PolarHBondContact O-N 2.92Å; E840-T844 PolarHBondContact O-N 3.2Å; E840-T844 PolarHBondContact O-OG1 2.73Å; E840-S923 PolarHBondContact OE1-OG 3Å; E840-S923 PolarHBondContact OE2-OG 3.48Å
841	A	91.2	Very high	89.8	Confident	22 Å²	22	35.7 Å²	35.7	18%	0.182	18%	0.182	C	C	.	.	H	α-helix	trans	-65.9	-43.7	-178.5	0	0	0	0	0	112.6	F794 Y818 K837 F838 V843 T844	F794-A841 HydrophobicContact CE2-CB 4.38Å; F794-A841 HydrophobicContact CZ-CB 4.25Å; Y818-A841 HydrophobicContact CD1-CB 4.49Å; Y818-A841 VanDerWaalsContact CE1-C 3.45Å; Y818-A841 HydrophobicContact CE1-CB 4.11Å; Y818-A841 WeakPolarHBondContact CE1-O 3.47Å; Y818-A841 PolarHBondContact OH-O 3.15Å; K837-A841 VanDerWaalsContact O-CB 3.28Å; K837-A841 WeakPolarHBondContact O-CB 3.47Å; K837-A841 PolarHBondContact O-N 3.19Å; F838-A841 PolarHBondContact O-N 3.45Å; A841-V843 PolarHBondContact O-N 3.47Å; A841-T844 WeakPolarHBondContact O-CB 3.25Å; A841-T844 PolarHBondContact O-N 3.43Å
842	S	93.8	Very high	90.2	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66	-38.6	-175.3	65	0	0	0	0	113.2	F838 V839 Y867	F838-S842 VanDerWaalsContact O-CB 3.27Å; F838-S842 WeakPolarHBondContact O-CB 3.4Å; F838-S842 PolarHBondContact O-N 3.22Å; F838-S842 PolarHBondContact O-OG 3.33Å; F838-S842 VanDerWaalsContact O-OG 3.13Å; V839-S842 PolarHBondContact O-OG 3.16Å; V839-S842 VanDerWaalsContact O-OG 3.11Å; S842-Y867 PolarHBondContact OG-OH 3Å
843	V	92.9	Very high	90.4	Very high	29 Å²	29	35.2 Å²	35.2	18%	0.176	18%	0.179	C	C	.	.	H	α-helix	trans	-84.9	-10.2	-176.8	-52.4	0	0	0	0	113.3	V839 A841 H845 W846 I853 E871	V839-V843 WeakPolarHBondContact O-CG1 3.28Å; V839-V843 WeakPolarHBondContact O-CG2 3.47Å; V839-V843 PolarHBondContact O-N 3.04Å; A841-V843 PolarHBondContact O-N 3.47Å; V843-H845 VanDerWaalsContact C-N 3.29Å; V843-H845 PolarHBondContact O-N 3.09Å; V843-W846 PolarHBondContact O-N 3.42Å; V843-I853 HydrophobicContact CG1-CD1 4.24Å; V843-E871 HydrophobicContact CG1-CG 3.8Å; V843-E871 WeakPolarHBondContact CG1-OE1 3.35Å
844	T	89.5	Confident	90.7	Very high	75 Å²	75	35.2 Å²	35.2	46%	0.46	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-40.5	-179.3	-73.7	0	0	0	0	112.6	E840 A841	E840-T844 PolarHBondContact O-N 3.2Å; E840-T844 PolarHBondContact O-OG1 2.73Å; A841-T844 WeakPolarHBondContact O-CB 3.25Å; A841-T844 PolarHBondContact O-N 3.43Å
845	H	87.7	Confident	91	Very high	59 Å²	59	35 Å²	35	27%	0.273	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	1	178	-66.1	106.8	0	0	0	114.3	N750 V751 Y816 Y818 V843	N750-H845 PolarHBondContact ND2-O 2.94Å; V751-H845 HydrophobicContact CG2-CB 4.49Å; Y816-H845 HydrophobicContact CD1-CB 4.31Å; Y816-H845 AromaticContact CD1-CE1 3.88Å; Y816-H845 AromaticContact CD1-CG 3.77Å; Y816-H845 AromaticContact CD1-ND1 3.52Å; Y816-H845 HydrophobicContact CD2-CB 3.67Å; Y816-H845 AromaticContact CD2-CG 3.95Å; Y816-H845 HydrophobicContact CE1-CB 4.46Å; Y816-H845 AromaticContact CE1-CD2 3.68Å; Y816-H845 AromaticContact CE1-CE1 3.64Å; Y816-H845 AromaticContact CE1-CG 3.68Å; Y816-H845 AromaticContact CE1-ND1 3.65Å; Y816-H845 AromaticContact CE1-NE2 3.66Å; Y816-H845 HydrophobicContact CE2-CB 3.85Å; Y816-H845 AromaticContact CE2-CD2 3.98Å; Y816-H845 AromaticContact CE2-CG 3.86Å; Y816-H845 HydrophobicContact CG-CB 3.93Å; Y816-H845 AromaticContact CG-CG 3.92Å; Y816-H845 AromaticContact CG-ND1 3.97Å; Y816-H845 AromaticContact CZ-CD2 3.53Å; Y816-H845 AromaticContact CZ-CG 3.73Å; Y816-H845 AromaticContact CZ-NE2 3.91Å; Y818-H845 PolarHBondContact OH-ND1 3.04Å; V843-H845 VanDerWaalsContact C-N 3.29Å; V843-H845 PolarHBondContact O-N 3.09Å
846	W	91.3	Very high	91.2	Very high	4 Å²	4	35 Å²	35	2%	0.015	18%	0.178	C	C	.	.			trans	-96.6	139.5	-178.6	-174	71.9	0	0	0	112.3	R722 A725 V751 V843 G851 I853 R1239	R722-W846 VanDerWaalsContact NH1-CH2 3.34Å; A725-W846 HydrophobicContact CB-CH2 4.3Å; A725-W846 HydrophobicContact CB-CZ2 4.49Å; V751-W846 HydrophobicContact CG2-CB 3.97Å; V843-W846 PolarHBondContact O-N 3.42Å; W846-G851 PolarHBondContact NE1-O 2.78Å; W846-I853 HydrophobicContact CB-CD1 4.28Å; W846-I853 HydrophobicContact CD2-CD1 3.79Å; W846-I853 HydrophobicContact CD2-CG1 3.87Å; W846-I853 HydrophobicContact CE3-CD1 4.2Å; W846-I853 HydrophobicContact CG-CD1 3.87Å; W846-I853 HydrophobicContact CG-CG1 3.79Å; W846-I853 HydrophobicContact CZ2-CD1 4.3Å; W846-I853 HydrophobicContact CZ2-CG1 4.03Å; W846-R1239 PolarHBondContact O-NH2 3.43Å
847	T	79.6	Confident	91.2	Very high	39 Å²	39	34.3 Å²	34.3	24%	0.239	17%	0.174	C	C	.	.			trans	-139	165.2	-176.6	55.4	0	0	0	0	111.7	R722 D849 R850	R722-T847 PolarHBondContact NH1-O 2.78Å; T847-D849 VanDerWaalsContact C-N 3.29Å; T847-D849 WeakPolarHBondContact CB-OD1 3.41Å; T847-D849 PolarHBondContact O-N 2.84Å; T847-D849 PolarHBondContact OG1-OD1 3.37Å; T847-R850 PolarHBondContact O-N 2.83Å; T847-R850 VanDerWaalsContact OG1-CG 3.27Å; T847-R850 WeakPolarHBondContact OG1-CG 3.34Å
848	F	75	Confident	91.3	Very high	137 Å²	137	32.9 Å²	32.9	60%	0.601	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-23.2	-174.6	-71.3	-72.2	0	0	0	113.7	R850	F848-R850 VanDerWaalsContact C-N 3.3Å
849	D	80.2	Confident	91.3	Very high	102 Å²	102	33.3 Å²	33.3	55%	0.545	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-10.6	173.5	61.9	-64.4	0	0	0	114.2	T847	T847-D849 VanDerWaalsContact C-N 3.29Å; T847-D849 WeakPolarHBondContact CB-OD1 3.41Å; T847-D849 PolarHBondContact O-N 2.84Å; T847-D849 PolarHBondContact OG1-OD1 3.37Å
850	R	86.5	Confident	91.3	Very high	105 Å²	105	32.9 Å²	32.9	40%	0.396	17%	0.169	S	C	.	.	S	Bend	trans	-95.8	163.6	-177.6	-59.6	-68.4	143.8	148.7	5.3	112.1	R722 N750 T847 F848	R722-R850 PolarHBondContact NH2-O 3.5Å; N750-R850 HydrophobicContact CB-CG 4.47Å; N750-R850 VanDerWaalsContact OD1-CB 3.23Å; N750-R850 WeakPolarHBondContact OD1-CB 3.42Å; N750-R850 WeakPolarHBondContact OD1-CG 3.36Å; T847-R850 PolarHBondContact O-N 2.83Å; T847-R850 VanDerWaalsContact OG1-CG 3.27Å; T847-R850 WeakPolarHBondContact OG1-CG 3.34Å; F848-R850 VanDerWaalsContact C-N 3.3Å
851	G	91	Very high	91.5	Very high	9 Å²	9	28.6 Å²	28.6	9%	0.093	15%	0.149	C	C	.	.			trans	-62.5	178.3	175.3	0	0	0	0	0	114.1	Q747 N748 W846	Q747-G851 VanDerWaalsContact O-CA 3.27Å; Q747-G851 WeakPolarHBondContact O-CA 3.47Å; N748-G851 WeakPolarHBondContact O-CA 3.29Å; N748-G851 PolarHBondContact O-N 3.15Å; W846-G851 PolarHBondContact NE1-O 2.78Å
852	P	96	Very high	91.7	Very high	11 Å²	11	27.6 Å²	27.6	7%	0.071	14%	0.141	C	C	.	.			trans	-58.5	150.3	172.7	23.6	-32.7	0	0	0	112.1	A725 I727 Q747 S749 V854	A725-P852 CarbonylContact O-C 3.55Å; A725-P852 WeakPolarHBondContact O-CA 3.44Å; I727-P852 HydrophobicContact CD1-CB 4.26Å; I727-P852 HydrophobicContact CD1-CG 3.42Å; I727-P852 VanDerWaalsContact CD1-CG 3.42Å; I727-P852 HydrophobicContact CG1-CB 3.92Å; I727-P852 HydrophobicContact CG1-CG 3.6Å; Q747-P852 HydrophobicContact CB-CG 4.33Å; S749-P852 VanDerWaalsContact CB-O 3.22Å; S749-P852 WeakPolarHBondContact CB-O 3.41Å; S749-P852 PolarHBondContact OG-O 2.96Å; P852-V854 PolarHBondContact O-N 2.78Å
853	I	97.5	Very high	91.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	124.7	166.2	-56.7	-179.4	0	0	0	107.7	A725 Y726 I727 V751 V753 V843 W846 V855	A725-I853 PolarHBondContact O-N 2.87Å; Y726-I853 CarbonylContact C-O 3.53Å; Y726-I853 VanDerWaalsContact CA-O 3.29Å; Y726-I853 WeakPolarHBondContact CA-O 3.38Å; Y726-I853 HydrophobicContact CD1-CB 3.94Å; Y726-I853 HydrophobicContact CE1-CB 4.19Å; Y726-I853 HydrophobicContact CE1-CD1 4.13Å; I727-I853 PolarHBondContact N-O 2.99Å; V751-I853 HydrophobicContact CB-CG1 4.43Å; V751-I853 HydrophobicContact CB-CG2 4.28Å; V751-I853 HydrophobicContact CG1-CG2 4Å; V753-I853 HydrophobicContact CB-CG2 4.41Å; V753-I853 HydrophobicContact CG2-CG2 3.59Å; V843-I853 HydrophobicContact CG1-CD1 4.24Å; W846-I853 HydrophobicContact CB-CD1 4.28Å; W846-I853 HydrophobicContact CD2-CD1 3.79Å; W846-I853 HydrophobicContact CD2-CG1 3.87Å; W846-I853 HydrophobicContact CE3-CD1 4.2Å; W846-I853 HydrophobicContact CG-CD1 3.87Å; W846-I853 HydrophobicContact CG-CG1 3.79Å; W846-I853 HydrophobicContact CZ2-CD1 4.3Å; W846-I853 HydrophobicContact CZ2-CG1 4.03Å; I853-V855 HydrophobicContact CB-CG2 4.48Å; I853-V855 HydrophobicContact CG2-CG2 3.89Å; I853-V855 PolarHBondContact O-N 3.2Å
854	V	98.4	Very high	92	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	114.4	174.5	178	0	0	0	0	108.2	I727 F740 M743 V744 V751 I752 V753 P852	I727-V854 HydrophobicContact CB-CG2 4.31Å; I727-V854 HydrophobicContact CD1-CG2 4.45Å; F740-V854 HydrophobicContact CE2-CG1 3.71Å; F740-V854 HydrophobicContact CZ-CG1 3.87Å; M743-V854 HydrophobicContact CE-CG1 3.82Å; M743-V854 HydrophobicContact CE-CG2 4.23Å; V744-V854 HydrophobicContact CG2-CG2 4.3Å; V751-V854 PolarHBondContact O-N 3.04Å; V751-V854 VanDerWaalsContact O-N 3.08Å; I752-V854 CarbonylContact C-O 3.59Å; I752-V854 WeakPolarHBondContact CA-O 3.48Å; I752-V854 HydrophobicContact CG1-CB 4.4Å; I752-V854 HydrophobicContact CG2-CB 4.49Å; V753-V854 PolarHBondContact N-O 3.46Å; P852-V854 PolarHBondContact O-N 2.78Å
855	V	98.5	Very high	92.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	126.8	-178.5	-169.3	0	0	0	0	109.2	Y726 I727 A728 A729 V753 I755 I853 T864 Y867 I868	Y726-V855 HydrophobicContact CD1-CG2 3.76Å; Y726-V855 HydrophobicContact CE1-CG2 4.42Å; I727-V855 PolarHBondContact O-N 3.48Å; A728-V855 WeakPolarHBondContact CA-O 3.25Å; A729-V855 PolarHBondContact N-O 3.2Å; V753-V855 HydrophobicContact CB-CB 4.45Å; V753-V855 HydrophobicContact CB-CG1 4.21Å; V753-V855 HydrophobicContact CB-CG2 4.23Å; V753-V855 HydrophobicContact CG1-CG1 4.08Å; V753-V855 CarbonylContact O-C 3.56Å; V753-V855 WeakPolarHBondContact O-CA 3.41Å; I755-V855 HydrophobicContact CD1-CG1 4.28Å; I853-V855 HydrophobicContact CB-CG2 4.48Å; I853-V855 HydrophobicContact CG2-CG2 3.89Å; I853-V855 PolarHBondContact O-N 3.2Å; V855-T864 HydrophobicContact CB-CG2 4.03Å; V855-T864 HydrophobicContact CG1-CG2 3.81Å; V855-Y867 HydrophobicContact CG1-CD1 3.77Å; V855-Y867 HydrophobicContact CG1-CE1 4.38Å; V855-Y867 HydrophobicContact CG1-CG 4.31Å; V855-Y867 HydrophobicContact CG2-CD1 3.89Å; V855-Y867 HydrophobicContact CG2-CE1 3.79Å; V855-I868 HydrophobicContact CB-CD1 4.44Å; V855-I868 HydrophobicContact CG2-CD1 4.49Å; V855-I868 HydrophobicContact CG2-CG1 4.28Å
856	H	98	Very high	92.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	158.9	175.9	78.3	89.3	0	0	0	112.8	A729 V753 M754 I755 C766 Y769	A729-H856 HydrophobicContact CB-CB 4.46Å; A729-H856 VanDerWaalsContact O-CA 3.32Å; A729-H856 WeakPolarHBondContact O-CA 3.49Å; A729-H856 WeakPolarHBondContact O-CB 3.37Å; V753-H856 PolarHBondContact O-N 3.08Å; M754-H856 WeakPolarHBondContact CA-O 2.97Å; M754-H856 WeakPolarHBondContact CB-NE2 3.33Å; M754-H856 WeakPolarHBondContact CG-CE1 3Å; I755-H856 PolarHBondContact N-O 2.88Å; C766-H856 VanDerWaalsContact SG-CE1 3.57Å; Y769-H856 AromaticContact CE1-CE1 3.74Å; Y769-H856 AromaticContact CE1-NE2 3.45Å; Y769-H856 WeakPolarHBondContact CE1-NE2 3.42Å; Y769-H856 AromaticContact CZ-NE2 3.55Å; Y769-H856 PolarHBondContact OH-NE2 3.27Å
857	C	94.4	Very high	93.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	-129.5	-126.7	166.4	61.7	0	0	0	0	108	G731 I755 G860 R863 T864	G731-C857 VanDerWaalsContact CA-O 3.22Å; G731-C857 WeakPolarHBondContact CA-O 3.37Å; G731-C857 PolarHBondContact N-O 3.06Å; I755-C857 HydrophobicContact CB-CB 4.49Å; I755-C857 WeakPolarHBondContact O-CB 3.26Å; C857-G860 PolarHBondContact SG-N 3.19Å; C857-R863 HydrophobicContact CB-CB 4.09Å; C857-T864 PolarHBondContact N-OG1 2.89Å; C857-T864 PolarHBondContact SG-OG1 3.27Å
858	S	94	Very high	94	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.085	C	C	.	.	S	Bend	trans	-76	-69	164.2	-169.6	0	0	0	0	111.5	Y689 G731 K765	Y689-S858 WeakPolarHBondContact CE2-OG 3.31Å; Y689-S858 PolarHBondContact OH-OG 2.82Å; G731-S858 PolarHBondContact N-O 3.39Å; K765-S858 PolarHBondContact O-OG 3.4Å; K765-S858 VanDerWaalsContact O-OG 3.08Å
859	A	94.4	Very high	95.1	Very high	9 Å²	9	11.3 Å²	11.3	7%	0.074	6%	0.057	C	C	.	.	S	Bend	trans	-89.9	-9.8	-177.6	0	0	0	0	0	114.2	Y689 I692 V861 R896	Y689-A859 HydrophobicContact CD2-CB 3.59Å; Y689-A859 HydrophobicContact CE2-CB 3.67Å; I692-A859 HydrophobicContact CG1-CB 4.24Å; I692-A859 HydrophobicContact CG2-CB 4.31Å; A859-V861 HydrophobicContact CB-CG2 3.5Å; A859-R896 PolarHBondContact O-NH2 2.85Å
860	G	96	Very high	95.9	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.031	C	C	.	.	S	Bend	trans	73.5	31.1	-179.1	0	0	0	0	0	114.2	A729 C857 T864 R896	A729-G860 WeakPolarHBondContact O-CA 3.42Å; C857-G860 PolarHBondContact SG-N 3.19Å; G860-T864 WeakPolarHBondContact CA-OG1 3.46Å; G860-R896 PolarHBondContact O-NE 2.82Å
861	V	96	Very high	96.4	Very high	0 Å²	0	1.7 Å²	1.7	0%	0	1%	0.013	C	C	.	.	S	Bend	trans	-135.5	-60.2	-170.9	-78.5	0	0	0	0	114.3	I692 A859 G865 R896 M897 L899 V900 Q901	I692-V861 HydrophobicContact CD1-CG2 4.26Å; I692-V861 HydrophobicContact CG1-CG2 4.46Å; I692-V861 HydrophobicContact CG2-CG1 3.76Å; I692-V861 HydrophobicContact CG2-CG2 3.97Å; A859-V861 HydrophobicContact CB-CG2 3.5Å; V861-G865 WeakPolarHBondContact O-CA 3.34Å; V861-G865 PolarHBondContact O-N 2.73Å; V861-R896 HydrophobicContact CG1-CG 4.21Å; V861-M897 WeakPolarHBondContact CG1-O 3.48Å; V861-L899 WeakPolarHBondContact O-CA 3.46Å; V861-V900 PolarHBondContact O-N 2.84Å; V861-V900 VanDerWaalsContact O-N 3.08Å; V861-Q901 HydrophobicContact CB-CG 4.27Å; V861-Q901 VanDerWaalsContact CG2-CD 3.43Å; V861-Q901 HydrophobicContact CG2-CG 4.11Å
862	G	94.8	Very high	96.6	Very high	1 Å²	1	1.3 Å²	1.3	1%	0.01	1%	0.009	C	C	.	.	H	α-helix	trans	-63.1	-89.1	-179.9	0	0	0	0	0	113.7	T864 G865 T866 Q901	G862-T864 PolarHBondContact O-N 3.44Å; G862-T864 VanDerWaalsContact O-N 3.09Å; G862-G865 WeakPolarHBondContact O-CA 3.19Å; G862-G865 PolarHBondContact O-N 3.29Å; G862-T866 PolarHBondContact O-N 3.26Å; G862-T866 PolarHBondContact O-OG1 3.45Å; G862-T866 VanDerWaalsContact O-OG1 3.12Å; G862-Q901 VanDerWaalsContact N-OE1 3.09Å
863	R	95.7	Very high	96.7	Very high	0 Å²	0	0.8 Å²	0.8	0%	0	1%	0.005	C	C	.	.	H	α-helix	trans	-49.7	-36.2	176.8	-59.4	-177.9	-98.4	178.6	-4.5	113.6	I755 S756 E760 W823 D825 C857 T866 Y867	I755-R863 HydrophobicContact CB-CB 4.2Å; I755-R863 HydrophobicContact CG2-CB 3.91Å; I755-R863 PolarHBondContact O-NE 2.9Å; I755-R863 PolarHBondContact O-NH1 2.89Å; S756-R863 PolarHBondContact OG-NH2 3.01Å; E760-R863 IonicContact OE1-CZ 3.99Å; E760-R863 IonicContact OE1-NH1 3.16Å; E760-R863 PolarHBondContact OE1-NH1 2.68Å; E760-R863 IonicContact OE1-NH2 2.67Å; E760-R863 PolarHBondContact OE1-NH2 2.88Å; E760-R863 VanDerWaalsContact OE1-NH2 3.14Å; E760-R863 IonicContact OE2-CZ 3.2Å; E760-R863 IonicContact OE2-NH1 3.51Å; E760-R863 PolarHBondContact OE2-NH1 3.4Å; E760-R863 IonicContact OE2-NH2 2.76Å; E760-R863 PolarHBondContact OE2-NH2 3.24Å; W823-R863 VanDerWaalsContact CD1-CD 3.48Å; W823-R863 HydrophobicContact CD2-CG 4.11Å; W823-R863 HydrophobicContact CG-CG 4.25Å; W823-R863 HydrophobicContact CZ2-CB 4.37Å; W823-R863 HydrophobicContact CZ2-CG 4.18Å; W823-R863 PolarHBondContact O-NH1 2.84Å; D825-R863 VanDerWaalsContact CA-NH2 3.35Å; D825-R863 VanDerWaalsContact CB-NH2 3.28Å; D825-R863 IonicContact OD1-CZ 3.32Å; D825-R863 IonicContact OD1-NE 3.39Å; D825-R863 PolarHBondContact OD1-NE 3.38Å; D825-R863 IonicContact OD1-NH2 3.06Å; D825-R863 PolarHBondContact OD1-NH2 2.81Å; C857-R863 HydrophobicContact CB-CB 4.09Å; R863-T866 PolarHBondContact O-N 3.33Å; R863-Y867 PolarHBondContact O-N 3.49Å
864	T	97.6	Very high	96.5	Very high	0 Å²	0	1.4 Å²	1.4	0%	0	1%	0.009	C	C	.	.	H	α-helix	trans	-60.9	-46	173.4	-64.3	0	0	0	0	112.6	A728 V855 C857 G860 G862 I868	A728-T864 HydrophobicContact CB-CG2 3.73Å; V855-T864 HydrophobicContact CB-CG2 4.03Å; V855-T864 HydrophobicContact CG1-CG2 3.81Å; C857-T864 PolarHBondContact N-OG1 2.89Å; C857-T864 PolarHBondContact SG-OG1 3.27Å; G860-T864 WeakPolarHBondContact CA-OG1 3.46Å; G862-T864 PolarHBondContact O-N 3.44Å; G862-T864 VanDerWaalsContact O-N 3.09Å; T864-I868 HydrophobicContact CG2-CD1 4.02Å; T864-I868 WeakPolarHBondContact O-CD1 3.41Å; T864-I868 VanDerWaalsContact O-CG1 3.26Å; T864-I868 WeakPolarHBondContact O-CG1 3.49Å; T864-I868 PolarHBondContact O-N 2.67Å; T864-I868 VanDerWaalsContact O-N 3.15Å
865	G	97.2	Very high	96.3	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-64.4	-44.4	173.4	0	0	0	0	0	111.7	V861 G862 Y867 I868 C869	V861-G865 WeakPolarHBondContact O-CA 3.34Å; V861-G865 PolarHBondContact O-N 2.73Å; G862-G865 WeakPolarHBondContact O-CA 3.19Å; G862-G865 PolarHBondContact O-N 3.29Å; G865-Y867 PolarHBondContact O-N 3.46Å; G865-I868 PolarHBondContact O-N 3.43Å; G865-I868 VanDerWaalsContact O-N 3.13Å; G865-C869 WeakPolarHBondContact O-CB 3.46Å; G865-C869 PolarHBondContact O-N 3.18Å; G865-C869 PolarHBondContact O-SG 3.27Å; G865-C869 VanDerWaalsContact O-SG 3.39Å
866	T	97.6	Very high	96	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-55.4	-48	178.5	-43.4	0	0	0	0	111.8	W823 G862 R863 C869 I870 F908 I909	W823-T866 HydrophobicContact CH2-CG2 3.66Å; W823-T866 HydrophobicContact CZ2-CG2 3.85Å; G862-T866 PolarHBondContact O-N 3.26Å; G862-T866 PolarHBondContact O-OG1 3.45Å; G862-T866 VanDerWaalsContact O-OG1 3.12Å; R863-T866 PolarHBondContact O-N 3.33Å; T866-C869 PolarHBondContact O-N 3.03Å; T866-I870 HydrophobicContact CG2-CD1 4.03Å; T866-I870 VanDerWaalsContact O-CG1 3.31Å; T866-I870 WeakPolarHBondContact O-CG1 3.43Å; T866-I870 PolarHBondContact O-N 2.82Å; T866-F908 HydrophobicContact CG2-CD1 4.05Å; T866-I909 HydrophobicContact CG2-CD1 4.36Å; T866-I909 HydrophobicContact CG2-CG1 3.78Å
867	Y	97.9	Very high	95.8	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-62.1	-45.5	175.2	171.7	-83.5	0	0	0	112.9	Y726 V753 I755 F838 V839 S842 V855 R863 G865 C869 I870 E871	Y726-Y867 HydrophobicContact CE1-CE1 4.09Å; V753-Y867 HydrophobicContact CG1-CD1 4.43Å; V753-Y867 HydrophobicContact CG1-CD2 4.07Å; V753-Y867 HydrophobicContact CG1-CE1 4.26Å; V753-Y867 HydrophobicContact CG1-CE2 3.85Å; V753-Y867 HydrophobicContact CG1-CG 4.37Å; V753-Y867 HydrophobicContact CG2-CE1 4.36Å; V753-Y867 HydrophobicContact CG2-CE2 4.45Å; I755-Y867 VanDerWaalsContact CD1-CB 3.42Å; I755-Y867 HydrophobicContact CD1-CD2 4Å; I755-Y867 HydrophobicContact CD1-CG 3.81Å; F838-Y867 HydrophobicContact CD1-CD2 4.17Å; F838-Y867 HydrophobicContact CD1-CE2 4.1Å; F838-Y867 HydrophobicContact CE1-CD2 4.09Å; F838-Y867 HydrophobicContact CE1-CE2 4.04Å; V839-Y867 HydrophobicContact CG2-CD2 3.8Å; V839-Y867 HydrophobicContact CG2-CE2 3.73Å; S842-Y867 PolarHBondContact OG-OH 3Å; V855-Y867 HydrophobicContact CG1-CD1 3.77Å; V855-Y867 HydrophobicContact CG1-CE1 4.38Å; V855-Y867 HydrophobicContact CG1-CG 4.31Å; V855-Y867 HydrophobicContact CG2-CD1 3.89Å; V855-Y867 HydrophobicContact CG2-CE1 3.79Å; R863-Y867 PolarHBondContact O-N 3.49Å; G865-Y867 PolarHBondContact O-N 3.46Å; Y867-C869 VanDerWaalsContact C-N 3.31Å; Y867-C869 PolarHBondContact O-N 2.82Å; Y867-I870 PolarHBondContact O-N 2.85Å; Y867-E871 PolarHBondContact O-N 2.77Å
868	I	98	Very high	95.7	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-62.7	-39.7	179.9	-72.5	170.5	0	0	0	111.1	V717 Y726 A728 V855 T864 G865 S872 F888 I892	V717-I868 HydrophobicContact CB-CD1 4.42Å; V717-I868 HydrophobicContact CG1-CD1 4.42Å; V717-I868 HydrophobicContact CG1-CG2 4.02Å; Y726-I868 HydrophobicContact CD1-CD1 4.45Å; Y726-I868 HydrophobicContact CD1-CG1 3.92Å; Y726-I868 HydrophobicContact CD2-CB 4.42Å; Y726-I868 HydrophobicContact CD2-CD1 4.44Å; Y726-I868 HydrophobicContact CD2-CG1 4.04Å; Y726-I868 HydrophobicContact CD2-CG2 3.73Å; Y726-I868 HydrophobicContact CE1-CG1 4.3Å; Y726-I868 HydrophobicContact CE2-CG1 4.42Å; Y726-I868 HydrophobicContact CE2-CG2 3.89Å; Y726-I868 HydrophobicContact CG-CD1 4.02Å; Y726-I868 HydrophobicContact CG-CG1 3.78Å; Y726-I868 HydrophobicContact CG-CG2 4.34Å; A728-I868 HydrophobicContact CB-CD1 4.12Å; V855-I868 HydrophobicContact CB-CD1 4.44Å; V855-I868 HydrophobicContact CG2-CD1 4.49Å; V855-I868 HydrophobicContact CG2-CG1 4.28Å; T864-I868 HydrophobicContact CG2-CD1 4.02Å; T864-I868 WeakPolarHBondContact O-CD1 3.41Å; T864-I868 VanDerWaalsContact O-CG1 3.26Å; T864-I868 WeakPolarHBondContact O-CG1 3.49Å; T864-I868 PolarHBondContact O-N 2.67Å; T864-I868 VanDerWaalsContact O-N 3.15Å; G865-I868 PolarHBondContact O-N 3.43Å; G865-I868 VanDerWaalsContact O-N 3.13Å; I868-S872 WeakPolarHBondContact O-CB 3.43Å; I868-S872 PolarHBondContact O-N 3.47Å; I868-S872 PolarHBondContact O-OG 2.82Å; I868-F888 HydrophobicContact CG2-CE1 4.33Å; I868-F888 HydrophobicContact CG2-CZ 4.48Å; I868-I892 HydrophobicContact CG2-CD1 4.15Å
869	C	97.7	Very high	95.6	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.3	-56.3	172.6	-73.3	0	0	0	0	111.6	G865 T866 Y867 E871 S872 L873 I909	G865-C869 WeakPolarHBondContact O-CB 3.46Å; G865-C869 PolarHBondContact O-N 3.18Å; G865-C869 PolarHBondContact O-SG 3.27Å; G865-C869 VanDerWaalsContact O-SG 3.39Å; T866-C869 PolarHBondContact O-N 3.03Å; Y867-C869 VanDerWaalsContact C-N 3.31Å; Y867-C869 PolarHBondContact O-N 2.82Å; C869-E871 PolarHBondContact O-N 3.35Å; C869-S872 PolarHBondContact O-N 3.24Å; C869-L873 HydrophobicContact CB-CD1 4.1Å; C869-L873 VanDerWaalsContact O-CB 3.23Å; C869-L873 WeakPolarHBondContact O-CB 3.37Å; C869-L873 WeakPolarHBondContact O-CD1 3.17Å; C869-L873 WeakPolarHBondContact O-CG 3.22Å; C869-L873 PolarHBondContact O-N 2.78Å; C869-I909 HydrophobicContact CB-CD1 3.62Å; C869-I909 HydrophobicContact CB-CG1 4.07Å; C869-I909 HydrophobicContact CB-CG2 4.14Å
870	I	97.8	Very high	95.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-56.9	-49.2	-176.3	-69.2	167.6	0	0	0	111.1	V835 L836 V839 T866 Y867 I874 F908 I909 A912	V835-I870 HydrophobicContact CG1-CD1 4Å; L836-I870 HydrophobicContact CD2-CG2 4.18Å; V839-I870 HydrophobicContact CG2-CG2 4.21Å; T866-I870 HydrophobicContact CG2-CD1 4.03Å; T866-I870 VanDerWaalsContact O-CG1 3.31Å; T866-I870 WeakPolarHBondContact O-CG1 3.43Å; T866-I870 PolarHBondContact O-N 2.82Å; Y867-I870 PolarHBondContact O-N 2.85Å; I870-I874 HydrophobicContact CG2-CD1 3.71Å; I870-I874 WeakPolarHBondContact O-CB 3.44Å; I870-I874 WeakPolarHBondContact O-CD1 3.3Å; I870-I874 WeakPolarHBondContact O-CG1 3.36Å; I870-I874 PolarHBondContact O-N 2.97Å; I870-F908 HydrophobicContact CD1-CD1 4.28Å; I870-F908 HydrophobicContact CD1-CE1 4.11Å; I870-I909 HydrophobicContact CG1-CB 4.49Å; I870-I909 HydrophobicContact CG1-CG1 4.22Å; I870-I909 HydrophobicContact CG1-CG2 4.35Å; I870-A912 HydrophobicContact CD1-CB 3.71Å; I870-A912 HydrophobicContact CG1-CB 3.99Å; I870-A912 HydrophobicContact CG2-CB 4.34Å
871	E	96.3	Very high	95.3	Very high	6 Å²	6	24.2 Å²	24.2	3%	0.028	12%	0.116	C	C	.	.	H	α-helix	trans	-61.3	-50	179.8	-158.8	-78.8	-176.9	0	0	111.6	Y726 V839 V843 Y867 C869 L873 I874 R875	Y726-E871 WeakPolarHBondContact OH-CB 3.47Å; Y726-E871 WeakPolarHBondContact OH-CG 3.37Å; Y726-E871 PolarHBondContact OH-OE2 3.23Å; V839-E871 HydrophobicContact CG1-CB 4Å; V839-E871 HydrophobicContact CG1-CG 3.82Å; V843-E871 HydrophobicContact CG1-CG 3.8Å; V843-E871 WeakPolarHBondContact CG1-OE1 3.35Å; Y867-E871 PolarHBondContact O-N 2.77Å; C869-E871 PolarHBondContact O-N 3.35Å; E871-L873 PolarHBondContact O-N 3.25Å; E871-I874 PolarHBondContact O-N 2.95Å; E871-R875 PolarHBondContact O-N 3.44Å; E871-R875 IonicContact OE1-CZ 3.93Å; E871-R875 IonicContact OE1-NE 3.15Å; E871-R875 PolarHBondContact OE1-NE 3.1Å; E871-R875 IonicContact OE1-NH2 3.44Å; E871-R875 PolarHBondContact OE1-NH2 2.78Å; E871-R875 WeakPolarHBondContact OE2-CD 3.1Å; E871-R875 IonicContact OE2-CZ 3.9Å; E871-R875 IonicContact OE2-NE 3.5Å; E871-R875 PolarHBondContact OE2-NE 3.42Å
872	S	95.8	Very high	95.2	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.9	-37.6	-175.9	-58.4	0	0	0	0	112.5	G719 Y720 Y726 I868 C869 R875 Q876 F888	G719-S872 WeakPolarHBondContact CA-OG 3.34Å; Y720-S872 WeakPolarHBondContact CB-O 3.47Å; Y726-S872 WeakPolarHBondContact CE2-OG 3.26Å; I868-S872 WeakPolarHBondContact O-CB 3.43Å; I868-S872 PolarHBondContact O-N 3.47Å; I868-S872 PolarHBondContact O-OG 2.82Å; C869-S872 PolarHBondContact O-N 3.24Å; S872-R875 WeakPolarHBondContact O-CB 3.37Å; S872-R875 PolarHBondContact O-N 3.09Å; S872-Q876 PolarHBondContact O-N 2.88Å; S872-F888 WeakPolarHBondContact OG-CZ 3.32Å
873	L	96.3	Very high	95.1	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-76.2	-31.4	179.4	-66.5	163.9	0	0	0	111.1	C869 E871 R875 Q876 L877 V883 V885 F888 I909 L913	C869-L873 HydrophobicContact CB-CD1 4.1Å; C869-L873 VanDerWaalsContact O-CB 3.23Å; C869-L873 WeakPolarHBondContact O-CB 3.37Å; C869-L873 WeakPolarHBondContact O-CD1 3.17Å; C869-L873 WeakPolarHBondContact O-CG 3.22Å; C869-L873 PolarHBondContact O-N 2.78Å; E871-L873 PolarHBondContact O-N 3.25Å; L873-R875 VanDerWaalsContact C-N 3.31Å; L873-R875 PolarHBondContact O-N 2.79Å; L873-Q876 WeakPolarHBondContact O-CB 3.31Å; L873-Q876 PolarHBondContact O-N 3.47Å; L873-L877 WeakPolarHBondContact O-CG 3.39Å; L873-L877 PolarHBondContact O-N 3.09Å; L873-V883 HydrophobicContact CB-CG1 3.99Å; L873-V883 HydrophobicContact CD2-CB 4.22Å; L873-V883 HydrophobicContact CD2-CG1 3.93Å; L873-V885 HydrophobicContact CD1-CB 4.21Å; L873-V885 HydrophobicContact CD1-CG1 3.83Å; L873-V885 HydrophobicContact CD1-CG2 4.13Å; L873-F888 HydrophobicContact CD1-CD1 4.44Å; L873-F888 HydrophobicContact CD2-CB 3.93Å; L873-F888 HydrophobicContact CD2-CG 4.21Å; L873-F888 HydrophobicContact CG-CD1 4.3Å; L873-F888 HydrophobicContact CG-CG 4.47Å; L873-I909 HydrophobicContact CD1-CG2 3.91Å; L873-L913 HydrophobicContact CB-CD1 3.77Å; L873-L913 HydrophobicContact CB-CD2 3.76Å; L873-L913 HydrophobicContact CB-CG 4.4Å; L873-L913 HydrophobicContact CD1-CD1 3.88Å; L873-L913 HydrophobicContact CG-CD1 4.41Å
874	I	95.2	Very high	94.9	Very high	13 Å²	13	25.4 Å²	25.4	7%	0.067	13%	0.125	C	C	.	.	H	α-helix	trans	-62.5	-37.7	166.1	-72.7	169.8	0	0	0	111.1	L836 I870 E871 K878 L913 Y916	L836-I874 HydrophobicContact CD2-CD1 3.62Å; I870-I874 HydrophobicContact CG2-CD1 3.71Å; I870-I874 WeakPolarHBondContact O-CB 3.44Å; I870-I874 WeakPolarHBondContact O-CD1 3.3Å; I870-I874 WeakPolarHBondContact O-CG1 3.36Å; I870-I874 PolarHBondContact O-N 2.97Å; E871-I874 PolarHBondContact O-N 2.95Å; I874-K878 HydrophobicContact CG2-CD 4.18Å; I874-K878 WeakPolarHBondContact O-CB 3.34Å; I874-K878 VanDerWaalsContact O-CG 3.28Å; I874-K878 WeakPolarHBondContact O-CG 3.42Å; I874-K878 PolarHBondContact O-N 2.83Å; I874-K878 VanDerWaalsContact O-N 3.1Å; I874-L913 HydrophobicContact CG1-CD2 3.88Å; I874-Y916 HydrophobicContact CD1-CD2 4.17Å; I874-Y916 HydrophobicContact CD1-CG 4.09Å; I874-Y916 HydrophobicContact CG1-CD1 3.94Å; I874-Y916 HydrophobicContact CG1-CD2 4.33Å; I874-Y916 HydrophobicContact CG1-CE1 4.4Å; I874-Y916 HydrophobicContact CG1-CG 3.93Å; I874-Y916 HydrophobicContact CG2-CD1 4.42Å; I874-Y916 HydrophobicContact CG2-CD2 4.4Å; I874-Y916 HydrophobicContact CG2-CE1 4.07Å; I874-Y916 HydrophobicContact CG2-CE2 4.03Å
875	R	93	Very high	94.7	Very high	63 Å²	63	25.5 Å²	25.5	24%	0.238	13%	0.126	C	C	.	.	H	α-helix	trans	-65.6	-38.5	171.4	-68.1	-178	-179.6	-76.1	-17.9	112.5	Y720 E871 S872 L873 K878 V879	Y720-R875 HydrophobicContact CD1-CB 3.78Å; Y720-R875 HydrophobicContact CG-CB 4.28Å; E871-R875 PolarHBondContact O-N 3.44Å; E871-R875 IonicContact OE1-CZ 3.93Å; E871-R875 IonicContact OE1-NE 3.15Å; E871-R875 PolarHBondContact OE1-NE 3.1Å; E871-R875 IonicContact OE1-NH2 3.44Å; E871-R875 PolarHBondContact OE1-NH2 2.78Å; E871-R875 WeakPolarHBondContact OE2-CD 3.1Å; E871-R875 IonicContact OE2-CZ 3.9Å; E871-R875 IonicContact OE2-NE 3.5Å; E871-R875 PolarHBondContact OE2-NE 3.42Å; S872-R875 WeakPolarHBondContact O-CB 3.37Å; S872-R875 PolarHBondContact O-N 3.09Å; L873-R875 VanDerWaalsContact C-N 3.31Å; L873-R875 PolarHBondContact O-N 2.79Å; R875-K878 PolarHBondContact O-N 3.19Å; R875-V879 PolarHBondContact O-N 3.44Å
876	Q	93.3	Very high	94.5	Very high	3 Å²	3	26.5 Å²	26.5	1%	0.014	13%	0.13	C	C	.	.	H	α-helix	trans	-63.1	-50.3	175	-168.4	178.9	10.9	0	0	110.8	Y720 S872 L873 K878 V879 E880 A882 V883	Y720-Q876 HydrophobicContact CD1-CB 4.49Å; Y720-Q876 HydrophobicContact CD2-CB 3.65Å; Y720-Q876 HydrophobicContact CD2-CG 3.79Å; Y720-Q876 HydrophobicContact CE2-CB 3.86Å; Y720-Q876 HydrophobicContact CE2-CG 3.56Å; Y720-Q876 HydrophobicContact CG-CB 3.99Å; S872-Q876 PolarHBondContact O-N 2.88Å; L873-Q876 WeakPolarHBondContact O-CB 3.31Å; L873-Q876 PolarHBondContact O-N 3.47Å; Q876-K878 VanDerWaalsContact C-N 3.27Å; Q876-K878 PolarHBondContact O-N 2.92Å; Q876-V879 PolarHBondContact O-N 3.01Å; Q876-E880 HydrophobicContact CG-CB 4.34Å; Q876-E880 WeakPolarHBondContact CG-OE2 3.48Å; Q876-E880 PolarHBondContact NE2-OE2 2.86Å; Q876-E880 PolarHBondContact O-N 2.92Å; Q876-A882 WeakPolarHBondContact CG-O 3.48Å; Q876-V883 HydrophobicContact CB-CG1 4.21Å; Q876-V883 HydrophobicContact CG-CG1 4.46Å
877	L	93.2	Very high	94.1	Very high	6 Å²	6	26.5 Å²	26.5	3%	0.031	13%	0.13	C	C	.	.	H	α-helix	trans	-53.4	-43	175.7	-72.7	175.2	0	0	0	112.7	L873 V879 Q881 V883 L913 Y916 I917	L873-L877 WeakPolarHBondContact O-CG 3.39Å; L873-L877 PolarHBondContact O-N 3.09Å; L877-V879 PolarHBondContact O-N 3.28Å; L877-Q881 WeakPolarHBondContact O-CA 3.47Å; L877-Q881 PolarHBondContact O-N 3.38Å; L877-Q881 VanDerWaalsContact O-N 3.12Å; L877-Q881 PolarHBondContact O-NE2 3.11Å; L877-V883 HydrophobicContact CD1-CG1 4.47Å; L877-V883 HydrophobicContact CD2-CB 4.44Å; L877-V883 HydrophobicContact CD2-CG1 3.69Å; L877-V883 HydrophobicContact CD2-CG2 4.1Å; L877-V883 HydrophobicContact CG-CG1 3.62Å; L877-L913 HydrophobicContact CD1-CD2 3.76Å; L877-Y916 HydrophobicContact CB-CE1 4.4Å; L877-Y916 HydrophobicContact CD1-CD1 3.72Å; L877-Y916 HydrophobicContact CD1-CE1 4.05Å; L877-I917 HydrophobicContact CD1-CD1 3.84Å; L877-I917 HydrophobicContact CD1-CG1 3.62Å; L877-I917 HydrophobicContact CD2-CD1 3.89Å; L877-I917 HydrophobicContact CD2-CG1 4.15Å
878	K	91.7	Very high	93.9	Very high	115 Å²	115	26.8 Å²	26.8	50%	0.5	13%	0.131	S	C	.	.	H	α-helix	trans	-64.1	-17.7	179.4	-77	174.4	-178.9	179.6	0	114.3	I874 R875 Q876 Y916	I874-K878 HydrophobicContact CG2-CD 4.18Å; I874-K878 WeakPolarHBondContact O-CB 3.34Å; I874-K878 VanDerWaalsContact O-CG 3.28Å; I874-K878 WeakPolarHBondContact O-CG 3.42Å; I874-K878 PolarHBondContact O-N 2.83Å; I874-K878 VanDerWaalsContact O-N 3.1Å; R875-K878 PolarHBondContact O-N 3.19Å; Q876-K878 VanDerWaalsContact C-N 3.27Å; Q876-K878 PolarHBondContact O-N 2.92Å; K878-Y916 WeakPolarHBondContact CE-OH 3.43Å
879	V	91.7	Very high	93.8	Very high	103 Å²	103	26.8 Å²	26.8	62%	0.624	13%	0.131	S	C	*	.	H	α-helix	trans	-114.4	-44.2	-177.6	178.1	0	0	0	0	112.4	Y720 R875 Q876 L877	Y720-V879 HydrophobicContact CE1-CB 4Å; Y720-V879 HydrophobicContact CE1-CG1 4.45Å; Y720-V879 HydrophobicContact CE1-CG2 4Å; Y720-V879 WeakPolarHBondContact OH-CG1 3.32Å; R875-V879 PolarHBondContact O-N 3.44Å; Q876-V879 PolarHBondContact O-N 3.01Å; L877-V879 PolarHBondContact O-N 3.28Å
880	E	92	Very high	93.5	Very high	86 Å²	86	28.5 Å²	28.5	40%	0.402	14%	0.139	S	C	.	.	H	α-helix	trans	-102.6	-12.7	-172	-74.1	169.3	-157.7	0	0	114	Y720 H721 Q876 A882	Y720-E880 WeakPolarHBondContact CE2-OE1 3.32Å; Y720-E880 VanDerWaalsContact CZ-OE1 3.28Å; Y720-E880 VanDerWaalsContact OH-CD 3.25Å; Y720-E880 WeakPolarHBondContact OH-CG 3.45Å; Y720-E880 PolarHBondContact OH-OE1 3.46Å; H721-E880 IonicContact CE1-OE1 3.51Å; Q876-E880 HydrophobicContact CG-CB 4.34Å; Q876-E880 WeakPolarHBondContact CG-OE2 3.48Å; Q876-E880 PolarHBondContact NE2-OE2 2.86Å; Q876-E880 PolarHBondContact O-N 2.92Å; E880-A882 PolarHBondContact O-N 2.89Å; E880-A882 VanDerWaalsContact O-N 3.1Å
881	Q	93.2	Very high	93.2	Very high	113 Å²	113	29.8 Å²	29.8	53%	0.528	15%	0.145	S	C	.	.	S	Bend	trans	53.4	24.4	-170.7	-68.5	-65.7	-37.9	0	0	113.9	S640 L877	S640-Q881 PolarHBondContact N-O 2.89Å; S640-Q881 PolarHBondContact OG-O 3.12Å; S640-Q881 PolarHBondContact OG-OE1 3.34Å; L877-Q881 WeakPolarHBondContact O-CA 3.47Å; L877-Q881 PolarHBondContact O-N 3.38Å; L877-Q881 VanDerWaalsContact O-N 3.12Å; L877-Q881 PolarHBondContact O-NE2 3.11Å
882	A	93.4	Very high	93.1	Very high	16 Å²	16	29.5 Å²	29.5	13%	0.132	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	164.8	177.5	0	0	0	0	0	110	A637 I638 Q876 E880	A637-A882 HydrophobicContact CB-CB 4.1Å; I638-A882 CarbonylContact O-C 3.51Å; I638-A882 WeakPolarHBondContact O-CA 3.4Å; I638-A882 WeakPolarHBondContact O-CB 3.22Å; Q876-A882 WeakPolarHBondContact CG-O 3.48Å; E880-A882 PolarHBondContact O-N 2.89Å; E880-A882 VanDerWaalsContact O-N 3.1Å
883	V	93.3	Very high	93	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	150.4	176.4	-85.2	0	0	0	0	112.3	A637 I638 F643 L873 Q876 L877 V885	A637-V883 CarbonylContact C-O 3.59Å; A637-V883 VanDerWaalsContact CA-O 3.3Å; A637-V883 WeakPolarHBondContact CA-O 3.18Å; I638-V883 PolarHBondContact N-O 3.13Å; I638-V883 PolarHBondContact O-N 3.22Å; F643-V883 HydrophobicContact CD2-CG2 3.65Å; F643-V883 HydrophobicContact CE2-CG2 3.46Å; F643-V883 VanDerWaalsContact CE2-CG2 3.46Å; F643-V883 HydrophobicContact CZ-CG2 4.35Å; L873-V883 HydrophobicContact CB-CG1 3.99Å; L873-V883 HydrophobicContact CD2-CB 4.22Å; L873-V883 HydrophobicContact CD2-CG1 3.93Å; Q876-V883 HydrophobicContact CB-CG1 4.21Å; Q876-V883 HydrophobicContact CG-CG1 4.46Å; L877-V883 HydrophobicContact CD1-CG1 4.47Å; L877-V883 HydrophobicContact CD2-CB 4.44Å; L877-V883 HydrophobicContact CD2-CG1 3.69Å; L877-V883 HydrophobicContact CD2-CG2 4.1Å; L877-V883 HydrophobicContact CG-CG1 3.62Å; V883-V885 HydrophobicContact CB-CG2 4.41Å; V883-V885 HydrophobicContact CG2-CG2 4.35Å
884	S	91.3	Very high	92.8	Very high	9 Å²	9	31.3 Å²	31.3	6%	0.063	15%	0.152	C	C	.	.			trans	-123.7	82.2	166.6	-173.5	0	0	0	0	108.7	Y635 R886 G887 F888	Y635-S884 PolarHBondContact O-OG 2.95Å; S884-R886 PolarHBondContact O-N 2.92Å; S884-G887 PolarHBondContact O-N 3.12Å; S884-F888 WeakPolarHBondContact O-CB 3.27Å; S884-F888 PolarHBondContact O-N 2.94Å
885	V	93.9	Very high	92.8	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.018	15%	0.151	C	C	.	.	H	α-helix	trans	-59.4	-49.7	-174.2	-172.1	0	0	0	0	110.5	F643 L873 V883 F888 L889 Y906 I909 H910 L913	F643-V885 HydrophobicContact CE2-CG2 4.21Å; F643-V885 HydrophobicContact CZ-CG2 4.42Å; L873-V885 HydrophobicContact CD1-CB 4.21Å; L873-V885 HydrophobicContact CD1-CG1 3.83Å; L873-V885 HydrophobicContact CD1-CG2 4.13Å; V883-V885 HydrophobicContact CB-CG2 4.41Å; V883-V885 HydrophobicContact CG2-CG2 4.35Å; V885-F888 PolarHBondContact O-N 2.7Å; V885-L889 WeakPolarHBondContact O-CB 2.81Å; V885-L889 PolarHBondContact O-N 2.85Å; V885-Y906 HydrophobicContact CG1-CE2 3.92Å; V885-I909 HydrophobicContact CG1-CG2 3.73Å; V885-H910 WeakPolarHBondContact CB-NE2 3.41Å; V885-H910 WeakPolarHBondContact CG2-NE2 3.38Å; V885-L913 HydrophobicContact CG2-CD1 3.89Å
886	R	92	Very high	93	Very high	21 Å²	21	28.2 Å²	28.2	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-53.5	-55.1	174.2	-159.4	-173.1	160.4	89.2	-4.8	112.9	Y635 E661 S664 L665 S884 F888 L889 E890 Y906	Y635-R886 PolarHBondContact OH-NE 3.46Å; Y635-R886 PolarHBondContact OH-NH2 2.86Å; Y635-R886 VanDerWaalsContact OH-NH2 3.13Å; E661-R886 HydrophobicContact CG-CG 4.44Å; E661-R886 PolarHBondContact O-NH1 3.33Å; E661-R886 VanDerWaalsContact OE1-CB 3.28Å; E661-R886 WeakPolarHBondContact OE1-CB 3.28Å; E661-R886 WeakPolarHBondContact OE1-CG 3.35Å; S664-R886 PolarHBondContact OG-NH2 2.99Å; L665-R886 HydrophobicContact CD1-CG 3.83Å; S884-R886 PolarHBondContact O-N 2.92Å; R886-F888 VanDerWaalsContact C-N 3.31Å; R886-F888 PolarHBondContact O-N 3.2Å; R886-L889 PolarHBondContact O-N 3.26Å; R886-E890 WeakPolarHBondContact O-CB 3.48Å; R886-E890 PolarHBondContact O-N 3.03Å; R886-Y906 WeakPolarHBondContact CA-OH 3.22Å; R886-Y906 WeakPolarHBondContact CB-OH 3.15Å; R886-Y906 PolarHBondContact N-OH 3.13Å
887	G	90.1	Very high	93	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-67.8	-29.7	-175.6	0	0	0	0	0	113.3	N633 S884 H891	N633-G887 VanDerWaalsContact ND2-CA 3.34Å; N633-G887 WeakPolarHBondContact ND2-CA 3.17Å; N633-G887 PolarHBondContact ND2-O 3.43Å; S884-G887 PolarHBondContact O-N 3.12Å; G887-H891 WeakPolarHBondContact O-CB 3.17Å; G887-H891 PolarHBondContact O-N 2.95Å
888	F	93.5	Very high	93	Very high	5 Å²	5	33.3 Å²	33.3	2%	0.022	16%	0.162	C	C	.	.	H	α-helix	trans	-71.5	-44.9	171	-174	-100	0	0	0	111.6	L630 I868 S872 L873 S884 V885 R886 H891 I892	L630-F888 HydrophobicContact CD2-CB 4.16Å; I868-F888 HydrophobicContact CG2-CE1 4.33Å; I868-F888 HydrophobicContact CG2-CZ 4.48Å; S872-F888 WeakPolarHBondContact OG-CZ 3.32Å; L873-F888 HydrophobicContact CD1-CD1 4.44Å; L873-F888 HydrophobicContact CD2-CB 3.93Å; L873-F888 HydrophobicContact CD2-CG 4.21Å; L873-F888 HydrophobicContact CG-CD1 4.3Å; L873-F888 HydrophobicContact CG-CG 4.47Å; S884-F888 WeakPolarHBondContact O-CB 3.27Å; S884-F888 PolarHBondContact O-N 2.94Å; V885-F888 PolarHBondContact O-N 2.7Å; R886-F888 VanDerWaalsContact C-N 3.31Å; R886-F888 PolarHBondContact O-N 3.2Å; F888-H891 PolarHBondContact O-N 2.83Å; F888-I892 HydrophobicContact CD1-CD1 4.29Å; F888-I892 HydrophobicContact CD1-CG2 4.44Å; F888-I892 HydrophobicContact CE1-CD1 3.91Å; F888-I892 HydrophobicContact CE1-CG2 3.86Å; F888-I892 HydrophobicContact CE2-CG2 4.16Å; F888-I892 HydrophobicContact CZ-CG2 3.68Å; F888-I892 PolarHBondContact O-N 2.89Å
889	L	94.5	Very high	93.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.2	-42.7	179.7	-179.4	55	0	0	0	112.3	L665 V885 R886 H891 I892 R893 L899 V900 Y906	L665-L889 HydrophobicContact CD1-CB 4.14Å; L665-L889 HydrophobicContact CD1-CD2 3.91Å; L665-L889 HydrophobicContact CD1-CG 4.05Å; L665-L889 HydrophobicContact CD2-CD2 4.34Å; L665-L889 HydrophobicContact CD2-CG 4.32Å; V885-L889 WeakPolarHBondContact O-CB 2.81Å; V885-L889 PolarHBondContact O-N 2.85Å; R886-L889 PolarHBondContact O-N 3.26Å; L889-H891 PolarHBondContact O-N 3.29Å; L889-I892 HydrophobicContact CD1-CD1 4.04Å; L889-I892 HydrophobicContact CD1-CG1 4.1Å; L889-I892 WeakPolarHBondContact O-CG1 3.36Å; L889-I892 PolarHBondContact O-N 3.47Å; L889-R893 HydrophobicContact CD1-CG 4.09Å; L889-R893 WeakPolarHBondContact O-CB 3.48Å; L889-R893 VanDerWaalsContact O-CG 3.31Å; L889-R893 WeakPolarHBondContact O-CG 3.5Å; L889-R893 PolarHBondContact O-N 3.08Å; L889-L899 HydrophobicContact CD1-CB 4.5Å; L889-L899 WeakPolarHBondContact CD1-O 3.4Å; L889-V900 HydrophobicContact CD1-CB 3.88Å; L889-V900 HydrophobicContact CD1-CG2 3.56Å; L889-V900 HydrophobicContact CD2-CB 3.99Å; L889-V900 HydrophobicContact CD2-CG1 4.29Å; L889-V900 HydrophobicContact CD2-CG2 4.16Å; L889-Y906 HydrophobicContact CB-CE2 4.49Å; L889-Y906 HydrophobicContact CD2-CD2 3.49Å; L889-Y906 VanDerWaalsContact CD2-CD2 3.49Å; L889-Y906 HydrophobicContact CD2-CE2 3.5Å
890	E	91.6	Very high	93.4	Very high	37 Å²	37	22.9 Å²	22.9	17%	0.173	11%	0.109	C	C	.	.	H	α-helix	trans	-60.5	-42.8	175.4	-176.9	171.9	-150	0	0	112.1	Y635 V669 R886 R893 Q894	Y635-E890 WeakPolarHBondContact CE2-OE2 3.45Å; V669-E890 HydrophobicContact CG2-CB 4.49Å; V669-E890 HydrophobicContact CG2-CG 4.05Å; R886-E890 WeakPolarHBondContact O-CB 3.48Å; R886-E890 PolarHBondContact O-N 3.03Å; E890-R893 PolarHBondContact O-N 3.25Å; E890-Q894 PolarHBondContact O-N 2.58Å
891	H	91.1	Very high	93.4	Very high	26 Å²	26	21.1 Å²	21.1	12%	0.12	10%	0.1	C	C	.	.	H	α-helix	trans	-60.8	-52.6	174.8	172.8	74.7	0	0	0	112.1	F628 D718 G887 F888 L889 R893 Q894	F628-H891 AromaticContact CD1-CE1 3.97Å; F628-H891 AromaticContact CD1-CG 3.98Å; F628-H891 AromaticContact CD1-ND1 3.66Å; F628-H891 AromaticContact CD2-ND1 3.93Å; F628-H891 HydrophobicContact CE1-CB 4.31Å; F628-H891 AromaticContact CE1-ND1 3.89Å; F628-H891 AromaticContact CG-CE1 3.66Å; F628-H891 AromaticContact CG-ND1 3.68Å; D718-H891 IonicContact OD2-CE1 3.74Å; D718-H891 IonicContact OD2-NE2 3.84Å; D718-H891 PolarHBondContact OD2-NE2 3.28Å; D718-H891 VanDerWaalsContact OD2-NE2 3.15Å; G887-H891 WeakPolarHBondContact O-CB 3.17Å; G887-H891 PolarHBondContact O-N 2.95Å; F888-H891 PolarHBondContact O-N 2.83Å; L889-H891 PolarHBondContact O-N 3.29Å; H891-R893 VanDerWaalsContact C-N 3.29Å; H891-R893 PolarHBondContact O-N 2.98Å; H891-Q894 WeakPolarHBondContact O-CB 3.38Å; H891-Q894 PolarHBondContact O-N 2.81Å; H891-Q894 VanDerWaalsContact O-N 3.17Å
892	I	94.3	Very high	93.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-68	-28.5	-177.7	65.6	177.5	0	0	0	112.5	V717 I868 F888 L889 Q894 Q895 R896 L899	V717-I892 HydrophobicContact CG1-CB 3.68Å; V717-I892 HydrophobicContact CG1-CG2 3.62Å; I868-I892 HydrophobicContact CG2-CD1 4.15Å; F888-I892 HydrophobicContact CD1-CD1 4.29Å; F888-I892 HydrophobicContact CD1-CG2 4.44Å; F888-I892 HydrophobicContact CE1-CD1 3.91Å; F888-I892 HydrophobicContact CE1-CG2 3.86Å; F888-I892 HydrophobicContact CE2-CG2 4.16Å; F888-I892 HydrophobicContact CZ-CG2 3.68Å; F888-I892 PolarHBondContact O-N 2.89Å; L889-I892 HydrophobicContact CD1-CD1 4.04Å; L889-I892 HydrophobicContact CD1-CG1 4.1Å; L889-I892 WeakPolarHBondContact O-CG1 3.36Å; L889-I892 PolarHBondContact O-N 3.47Å; I892-Q894 PolarHBondContact O-N 3.47Å; I892-Q895 WeakPolarHBondContact O-CA 3.39Å; I892-Q895 WeakPolarHBondContact O-CB 3.45Å; I892-Q895 PolarHBondContact O-N 3.44Å; I892-R896 PolarHBondContact O-N 3.06Å; I892-R896 VanDerWaalsContact O-N 3.12Å; I892-L899 HydrophobicContact CB-CD1 3.77Å; I892-L899 HydrophobicContact CD1-CB 4.38Å; I892-L899 HydrophobicContact CD1-CD1 3.89Å; I892-L899 HydrophobicContact CG1-CB 4.44Å; I892-L899 HydrophobicContact CG1-CD1 3.71Å; I892-L899 WeakPolarHBondContact O-CD1 3.48Å
893	R	94.4	Very high	93.5	Very high	3 Å²	3	17.4 Å²	17.4	1%	0.011	8%	0.082	C	C	.	.	H	α-helix	trans	-66.4	-20.6	174.8	-82.5	173	163.2	-134.8	-5.4	114	E666 V669 L889 E890 H891 Q895 R896 L899 V900	E666-R893 VanDerWaalsContact CD-NH1 3.3Å; E666-R893 IonicContact OE1-CZ 2.69Å; E666-R893 IonicContact OE1-NH1 3.3Å; E666-R893 PolarHBondContact OE1-NH1 2.83Å; E666-R893 IonicContact OE1-NH2 3.74Å; E666-R893 PolarHBondContact OE1-NH2 3.2Å; E666-R893 IonicContact OE2-NH1 2.85Å; V669-R893 HydrophobicContact CG1-CB 4.01Å; V669-R893 HydrophobicContact CG2-CB 4.3Å; L889-R893 HydrophobicContact CD1-CG 4.09Å; L889-R893 WeakPolarHBondContact O-CB 3.48Å; L889-R893 VanDerWaalsContact O-CG 3.31Å; L889-R893 WeakPolarHBondContact O-CG 3.5Å; L889-R893 PolarHBondContact O-N 3.08Å; E890-R893 PolarHBondContact O-N 3.25Å; H891-R893 VanDerWaalsContact C-N 3.29Å; H891-R893 PolarHBondContact O-N 2.98Å; R893-Q895 PolarHBondContact O-N 3.07Å; R893-R896 WeakPolarHBondContact CA-O 3.32Å; R893-L899 HydrophobicContact CG-CB 4.15Å; R893-L899 PolarHBondContact NE-O 2.92Å; R893-L899 PolarHBondContact NH2-O 3.3Å; R893-V900 PolarHBondContact NH2-O 3.1Å
894	Q	92.6	Very high	93.5	Very high	36 Å²	36	21.6 Å²	21.6	17%	0.168	10%	0.102	C	C	.	.	H	α-helix	trans	-66	-28.8	166.1	-56.3	-51.8	-43.9	0	0	111.8	Q670 Y695 H697 E890 H891 I892	Q670-Q894 PolarHBondContact O-OE1 3.33Å; Y695-Q894 VanDerWaalsContact CD2-O 3.26Å; Y695-Q894 WeakPolarHBondContact CD2-O 3.16Å; Y695-Q894 WeakPolarHBondContact CE2-O 3.48Å; H697-Q894 PolarHBondContact CE1-O 2.94Å; H697-Q894 PolarHBondContact NE2-O 3.43Å; E890-Q894 PolarHBondContact O-N 2.58Å; H891-Q894 WeakPolarHBondContact O-CB 3.38Å; H891-Q894 PolarHBondContact O-N 2.81Å; H891-Q894 VanDerWaalsContact O-N 3.17Å; I892-Q894 PolarHBondContact O-N 3.47Å
895	Q	94.8	Very high	93.7	Very high	10 Å²	10	21.2 Å²	21.2	5%	0.047	10%	0.099	C	C	.	.	H	α-helix	trans	-92.9	-31.6	-171.3	-51.7	-172.3	-39.8	0	0	112.6	S698 N715 D718 I892 R893	S698-Q895 WeakPolarHBondContact CB-O 3.21Å; S698-Q895 PolarHBondContact OG-O 3.41Å; N715-Q895 WeakPolarHBondContact CB-O 3.38Å; D718-Q895 VanDerWaalsContact CG-NE2 3.26Å; D718-Q895 PolarHBondContact OD2-NE2 2.72Å; I892-Q895 WeakPolarHBondContact O-CA 3.39Å; I892-Q895 WeakPolarHBondContact O-CB 3.45Å; I892-Q895 PolarHBondContact O-N 3.44Å; R893-Q895 PolarHBondContact O-N 3.07Å
896	R	96	Very high	93.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.098	C	C	.	.	S	Bend	trans	-144.4	133.7	165.9	-173	170.2	172.6	83	-2.9	110.4	N713 N715 V717 A728 A859 G860 V861 I892 R893 L899	N713-R896 PolarHBondContact OD1-NH1 3.43Å; N713-R896 PolarHBondContact OD1-NH2 2.91Å; N715-R896 HydrophobicContact CB-CB 3.99Å; N715-R896 HydrophobicContact CB-CG 4.31Å; N715-R896 WeakPolarHBondContact OD1-CG 3.41Å; N715-R896 PolarHBondContact OD1-NH1 3.39Å; V717-R896 HydrophobicContact CG2-CB 4.39Å; A728-R896 WeakPolarHBondContact O-CD 3.43Å; A859-R896 PolarHBondContact O-NH2 2.85Å; G860-R896 PolarHBondContact O-NE 2.82Å; V861-R896 HydrophobicContact CG1-CG 4.21Å; I892-R896 PolarHBondContact O-N 3.06Å; I892-R896 VanDerWaalsContact O-N 3.12Å; R893-R896 WeakPolarHBondContact CA-O 3.32Å; R896-L899 HydrophobicContact CB-CD1 4.09Å; R896-L899 HydrophobicContact CB-CD2 4.35Å; R896-L899 HydrophobicContact CB-CG 4.07Å
897	M	93.8	Very high	94	Very high	27 Å²	27	20.3 Å²	20.3	13%	0.133	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	142.9	179.4	59	175.3	61.4	0	0	112.6	T675 L693 Y695 V861 L899	T675-M897 HydrophobicContact CG2-CE 3.86Å; L693-M897 HydrophobicContact CB-CE 4.09Å; L693-M897 PolarHBondContact N-SD 2.68Å; L693-M897 WeakPolarHBondContact O-CE 3.3Å; Y695-M897 HydrophobicContact CD1-CE 4.04Å; Y695-M897 HydrophobicContact CE1-CB 3.98Å; Y695-M897 HydrophobicContact CE1-CE 3.62Å; Y695-M897 HydrophobicContact CE2-CB 4.25Å; V861-M897 WeakPolarHBondContact CG1-O 3.48Å; M897-L899 PolarHBondContact O-N 3.07Å
898	K	93.6	Very high	94.2	Very high	89 Å²	89	20.7 Å²	20.7	39%	0.387	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	28.1	168.7	-60.5	-70.5	-174.1	173.3	0	115.6	E666 V900 Q901	E666-K898 IonicContact OE1-NZ 2.71Å; E666-K898 IonicContact OE2-NZ 2.75Å; E666-K898 PolarHBondContact OE2-NZ 3.45Å; K898-V900 PolarHBondContact O-N 2.85Å; K898-Q901 HydrophobicContact CB-CG 4.37Å; K898-Q901 WeakPolarHBondContact O-CG 3.4Å
899	L	96.3	Very high	94.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.096	C	C	.	.	S	Bend	trans	-55.2	132.9	165	-70.8	174.3	0	0	0	109.4	V717 A728 V861 L889 I892 R893 R896 M897	V717-L899 HydrophobicContact CG1-CD1 4.16Å; V717-L899 HydrophobicContact CG2-CD1 4.11Å; A728-L899 HydrophobicContact CB-CD2 4.25Å; V861-L899 WeakPolarHBondContact O-CA 3.46Å; L889-L899 HydrophobicContact CD1-CB 4.5Å; L889-L899 WeakPolarHBondContact CD1-O 3.4Å; I892-L899 HydrophobicContact CB-CD1 3.77Å; I892-L899 HydrophobicContact CD1-CB 4.38Å; I892-L899 HydrophobicContact CD1-CD1 3.89Å; I892-L899 HydrophobicContact CG1-CB 4.44Å; I892-L899 HydrophobicContact CG1-CD1 3.71Å; I892-L899 WeakPolarHBondContact O-CD1 3.48Å; R893-L899 HydrophobicContact CG-CB 4.15Å; R893-L899 PolarHBondContact NE-O 2.92Å; R893-L899 PolarHBondContact NH2-O 3.3Å; R896-L899 HydrophobicContact CB-CD1 4.09Å; R896-L899 HydrophobicContact CB-CD2 4.35Å; R896-L899 HydrophobicContact CB-CG 4.07Å; M897-L899 PolarHBondContact O-N 3.07Å
900	V	95.9	Very high	94.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	58.4	101.3	-165.7	-173.6	0	0	0	0	110.3	F662 V861 L889 R893 K898 Q905 I909	F662-V900 HydrophobicContact CE2-CG1 4.31Å; V861-V900 PolarHBondContact O-N 2.84Å; V861-V900 VanDerWaalsContact O-N 3.08Å; L889-V900 HydrophobicContact CD1-CB 3.88Å; L889-V900 HydrophobicContact CD1-CG2 3.56Å; L889-V900 HydrophobicContact CD2-CB 3.99Å; L889-V900 HydrophobicContact CD2-CG1 4.29Å; L889-V900 HydrophobicContact CD2-CG2 4.16Å; R893-V900 PolarHBondContact NH2-O 3.1Å; K898-V900 PolarHBondContact O-N 2.85Å; V900-Q905 HydrophobicContact CG1-CB 3.76Å; V900-I909 HydrophobicContact CG1-CD1 4.2Å; V900-I909 HydrophobicContact CG2-CD1 3.75Å
901	Q	92.3	Very high	94.7	Very high	48 Å²	48	20 Å²	20	22%	0.224	10%	0.095	C	C	.	.			trans	-94.7	-16.6	-165.1	-80.3	-175.1	-75.2	0	0	115.1	V861 G862 K898	V861-Q901 HydrophobicContact CB-CG 4.27Å; V861-Q901 VanDerWaalsContact CG2-CD 3.43Å; V861-Q901 HydrophobicContact CG2-CG 4.11Å; G862-Q901 VanDerWaalsContact N-OE1 3.09Å; K898-Q901 HydrophobicContact CB-CG 4.37Å; K898-Q901 WeakPolarHBondContact O-CG 3.4Å
902	T	93.8	Very high	94.9	Very high	23 Å²	23	18.8 Å²	18.8	14%	0.141	9%	0.09	C	C	.	.	S	Bend	trans	-134.4	156	-178.4	68.2	0	0	0	0	110.6	F826 Q904 Q905 Y906	F826-T902 HydrophobicContact CB-CG2 4.46Å; F826-T902 HydrophobicContact CD1-CG2 4.24Å; T902-Q904 VanDerWaalsContact C-N 3.29Å; T902-Q904 PolarHBondContact O-N 3.09Å; T902-Q905 WeakPolarHBondContact O-CB 3.26Å; T902-Q905 PolarHBondContact O-N 3Å; T902-Q905 VanDerWaalsContact O-N 3.14Å; T902-Q905 WeakPolarHBondContact OG1-CG 3.44Å; T902-Q905 PolarHBondContact OG1-N 3.34Å; T902-Y906 PolarHBondContact O-N 3.47Å
903	E	94	Very high	95	Very high	29 Å²	29	18.8 Å²	18.8	14%	0.136	9%	0.09	C	C	.	.	H	α-helix	trans	-56	-42.2	172.2	177.8	-146.5	-174.8	0	0	111.5	F658 Q659 F662 Q905 Y906 A907	F658-E903 HydrophobicContact CB-CG 4.4Å; Q659-E903 WeakPolarHBondContact CA-OE1 3.27Å; Q659-E903 WeakPolarHBondContact CB-OE1 3.3Å; Q659-E903 PolarHBondContact N-OE1 3.12Å; Q659-E903 VanDerWaalsContact OE1-CD 3.3Å; F662-E903 HydrophobicContact CB-CB 4.47Å; F662-E903 HydrophobicContact CB-CG 4.44Å; F662-E903 HydrophobicContact CD1-CB 3.93Å; F662-E903 HydrophobicContact CE1-CB 4.45Å; F662-E903 HydrophobicContact CG-CB 4.24Å; E903-Q905 PolarHBondContact O-N 2.88Å; E903-Y906 CarbonylContact O-C 3.6Å; E903-Y906 VanDerWaalsContact O-CA 3.27Å; E903-Y906 WeakPolarHBondContact O-CA 3.48Å; E903-Y906 WeakPolarHBondContact O-CB 3.45Å; E903-Y906 PolarHBondContact O-N 2.97Å; E903-A907 PolarHBondContact O-N 3.24Å
904	Q	93.5	Very high	95	Very high	88 Å²	88	20.5 Å²	20.5	41%	0.411	10%	0.096	S	C	.	.	H	α-helix	trans	-61.3	-36.3	177.9	-61.4	68.6	32.4	0	0	110.9	V828 T902 Y906 F908	V828-Q904 HydrophobicContact CG1-CB 4.23Å; V828-Q904 WeakPolarHBondContact CG1-O 3.37Å; T902-Q904 VanDerWaalsContact C-N 3.29Å; T902-Q904 PolarHBondContact O-N 3.09Å; Q904-Y906 PolarHBondContact O-N 3.38Å; Q904-F908 VanDerWaalsContact O-CB 3.25Å; Q904-F908 WeakPolarHBondContact O-CB 3.45Å; Q904-F908 PolarHBondContact O-N 3.02Å
905	Q	95.6	Very high	95	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-71	-16.5	172.4	-71.3	169.6	10.5	0	0	113.1	V828 V900 T902 E903 I909	V828-Q905 HydrophobicContact CG1-CG 3.9Å; V900-Q905 HydrophobicContact CG1-CB 3.76Å; T902-Q905 WeakPolarHBondContact O-CB 3.26Å; T902-Q905 PolarHBondContact O-N 3Å; T902-Q905 VanDerWaalsContact O-N 3.14Å; T902-Q905 WeakPolarHBondContact OG1-CG 3.44Å; T902-Q905 PolarHBondContact OG1-N 3.34Å; E903-Q905 PolarHBondContact O-N 2.88Å; Q905-I909 VanDerWaalsContact O-CD1 3.27Å; Q905-I909 WeakPolarHBondContact O-CD1 3.49Å; Q905-I909 VanDerWaalsContact O-CG1 3.28Å; Q905-I909 WeakPolarHBondContact O-CG1 3.36Å
906	Y	96.4	Very high	95	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-85.1	-46.5	172.4	-166.1	-115.8	0	0	0	111.6	F658 E661 F662 V885 R886 L889 T902 E903 Q904 F908 I909 H910	F658-Y906 HydrophobicContact CD1-CD1 4.24Å; E661-Y906 HydrophobicContact CB-CE1 4.32Å; E661-Y906 HydrophobicContact CG-CE1 4.16Å; E661-Y906 PolarHBondContact OE1-OH 3.48Å; F662-Y906 HydrophobicContact CB-CD1 4.33Å; F662-Y906 HydrophobicContact CD2-CD1 4.3Å; F662-Y906 HydrophobicContact CD2-CD2 4.34Å; F662-Y906 AromaticContact CD2-CG 3.87Å; F662-Y906 HydrophobicContact CD2-CG 3.87Å; V885-Y906 HydrophobicContact CG1-CE2 3.92Å; R886-Y906 WeakPolarHBondContact CA-OH 3.22Å; R886-Y906 WeakPolarHBondContact CB-OH 3.15Å; R886-Y906 PolarHBondContact N-OH 3.13Å; L889-Y906 HydrophobicContact CB-CE2 4.49Å; L889-Y906 HydrophobicContact CD2-CD2 3.49Å; L889-Y906 VanDerWaalsContact CD2-CD2 3.49Å; L889-Y906 HydrophobicContact CD2-CE2 3.5Å; T902-Y906 PolarHBondContact O-N 3.47Å; E903-Y906 CarbonylContact O-C 3.6Å; E903-Y906 VanDerWaalsContact O-CA 3.27Å; E903-Y906 WeakPolarHBondContact O-CA 3.48Å; E903-Y906 WeakPolarHBondContact O-CB 3.45Å; E903-Y906 PolarHBondContact O-N 2.97Å; Q904-Y906 PolarHBondContact O-N 3.38Å; Y906-F908 VanDerWaalsContact C-N 3.35Å; Y906-F908 PolarHBondContact O-N 2.89Å; Y906-I909 PolarHBondContact O-N 3.25Å; Y906-H910 AromaticContact CE1-CE1 3.62Å; Y906-H910 AromaticContact CZ-CE1 3.65Å; Y906-H910 PolarHBondContact O-ND1 3.42Å
907	A	95.2	Very high	94.9	Very high	4 Å²	4	22 Å²	22	3%	0.033	10%	0.103	C	C	.	.	H	α-helix	trans	-55.8	-48.1	170.6	0	0	0	0	0	111.1	F658 E903 I909 H910 D911	F658-A907 HydrophobicContact CB-CB 4.44Å; F658-A907 HydrophobicContact CD2-CB 3.58Å; F658-A907 HydrophobicContact CE2-CB 3.9Å; F658-A907 HydrophobicContact CG-CB 3.95Å; E903-A907 PolarHBondContact O-N 3.24Å; A907-I909 VanDerWaalsContact C-N 3.26Å; A907-I909 PolarHBondContact O-N 2.8Å; A907-I909 VanDerWaalsContact O-N 3.13Å; A907-H910 CarbonylContact O-C 3.55Å; A907-H910 VanDerWaalsContact O-CA 3.29Å; A907-H910 WeakPolarHBondContact O-CA 3.33Å; A907-H910 VanDerWaalsContact O-CB 3.24Å; A907-H910 WeakPolarHBondContact O-CB 3.46Å; A907-H910 PolarHBondContact O-N 2.92Å; A907-D911 PolarHBondContact O-N 2.88Å
908	F	95.8	Very high	94.6	Very high	8 Å²	8	22.7 Å²	22.7	4%	0.035	11%	0.107	C	C	.	.	H	α-helix	trans	-62.2	-25.4	179.8	-174.9	-94.9	0	0	0	114.6	W823 V828 P829 P832 V835 T866 I870 Q904 Y906 H910 A912	W823-F908 HydrophobicContact CH2-CD1 4.49Å; W823-F908 HydrophobicContact CH2-CE1 4.16Å; W823-F908 HydrophobicContact CZ2-CE1 4.49Å; V828-F908 HydrophobicContact CB-CB 4.1Å; V828-F908 HydrophobicContact CB-CD2 3.97Å; V828-F908 HydrophobicContact CB-CG 4Å; V828-F908 HydrophobicContact CG1-CB 3.77Å; V828-F908 HydrophobicContact CG1-CG 4.1Å; V828-F908 HydrophobicContact CG2-CD2 4.35Å; P829-F908 HydrophobicContact CB-CE2 4.36Å; P829-F908 HydrophobicContact CB-CZ 4.16Å; P829-F908 HydrophobicContact CG-CE1 4.48Å; P829-F908 HydrophobicContact CG-CZ 4.03Å; P829-F908 VanDerWaalsContact O-CE2 3.25Å; P829-F908 WeakPolarHBondContact O-CE2 3.16Å; P832-F908 HydrophobicContact CB-CE2 4.43Å; P832-F908 HydrophobicContact CB-CZ 4.42Å; V835-F908 HydrophobicContact CB-CE1 4.26Å; V835-F908 HydrophobicContact CB-CZ 4.19Å; V835-F908 HydrophobicContact CG1-CE1 4.28Å; V835-F908 HydrophobicContact CG2-CE1 3.92Å; V835-F908 HydrophobicContact CG2-CZ 3.71Å; T866-F908 HydrophobicContact CG2-CD1 4.05Å; I870-F908 HydrophobicContact CD1-CD1 4.28Å; I870-F908 HydrophobicContact CD1-CE1 4.11Å; Q904-F908 VanDerWaalsContact O-CB 3.25Å; Q904-F908 WeakPolarHBondContact O-CB 3.45Å; Q904-F908 PolarHBondContact O-N 3.02Å; Y906-F908 VanDerWaalsContact C-N 3.35Å; Y906-F908 PolarHBondContact O-N 2.89Å; F908-H910 VanDerWaalsContact C-N 3.31Å; F908-A912 WeakPolarHBondContact O-CB 3.17Å; F908-A912 PolarHBondContact O-N 3.03Å
909	I	97.7	Very high	94.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-66.2	-39.6	170.4	-66.9	159.9	0	0	0	109.7	T866 C869 I870 L873 V885 V900 Q905 Y906 A907 L913	T866-I909 HydrophobicContact CG2-CD1 4.36Å; T866-I909 HydrophobicContact CG2-CG1 3.78Å; C869-I909 HydrophobicContact CB-CD1 3.62Å; C869-I909 HydrophobicContact CB-CG1 4.07Å; C869-I909 HydrophobicContact CB-CG2 4.14Å; I870-I909 HydrophobicContact CG1-CB 4.49Å; I870-I909 HydrophobicContact CG1-CG1 4.22Å; I870-I909 HydrophobicContact CG1-CG2 4.35Å; L873-I909 HydrophobicContact CD1-CG2 3.91Å; V885-I909 HydrophobicContact CG1-CG2 3.73Å; V900-I909 HydrophobicContact CG1-CD1 4.2Å; V900-I909 HydrophobicContact CG2-CD1 3.75Å; Q905-I909 VanDerWaalsContact O-CD1 3.27Å; Q905-I909 WeakPolarHBondContact O-CD1 3.49Å; Q905-I909 VanDerWaalsContact O-CG1 3.28Å; Q905-I909 WeakPolarHBondContact O-CG1 3.36Å; Y906-I909 PolarHBondContact O-N 3.25Å; A907-I909 VanDerWaalsContact C-N 3.26Å; A907-I909 PolarHBondContact O-N 2.8Å; A907-I909 VanDerWaalsContact O-N 3.13Å; I909-L913 HydrophobicContact CG2-CD1 3.85Å; I909-L913 WeakPolarHBondContact O-CB 3.28Å; I909-L913 WeakPolarHBondContact O-CD1 3.47Å; I909-L913 WeakPolarHBondContact O-CG 3.26Å; I909-L913 PolarHBondContact O-N 3.46Å
910	H	96.8	Very high	93.5	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.009	11%	0.112	C	C	.	.	H	α-helix	trans	-70.2	-40.6	175.9	-64.4	86	0	0	0	111.9	F643 H646 V647 F658 V885 Y906 A907 F908 A912 L913 R914	F643-H910 WeakPolarHBondContact CE1-O 3.34Å; F643-H910 HydrophobicContact CZ-CB 4.29Å; F643-H910 AromaticContact CZ-CD2 3.67Å; H646-H910 AromaticContact NE2-CD2 3.86Å; V647-H910 HydrophobicContact CG1-CB 4.28Å; V647-H910 HydrophobicContact CG2-CB 3.76Å; F658-H910 HydrophobicContact CE1-CB 3.88Å; F658-H910 AromaticContact CE1-CD2 3.95Å; F658-H910 AromaticContact CE1-CE1 3.86Å; F658-H910 AromaticContact CE1-CG 3.5Å; F658-H910 VanDerWaalsContact CE1-CG 3.5Å; F658-H910 AromaticContact CE1-ND1 3.44Å; F658-H910 WeakPolarHBondContact CE1-ND1 3.38Å; F658-H910 HydrophobicContact CZ-CB 3.71Å; F658-H910 AromaticContact CZ-CG 3.88Å; V885-H910 WeakPolarHBondContact CB-NE2 3.41Å; V885-H910 WeakPolarHBondContact CG2-NE2 3.38Å; Y906-H910 AromaticContact CE1-CE1 3.62Å; Y906-H910 AromaticContact CZ-CE1 3.65Å; Y906-H910 PolarHBondContact O-ND1 3.42Å; A907-H910 CarbonylContact O-C 3.55Å; A907-H910 VanDerWaalsContact O-CA 3.29Å; A907-H910 WeakPolarHBondContact O-CA 3.33Å; A907-H910 VanDerWaalsContact O-CB 3.24Å; A907-H910 WeakPolarHBondContact O-CB 3.46Å; A907-H910 PolarHBondContact O-N 2.92Å; F908-H910 VanDerWaalsContact C-N 3.31Å; H910-A912 PolarHBondContact O-N 2.82Å; H910-L913 PolarHBondContact O-N 3.36Å; H910-R914 VanDerWaalsContact O-CB 3.26Å; H910-R914 WeakPolarHBondContact O-CB 3.29Å; H910-R914 PolarHBondContact O-N 3.24Å
911	D	94.5	Very high	92.9	Very high	27 Å²	27	30.9 Å²	30.9	14%	0.144	14%	0.144	C	C	.	.	H	α-helix	trans	-57.2	-48	170.7	-71.4	-69.8	0	0	0	112.1	H651 A907 L913 R914 E915	H651-D911 IonicContact CE1-OD1 2.65Å; H651-D911 IonicContact CE1-OD2 3.85Å; H651-D911 IonicContact NE2-OD1 2.87Å; H651-D911 PolarHBondContact NE2-OD1 2.99Å; H651-D911 IonicContact NE2-OD2 3.73Å; A907-D911 PolarHBondContact O-N 2.88Å; D911-L913 PolarHBondContact O-N 3.18Å; D911-R914 PolarHBondContact O-N 3.22Å; D911-R914 IonicContact OD1-CZ 2.96Å; D911-R914 IonicContact OD1-NH1 2.71Å; D911-R914 PolarHBondContact OD1-NH1 2.88Å; D911-R914 IonicContact OD1-NH2 3.01Å; D911-R914 PolarHBondContact OD1-NH2 2.75Å; D911-E915 WeakPolarHBondContact O-CB 3.26Å; D911-E915 PolarHBondContact O-N 2.79Å
912	A	95.6	Very high	92.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.9	-37.7	180	0	0	0	0	0	112.7	P832 L836 I870 F908 H910 Y916	P832-A912 HydrophobicContact CB-CB 3.99Å; L836-A912 HydrophobicContact CD2-CB 4.35Å; I870-A912 HydrophobicContact CD1-CB 3.71Å; I870-A912 HydrophobicContact CG1-CB 3.99Å; I870-A912 HydrophobicContact CG2-CB 4.34Å; F908-A912 WeakPolarHBondContact O-CB 3.17Å; F908-A912 PolarHBondContact O-N 3.03Å; H910-A912 PolarHBondContact O-N 2.82Å; A912-Y916 VanDerWaalsContact O-CB 3.28Å; A912-Y916 WeakPolarHBondContact O-CB 3.47Å; A912-Y916 PolarHBondContact O-N 3.24Å
913	L	96.8	Very high	92.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-72.4	-35.6	174.1	-68.3	168.5	0	0	0	112.1	F643 L873 I874 L877 V885 I909 H910 D911 Y916 I917	F643-L913 HydrophobicContact CE1-CB 3.58Å; F643-L913 HydrophobicContact CZ-CB 3.7Å; F643-L913 HydrophobicContact CZ-CD1 4.13Å; L873-L913 HydrophobicContact CB-CD1 3.77Å; L873-L913 HydrophobicContact CB-CD2 3.76Å; L873-L913 HydrophobicContact CB-CG 4.4Å; L873-L913 HydrophobicContact CD1-CD1 3.88Å; L873-L913 HydrophobicContact CG-CD1 4.41Å; I874-L913 HydrophobicContact CG1-CD2 3.88Å; L877-L913 HydrophobicContact CD1-CD2 3.76Å; V885-L913 HydrophobicContact CG2-CD1 3.89Å; I909-L913 HydrophobicContact CG2-CD1 3.85Å; I909-L913 WeakPolarHBondContact O-CB 3.28Å; I909-L913 WeakPolarHBondContact O-CD1 3.47Å; I909-L913 WeakPolarHBondContact O-CG 3.26Å; I909-L913 PolarHBondContact O-N 3.46Å; H910-L913 PolarHBondContact O-N 3.36Å; D911-L913 PolarHBondContact O-N 3.18Å; L913-Y916 PolarHBondContact O-N 2.87Å; L913-I917 WeakPolarHBondContact O-CB 3.44Å; L913-I917 WeakPolarHBondContact O-CD1 3.33Å; L913-I917 WeakPolarHBondContact O-CG1 3.43Å; L913-I917 PolarHBondContact O-N 3.35Å
914	R	94.6	Very high	92.3	Very high	39 Å²	39	29.2 Å²	29.2	15%	0.147	14%	0.139	C	C	.	.	H	α-helix	trans	-62.2	-49.9	174.3	-176.5	-173.1	70.2	-124.5	-10.3	110.4	F643 R644 H651 H910 D911 I917 L918	F643-R914 HydrophobicContact CD1-CB 4.38Å; F643-R914 HydrophobicContact CE1-CB 4.31Å; R644-R914 HydrophobicContact CG-CG 4.3Å; H651-R914 PolarHBondContact NE2-NH1 3.24Å; H910-R914 VanDerWaalsContact O-CB 3.26Å; H910-R914 WeakPolarHBondContact O-CB 3.29Å; H910-R914 PolarHBondContact O-N 3.24Å; D911-R914 PolarHBondContact O-N 3.22Å; D911-R914 IonicContact OD1-CZ 2.96Å; D911-R914 IonicContact OD1-NH1 2.71Å; D911-R914 PolarHBondContact OD1-NH1 2.88Å; D911-R914 IonicContact OD1-NH2 3.01Å; D911-R914 PolarHBondContact OD1-NH2 2.75Å; R914-I917 PolarHBondContact O-N 3.04Å; R914-L918 HydrophobicContact CG-CD1 4.06Å; R914-L918 WeakPolarHBondContact O-CB 3.27Å; R914-L918 VanDerWaalsContact O-CG 3.29Å; R914-L918 WeakPolarHBondContact O-CG 3.4Å; R914-L918 PolarHBondContact O-N 3Å
915	E	93	Very high	92.2	Very high	8 Å²	8	31 Å²	31	4%	0.037	14%	0.142	C	C	.	.	H	α-helix	trans	-60.9	-45.7	177.4	-169.5	69.8	-158.7	0	0	111.3	P832 L833 L836 D911 I917 L918 Y919 Y1165 K1169	P832-E915 HydrophobicContact CB-CB 4.19Å; P832-E915 HydrophobicContact CG-CB 3.74Å; P832-E915 HydrophobicContact CG-CG 3.91Å; L833-E915 HydrophobicContact CD2-CG 3.96Å; L833-E915 HydrophobicContact CG-CG 4.24Å; L836-E915 HydrophobicContact CD1-CB 3.98Å; L836-E915 HydrophobicContact CD1-CG 3.94Å; D911-E915 WeakPolarHBondContact O-CB 3.26Å; D911-E915 PolarHBondContact O-N 2.79Å; E915-I917 PolarHBondContact O-N 2.86Å; E915-L918 PolarHBondContact O-N 2.81Å; E915-Y919 PolarHBondContact O-N 3.47Å; E915-Y1165 WeakPolarHBondContact OE1-CE1 3.46Å; E915-Y1165 PolarHBondContact OE1-OH 2.87Å; E915-K1169 VanDerWaalsContact CD-NZ 3.29Å; E915-K1169 IonicContact OE1-NZ 3.29Å; E915-K1169 PolarHBondContact OE1-NZ 2.91Å; E915-K1169 IonicContact OE2-NZ 3.91Å; E915-K1169 PolarHBondContact OE2-NZ 2.98Å
916	Y	94.3	Very high	91.9	Very high	27 Å²	27	32 Å²	32	11%	0.106	15%	0.148	C	C	.	.	H	α-helix	trans	-64.6	-36.6	176.9	174.9	-91.9	0	0	0	113.3	I874 L877 K878 A912 L913 P920	I874-Y916 HydrophobicContact CD1-CD2 4.17Å; I874-Y916 HydrophobicContact CD1-CG 4.09Å; I874-Y916 HydrophobicContact CG1-CD1 3.94Å; I874-Y916 HydrophobicContact CG1-CD2 4.33Å; I874-Y916 HydrophobicContact CG1-CE1 4.4Å; I874-Y916 HydrophobicContact CG1-CG 3.93Å; I874-Y916 HydrophobicContact CG2-CD1 4.42Å; I874-Y916 HydrophobicContact CG2-CD2 4.4Å; I874-Y916 HydrophobicContact CG2-CE1 4.07Å; I874-Y916 HydrophobicContact CG2-CE2 4.03Å; L877-Y916 HydrophobicContact CB-CE1 4.4Å; L877-Y916 HydrophobicContact CD1-CD1 3.72Å; L877-Y916 HydrophobicContact CD1-CE1 4.05Å; K878-Y916 WeakPolarHBondContact CE-OH 3.43Å; A912-Y916 VanDerWaalsContact O-CB 3.28Å; A912-Y916 WeakPolarHBondContact O-CB 3.47Å; A912-Y916 PolarHBondContact O-N 3.24Å; L913-Y916 PolarHBondContact O-N 2.87Å; Y916-P920 HydrophobicContact CD2-CB 4.39Å; Y916-P920 HydrophobicContact CE1-CB 4.3Å; Y916-P920 HydrophobicContact CE2-CB 3.8Å; Y916-P920 VanDerWaalsContact O-CA 3.24Å; Y916-P920 WeakPolarHBondContact O-CA 3.18Å; Y916-P920 VanDerWaalsContact O-CB 3.31Å; Y916-P920 WeakPolarHBondContact O-CB 3.42Å; Y916-P920 WeakPolarHBondContact O-CD 3.27Å
917	I	93.5	Very high	91.5	Very high	42 Å²	42	36 Å²	36	22%	0.215	17%	0.169	C	C	.	.	H	α-helix	trans	-68.3	-40.5	174.7	-75	161.8	0	0	0	110.9	S640 F643 L877 L913 R914 E915	S640-I917 WeakPolarHBondContact O-CG2 3.39Å; F643-I917 HydrophobicContact CB-CD1 3.75Å; F643-I917 HydrophobicContact CD1-CD1 3.54Å; F643-I917 HydrophobicContact CD2-CD1 4.47Å; F643-I917 HydrophobicContact CE1-CD1 4.26Å; F643-I917 HydrophobicContact CG-CD1 3.66Å; L877-I917 HydrophobicContact CD1-CD1 3.84Å; L877-I917 HydrophobicContact CD1-CG1 3.62Å; L877-I917 HydrophobicContact CD2-CD1 3.89Å; L877-I917 HydrophobicContact CD2-CG1 4.15Å; L913-I917 WeakPolarHBondContact O-CB 3.44Å; L913-I917 WeakPolarHBondContact O-CD1 3.33Å; L913-I917 WeakPolarHBondContact O-CG1 3.43Å; L913-I917 PolarHBondContact O-N 3.35Å; R914-I917 PolarHBondContact O-N 3.04Å; E915-I917 PolarHBondContact O-N 2.86Å
918	L	87.4	Confident	91.4	Very high	42 Å²	42	39.9 Å²	39.9	22%	0.22	19%	0.19	C	C	.	.	H	α-helix	trans	-65.9	-43.2	179.3	-79.3	172.1	0	0	0	112	R914 E915 M953	R914-L918 HydrophobicContact CG-CD1 4.06Å; R914-L918 WeakPolarHBondContact O-CB 3.27Å; R914-L918 VanDerWaalsContact O-CG 3.29Å; R914-L918 WeakPolarHBondContact O-CG 3.4Å; R914-L918 PolarHBondContact O-N 3Å; E915-L918 PolarHBondContact O-N 2.81Å; L918-M953 HydrophobicContact CB-CE 3.74Å
919	Y	84.8	Confident	91.2	Very high	41 Å²	41	39.6 Å²	39.6	16%	0.161	19%	0.188	C	C	.	.			trans	-142.5	77	-177.7	-139.2	-87.9	0	0	0	113.4	E915 Y921 H922 Y932 Q950 M953 Y1165	E915-Y919 PolarHBondContact O-N 3.47Å; Y919-Y921 VanDerWaalsContact C-N 3.34Å; Y919-Y921 PolarHBondContact O-N 2.73Å; Y919-H922 HydrophobicContact CD1-CB 3.69Å; Y919-H922 HydrophobicContact CE1-CB 3.78Å; Y919-H922 PolarHBondContact O-CD2 2.74Å; Y919-Y932 PolarHBondContact OH-OH 2.93Å; Y919-Q950 PolarHBondContact OH-NE2 3.44Å; Y919-Q950 VanDerWaalsContact OH-NE2 3.1Å; Y919-M953 HydrophobicContact CD2-CE 3.55Å; Y919-M953 HydrophobicContact CD2-SD 4.31Å; Y919-M953 HydrophobicContact CG-CE 4.15Å; Y919-Y1165 AromaticContact CD1-CD1 3.96Å; Y919-Y1165 HydrophobicContact CD1-CD1 3.96Å; Y919-Y1165 HydrophobicContact CD1-CE1 4.35Å; Y919-Y1165 HydrophobicContact CD1-CG 4.17Å; Y919-Y1165 HydrophobicContact CE1-CG 4.49Å; Y919-Y1165 HydrophobicContact CG-CD1 4.16Å; Y919-Y1165 HydrophobicContact CG-CE1 4.11Å; Y919-Y1165 HydrophobicContact CG-CG 4.43Å
920	P	82.8	Confident	90.9	Very high	51 Å²	51	42 Å²	42	33%	0.331	21%	0.206	S	C	.	.	S	Bend	trans	-73.7	-17	-170.7	26.4	-34.9	0	0	0	115.4	Y916	Y916-P920 HydrophobicContact CD2-CB 4.39Å; Y916-P920 HydrophobicContact CE1-CB 4.3Å; Y916-P920 HydrophobicContact CE2-CB 3.8Å; Y916-P920 VanDerWaalsContact O-CA 3.24Å; Y916-P920 WeakPolarHBondContact O-CA 3.18Å; Y916-P920 VanDerWaalsContact O-CB 3.31Å; Y916-P920 WeakPolarHBondContact O-CB 3.42Å; Y916-P920 WeakPolarHBondContact O-CD 3.27Å
921	Y	81.5	Confident	90.7	Very high	169 Å²	169	46.1 Å²	46.1	66%	0.663	23%	0.228	S	C	*	.			trans	-141.4	93.4	-174.3	-61.2	-67.1	0	0	0	111.5	Y919	Y919-Y921 VanDerWaalsContact C-N 3.34Å; Y919-Y921 PolarHBondContact O-N 2.73Å
922	H	86.7	Confident	90.6	Very high	14 Å²	14	46.6 Å²	46.6	7%	0.065	23%	0.228	C	C	.	.			trans	-116.8	-7	176.8	46.3	117	0	0	0	114.1	K837 Y919 I924 D1163 Y1165	K837-H922 PolarHBondContact NZ-CE1 3.3Å; K837-H922 VanDerWaalsContact NZ-CE1 3.35Å; Y919-H922 HydrophobicContact CD1-CB 3.69Å; Y919-H922 HydrophobicContact CE1-CB 3.78Å; Y919-H922 PolarHBondContact O-CD2 2.74Å; H922-I924 PolarHBondContact O-N 2.92Å; H922-I924 VanDerWaalsContact O-N 3.08Å; H922-D1163 WeakPolarHBondContact CB-OD1 3.2Å; H922-D1163 IonicContact CE1-OD1 3.51Å; H922-D1163 IonicContact CE1-OD2 2.66Å; H922-D1163 PolarHBondContact CE1-OD2 3.44Å; H922-D1163 IonicContact CG-OD1 3.39Å; H922-D1163 IonicContact CG-OD2 3.92Å; H922-D1163 IonicContact ND1-OD1 2.7Å; H922-D1163 PolarHBondContact ND1-OD1 3.37Å; H922-D1163 IonicContact ND1-OD2 2.88Å; H922-D1163 PolarHBondContact ND1-OD2 3.05Å; H922-Y1165 HydrophobicContact CB-CD1 4.15Å; H922-Y1165 HydrophobicContact CB-CG 4.44Å
923	S	90.3	Very high	90.4	Very high	41 Å²	41	47 Å²	47	29%	0.287	23%	0.229	S	C	.	.			trans	-72.3	93.1	173.4	-50.9	0	0	0	0	111.1	K837 E840	K837-S923 PolarHBondContact NZ-OG 2.75Å; E840-S923 PolarHBondContact OE1-OG 3Å; E840-S923 PolarHBondContact OE2-OG 3.48Å
924	I	91.8	Very high	90.2	Very high	9 Å²	9	54 Å²	54	5%	0.046	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-84.8	139.1	-179.9	-49.8	149.6	0	0	0	109.6	H922 F929 Y932 L1161 L1162 V1164 Y1189	H922-I924 PolarHBondContact O-N 2.92Å; H922-I924 VanDerWaalsContact O-N 3.08Å; I924-F929 HydrophobicContact CB-CD2 4.43Å; I924-F929 HydrophobicContact CD1-CD2 4.33Å; I924-F929 HydrophobicContact CD1-CE2 4.21Å; I924-F929 HydrophobicContact CG2-CB 4.2Å; I924-F929 HydrophobicContact CG2-CD2 3.77Å; I924-F929 HydrophobicContact CG2-CG 4.4Å; I924-Y932 HydrophobicContact CD1-CD1 3.51Å; I924-Y932 HydrophobicContact CD1-CE1 3.31Å; I924-Y932 HydrophobicContact CD1-CG 4.33Å; I924-Y932 HydrophobicContact CG1-CD1 3.76Å; I924-Y932 HydrophobicContact CG1-CD2 4.38Å; I924-Y932 HydrophobicContact CG1-CE1 3.75Å; I924-Y932 HydrophobicContact CG1-CE2 4.39Å; I924-Y932 HydrophobicContact CG1-CG 4.07Å; I924-Y932 HydrophobicContact CG2-CD1 4.42Å; I924-Y932 HydrophobicContact CG2-CG 4.39Å; I924-L1161 WeakPolarHBondContact O-CA 3.17Å; I924-L1162 WeakPolarHBondContact CA-O 3.42Å; I924-L1162 HydrophobicContact CB-CB 4.42Å; I924-L1162 VanDerWaalsContact CB-O 3.32Å; I924-L1162 WeakPolarHBondContact CB-O 3.23Å; I924-L1162 PolarHBondContact N-O 2.57Å; I924-L1162 PolarHBondContact O-N 2.02Å; I924-V1164 HydrophobicContact CD1-CG2 4.39Å; I924-Y1189 HydrophobicContact CD1-CE1 4.31Å
925	R	91	Very high	90.1	Very high	125 Å²	125	56 Å²	56	47%	0.472	27%	0.267	S	S	.	.			trans	-91.4	143.8	167.5	-70.2	-179.4	-179.8	178.4	1.1	109.9	L927 N928 F929 L1161	R925-L927 VanDerWaalsContact C-N 3.29Å; R925-L927 PolarHBondContact O-N 3.13Å; R925-N928 HydrophobicContact CB-CB 4.46Å; R925-N928 CarbonylContact O-C 3.57Å; R925-N928 WeakPolarHBondContact O-CA 3.27Å; R925-N928 PolarHBondContact O-N 3.28Å; R925-F929 PolarHBondContact O-N 3.38Å; R925-L1161 HydrophobicContact CG-CD2 3.81Å
926	P	89.1	Confident	90	Very high	22 Å²	22	55.7 Å²	55.7	14%	0.143	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-49.7	-45	177.5	-31.1	36.8	0	0	0	114.1	N928 F929 F1156 L1160 L1196	P926-N928 PolarHBondContact O-N 3.43Å; P926-N928 VanDerWaalsContact O-N 3.16Å; P926-F929 VanDerWaalsContact O-CB 3.3Å; P926-F929 WeakPolarHBondContact O-CB 3.44Å; P926-F929 PolarHBondContact O-N 3.19Å; P926-F929 VanDerWaalsContact O-N 3.1Å; P926-F1156 HydrophobicContact CB-CD2 4.42Å; P926-F1156 HydrophobicContact CB-CE2 4.12Å; P926-F1156 HydrophobicContact CG-CD2 3.57Å; P926-F1156 HydrophobicContact CG-CE2 3.65Å; P926-L1160 VanDerWaalsContact CD-O 3.24Å; P926-L1160 WeakPolarHBondContact CD-O 3.34Å; P926-L1196 HydrophobicContact CB-CD1 4.31Å; P926-L1196 HydrophobicContact CB-CD2 4.03Å
927	L	88.9	Confident	89.9	Confident	85 Å²	85	59 Å²	59	45%	0.445	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-54.7	-30.6	174.5	-79.7	157.1	0	0	0	114.2	R925 L1220	R925-L927 VanDerWaalsContact C-N 3.29Å; R925-L927 PolarHBondContact O-N 3.13Å; L927-L1220 HydrophobicContact CD2-CD2 3.5Å; L927-L1220 VanDerWaalsContact CD2-CD2 3.5Å; L927-L1220 HydrophobicContact CD2-CG 4.03Å; L927-L1220 HydrophobicContact CG-CD2 4.35Å
928	N	91.8	Very high	89.8	Confident	86 Å²	86	61.7 Å²	61.7	46%	0.46	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-98.8	-3.8	-176.5	-64	61.2	0	0	0	112.5	R925 P926 S930 D931 Y932	R925-N928 HydrophobicContact CB-CB 4.46Å; R925-N928 CarbonylContact O-C 3.57Å; R925-N928 WeakPolarHBondContact O-CA 3.27Å; R925-N928 PolarHBondContact O-N 3.28Å; P926-N928 PolarHBondContact O-N 3.43Å; P926-N928 VanDerWaalsContact O-N 3.16Å; N928-S930 PolarHBondContact O-N 3.48Å; N928-D931 PolarHBondContact O-N 3.38Å; N928-Y932 WeakPolarHBondContact O-CB 3.34Å; N928-Y932 PolarHBondContact O-N 2.59Å
929	F	92	Very high	90	Very high	1 Å²	1	65.4 Å²	65.4	0%	0.004	31%	0.309	C	S	.	.	H	α-helix	trans	-64.5	-41.3	-167	-166.9	-90.2	0	0	0	112.7	I924 R925 P926 Y932 L933 L1162 V1164 Y1189 M1192 Q1193 L1196	I924-F929 HydrophobicContact CB-CD2 4.43Å; I924-F929 HydrophobicContact CD1-CD2 4.33Å; I924-F929 HydrophobicContact CD1-CE2 4.21Å; I924-F929 HydrophobicContact CG2-CB 4.2Å; I924-F929 HydrophobicContact CG2-CD2 3.77Å; I924-F929 HydrophobicContact CG2-CG 4.4Å; R925-F929 PolarHBondContact O-N 3.38Å; P926-F929 VanDerWaalsContact O-CB 3.3Å; P926-F929 WeakPolarHBondContact O-CB 3.44Å; P926-F929 PolarHBondContact O-N 3.19Å; P926-F929 VanDerWaalsContact O-N 3.1Å; F929-Y932 PolarHBondContact O-N 2.99Å; F929-L933 WeakPolarHBondContact O-CB 3.29Å; F929-L933 PolarHBondContact O-N 3.29Å; F929-L1162 HydrophobicContact CD2-CB 4.3Å; F929-L1162 HydrophobicContact CD2-CD1 3.6Å; F929-L1162 HydrophobicContact CE2-CB 4.22Å; F929-L1162 HydrophobicContact CE2-CD1 3.75Å; F929-L1162 HydrophobicContact CG-CD1 4.4Å; F929-V1164 HydrophobicContact CE2-CG2 4.26Å; F929-Y1189 HydrophobicContact CE1-CD1 4.24Å; F929-Y1189 HydrophobicContact CE2-CD1 4.25Å; F929-Y1189 HydrophobicContact CE2-CE1 4.47Å; F929-Y1189 AromaticContact CZ-CD1 3.64Å; F929-Y1189 HydrophobicContact CZ-CD1 3.64Å; F929-Y1189 HydrophobicContact CZ-CE1 4.29Å; F929-M1192 HydrophobicContact CE1-CB 4.07Å; F929-M1192 HydrophobicContact CE2-CB 4.4Å; F929-M1192 HydrophobicContact CZ-CB 3.63Å; F929-Q1193 HydrophobicContact CD1-CB 4.19Å; F929-Q1193 HydrophobicContact CD1-CG 4.45Å; F929-Q1193 HydrophobicContact CE1-CB 3.99Å; F929-L1196 HydrophobicContact CB-CD1 3.82Å; F929-L1196 HydrophobicContact CD1-CD1 4.04Å; F929-L1196 HydrophobicContact CD2-CD1 4.31Å; F929-L1196 HydrophobicContact CG-CD1 3.8Å
930	S	91.5	Very high	90	Very high	52 Å²	52	66.4 Å²	66.4	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-68.2	-33.2	177.3	-61.8	0	0	0	0	113.6	N928 R934 Q1193	N928-S930 PolarHBondContact O-N 3.48Å; S930-R934 PolarHBondContact O-N 3.25Å; S930-R934 VanDerWaalsContact O-N 3.09Å; S930-Q1193 PolarHBondContact OG-NE2 3.26Å
931	D	91.8	Very high	90.2	Very high	88 Å²	88	70.4 Å²	70.4	47%	0.471	35%	0.347	S	S	.	.	H	α-helix	trans	-75.5	-39.8	176.4	-68.5	-31.4	0	0	0	111.6	N928 R934 H935	N928-D931 PolarHBondContact O-N 3.38Å; D931-R934 WeakPolarHBondContact O-CB 3.24Å; D931-R934 PolarHBondContact O-N 3.31Å; D931-R934 IonicContact OD1-CZ 3.47Å; D931-R934 IonicContact OD1-NH1 3.05Å; D931-R934 PolarHBondContact OD1-NH1 2.87Å; D931-R934 IonicContact OD1-NH2 3.42Å; D931-R934 PolarHBondContact OD1-NH2 3.36Å; D931-H935 PolarHBondContact O-N 2.66Å
932	Y	92.5	Very high	90.3	Very high	37 Å²	37	67.2 Å²	67.2	15%	0.145	35%	0.345	C	S	.	.	H	α-helix	trans	-62.8	-43.4	173.3	178.5	-98.1	0	0	0	111.6	Y919 I924 N928 F929 R934 H935 L936 Q950 Y1189	Y919-Y932 PolarHBondContact OH-OH 2.93Å; I924-Y932 HydrophobicContact CD1-CD1 3.51Å; I924-Y932 HydrophobicContact CD1-CE1 3.31Å; I924-Y932 HydrophobicContact CD1-CG 4.33Å; I924-Y932 HydrophobicContact CG1-CD1 3.76Å; I924-Y932 HydrophobicContact CG1-CD2 4.38Å; I924-Y932 HydrophobicContact CG1-CE1 3.75Å; I924-Y932 HydrophobicContact CG1-CE2 4.39Å; I924-Y932 HydrophobicContact CG1-CG 4.07Å; I924-Y932 HydrophobicContact CG2-CD1 4.42Å; I924-Y932 HydrophobicContact CG2-CG 4.39Å; N928-Y932 WeakPolarHBondContact O-CB 3.34Å; N928-Y932 PolarHBondContact O-N 2.59Å; F929-Y932 PolarHBondContact O-N 2.99Å; Y932-R934 VanDerWaalsContact C-N 3.33Å; Y932-R934 PolarHBondContact O-N 3.34Å; Y932-H935 WeakPolarHBondContact O-CB 3.26Å; Y932-H935 PolarHBondContact O-N 2.9Å; Y932-H935 VanDerWaalsContact O-N 3.17Å; Y932-L936 HydrophobicContact CD1-CD1 4.1Å; Y932-L936 HydrophobicContact CD1-CG 4.41Å; Y932-L936 HydrophobicContact CE1-CD1 3.64Å; Y932-L936 HydrophobicContact CE1-CD2 4.44Å; Y932-L936 HydrophobicContact CE1-CG 4.09Å; Y932-L936 PolarHBondContact O-N 3.13Å; Y932-Q950 PolarHBondContact OH-NE2 2.78Å; Y932-Y1189 HydrophobicContact CD1-CE1 4.21Å; Y932-Y1189 AromaticContact CE1-CE1 3.82Å; Y932-Y1189 HydrophobicContact CE1-CE1 3.82Å
933	L	92.4	Very high	90.2	Very high	7 Å²	7	68.8 Å²	68.8	4%	0.037	37%	0.365	C	S	.	.	H	α-helix	trans	-63.3	-37.6	174.4	-177.2	53.6	0	0	0	111.9	F929 H935 L936 Y937 Y1189 Q1193	F929-L933 WeakPolarHBondContact O-CB 3.29Å; F929-L933 PolarHBondContact O-N 3.29Å; L933-H935 VanDerWaalsContact C-N 3.33Å; L933-H935 PolarHBondContact O-N 3.22Å; L933-L936 HydrophobicContact CD1-CB 4.49Å; L933-L936 HydrophobicContact CD1-CD1 4.34Å; L933-L936 WeakPolarHBondContact O-CB 3.43Å; L933-L936 PolarHBondContact O-N 2.83Å; L933-Y937 HydrophobicContact CD1-CD2 4.24Å; L933-Y937 HydrophobicContact CD1-CE2 3.66Å; L933-Y937 HydrophobicContact CD2-CE2 4.41Å; L933-Y937 HydrophobicContact CG-CD2 4.27Å; L933-Y937 HydrophobicContact CG-CE2 3.75Å; L933-Y937 WeakPolarHBondContact O-CD2 3.49Å; L933-Y937 PolarHBondContact O-N 3.31Å; L933-Y1189 HydrophobicContact CD1-CD1 4.16Å; L933-Y1189 HydrophobicContact CD1-CD2 4.47Å; L933-Y1189 HydrophobicContact CD1-CG 3.88Å; L933-Q1193 HydrophobicContact CD2-CB 4.4Å
934	R	92.6	Very high	90	Very high	147 Å²	147	68.6 Å²	68.6	56%	0.555	36%	0.362	S	S	*	.	H	α-helix	trans	-60.8	-42.4	172.5	-161.2	-173	-50.5	101.5	6.1	111.9	S930 D931 Y932 L936 Y937 E938	S930-R934 PolarHBondContact O-N 3.25Å; S930-R934 VanDerWaalsContact O-N 3.09Å; D931-R934 WeakPolarHBondContact O-CB 3.24Å; D931-R934 PolarHBondContact O-N 3.31Å; D931-R934 IonicContact OD1-CZ 3.47Å; D931-R934 IonicContact OD1-NH1 3.05Å; D931-R934 PolarHBondContact OD1-NH1 2.87Å; D931-R934 IonicContact OD1-NH2 3.42Å; D931-R934 PolarHBondContact OD1-NH2 3.36Å; Y932-R934 VanDerWaalsContact C-N 3.33Å; Y932-R934 PolarHBondContact O-N 3.34Å; R934-L936 VanDerWaalsContact C-N 3.3Å; R934-L936 PolarHBondContact O-N 2.88Å; R934-Y937 PolarHBondContact O-N 3.28Å; R934-Y937 VanDerWaalsContact O-N 3.14Å; R934-E938 PolarHBondContact O-N 3.48Å
935	H	91.5	Very high	90	Very high	82 Å²	82	69 Å²	69	38%	0.38	37%	0.366	S	S	.	.	H	α-helix	trans	-65.2	-30.4	175.4	176.4	59.7	0	0	0	113.1	D931 Y932 L933 Y937 E938 N946	D931-H935 PolarHBondContact O-N 2.66Å; Y932-H935 WeakPolarHBondContact O-CB 3.26Å; Y932-H935 PolarHBondContact O-N 2.9Å; Y932-H935 VanDerWaalsContact O-N 3.17Å; L933-H935 VanDerWaalsContact C-N 3.33Å; L933-H935 PolarHBondContact O-N 3.22Å; H935-Y937 VanDerWaalsContact C-N 3.3Å; H935-Y937 PolarHBondContact O-N 3.03Å; H935-E938 IonicContact CE1-OE2 3.14Å; H935-E938 IonicContact CG-OE2 3.3Å; H935-E938 IonicContact ND1-OE1 2.82Å; H935-E938 IonicContact ND1-OE2 2.73Å; H935-E938 PolarHBondContact ND1-OE2 2.94Å; H935-E938 WeakPolarHBondContact O-CB 3.39Å; H935-E938 PolarHBondContact O-N 2.83Å; H935-N946 PolarHBondContact CE1-ND2 3.2Å; H935-N946 WeakPolarHBondContact O-CB 3.37Å; H935-N946 PolarHBondContact O-ND2 3.18Å
936	L	91.9	Very high	90	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.005	35%	0.354	C	S	.	.	H	α-helix	trans	-66.4	-30.3	172	-69.6	179.6	0	0	0	113	Y932 L933 R934 E938 N946 L947 Y1189	Y932-L936 HydrophobicContact CD1-CD1 4.1Å; Y932-L936 HydrophobicContact CD1-CG 4.41Å; Y932-L936 HydrophobicContact CE1-CD1 3.64Å; Y932-L936 HydrophobicContact CE1-CD2 4.44Å; Y932-L936 HydrophobicContact CE1-CG 4.09Å; Y932-L936 PolarHBondContact O-N 3.13Å; L933-L936 HydrophobicContact CD1-CB 4.49Å; L933-L936 HydrophobicContact CD1-CD1 4.34Å; L933-L936 WeakPolarHBondContact O-CB 3.43Å; L933-L936 PolarHBondContact O-N 2.83Å; R934-L936 VanDerWaalsContact C-N 3.3Å; R934-L936 PolarHBondContact O-N 2.88Å; L936-E938 VanDerWaalsContact C-N 3.35Å; L936-N946 HydrophobicContact CD2-CB 4.28Å; L936-N946 CarbonylContact O-C 3.54Å; L936-N946 PolarHBondContact O-N 2.87Å; L936-L947 HydrophobicContact CB-CB 4.1Å; L936-L947 HydrophobicContact CB-CD1 4.48Å; L936-L947 HydrophobicContact CD1-CD1 4.19Å; L936-L947 WeakPolarHBondContact O-CB 3.41Å; L936-L947 PolarHBondContact O-N 2.88Å; L936-Y1189 HydrophobicContact CD1-CD1 4.21Å; L936-Y1189 HydrophobicContact CD1-CD2 4.06Å; L936-Y1189 HydrophobicContact CD1-CE1 3.66Å; L936-Y1189 HydrophobicContact CD1-CE2 3.47Å; L936-Y1189 VanDerWaalsContact CD1-CE2 3.47Å; L936-Y1189 HydrophobicContact CD1-CG 4.41Å; L936-Y1189 WeakPolarHBondContact CD1-OH 3.38Å
937	Y	93	Very high	90.2	Very high	96 Å²	96	64.1 Å²	64.1	38%	0.376	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-7.5	173.6	-68.9	-63.9	0	0	0	114.4	L933 R934 H935 L939 L947 E1186	L933-Y937 HydrophobicContact CD1-CD2 4.24Å; L933-Y937 HydrophobicContact CD1-CE2 3.66Å; L933-Y937 HydrophobicContact CD2-CE2 4.41Å; L933-Y937 HydrophobicContact CG-CD2 4.27Å; L933-Y937 HydrophobicContact CG-CE2 3.75Å; L933-Y937 WeakPolarHBondContact O-CD2 3.49Å; L933-Y937 PolarHBondContact O-N 3.31Å; R934-Y937 PolarHBondContact O-N 3.28Å; R934-Y937 VanDerWaalsContact O-N 3.14Å; H935-Y937 VanDerWaalsContact C-N 3.3Å; H935-Y937 PolarHBondContact O-N 3.03Å; Y937-L939 PolarHBondContact O-N 2.89Å; Y937-L947 HydrophobicContact CE1-CD2 4.15Å; Y937-E1186 HydrophobicContact CE1-CG 4.19Å; Y937-E1186 WeakPolarHBondContact CE1-OE1 3.43Å; Y937-E1186 VanDerWaalsContact OH-CG 3.28Å; Y937-E1186 WeakPolarHBondContact OH-CG 3.48Å; Y937-E1186 PolarHBondContact OH-OE1 2.68Å; Y937-E1186 VanDerWaalsContact OH-OE1 3.13Å
938	E	91.1	Very high	90.4	Very high	99 Å²	99	63.5 Å²	63.5	46%	0.463	34%	0.344	S	S	.	.			trans	-64	132.3	173.1	-70.2	168.7	-165.2	0	0	110.4	R934 H935 L936 S945 N946	R934-E938 PolarHBondContact O-N 3.48Å; H935-E938 IonicContact CE1-OE2 3.14Å; H935-E938 IonicContact CG-OE2 3.3Å; H935-E938 IonicContact ND1-OE1 2.82Å; H935-E938 IonicContact ND1-OE2 2.73Å; H935-E938 PolarHBondContact ND1-OE2 2.94Å; H935-E938 WeakPolarHBondContact O-CB 3.39Å; H935-E938 PolarHBondContact O-N 2.83Å; L936-E938 VanDerWaalsContact C-N 3.35Å; E938-S945 WeakPolarHBondContact O-CA 3.44Å; E938-N946 PolarHBondContact O-N 2.86Å; E938-N946 VanDerWaalsContact O-N 3.13Å
939	L	91.5	Very high	90.3	Very high	120 Å²	120	65.9 Å²	65.9	63%	0.628	35%	0.346	S	S	*	.	B	Isolated β-bridge	trans	-94.5	138.9	178.4	-52.7	-175.7	0	0	0	110.2	Y937 T944	Y937-L939 PolarHBondContact O-N 2.89Å; L939-T944 WeakPolarHBondContact CA-O 3.23Å
940	D	85.2	Confident	90.3	Very high	63 Å²	63	65.9 Å²	65.9	34%	0.337	35%	0.346	S	S	.	.			trans	-79.7	-178.7	169.5	78	5.9	0	0	0	112.6	T942 G943 T944	D940-T942 PolarHBondContact O-N 3.2Å; D940-T942 WeakPolarHBondContact OD1-CA 3.22Å; D940-T942 WeakPolarHBondContact OD1-CB 3.32Å; D940-T942 PolarHBondContact OD1-N 3.2Å; D940-T942 PolarHBondContact OD1-OG1 2.85Å; D940-T942 PolarHBondContact OD2-OG1 2.92Å; D940-G943 PolarHBondContact O-N 3.42Å; D940-G943 PolarHBondContact OD1-N 3.1Å; D940-T944 PolarHBondContact N-O 3.09Å; D940-T944 PolarHBondContact OD1-N 3.16Å; D940-T944 VanDerWaalsContact OD1-N 3.08Å
941	S	85.2	Confident	90.3	Very high	135 Å²	135	64.8 Å²	64.8	94%	0.944	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-4.4	179.4	55.1	0	0	0	0	115
942	T	84.9	Confident	90.2	Very high	102 Å²	102	65.3 Å²	65.3	63%	0.626	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-9.7	172.1	74.7	0	0	0	0	112.7	D940 T944	D940-T942 PolarHBondContact O-N 3.2Å; D940-T942 WeakPolarHBondContact OD1-CA 3.22Å; D940-T942 WeakPolarHBondContact OD1-CB 3.32Å; D940-T942 PolarHBondContact OD1-N 3.2Å; D940-T942 PolarHBondContact OD1-OG1 2.85Å; D940-T942 PolarHBondContact OD2-OG1 2.92Å; T942-T944 WeakPolarHBondContact OG1-CB 3.44Å; T942-T944 PolarHBondContact OG1-N 3.25Å; T942-T944 PolarHBondContact OG1-OG1 2.76Å
943	G	83.3	Confident	89.8	Confident	46 Å²	46	64.4 Å²	64.4	47%	0.474	33%	0.332	S	S	.	.	S	Bend	trans	85.8	8.6	-170.7	0	0	0	0	0	113.8	D940	D940-G943 PolarHBondContact O-N 3.42Å; D940-G943 PolarHBondContact OD1-N 3.1Å
944	T	87.5	Confident	89.7	Confident	37 Å²	37	64.1 Å²	64.1	23%	0.227	33%	0.33	C	S	.	.			trans	-83.8	130.1	177.7	-54.4	0	0	0	0	109.4	L939 D940 T942 M948	L939-T944 WeakPolarHBondContact CA-O 3.23Å; D940-T944 PolarHBondContact N-O 3.09Å; D940-T944 PolarHBondContact OD1-N 3.16Å; D940-T944 VanDerWaalsContact OD1-N 3.08Å; T942-T944 WeakPolarHBondContact OG1-CB 3.44Å; T942-T944 PolarHBondContact OG1-N 3.25Å; T942-T944 PolarHBondContact OG1-OG1 2.76Å; T944-M948 HydrophobicContact CG2-CB 4.25Å; T944-M948 HydrophobicContact CG2-CG 4.25Å; T944-M948 HydrophobicContact CG2-SD 4.32Å
945	S	92.3	Very high	89.3	Confident	19 Å²	19	60.4 Å²	60.4	13%	0.133	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-79.2	149.6	176.4	65.9	0	0	0	0	111.8	E938 L947 M948 R949	E938-S945 WeakPolarHBondContact O-CA 3.44Å; S945-L947 PolarHBondContact O-N 3.21Å; S945-M948 PolarHBondContact O-N 3.48Å; S945-M948 VanDerWaalsContact O-N 3.11Å; S945-M948 WeakPolarHBondContact OG-CB 3.42Å; S945-M948 PolarHBondContact OG-N 2.83Å; S945-R949 PolarHBondContact O-N 3.08Å
946	N	91	Very high	88.7	Confident	42 Å²	42	59.8 Å²	59.8	23%	0.225	32%	0.319	C	S	.	.	H	α-helix	trans	-58.3	-28.8	171.5	-75.1	-42	0	0	0	112.2	H935 L936 E938 Q950	H935-N946 PolarHBondContact CE1-ND2 3.2Å; H935-N946 WeakPolarHBondContact O-CB 3.37Å; H935-N946 PolarHBondContact O-ND2 3.18Å; L936-N946 HydrophobicContact CD2-CB 4.28Å; L936-N946 CarbonylContact O-C 3.54Å; L936-N946 PolarHBondContact O-N 2.87Å; E938-N946 PolarHBondContact O-N 2.86Å; E938-N946 VanDerWaalsContact O-N 3.13Å; N946-Q950 WeakPolarHBondContact O-CB 3.37Å; N946-Q950 PolarHBondContact O-N 3.17Å
947	L	92.6	Very high	87.5	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-63.6	-50.1	170.9	-175.9	65.9	0	0	0	112.6	L936 Y937 S945 R949 Q950 F951 Y1182 L1185 E1186 Y1189	L936-L947 HydrophobicContact CB-CB 4.1Å; L936-L947 HydrophobicContact CB-CD1 4.48Å; L936-L947 HydrophobicContact CD1-CD1 4.19Å; L936-L947 WeakPolarHBondContact O-CB 3.41Å; L936-L947 PolarHBondContact O-N 2.88Å; Y937-L947 HydrophobicContact CE1-CD2 4.15Å; S945-L947 PolarHBondContact O-N 3.21Å; L947-R949 VanDerWaalsContact C-N 3.32Å; L947-R949 PolarHBondContact O-N 2.94Å; L947-Q950 WeakPolarHBondContact O-CB 3.18Å; L947-Q950 PolarHBondContact O-N 3.01Å; L947-F951 PolarHBondContact O-N 3.28Å; L947-Y1182 HydrophobicContact CD2-CD2 4.36Å; L947-L1185 HydrophobicContact CD1-CD2 3.86Å; L947-L1185 HydrophobicContact CD1-CG 3.94Å; L947-E1186 HydrophobicContact CD2-CB 3.82Å; L947-E1186 HydrophobicContact CD2-CG 3.71Å; L947-Y1189 HydrophobicContact CD1-CD2 3.83Å; L947-Y1189 HydrophobicContact CD1-CE2 3.82Å
948	M	92.7	Very high	85.7	Confident	72 Å²	72	64.8 Å²	64.8	36%	0.355	34%	0.339	S	S	.	.	H	α-helix	trans	-62.6	-42.4	178.4	178.8	168.9	169.1	0	0	110.7	T944 S945 Q950 F951 E952	T944-M948 HydrophobicContact CG2-CB 4.25Å; T944-M948 HydrophobicContact CG2-CG 4.25Å; T944-M948 HydrophobicContact CG2-SD 4.32Å; S945-M948 PolarHBondContact O-N 3.48Å; S945-M948 VanDerWaalsContact O-N 3.11Å; S945-M948 WeakPolarHBondContact OG-CB 3.42Å; S945-M948 PolarHBondContact OG-N 2.83Å; M948-Q950 VanDerWaalsContact C-N 3.34Å; M948-Q950 PolarHBondContact O-N 2.98Å; M948-F951 WeakPolarHBondContact O-CB 3.4Å; M948-F951 PolarHBondContact O-N 2.89Å; M948-E952 WeakPolarHBondContact O-CG 3.48Å; M948-E952 PolarHBondContact O-N 2.83Å
949	R	89.3	Confident	83.5	Confident	135 Å²	135	62.4 Å²	62.4	51%	0.509	33%	0.333	S	S	.	.	H	α-helix	trans	-61.9	-38.7	173.5	-176.1	175.9	177	161.5	-0.5	112.8	S945 L947 M953	S945-R949 PolarHBondContact O-N 3.08Å; L947-R949 VanDerWaalsContact C-N 3.32Å; L947-R949 PolarHBondContact O-N 2.94Å; R949-M953 HydrophobicContact CG-SD 4.42Å; R949-M953 WeakPolarHBondContact O-CB 3.45Å; R949-M953 VanDerWaalsContact O-CG 3.28Å; R949-M953 WeakPolarHBondContact O-CG 3.43Å; R949-M953 PolarHBondContact O-N 2.73Å
950	Q	91.6	Very high	80.9	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-65.6	-40.4	173.7	-173.9	-178.1	80.4	0	0	111.4	Y919 Y932 N946 L947 M948 M953 C954 Y1165 L1185 Y1189	Y919-Q950 PolarHBondContact OH-NE2 3.44Å; Y919-Q950 VanDerWaalsContact OH-NE2 3.1Å; Y932-Q950 PolarHBondContact OH-NE2 2.78Å; N946-Q950 WeakPolarHBondContact O-CB 3.37Å; N946-Q950 PolarHBondContact O-N 3.17Å; L947-Q950 WeakPolarHBondContact O-CB 3.18Å; L947-Q950 PolarHBondContact O-N 3.01Å; M948-Q950 VanDerWaalsContact C-N 3.34Å; M948-Q950 PolarHBondContact O-N 2.98Å; Q950-M953 PolarHBondContact O-N 3.35Å; Q950-C954 PolarHBondContact O-N 3.14Å; Q950-C954 PolarHBondContact O-SG 3.49Å; Q950-Y1165 HydrophobicContact CG-CD2 3.7Å; Q950-Y1165 HydrophobicContact CG-CE2 4.4Å; Q950-L1185 HydrophobicContact CB-CD2 4.46Å; Q950-L1185 HydrophobicContact CG-CD2 4.39Å; Q950-Y1189 PolarHBondContact NE2-OH 2.82Å; Q950-Y1189 PolarHBondContact OE1-OH 3.11Å
951	F	92.4	Very high	78.1	Confident	30 Å²	30	64.9 Å²	64.9	13%	0.132	36%	0.356	C	S	.	.	H	α-helix	trans	-61.7	-48.2	174.5	180	-94	0	0	0	111.6	L947 M948 M953 C954 M955 F1168 G1181 L1185	L947-F951 PolarHBondContact O-N 3.28Å; M948-F951 WeakPolarHBondContact O-CB 3.4Å; M948-F951 PolarHBondContact O-N 2.89Å; F951-M953 VanDerWaalsContact C-N 3.27Å; F951-M953 PolarHBondContact O-N 2.81Å; F951-C954 WeakPolarHBondContact O-CA 3.4Å; F951-C954 WeakPolarHBondContact O-CB 3.41Å; F951-C954 PolarHBondContact O-N 2.9Å; F951-M955 HydrophobicContact CD1-CG 4.22Å; F951-M955 HydrophobicContact CD2-CE 3.99Å; F951-M955 HydrophobicContact CE1-CE 4.21Å; F951-M955 HydrophobicContact CE1-CG 3.8Å; F951-M955 HydrophobicContact CE1-SD 4.38Å; F951-M955 HydrophobicContact CE2-CE 3.49Å; F951-M955 VanDerWaalsContact CE2-CE 3.49Å; F951-M955 HydrophobicContact CZ-CE 3.6Å; F951-M955 HydrophobicContact CZ-CG 4.08Å; F951-M955 HydrophobicContact CZ-SD 4.05Å; F951-M955 WeakPolarHBondContact O-CG 3.36Å; F951-M955 PolarHBondContact O-N 3.44Å; F951-M955 VanDerWaalsContact O-N 3.09Å; F951-F1168 AromaticContact CD2-CE1 3.7Å; F951-F1168 HydrophobicContact CD2-CE1 3.7Å; F951-F1168 HydrophobicContact CD2-CZ 4.08Å; F951-F1168 AromaticContact CE2-CE1 3.75Å; F951-F1168 HydrophobicContact CE2-CE1 3.75Å; F951-F1168 AromaticContact CE2-CZ 3.98Å; F951-F1168 HydrophobicContact CE2-CZ 3.98Å; F951-G1181 VanDerWaalsContact CE2-O 3.28Å; F951-G1181 WeakPolarHBondContact CE2-O 3.19Å; F951-G1181 VanDerWaalsContact CZ-C 3.41Å; F951-G1181 VanDerWaalsContact CZ-CA 3.42Å; F951-L1185 HydrophobicContact CB-CD2 3.89Å; F951-L1185 HydrophobicContact CD2-CB 4.23Å; F951-L1185 HydrophobicContact CD2-CD2 4.45Å
952	E	89.1	Confident	75.3	Confident	98 Å²	98	62.9 Å²	62.9	46%	0.458	35%	0.347	S	S	.	.	H	α-helix	trans	-54.7	-43.1	173.9	-72	174.4	174.3	0	0	111.7	M948 C954 M955 D956	M948-E952 WeakPolarHBondContact O-CG 3.48Å; M948-E952 PolarHBondContact O-N 2.83Å; E952-C954 VanDerWaalsContact C-N 3.27Å; E952-C954 PolarHBondContact O-N 3.49Å; E952-M955 CarbonylContact O-C 3.6Å; E952-M955 WeakPolarHBondContact O-CA 3.24Å; E952-M955 PolarHBondContact O-N 2.88Å; E952-D956 PolarHBondContact O-N 3.48Å
953	M	85.6	Confident	72.4	Confident	19 Å²	19	61.7 Å²	61.7	9%	0.094	36%	0.355	C	S	.	.	H	α-helix	trans	-69.5	-19.6	176	-72.4	178.3	49.8	0	0	114.6	L918 Y919 R949 Q950 F951 Y1165 K1169	L918-M953 HydrophobicContact CB-CE 3.74Å; Y919-M953 HydrophobicContact CD2-CE 3.55Å; Y919-M953 HydrophobicContact CD2-SD 4.31Å; Y919-M953 HydrophobicContact CG-CE 4.15Å; R949-M953 HydrophobicContact CG-SD 4.42Å; R949-M953 WeakPolarHBondContact O-CB 3.45Å; R949-M953 VanDerWaalsContact O-CG 3.28Å; R949-M953 WeakPolarHBondContact O-CG 3.43Å; R949-M953 PolarHBondContact O-N 2.73Å; Q950-M953 PolarHBondContact O-N 3.35Å; F951-M953 VanDerWaalsContact C-N 3.27Å; F951-M953 PolarHBondContact O-N 2.81Å; M953-Y1165 HydrophobicContact CB-CE2 4.09Å; M953-Y1165 HydrophobicContact CE-CE2 4.45Å; M953-K1169 WeakPolarHBondContact O-CD 3.33Å; M953-K1169 VanDerWaalsContact O-CE 3.25Å; M953-K1169 WeakPolarHBondContact O-CE 3.21Å; M953-K1169 PolarHBondContact O-NZ 2.81Å
954	C	88.8	Confident	69.5	Low	0 Å²	0	64.4 Å²	64.4	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-80.2	-21.4	168.3	-62.4	0	0	0	0	112.5	Q950 F951 E952 F957 F1168 K1169	Q950-C954 PolarHBondContact O-N 3.14Å; Q950-C954 PolarHBondContact O-SG 3.49Å; F951-C954 WeakPolarHBondContact O-CA 3.4Å; F951-C954 WeakPolarHBondContact O-CB 3.41Å; F951-C954 PolarHBondContact O-N 2.9Å; E952-C954 VanDerWaalsContact C-N 3.27Å; E952-C954 PolarHBondContact O-N 3.49Å; C954-F957 WeakPolarHBondContact O-CD1 3.36Å; C954-F957 WeakPolarHBondContact O-CE1 3.42Å; C954-F1168 HydrophobicContact CB-CD1 3.9Å; C954-F1168 HydrophobicContact CB-CE1 4.49Å; C954-K1169 HydrophobicContact CB-CB 4.14Å
955	M	85.6	Confident	66.5	Low	69 Å²	69	70.6 Å²	70.6	34%	0.34	40%	0.398	S	S	.	.	H	α-helix	trans	-93.2	-14.7	174.4	-55.9	-57.2	124.9	0	0	113.4	F951 E952 F957 F1168 C1172	F951-M955 HydrophobicContact CD1-CG 4.22Å; F951-M955 HydrophobicContact CD2-CE 3.99Å; F951-M955 HydrophobicContact CE1-CE 4.21Å; F951-M955 HydrophobicContact CE1-CG 3.8Å; F951-M955 HydrophobicContact CE1-SD 4.38Å; F951-M955 HydrophobicContact CE2-CE 3.49Å; F951-M955 VanDerWaalsContact CE2-CE 3.49Å; F951-M955 HydrophobicContact CZ-CE 3.6Å; F951-M955 HydrophobicContact CZ-CG 4.08Å; F951-M955 HydrophobicContact CZ-SD 4.05Å; F951-M955 WeakPolarHBondContact O-CG 3.36Å; F951-M955 PolarHBondContact O-N 3.44Å; F951-M955 VanDerWaalsContact O-N 3.09Å; E952-M955 CarbonylContact O-C 3.6Å; E952-M955 WeakPolarHBondContact O-CA 3.24Å; E952-M955 PolarHBondContact O-N 2.88Å; M955-F957 VanDerWaalsContact C-N 3.27Å; M955-F957 WeakPolarHBondContact O-CD1 3.28Å; M955-F957 PolarHBondContact O-N 3.35Å; M955-F1168 HydrophobicContact CE-CD1 4.47Å; M955-F1168 HydrophobicContact CE-CE1 3.85Å; M955-C1172 HydrophobicContact CE-CB 4.32Å; M955-C1172 WeakPolarHBondContact CE-SG 3.43Å
956	D	77.6	Confident	63.4	Low	69 Å²	69	77.8 Å²	77.8	37%	0.369	43%	0.429	S	S	.	.			trans	-72.9	76.3	178	-170.5	29.4	0	0	0	111.4	R644 E952	R644-D956 IonicContact CZ-OD2 2.77Å; R644-D956 IonicContact NE-OD2 2.72Å; R644-D956 IonicContact NH2-OD1 2.85Å; R644-D956 IonicContact NH2-OD2 3.11Å; R644-D956 PolarHBondContact NH2-OD2 3.26Å; E952-D956 PolarHBondContact O-N 3.48Å
957	F	67.4	Low	60.2	Low	50 Å²	50	81.6 Å²	81.6	22%	0.219	46%	0.459	C	S	.	.			trans	-142.4	146.3	171.8	58.5	-92.9	0	0	0	111.4	C954 M955 C1172 L1173 P1176	C954-F957 WeakPolarHBondContact O-CD1 3.36Å; C954-F957 WeakPolarHBondContact O-CE1 3.42Å; M955-F957 VanDerWaalsContact C-N 3.27Å; M955-F957 WeakPolarHBondContact O-CD1 3.28Å; M955-F957 PolarHBondContact O-N 3.35Å; F957-C1172 HydrophobicContact CE1-CB 3.8Å; F957-C1172 HydrophobicContact CZ-CB 4.25Å; F957-C1172 WeakPolarHBondContact CZ-O 3.44Å; F957-L1173 HydrophobicContact CB-CD2 3.51Å; F957-L1173 HydrophobicContact CD1-CD2 4.06Å; F957-L1173 HydrophobicContact CD1-CG 4.44Å; F957-L1173 HydrophobicContact CD2-CD2 3.98Å; F957-L1173 HydrophobicContact CG-CD2 3.61Å; F957-L1173 HydrophobicContact CG-CG 4.46Å; F957-P1176 HydrophobicContact CE2-CG 4.27Å
958	R	55.1	Low	57	Low	153 Å²	153	84.5 Å²	84.5	58%	0.577	49%	0.49	S	S	*	.			trans	-79.4	122.1	172.6	-72.4	-172.7	177.3	-172.3	1	109.7	H651	H651-R958 VanDerWaalsContact O-CZ 3.31Å; H651-R958 PolarHBondContact O-NH1 3.17Å; H651-R958 PolarHBondContact O-NH2 2.97Å
959	C	44.1	Very low	53.8	Low	49 Å²	49	87.9 Å²	87.9	33%	0.331	51%	0.514	S	S	.	.			trans	-91.3	96.4	159.5	-95.2	0	0	0	0	109.4	S961 C980	C959-S961 PolarHBondContact O-N 3.43Å; C959-S961 VanDerWaalsContact O-N 3.08Å; C959-S961 PolarHBondContact O-OG 2.76Å; C959-C980 WeakPolarHBondContact CA-SG 3.43Å; C959-C980 HydrophobicContact CB-CB 3.5Å; C959-C980 VanDerWaalsContact CB-CB 3.5Å; C959-C980 WeakPolarHBondContact CB-SG 3.36Å; C959-C980 WeakPolarHBondContact SG-CB 3.45Å; C959-C980 CovalentContact SG-SG 2.04Å; C959-C980 PolarHBondContact SG-SG 2.87Å
960	D	36.8	Very low	50.7	Low	122 Å²	122	89.1 Å²	89.1	65%	0.652	53%	0.53	S	S	*	.			trans	-64.4	112.4	176.6	-63.8	-29.7	0	0	0	109.8	A962	D960-A962 PolarHBondContact O-N 2.94Å; D960-A962 VanDerWaalsContact O-N 3.09Å
961	S	27.4	Very low	47.5	Very low	113 Å²	113	96.8 Å²	96.8	79%	0.79	57%	0.571	S	S	*	*			trans	-82.5	93.2	-168.3	-66.3	0	0	0	0	111.5	C959	C959-S961 PolarHBondContact O-N 3.43Å; C959-S961 VanDerWaalsContact O-N 3.08Å; C959-S961 PolarHBondContact O-OG 2.76Å
962	A	26.1	Very low	44.5	Very low	92 Å²	92	101.5 Å²	101.5	76%	0.76	60%	0.602	S	S	*	*			trans	54.6	73.3	162.5	0	0	0	0	0	116.7	D960 S964	D960-A962 PolarHBondContact O-N 2.94Å; D960-A962 VanDerWaalsContact O-N 3.09Å; A962-S964 PolarHBondContact O-N 3.39Å
963	G	24.2	Very low	41.8	Very low	78 Å²	78	102 Å²	102	80%	0.804	61%	0.608	S	S	*	*			trans	-60	121.5	160.4	0	0	0	0	0	111.3	L965	G963-L965 PolarHBondContact O-N 3.48Å
964	S	21.8	Very low	39.4	Very low	102 Å²	102	109 Å²	109	71%	0.713	64%	0.64	S	S	*	*			trans	-64.3	115.4	-172.3	-176.6	0	0	0	0	113.1	A962	A962-S964 PolarHBondContact O-N 3.39Å
965	L	25.6	Very low	37	Very low	168 Å²	168	111.6 Å²	111.6	88%	0.88	66%	0.657	S	S	*	*			trans	-108.5	63.6	174.5	-111.5	167	0	0	0	111.1	G963	G963-L965 PolarHBondContact O-N 3.48Å
966	H	26.1	Very low	34.7	Very low	169 Å²	169	114 Å²	114	78%	0.782	67%	0.665	S	S	*	*			trans	-73.5	139.2	164.4	-83.3	-5	0	0	0	111.3
967	S	25.2	Very low	32.7	Very low	123 Å²	123	111.8 Å²	111.8	86%	0.86	65%	0.653	S	S	*	*	S	Bend	trans	65.6	104.2	170.3	-179.2	0	0	0	0	117.9
968	G	24.7	Very low	31	Very low	63 Å²	63	113.9 Å²	113.9	65%	0.649	67%	0.671	S	S	*	*			trans	147.5	84.4	147.5	0	0	0	0	0	118
969	T	25.9	Very low	30.1	Very low	143 Å²	143	110 Å²	110	88%	0.877	66%	0.658	S	S	*	*			trans	55.2	128.4	157.6	44.3	0	0	0	0	119.8	N971	T969-N971 PolarHBondContact O-N 2.98Å
970	L	24.5	Very low	29.4	Very low	161 Å²	161	109.9 Å²	109.9	84%	0.843	66%	0.656	S	S	*	*	S	Bend	trans	-64.3	128.1	174.5	-71.7	72.6	0	0	0	111.9
971	N	24.1	Very low	29	Very low	162 Å²	162	107.6 Å²	107.6	87%	0.866	65%	0.65	S	S	*	*			trans	178.4	75.4	143.7	-94.2	-25.2	0	0	0	108.6	T969	T969-N971 PolarHBondContact O-N 2.98Å
972	V	28.5	Very low	29.2	Very low	128 Å²	128	106.3 Å²	106.3	78%	0.776	64%	0.641	S	S	*	*			trans	-94.8	100.4	-180	-176.6	0	0	0	0	109.7	Q974	V972-Q974 PolarHBondContact O-N 3.38Å
973	D	33.3	Very low	29.5	Very low	108 Å²	108	103.4 Å²	103.4	58%	0.578	61%	0.614	S	S	*	*			trans	-52.8	118.3	171.8	-164.5	-8.6	0	0	0	110.3	T975	D973-T975 PolarHBondContact O-N 3.15Å
974	Q	35.6	Very low	30	Very low	166 Å²	166	105.1 Å²	105.1	78%	0.776	61%	0.609	S	S	*	*	S	Bend	trans	-68.3	10.8	-165	-71.4	-179.5	-20.3	0	0	115.4	V972 K976	V972-Q974 PolarHBondContact O-N 3.38Å; Q974-K976 VanDerWaalsContact C-N 3.34Å; Q974-K976 PolarHBondContact O-N 2.84Å
975	T	36.5	Very low	30.8	Very low	56 Å²	56	104.8 Å²	104.8	34%	0.344	60%	0.599	S	S	.	*			trans	-93.6	45	-176.7	61.8	0	0	0	0	112.5	R824 D973	R824-T975 PolarHBondContact NH1-O 2.7Å; R824-T975 PolarHBondContact NH1-OG1 2.83Å; D973-T975 PolarHBondContact O-N 3.15Å
976	K	37.9	Very low	31.3	Very low	120 Å²	120	103.7 Å²	103.7	52%	0.522	61%	0.605	S	S	.	*			trans	-133.7	106.3	-179.9	-96.6	-158.3	169.6	-159	0	114	Q974	Q974-K976 VanDerWaalsContact C-N 3.34Å; Q974-K976 PolarHBondContact O-N 2.84Å
977	L	35.5	Very low	32.4	Very low	22 Å²	22	97.4 Å²	97.4	12%	0.115	58%	0.58	C	S	.	*			trans	-88.8	162.2	140	-71.1	147.5	0	0	0	108.4	P830 H995 Q1174	P830-L977 HydrophobicContact CB-CB 3.79Å; P830-L977 HydrophobicContact CG-CB 3.65Å; L977-H995 VanDerWaalsContact CD1-NE2 3.35Å; L977-H995 WeakPolarHBondContact CD1-NE2 3.17Å; L977-Q1174 HydrophobicContact CD1-CG 3.57Å; L977-Q1174 HydrophobicContact CD2-CB 4.1Å; L977-Q1174 HydrophobicContact CD2-CG 3.68Å; L977-Q1174 HydrophobicContact CG-CG 4.26Å
978	P	31.6	Very low	33.7	Very low	93 Å²	93	94.1 Å²	94.1	60%	0.604	57%	0.567	S	S	*	*			cis	-74.3	155.3	4	32.6	-36.9	0	0	0	113.4
979	Y	36	Very low	35.6	Very low	73 Å²	73	91.7 Å²	91.7	29%	0.286	54%	0.538	S	S	.	.			trans	-127.2	92.1	-179.8	-135	-106.2	0	0	0	111.3	S981 T983 P1176	Y979-S981 WeakPolarHBondContact CD1-O 3.24Å; Y979-S981 WeakPolarHBondContact CE1-O 3.45Å; Y979-T983 HydrophobicContact CE1-CG2 4.25Å; Y979-T983 WeakPolarHBondContact CE1-OG1 3.21Å; Y979-T983 WeakPolarHBondContact OH-CG2 3.4Å; Y979-T983 PolarHBondContact OH-OG1 3.13Å; Y979-P1176 WeakPolarHBondContact O-CD 2.98Å
980	C	29.6	Very low	38	Very low	45 Å²	45	86.2 Å²	86.2	30%	0.304	50%	0.504	S	S	.	.			trans	-119.6	39.8	175.5	-65.4	0	0	0	0	112.1	C959	C959-C980 WeakPolarHBondContact CA-SG 3.43Å; C959-C980 HydrophobicContact CB-CB 3.5Å; C959-C980 VanDerWaalsContact CB-CB 3.5Å; C959-C980 WeakPolarHBondContact CB-SG 3.36Å; C959-C980 WeakPolarHBondContact SG-CB 3.45Å; C959-C980 CovalentContact SG-SG 2.04Å; C959-C980 PolarHBondContact SG-SG 2.87Å
981	S	28.2	Very low	40.8	Very low	74 Å²	74	79.7 Å²	79.7	52%	0.517	47%	0.471	S	S	.	.	S	Bend	trans	-144.5	124.1	163.6	57	0	0	0	0	107.7	Y979 T983	Y979-S981 WeakPolarHBondContact CD1-O 3.24Å; Y979-S981 WeakPolarHBondContact CE1-O 3.45Å; S981-T983 PolarHBondContact O-N 2.77Å
982	S	31.6	Very low	43.7	Very low	86 Å²	86	72.3 Å²	72.3	60%	0.601	43%	0.433	S	S	*	.			trans	-65	105.5	164.1	39.8	0	0	0	0	108	T984	S982-T984 VanDerWaalsContact C-N 3.3Å; S982-T984 PolarHBondContact O-N 2.72Å
983	T	34.1	Very low	46.6	Very low	31 Å²	31	68.7 Å²	68.7	19%	0.19	41%	0.411	C	S	.	.			trans	-66.5	95.9	170.5	34	0	0	0	0	108.5	Y979 S981 D985	Y979-T983 HydrophobicContact CE1-CG2 4.25Å; Y979-T983 WeakPolarHBondContact CE1-OG1 3.21Å; Y979-T983 WeakPolarHBondContact OH-CG2 3.4Å; Y979-T983 PolarHBondContact OH-OG1 3.13Å; S981-T983 PolarHBondContact O-N 2.77Å; T983-D985 PolarHBondContact O-N 3.11Å
984	T	33.6	Very low	49.3	Very low	115 Å²	115	63.6 Å²	63.6	71%	0.706	38%	0.383	S	S	*	.	B	Isolated β-bridge	trans	-62.4	79.6	134.3	45	0	0	0	0	107.3	S982	S982-T984 VanDerWaalsContact C-N 3.3Å; S982-T984 PolarHBondContact O-N 2.72Å
985	D	38	Very low	51.8	Low	94 Å²	94	56.5 Å²	56.5	50%	0.503	35%	0.35	S	S	.	.			trans	-52.6	163.1	156.6	-90.9	-16.5	0	0	0	108.2	T983 S987 G988	T983-D985 PolarHBondContact O-N 3.11Å; D985-S987 WeakPolarHBondContact CB-OG 3.5Å; D985-S987 PolarHBondContact O-N 3.34Å; D985-G988 PolarHBondContact O-N 3.33Å
986	S	37.8	Very low	54.3	Low	145 Å²	145	54.1 Å²	54.1	100%	1.014	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-2.4	177.2	55.8	0	0	0	0	115
987	S	47.4	Very low	56.7	Low	37 Å²	37	49.3 Å²	49.3	26%	0.259	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-5	168.3	54.5	0	0	0	0	115.1	D985 I989 E1016	D985-S987 WeakPolarHBondContact CB-OG 3.5Å; D985-S987 PolarHBondContact O-N 3.34Å; S987-I989 PolarHBondContact O-N 2.91Å; S987-I989 VanDerWaalsContact O-N 3.11Å; S987-E1016 VanDerWaalsContact O-CB 3.23Å; S987-E1016 WeakPolarHBondContact O-CB 3.31Å; S987-E1016 WeakPolarHBondContact O-CG 2.99Å
988	G	54	Low	59	Low	55 Å²	55	50.4 Å²	50.4	57%	0.567	32%	0.322	S	S	*	.			trans	67.1	13.1	170.8	0	0	0	0	0	116.7	D985	D985-G988 PolarHBondContact O-N 3.33Å
989	I	65	Low	61.4	Low	11 Å²	11	49.2 Å²	49.2	6%	0.056	31%	0.311	C	S	.	.			trans	-107.4	125.5	177	-67.6	-178.4	0	0	0	111	S987 S991 T1006 S1013 E1016 F1017	S987-I989 PolarHBondContact O-N 2.91Å; S987-I989 VanDerWaalsContact O-N 3.11Å; I989-S991 PolarHBondContact O-N 2.83Å; I989-S991 VanDerWaalsContact O-N 3.12Å; I989-T1006 VanDerWaalsContact CG2-OG1 3.24Å; I989-T1006 WeakPolarHBondContact CG2-OG1 3.41Å; I989-S1013 WeakPolarHBondContact CD1-O 3.45Å; I989-E1016 HydrophobicContact CD1-CB 3.61Å; I989-E1016 HydrophobicContact CG1-CB 4.03Å; I989-F1017 HydrophobicContact CD1-CB 3.91Å
990	D	74.6	Confident	63.6	Low	28 Å²	28	48 Å²	48	15%	0.15	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-70.2	99.1	164.7	174.2	12.2	0	0	0	109.6	T1006 R1007 R1175	D990-T1006 PolarHBondContact O-OG1 3.16Å; D990-R1007 IonicContact OD2-CZ 2.63Å; D990-R1007 IonicContact OD2-NH1 2.74Å; D990-R1007 PolarHBondContact OD2-NH1 3.27Å; D990-R1007 IonicContact OD2-NH2 2.86Å; D990-R1007 PolarHBondContact OD2-NH2 2.89Å; D990-R1175 VanDerWaalsContact CG-NH2 3.32Å; D990-R1175 IonicContact OD1-CZ 2.73Å; D990-R1175 VanDerWaalsContact OD1-CZ 3.29Å; D990-R1175 IonicContact OD1-NH1 2.8Å; D990-R1175 PolarHBondContact OD1-NH1 2.8Å; D990-R1175 IonicContact OD1-NH2 2.73Å; D990-R1175 PolarHBondContact OD1-NH2 2.8Å; D990-R1175 IonicContact OD2-NH2 3.19Å; D990-R1175 PolarHBondContact OD2-NH2 3.15Å; D990-R1175 VanDerWaalsContact OD2-NH2 3.16Å
991	S	83.5	Confident	66.3	Low	24 Å²	24	47.5 Å²	47.5	17%	0.168	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	162.8	173.8	64.7	0	0	0	0	110.7	I989 V1005	I989-S991 PolarHBondContact O-N 2.83Å; I989-S991 VanDerWaalsContact O-N 3.12Å; S991-V1005 CarbonylContact C-O 3.17Å; S991-V1005 WeakPolarHBondContact CA-O 3.45Å; S991-V1005 WeakPolarHBondContact CB-O 3.47Å
992	S	86	Confident	69.1	Low	8 Å²	8	44.5 Å²	44.5	6%	0.056	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	152	173.1	-52	0	0	0	0	110.8	V1005 R1175	S992-V1005 PolarHBondContact N-O 2.77Å; S992-V1005 WeakPolarHBondContact O-CG2 3.46Å; S992-V1005 PolarHBondContact O-N 3.25Å; S992-R1175 PolarHBondContact OG-NH1 3.45Å
993	V	88.4	Confident	72	Confident	52 Å²	52	40.4 Å²	40.4	32%	0.315	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	115.7	-179.1	-175.6	0	0	0	0	109.3	C1001 Y1003 I1004	V993-C1001 HydrophobicContact CG1-CB 3.38Å; V993-C1001 WeakPolarHBondContact CG1-SG 3.39Å; V993-Y1003 CarbonylContact C-O 3.48Å; V993-Y1003 WeakPolarHBondContact CA-O 3.45Å; V993-I1004 HydrophobicContact CG2-CG1 4.33Å
994	L	90.2	Very high	74.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	157.1	179	-47.2	-174.5	0	0	0	110.2	C1001 E1002 Y1003 V1005 L1171 Q1174 R1175 L1178	L994-C1001 CarbonylContact O-C 3.52Å; L994-C1001 VanDerWaalsContact O-CA 3.3Å; L994-C1001 WeakPolarHBondContact O-CA 3.44Å; L994-E1002 PolarHBondContact O-N 3.48Å; L994-Y1003 PolarHBondContact N-O 3.2Å; L994-Y1003 PolarHBondContact O-N 3.25Å; L994-V1005 HydrophobicContact CD1-CB 4.3Å; L994-V1005 HydrophobicContact CD1-CG1 3.4Å; L994-V1005 HydrophobicContact CD1-CG2 3.86Å; L994-V1005 HydrophobicContact CD2-CG2 4.1Å; L994-V1005 HydrophobicContact CG-CG1 3.94Å; L994-V1005 HydrophobicContact CG-CG2 3.85Å; L994-L1171 HydrophobicContact CB-CD2 4.37Å; L994-L1171 HydrophobicContact CD1-CD2 3.87Å; L994-Q1174 HydrophobicContact CD2-CB 3.55Å; L994-R1175 HydrophobicContact CD2-CB 4.08Å; L994-L1178 HydrophobicContact CD1-CD2 4.48Å
995	H	89.2	Confident	77.7	Confident	17 Å²	17	34.1 Å²	34.1	8%	0.079	22%	0.217	C	C	.	.			trans	-103.7	145.6	176.8	-54.8	-1.8	0	0	0	109.7	F793 L977 C1001 Q1174	F793-H995 AromaticContact CE1-CD2 3.78Å; F793-H995 HydrophobicContact CZ-CB 4.23Å; F793-H995 AromaticContact CZ-CD2 3.85Å; L977-H995 VanDerWaalsContact CD1-NE2 3.35Å; L977-H995 WeakPolarHBondContact CD1-NE2 3.17Å; H995-C1001 PolarHBondContact ND1-N 3.43Å; H995-C1001 VanDerWaalsContact ND1-N 3.18Å; H995-Q1174 VanDerWaalsContact CB-NE2 3.33Å; H995-Q1174 PolarHBondContact CD2-NE2 3.37Å; H995-Q1174 PolarHBondContact ND1-NE2 3.15Å
996	G	89	Confident	80.2	Confident	7 Å²	7	29.8 Å²	29.8	7%	0.072	19%	0.194	C	C	.	.			trans	-106.3	-150.6	-179.4	0	0	0	0	0	113	N999 E1002	G996-N999 PolarHBondContact N-O 3.03Å; G996-E1002 VanDerWaalsContact CA-CD 3.47Å; G996-E1002 WeakPolarHBondContact CA-OE1 3.37Å; G996-E1002 WeakPolarHBondContact CA-OE2 3.1Å
997	F	88.5	Confident	82.8	Confident	19 Å²	19	27.7 Å²	27.7	8%	0.083	16%	0.164	C	C	.	.	S	Bend	trans	-88.6	-41.5	-179.9	178.6	-110.1	0	0	0	112.1	R791 A792 E1002 I1151 S1154 Q1155 N1158 D1159	R791-F997 WeakPolarHBondContact CA-O 3.48Å; R791-F997 VanDerWaalsContact CD-CZ 3.43Å; A792-F997 PolarHBondContact N-O 3.48Å; A792-F997 VanDerWaalsContact N-O 3.11Å; F997-E1002 PolarHBondContact N-OE1 3.32Å; F997-E1002 PolarHBondContact N-OE2 2.87Å; F997-I1151 HydrophobicContact CB-CG2 4.22Å; F997-S1154 WeakPolarHBondContact CE1-O 3.37Å; F997-Q1155 HydrophobicContact CD2-CG 3.58Å; F997-Q1155 HydrophobicContact CE2-CB 4.19Å; F997-Q1155 HydrophobicContact CE2-CG 3.53Å; F997-Q1155 HydrophobicContact CZ-CG 4.47Å; F997-N1158 HydrophobicContact CE1-CB 3.67Å; F997-N1158 HydrophobicContact CZ-CB 3.83Å; F997-D1159 WeakPolarHBondContact CZ-OD2 3.41Å
998	L	83	Confident	85	Confident	44 Å²	44	26.1 Å²	26.1	23%	0.23	15%	0.153	C	C	.	.	S	Bend	trans	-91.1	-41.6	-175.1	-60.9	179.3	0	0	0	110.8	R791 A792 E1002	R791-L998 CarbonylContact C-O 3.44Å; R791-L998 VanDerWaalsContact C-O 3.23Å; A792-L998 WeakPolarHBondContact CA-O 3.28Å; A792-L998 PolarHBondContact N-O 2.99Å; A792-L998 VanDerWaalsContact N-O 3.08Å; L998-E1002 PolarHBondContact N-OE2 2.91Å
999	N	82.1	Confident	86.8	Confident	69 Å²	69	23.8 Å²	23.8	37%	0.369	13%	0.127	S	C	.	.			trans	-122	143.9	-171.2	-63.7	-49.3	0	0	0	113.3	A792 G996 E1002	A792-N999 WeakPolarHBondContact CB-O 3.45Å; G996-N999 PolarHBondContact N-O 3.03Å; N999-E1002 HydrophobicContact CB-CB 4.07Å; N999-E1002 HydrophobicContact CB-CG 4.21Å; N999-E1002 PolarHBondContact N-OE2 2.93Å
1000	V	82.6	Confident	87.8	Confident	47 Å²	47	27.8 Å²	27.8	29%	0.285	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	140.5	155.5	-169.9	0	0	0	0	106.7	A792 E1002	A792-V1000 HydrophobicContact CB-CG2 4.27Å; A792-V1000 WeakPolarHBondContact O-CG2 3.39Å; V1000-E1002 VanDerWaalsContact C-N 3.34Å; V1000-E1002 PolarHBondContact O-N 2.93Å
1001	C	85.7	Confident	88.2	Confident	35 Å²	35	29.4 Å²	29.4	24%	0.236	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	37.3	-178.5	-55.7	0	0	0	0	114.8	V993 L994 H995 Y1003 P1131	V993-C1001 HydrophobicContact CG1-CB 3.38Å; V993-C1001 WeakPolarHBondContact CG1-SG 3.39Å; L994-C1001 CarbonylContact O-C 3.52Å; L994-C1001 VanDerWaalsContact O-CA 3.3Å; L994-C1001 WeakPolarHBondContact O-CA 3.44Å; H995-C1001 PolarHBondContact ND1-N 3.43Å; H995-C1001 VanDerWaalsContact ND1-N 3.18Å; C1001-Y1003 VanDerWaalsContact C-N 3.27Å; C1001-Y1003 PolarHBondContact O-N 3.35Å; C1001-P1131 WeakPolarHBondContact O-CB 3.49Å
1002	E	87.7	Confident	88	Confident	10 Å²	10	35 Å²	35	5%	0.047	20%	0.2	C	C	.	.			trans	-66.9	-23	-179.6	-160.7	172.7	103.4	0	0	113.5	L994 G996 F997 L998 N999 V1000 P1131 I1132	L994-E1002 PolarHBondContact O-N 3.48Å; G996-E1002 VanDerWaalsContact CA-CD 3.47Å; G996-E1002 WeakPolarHBondContact CA-OE1 3.37Å; G996-E1002 WeakPolarHBondContact CA-OE2 3.1Å; F997-E1002 PolarHBondContact N-OE1 3.32Å; F997-E1002 PolarHBondContact N-OE2 2.87Å; L998-E1002 PolarHBondContact N-OE2 2.91Å; N999-E1002 HydrophobicContact CB-CB 4.07Å; N999-E1002 HydrophobicContact CB-CG 4.21Å; N999-E1002 PolarHBondContact N-OE2 2.93Å; V1000-E1002 VanDerWaalsContact C-N 3.34Å; V1000-E1002 PolarHBondContact O-N 2.93Å; E1002-P1131 WeakPolarHBondContact O-CA 3.18Å; E1002-I1132 PolarHBondContact O-N 2.57Å
1003	Y	92.7	Very high	88	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	141.9	-177.9	-52.4	-84.7	0	0	0	112.8	V993 L994 C1001 I1132 L1134 R1150	V993-Y1003 CarbonylContact C-O 3.48Å; V993-Y1003 WeakPolarHBondContact CA-O 3.45Å; L994-Y1003 PolarHBondContact N-O 3.2Å; L994-Y1003 PolarHBondContact O-N 3.25Å; C1001-Y1003 VanDerWaalsContact C-N 3.27Å; C1001-Y1003 PolarHBondContact O-N 3.35Å; Y1003-I1132 CarbonylContact C-O 3.26Å; Y1003-I1132 VanDerWaalsContact CA-O 3.29Å; Y1003-I1132 WeakPolarHBondContact CA-O 3.3Å; Y1003-I1132 HydrophobicContact CD1-CB 3.92Å; Y1003-I1132 HydrophobicContact CD1-CG2 4.41Å; Y1003-I1132 HydrophobicContact CE1-CB 4.21Å; Y1003-I1132 HydrophobicContact CE1-CD1 4.07Å; Y1003-L1134 HydrophobicContact CD1-CD1 3.61Å; Y1003-L1134 HydrophobicContact CD1-CD2 4.22Å; Y1003-L1134 HydrophobicContact CD1-CG 3.89Å; Y1003-L1134 HydrophobicContact CE1-CD1 4.35Å; Y1003-L1134 HydrophobicContact CG-CD1 4.1Å; Y1003-R1150 VanDerWaalsContact OH-CD 3.24Å; Y1003-R1150 WeakPolarHBondContact OH-CD 3.38Å; Y1003-R1150 PolarHBondContact OH-NE 3.09Å
1004	I	92.4	Very high	88.1	Confident	14 Å²	14	34.2 Å²	34.2	7%	0.072	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117.9	159.4	-69.6	168.7	0	0	0	107	V993 V1020 A1024 P1131 I1132 V1133 L1134	V993-I1004 HydrophobicContact CG2-CG1 4.33Å; I1004-V1020 HydrophobicContact CD1-CG1 4.26Å; I1004-V1020 HydrophobicContact CG2-CG1 4.33Å; I1004-A1024 HydrophobicContact CD1-CB 3.57Å; I1004-P1131 HydrophobicContact CD1-CB 4.08Å; I1004-P1131 HydrophobicContact CD1-CG 3.48Å; I1004-P1131 VanDerWaalsContact CD1-CG 3.48Å; I1004-P1131 HydrophobicContact CG1-CB 3.88Å; I1004-P1131 HydrophobicContact CG1-CG 3.86Å; I1004-I1132 PolarHBondContact N-O 2.96Å; I1004-V1133 HydrophobicContact CB-CG2 4.13Å; I1004-V1133 HydrophobicContact CD1-CG2 4.32Å; I1004-V1133 HydrophobicContact CG2-CG2 4.48Å; I1004-V1133 CarbonylContact O-C 3.53Å; I1004-V1133 WeakPolarHBondContact O-CA 3.45Å; I1004-L1134 PolarHBondContact O-N 3.17Å
1005	V	93.2	Very high	88	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	138	172.3	-65.1	0	0	0	0	110.9	S991 S992 L994 L1134 V1143	S991-V1005 CarbonylContact C-O 3.17Å; S991-V1005 WeakPolarHBondContact CA-O 3.45Å; S991-V1005 WeakPolarHBondContact CB-O 3.47Å; S992-V1005 PolarHBondContact N-O 2.77Å; S992-V1005 WeakPolarHBondContact O-CG2 3.46Å; S992-V1005 PolarHBondContact O-N 3.25Å; L994-V1005 HydrophobicContact CD1-CB 4.3Å; L994-V1005 HydrophobicContact CD1-CG1 3.4Å; L994-V1005 HydrophobicContact CD1-CG2 3.86Å; L994-V1005 HydrophobicContact CD2-CG2 4.1Å; L994-V1005 HydrophobicContact CG-CG1 3.94Å; L994-V1005 HydrophobicContact CG-CG2 3.85Å; V1005-L1134 WeakPolarHBondContact CA-O 3.34Å; V1005-L1134 HydrophobicContact CG1-CB 4.17Å; V1005-L1134 HydrophobicContact CG1-CD1 4.2Å; V1005-V1143 HydrophobicContact CB-CG2 3.99Å; V1005-V1143 HydrophobicContact CG1-CB 3.97Å; V1005-V1143 HydrophobicContact CG1-CG2 3.86Å
1006	T	91.9	Very high	87.8	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	173	172.6	-168.1	0	0	0	0	111.9	I989 D990 F1017 L1134 V1135 D1136 G1139	I989-T1006 VanDerWaalsContact CG2-OG1 3.24Å; I989-T1006 WeakPolarHBondContact CG2-OG1 3.41Å; D990-T1006 PolarHBondContact O-OG1 3.16Å; T1006-F1017 HydrophobicContact CG2-CD2 4.03Å; T1006-F1017 HydrophobicContact CG2-CE2 3.94Å; T1006-L1134 PolarHBondContact N-O 3.5Å; T1006-V1135 HydrophobicContact CG2-CG2 4.07Å; T1006-D1136 PolarHBondContact O-N 2.81Å; T1006-G1139 VanDerWaalsContact O-CA 3.31Å; T1006-G1139 WeakPolarHBondContact O-CA 3.41Å
1007	R	91.5	Very high	88	Confident	101 Å²	101	37.6 Å²	37.6	38%	0.381	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	159.5	173.4	67.8	168	45.8	81.2	29.3	111.8	D990 P1009 D1136 T1138	D990-R1007 IonicContact OD2-CZ 2.63Å; D990-R1007 IonicContact OD2-NH1 2.74Å; D990-R1007 PolarHBondContact OD2-NH1 3.27Å; D990-R1007 IonicContact OD2-NH2 2.86Å; D990-R1007 PolarHBondContact OD2-NH2 2.89Å; R1007-P1009 VanDerWaalsContact O-CD 3.24Å; R1007-P1009 WeakPolarHBondContact O-CD 3.27Å; R1007-P1009 VanDerWaalsContact O-N 3.13Å; R1007-D1136 CarbonylContact C-O 3.57Å; R1007-D1136 WeakPolarHBondContact CA-O 3.19Å; R1007-T1138 PolarHBondContact NH2-O 3.33Å
1008	H	93.2	Very high	88.3	Confident	5 Å²	5	36.7 Å²	36.7	2%	0.023	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-52	117.2	173.3	-156.8	98.1	0	0	0	110.4	L1010 S1033 L1037 L1038 F1040 V1135 D1136	H1008-L1010 PolarHBondContact O-N 3.24Å; H1008-S1033 VanDerWaalsContact ND1-CB 3.26Å; H1008-S1033 WeakPolarHBondContact ND1-CB 3.28Å; H1008-S1033 PolarHBondContact ND1-OG 3.06Å; H1008-L1037 HydrophobicContact CB-CD1 3.78Å; H1008-L1038 PolarHBondContact NE2-O 3.43Å; H1008-L1038 VanDerWaalsContact NE2-O 3.13Å; H1008-F1040 AromaticContact CE1-CD1 3.75Å; H1008-F1040 AromaticContact CE1-CE1 3.81Å; H1008-F1040 AromaticContact NE2-CD1 3.6Å; H1008-V1135 HydrophobicContact CB-CG1 4.21Å; H1008-D1136 PolarHBondContact N-O 3.41Å
1009	P	92.1	Very high	88.6	Confident	5 Å²	5	37.2 Å²	37.2	3%	0.032	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-64.2	132.2	-179.8	-21.6	31.9	0	0	0	111.4	R1007 V1014 F1017 F1040	R1007-P1009 VanDerWaalsContact O-CD 3.24Å; R1007-P1009 WeakPolarHBondContact O-CD 3.27Å; R1007-P1009 VanDerWaalsContact O-N 3.13Å; P1009-V1014 HydrophobicContact CB-CB 4.49Å; P1009-V1014 HydrophobicContact CB-CG2 4.01Å; P1009-F1017 HydrophobicContact CB-CB 3.89Å; P1009-F1017 HydrophobicContact CB-CG 4.23Å; P1009-F1017 HydrophobicContact CG-CB 3.5Å; P1009-F1017 VanDerWaalsContact CG-CB 3.5Å; P1009-F1017 HydrophobicContact CG-CD1 4.01Å; P1009-F1017 HydrophobicContact CG-CD2 3.39Å; P1009-F1017 HydrophobicContact CG-CE2 4.1Å; P1009-F1017 HydrophobicContact CG-CG 3.33Å; P1009-F1040 HydrophobicContact CB-CB 4.04Å; P1009-F1040 HydrophobicContact CB-CG 4.37Å; P1009-F1040 HydrophobicContact CG-CB 4.24Å; P1009-F1040 HydrophobicContact CG-CD1 4.09Å; P1009-F1040 HydrophobicContact CG-CD2 4.44Å; P1009-F1040 HydrophobicContact CG-CG 4.02Å
1010	L	86.4	Confident	88.9	Confident	95 Å²	95	35.5 Å²	35.5	50%	0.497	20%	0.202	S	C	.	.			trans	-132.4	139.1	-178.9	-66.9	174.3	0	0	0	111.2	H1008 N1012 S1013	H1008-L1010 PolarHBondContact O-N 3.24Å; L1010-N1012 PolarHBondContact O-N 2.89Å; L1010-S1013 PolarHBondContact N-OG 2.89Å; L1010-S1013 PolarHBondContact O-N 3.08Å; L1010-S1013 PolarHBondContact O-OG 2.9Å
1011	G	83.6	Confident	89.4	Confident	63 Å²	63	33.2 Å²	33.2	65%	0.649	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	53.8	-123.8	179.6	0	0	0	0	0	112	S1013 V1014	G1011-S1013 VanDerWaalsContact C-N 3.27Å; G1011-S1013 PolarHBondContact O-N 2.84Å; G1011-V1014 WeakPolarHBondContact O-CG2 3.34Å; G1011-V1014 PolarHBondContact O-N 2.94Å
1012	N	79.1	Confident	89.7	Confident	142 Å²	142	31.8 Å²	31.8	76%	0.759	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-54.5	-42.7	-178	-60.7	5.4	0	0	0	112.4	L1010 V1014 T1015	L1010-N1012 PolarHBondContact O-N 2.89Å; N1012-V1014 PolarHBondContact O-N 2.93Å; N1012-T1015 WeakPolarHBondContact O-CB 3.31Å; N1012-T1015 PolarHBondContact O-N 3.13Å; N1012-T1015 PolarHBondContact O-OG1 2.86Å
1013	S	85.1	Confident	89.7	Confident	35 Å²	35	37 Å²	37	25%	0.245	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-64.1	-11.6	-173.4	63.6	0	0	0	0	115.2	I989 L1010 G1011 T1015 E1016 F1017	I989-S1013 WeakPolarHBondContact CD1-O 3.45Å; L1010-S1013 PolarHBondContact N-OG 2.89Å; L1010-S1013 PolarHBondContact O-N 3.08Å; L1010-S1013 PolarHBondContact O-OG 2.9Å; G1011-S1013 VanDerWaalsContact C-N 3.27Å; G1011-S1013 PolarHBondContact O-N 2.84Å; S1013-T1015 PolarHBondContact O-N 3.15Å; S1013-E1016 PolarHBondContact O-N 3.39Å; S1013-F1017 WeakPolarHBondContact O-CB 3.32Å; S1013-F1017 PolarHBondContact O-N 3.36Å
1014	V	90.1	Very high	89.4	Confident	8 Å²	8	38.2 Å²	38.2	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-58.6	-34.7	166.2	179.4	0	0	0	0	110.8	P1009 G1011 N1012 F1017 W1018 F1040 I1051	P1009-V1014 HydrophobicContact CB-CB 4.49Å; P1009-V1014 HydrophobicContact CB-CG2 4.01Å; G1011-V1014 WeakPolarHBondContact O-CG2 3.34Å; G1011-V1014 PolarHBondContact O-N 2.94Å; N1012-V1014 PolarHBondContact O-N 2.93Å; V1014-F1017 PolarHBondContact O-N 2.97Å; V1014-W1018 VanDerWaalsContact O-CD1 3.25Å; V1014-W1018 PolarHBondContact O-N 3.45Å; V1014-F1040 HydrophobicContact CB-CB 4.49Å; V1014-F1040 HydrophobicContact CG1-CB 3.98Å; V1014-F1040 VanDerWaalsContact CG1-O 3.23Å; V1014-F1040 WeakPolarHBondContact CG1-O 3.49Å; V1014-F1040 HydrophobicContact CG2-CB 3.87Å; V1014-I1051 HydrophobicContact CG1-CD1 4.45Å
1015	T	88.4	Confident	89.3	Confident	50 Å²	50	41.2 Å²	41.2	31%	0.307	23%	0.233	S	C	.	.	H	α-helix	trans	-61.9	-47.5	179.6	-54.7	0	0	0	0	111.4	N1012 S1013 K1019 I1051	N1012-T1015 WeakPolarHBondContact O-CB 3.31Å; N1012-T1015 PolarHBondContact O-N 3.13Å; N1012-T1015 PolarHBondContact O-OG1 2.86Å; S1013-T1015 PolarHBondContact O-N 3.15Å; T1015-K1019 WeakPolarHBondContact O-CG 3.24Å; T1015-I1051 HydrophobicContact CG2-CG2 3.47Å; T1015-I1051 VanDerWaalsContact CG2-CG2 3.47Å
1016	E	86.5	Confident	89.2	Confident	40 Å²	40	41.2 Å²	41.2	19%	0.187	23%	0.233	C	C	.	.	H	α-helix	trans	-82.3	-21.8	-178.4	-72	70.6	-140	0	0	113.1	S987 I989 S1013 K1019 V1020	S987-E1016 VanDerWaalsContact O-CB 3.23Å; S987-E1016 WeakPolarHBondContact O-CB 3.31Å; S987-E1016 WeakPolarHBondContact O-CG 2.99Å; I989-E1016 HydrophobicContact CD1-CB 3.61Å; I989-E1016 HydrophobicContact CG1-CB 4.03Å; S1013-E1016 PolarHBondContact O-N 3.39Å; E1016-K1019 HydrophobicContact CG-CD 4.25Å; E1016-K1019 WeakPolarHBondContact O-CB 3.47Å; E1016-K1019 PolarHBondContact O-N 3.44Å; E1016-K1019 IonicContact OE1-NZ 2.74Å; E1016-K1019 PolarHBondContact OE1-NZ 2.83Å; E1016-V1020 WeakPolarHBondContact O-CG2 3.05Å; E1016-V1020 PolarHBondContact O-N 2.95Å
1017	F	93.2	Very high	89.2	Confident	4 Å²	4	42 Å²	42	2%	0.018	24%	0.239	C	C	.	.	H	α-helix	trans	-64.1	-48.7	174.8	171.8	-92.9	0	0	0	110.6	I989 T1006 P1009 S1013 V1014 K1019 V1020 V1021 I1029 F1040 V1133 V1135	I989-F1017 HydrophobicContact CD1-CB 3.91Å; T1006-F1017 HydrophobicContact CG2-CD2 4.03Å; T1006-F1017 HydrophobicContact CG2-CE2 3.94Å; P1009-F1017 HydrophobicContact CB-CB 3.89Å; P1009-F1017 HydrophobicContact CB-CG 4.23Å; P1009-F1017 HydrophobicContact CG-CB 3.5Å; P1009-F1017 VanDerWaalsContact CG-CB 3.5Å; P1009-F1017 HydrophobicContact CG-CD1 4.01Å; P1009-F1017 HydrophobicContact CG-CD2 3.39Å; P1009-F1017 HydrophobicContact CG-CE2 4.1Å; P1009-F1017 HydrophobicContact CG-CG 3.33Å; S1013-F1017 WeakPolarHBondContact O-CB 3.32Å; S1013-F1017 PolarHBondContact O-N 3.36Å; V1014-F1017 PolarHBondContact O-N 2.97Å; F1017-K1019 VanDerWaalsContact C-N 3.26Å; F1017-K1019 PolarHBondContact O-N 2.87Å; F1017-V1020 PolarHBondContact O-N 2.98Å; F1017-V1020 VanDerWaalsContact O-N 3.09Å; F1017-V1021 HydrophobicContact CD1-CG2 4.11Å; F1017-V1021 HydrophobicContact CE1-CG2 3.57Å; F1017-V1021 HydrophobicContact CE2-CG2 4.29Å; F1017-V1021 HydrophobicContact CZ-CG2 3.69Å; F1017-V1021 WeakPolarHBondContact O-CG2 3.41Å; F1017-V1021 PolarHBondContact O-N 2.95Å; F1017-I1029 HydrophobicContact CE1-CD1 4.01Å; F1017-I1029 HydrophobicContact CZ-CD1 4.04Å; F1017-I1029 HydrophobicContact CZ-CG1 4.4Å; F1017-I1029 HydrophobicContact CZ-CG2 4.25Å; F1017-F1040 AromaticContact CD1-CD2 3.83Å; F1017-F1040 HydrophobicContact CD1-CD2 3.83Å; F1017-F1040 AromaticContact CD1-CE2 3.95Å; F1017-F1040 HydrophobicContact CD1-CE2 3.95Å; F1017-F1040 AromaticContact CE1-CD2 3.61Å; F1017-F1040 HydrophobicContact CE1-CD2 3.61Å; F1017-F1040 AromaticContact CE1-CE2 3.25Å; F1017-F1040 HydrophobicContact CE1-CE2 3.25Å; F1017-F1040 HydrophobicContact CE1-CZ 4.09Å; F1017-F1040 HydrophobicContact CZ-CD2 4.32Å; F1017-F1040 AromaticContact CZ-CE2 3.62Å; F1017-F1040 HydrophobicContact CZ-CE2 3.62Å; F1017-F1040 HydrophobicContact CZ-CZ 4Å; F1017-V1133 HydrophobicContact CE2-CG1 3.65Å; F1017-V1133 HydrophobicContact CZ-CG1 3.81Å; F1017-V1135 HydrophobicContact CE2-CG2 3.72Å; F1017-V1135 HydrophobicContact CZ-CG2 4.06Å
1018	W	93.1	Very high	89.2	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67.2	-27.4	178.5	-72.7	112	0	0	0	112.9	V1014 V1021 W1022 I1029 F1040 W1041 I1051 L1054 I1056 F1073 L1075	V1014-W1018 VanDerWaalsContact O-CD1 3.25Å; V1014-W1018 PolarHBondContact O-N 3.45Å; W1018-V1021 HydrophobicContact CE3-CB 4.21Å; W1018-V1021 HydrophobicContact CE3-CG1 4.18Å; W1018-V1021 HydrophobicContact CE3-CG2 4.31Å; W1018-V1021 HydrophobicContact CZ3-CG1 4.25Å; W1018-W1022 WeakPolarHBondContact O-CB 3.35Å; W1018-W1022 PolarHBondContact O-N 3.39Å; W1018-I1029 HydrophobicContact CH2-CD1 3.84Å; W1018-I1029 HydrophobicContact CZ3-CD1 3.76Å; W1018-F1040 AromaticContact CZ2-CD2 3.98Å; W1018-F1040 HydrophobicContact CZ2-CD2 3.98Å; W1018-F1040 HydrophobicContact CZ2-CE2 4.22Å; W1018-F1040 PolarHBondContact NE1-O 3Å; W1018-W1041 HydrophobicContact CZ2-CB 3.98Å; W1018-I1051 HydrophobicContact CB-CD1 4.1Å; W1018-I1051 VanDerWaalsContact CD1-CD1 3.49Å; W1018-I1051 HydrophobicContact CG-CD1 4.04Å; W1018-L1054 HydrophobicContact CB-CD2 3.82Å; W1018-L1054 WeakPolarHBondContact O-CD2 3.23Å; W1018-I1056 HydrophobicContact CB-CD1 4.14Å; W1018-I1056 HydrophobicContact CB-CG1 4.4Å; W1018-I1056 HydrophobicContact CD2-CD1 4.39Å; W1018-I1056 HydrophobicContact CD2-CG1 3.86Å; W1018-I1056 HydrophobicContact CE3-CG1 4.06Å; W1018-I1056 HydrophobicContact CE3-CG2 4.44Å; W1018-I1056 HydrophobicContact CG-CD1 4.01Å; W1018-I1056 HydrophobicContact CG-CG1 4.02Å; W1018-I1056 HydrophobicContact CH2-CG2 4.06Å; W1018-I1056 HydrophobicContact CZ2-CG2 4.14Å; W1018-I1056 HydrophobicContact CZ3-CG2 4.22Å; W1018-F1073 HydrophobicContact CH2-CD2 4.06Å; W1018-F1073 HydrophobicContact CH2-CE2 4.36Å; W1018-F1073 HydrophobicContact CH2-CG 4.43Å; W1018-L1075 HydrophobicContact CE3-CD2 3.98Å; W1018-L1075 HydrophobicContact CZ3-CD1 4.17Å; W1018-L1075 HydrophobicContact CZ3-CD2 4.21Å
1019	K	89.4	Confident	89.3	Confident	55 Å²	55	37.4 Å²	37.4	24%	0.239	22%	0.222	C	C	.	.	H	α-helix	trans	-64.3	-48.8	167	-64.5	170.3	-162.4	162.9	0	111.2	T1015 E1016 F1017 V1021 W1022 D1023 W1053	T1015-K1019 WeakPolarHBondContact O-CG 3.24Å; E1016-K1019 HydrophobicContact CG-CD 4.25Å; E1016-K1019 WeakPolarHBondContact O-CB 3.47Å; E1016-K1019 PolarHBondContact O-N 3.44Å; E1016-K1019 IonicContact OE1-NZ 2.74Å; E1016-K1019 PolarHBondContact OE1-NZ 2.83Å; F1017-K1019 VanDerWaalsContact C-N 3.26Å; F1017-K1019 PolarHBondContact O-N 2.87Å; K1019-V1021 VanDerWaalsContact C-N 3.29Å; K1019-V1021 PolarHBondContact O-N 3.28Å; K1019-W1022 PolarHBondContact O-N 3.36Å; K1019-W1022 VanDerWaalsContact O-N 3.09Å; K1019-D1023 VanDerWaalsContact O-CB 3.32Å; K1019-D1023 WeakPolarHBondContact O-CB 3.48Å; K1019-D1023 PolarHBondContact O-N 2.95Å; K1019-W1053 HydrophobicContact CG-CZ2 4.4Å
1020	V	89.4	Confident	89.4	Confident	33 Å²	33	37.2 Å²	37.2	20%	0.2	22%	0.22	C	C	.	.	H	α-helix	trans	-59.8	-38.6	177.1	171	0	0	0	0	111.9	I1004 E1016 F1017 A1024	I1004-V1020 HydrophobicContact CD1-CG1 4.26Å; I1004-V1020 HydrophobicContact CG2-CG1 4.33Å; E1016-V1020 WeakPolarHBondContact O-CG2 3.05Å; E1016-V1020 PolarHBondContact O-N 2.95Å; F1017-V1020 PolarHBondContact O-N 2.98Å; F1017-V1020 VanDerWaalsContact O-N 3.09Å; V1020-A1024 WeakPolarHBondContact O-CB 3.49Å; V1020-A1024 PolarHBondContact O-N 3.04Å; V1020-A1024 VanDerWaalsContact O-N 3.09Å
1021	V	92.4	Very high	89.9	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.9	-44.9	173.3	173.2	0	0	0	0	111.5	F1017 W1018 K1019 N1025 S1026 I1029 L1075 V1133	F1017-V1021 HydrophobicContact CD1-CG2 4.11Å; F1017-V1021 HydrophobicContact CE1-CG2 3.57Å; F1017-V1021 HydrophobicContact CE2-CG2 4.29Å; F1017-V1021 HydrophobicContact CZ-CG2 3.69Å; F1017-V1021 WeakPolarHBondContact O-CG2 3.41Å; F1017-V1021 PolarHBondContact O-N 2.95Å; W1018-V1021 HydrophobicContact CE3-CB 4.21Å; W1018-V1021 HydrophobicContact CE3-CG1 4.18Å; W1018-V1021 HydrophobicContact CE3-CG2 4.31Å; W1018-V1021 HydrophobicContact CZ3-CG1 4.25Å; K1019-V1021 VanDerWaalsContact C-N 3.29Å; K1019-V1021 PolarHBondContact O-N 3.28Å; V1021-N1025 PolarHBondContact O-N 3.06Å; V1021-S1026 PolarHBondContact O-N 2.97Å; V1021-I1029 HydrophobicContact CG1-CD1 4.32Å; V1021-I1029 HydrophobicContact CG2-CD1 4.02Å; V1021-I1029 HydrophobicContact CG2-CG1 4.32Å; V1021-L1075 HydrophobicContact CG1-CD2 4.09Å; V1021-V1133 HydrophobicContact CG2-CG2 4.33Å
1022	W	91.6	Very high	90.5	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.015	17%	0.165	C	C	.	.	H	α-helix	trans	-68.5	-52.3	178.7	-176.7	-90	0	0	0	112.8	W1018 K1019 A1024 N1025 W1053 L1054 L1075 S1077 E1080 Y1082 L1084	W1018-W1022 WeakPolarHBondContact O-CB 3.35Å; W1018-W1022 PolarHBondContact O-N 3.39Å; K1019-W1022 PolarHBondContact O-N 3.36Å; K1019-W1022 VanDerWaalsContact O-N 3.09Å; W1022-A1024 PolarHBondContact O-N 2.82Å; W1022-N1025 WeakPolarHBondContact O-CA 3.42Å; W1022-N1025 PolarHBondContact O-N 3.29Å; W1022-W1053 AromaticContact CD1-CH2 3.62Å; W1022-W1053 AromaticContact CD1-CZ3 3.77Å; W1022-W1053 HydrophobicContact CG-CH2 4.2Å; W1022-W1053 HydrophobicContact CG-CZ3 4.22Å; W1022-W1053 AromaticContact NE1-CZ3 3.77Å; W1022-L1054 HydrophobicContact CB-CD1 4.29Å; W1022-L1054 HydrophobicContact CB-CD2 4.22Å; W1022-L1054 HydrophobicContact CD2-CD1 3.71Å; W1022-L1054 HydrophobicContact CE3-CD1 3.5Å; W1022-L1054 VanDerWaalsContact CE3-CD1 3.5Å; W1022-L1054 HydrophobicContact CG-CD1 4.07Å; W1022-L1054 HydrophobicContact CZ3-CD1 4.09Å; W1022-L1075 HydrophobicContact CE3-CB 3.74Å; W1022-L1075 HydrophobicContact CE3-CD2 4.14Å; W1022-L1075 HydrophobicContact CZ3-CB 3.66Å; W1022-S1077 VanDerWaalsContact CZ2-CB 3.45Å; W1022-E1080 HydrophobicContact CZ2-CB 4.41Å; W1022-E1080 PolarHBondContact NE1-OE2 2.82Å; W1022-Y1082 AromaticContact CE2-CZ 3.92Å; W1022-Y1082 AromaticContact CH2-CD2 3.94Å; W1022-Y1082 HydrophobicContact CH2-CD2 3.94Å; W1022-Y1082 AromaticContact CH2-CE2 3.58Å; W1022-Y1082 HydrophobicContact CH2-CE2 3.58Å; W1022-Y1082 AromaticContact CH2-CZ 3.97Å; W1022-Y1082 HydrophobicContact CZ2-CD2 4.2Å; W1022-Y1082 AromaticContact CZ2-CE1 3.97Å; W1022-Y1082 HydrophobicContact CZ2-CE1 3.97Å; W1022-Y1082 AromaticContact CZ2-CE2 3.54Å; W1022-Y1082 HydrophobicContact CZ2-CE2 3.54Å; W1022-Y1082 AromaticContact CZ2-CZ 3.4Å; W1022-Y1082 VanDerWaalsContact CZ2-CZ 3.4Å; W1022-Y1082 HydrophobicContact CZ3-CE2 4.26Å; W1022-L1084 HydrophobicContact CE3-CB 4.05Å; W1022-L1084 HydrophobicContact CE3-CD2 4.3Å; W1022-L1084 HydrophobicContact CZ3-CB 3.7Å
1023	D	88.5	Confident	91.2	Very high	119 Å²	119	22.9 Å²	22.9	64%	0.636	13%	0.129	S	C	*	.	H	α-helix	trans	-64.2	-28.5	-176.5	-62.8	-17.6	0	0	0	111.7	K1019	K1019-D1023 VanDerWaalsContact O-CB 3.32Å; K1019-D1023 WeakPolarHBondContact O-CB 3.48Å; K1019-D1023 PolarHBondContact O-N 2.95Å
1024	A	87.2	Confident	91.3	Very high	26 Å²	26	23.6 Å²	23.6	22%	0.215	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-2.3	171.4	0	0	0	0	0	114.1	I1004 V1020 W1022 S1026 P1131	I1004-A1024 HydrophobicContact CD1-CB 3.57Å; V1020-A1024 WeakPolarHBondContact O-CB 3.49Å; V1020-A1024 PolarHBondContact O-N 3.04Å; V1020-A1024 VanDerWaalsContact O-N 3.09Å; W1022-A1024 PolarHBondContact O-N 2.82Å; A1024-S1026 PolarHBondContact O-N 3.04Å; A1024-P1131 HydrophobicContact CB-CG 3.91Å
1025	N	90.3	Very high	90.9	Very high	77 Å²	77	29.8 Å²	29.8	41%	0.412	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	36.5	-173.5	-169	47.1	0	0	0	113.4	V1021 W1022 S1027 A1130	V1021-N1025 PolarHBondContact O-N 3.06Å; W1022-N1025 WeakPolarHBondContact O-CA 3.42Å; W1022-N1025 PolarHBondContact O-N 3.29Å; N1025-S1027 PolarHBondContact O-N 3.29Å; N1025-A1130 WeakPolarHBondContact O-CB 3.4Å
1026	S	90.5	Very high	90.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.184	C	C	.	.			trans	-80.3	110.4	-172	-171.9	0	0	0	0	111.9	V1021 A1024 L1028 C1086 P1131 V1133	V1021-S1026 PolarHBondContact O-N 2.97Å; A1024-S1026 PolarHBondContact O-N 3.04Å; S1026-L1028 VanDerWaalsContact C-N 3.29Å; S1026-L1028 PolarHBondContact OG-O 3.33Å; S1026-C1086 PolarHBondContact O-SG 3.3Å; S1026-P1131 WeakPolarHBondContact CB-O 3.35Å; S1026-P1131 PolarHBondContact OG-O 3.04Å; S1026-V1133 WeakPolarHBondContact OG-CG2 3.47Å
1027	S	91	Very high	90.7	Very high	21 Å²	21	35.7 Å²	35.7	15%	0.147	19%	0.189	C	C	.	.			trans	-83.3	-0.2	176.7	57.2	0	0	0	0	114.1	N1025 A1085 C1086 T1087	N1025-S1027 PolarHBondContact O-N 3.29Å; S1027-A1085 WeakPolarHBondContact CA-O 3.49Å; S1027-A1085 VanDerWaalsContact CB-O 3.31Å; S1027-A1085 WeakPolarHBondContact CB-O 3.31Å; S1027-C1086 WeakPolarHBondContact O-CA 3.27Å; S1027-T1087 PolarHBondContact O-N 3.17Å
1028	L	92.2	Very high	90.4	Very high	9 Å²	9	42.1 Å²	42.1	5%	0.047	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	114.5	-172.2	-176.4	57.1	0	0	0	112.6	S1026 T1087 L1089 L1118 F1125 I1132 V1133	S1026-L1028 VanDerWaalsContact C-N 3.29Å; S1026-L1028 PolarHBondContact OG-O 3.33Å; L1028-T1087 WeakPolarHBondContact CA-O 3.42Å; L1028-L1089 HydrophobicContact CD1-CD1 4.04Å; L1028-L1089 HydrophobicContact CD1-CG 4.28Å; L1028-L1118 HydrophobicContact CD2-CD2 4.16Å; L1028-F1125 HydrophobicContact CB-CE1 4.4Å; L1028-F1125 HydrophobicContact CD1-CE2 4.42Å; L1028-F1125 HydrophobicContact CD1-CZ 4.32Å; L1028-F1125 HydrophobicContact CD2-CD2 4.47Å; L1028-I1132 HydrophobicContact CD2-CD1 4.12Å; L1028-I1132 HydrophobicContact CD2-CG1 4.19Å; L1028-I1132 HydrophobicContact CD2-CG2 4.38Å; L1028-I1132 HydrophobicContact CG-CG2 4.19Å; L1028-V1133 PolarHBondContact O-N 2.59Å
1029	I	95.1	Very high	90.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	138.3	172.2	-57.7	163.4	0	0	0	108.6	F1017 W1018 V1021 F1040 T1087 L1088 L1089 V1133 V1135	F1017-I1029 HydrophobicContact CE1-CD1 4.01Å; F1017-I1029 HydrophobicContact CZ-CD1 4.04Å; F1017-I1029 HydrophobicContact CZ-CG1 4.4Å; F1017-I1029 HydrophobicContact CZ-CG2 4.25Å; W1018-I1029 HydrophobicContact CH2-CD1 3.84Å; W1018-I1029 HydrophobicContact CZ3-CD1 3.76Å; V1021-I1029 HydrophobicContact CG1-CD1 4.32Å; V1021-I1029 HydrophobicContact CG2-CD1 4.02Å; V1021-I1029 HydrophobicContact CG2-CG1 4.32Å; I1029-F1040 HydrophobicContact CG2-CZ 4.45Å; I1029-T1087 PolarHBondContact N-O 2.74Å; I1029-L1088 HydrophobicContact CB-CB 4.15Å; I1029-L1088 HydrophobicContact CB-CD1 4.27Å; I1029-L1088 HydrophobicContact CB-CG 4.05Å; I1029-L1088 HydrophobicContact CD1-CD1 4.32Å; I1029-L1088 HydrophobicContact CG2-CD1 3.88Å; I1029-L1088 HydrophobicContact CG2-CG 3.92Å; I1029-L1088 CarbonylContact O-C 3.53Å; I1029-L1088 WeakPolarHBondContact O-CA 3.43Å; I1029-L1089 PolarHBondContact O-N 2.55Å; I1029-V1133 CarbonylContact C-O 3.6Å; I1029-V1133 VanDerWaalsContact CA-O 3.26Å; I1029-V1133 WeakPolarHBondContact CA-O 3.33Å; I1029-V1133 HydrophobicContact CG1-CB 4.14Å; I1029-V1133 HydrophobicContact CG1-CG1 4.37Å; I1029-V1133 HydrophobicContact CG2-CG1 4.36Å; I1029-V1135 HydrophobicContact CG2-CG2 4.28Å
1030	I	95.3	Very high	90.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	116	168.6	-49.4	179.3	0	0	0	108.1	L1032 L1089 L1114 L1118 I1132 V1133 L1134 V1135 F1146	I1030-L1032 HydrophobicContact CG2-CD2 3.75Å; I1030-L1032 HydrophobicContact CG2-CG 4.36Å; I1030-L1089 CarbonylContact C-O 3.6Å; I1030-L1089 WeakPolarHBondContact CA-O 3.35Å; I1030-L1114 HydrophobicContact CG2-CD2 4.28Å; I1030-L1118 HydrophobicContact CD1-CD1 3.54Å; I1030-L1118 HydrophobicContact CD1-CD2 3.6Å; I1030-L1118 HydrophobicContact CD1-CG 4.23Å; I1030-L1118 HydrophobicContact CG1-CD2 4.34Å; I1030-I1132 HydrophobicContact CD1-CG2 3.88Å; I1030-I1132 HydrophobicContact CG1-CG2 3.99Å; I1030-V1133 PolarHBondContact N-O 3.37Å; I1030-L1134 HydrophobicContact CB-CD2 3.73Å; I1030-L1134 HydrophobicContact CD1-CD2 3.77Å; I1030-L1134 HydrophobicContact CG1-CD2 3.98Å; I1030-L1134 WeakPolarHBondContact O-CA 3.45Å; I1030-V1135 PolarHBondContact O-N 3.17Å; I1030-F1146 HydrophobicContact CD1-CE1 3.61Å; I1030-F1146 HydrophobicContact CD1-CZ 3.91Å
1031	C	96	Very high	90.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	115.3	177.8	-168.3	0	0	0	0	109.1	L1088 L1089 H1090 F1091	C1031-L1088 HydrophobicContact CB-CD2 4.15Å; C1031-L1089 PolarHBondContact N-O 2.85Å; C1031-H1090 HydrophobicContact CB-CB 4.5Å; C1031-H1090 CarbonylContact O-C 3.56Å; C1031-H1090 WeakPolarHBondContact O-CA 3.32Å; C1031-H1090 PolarHBondContact O-CD2 3Å; C1031-F1091 PolarHBondContact O-N 3.48Å
1032	L	96.1	Very high	90.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.218	C	C	.	.			trans	-102.4	19.4	177.3	-50.5	176.6	0	0	0	111.1	I1030 F1091 W1094 V1135 D1136 R1142 V1143 F1146	I1030-L1032 HydrophobicContact CG2-CD2 3.75Å; I1030-L1032 HydrophobicContact CG2-CG 4.36Å; L1032-F1091 WeakPolarHBondContact CA-O 3.3Å; L1032-F1091 HydrophobicContact CD2-CB 3.87Å; L1032-W1094 HydrophobicContact CB-CZ3 4.26Å; L1032-W1094 HydrophobicContact CD1-CH2 4.45Å; L1032-W1094 HydrophobicContact CD1-CZ3 4.04Å; L1032-W1094 HydrophobicContact CD2-CZ3 4.36Å; L1032-W1094 HydrophobicContact CG-CZ3 4.45Å; L1032-V1135 PolarHBondContact N-O 2.89Å; L1032-D1136 HydrophobicContact CB-CB 4.19Å; L1032-R1142 HydrophobicContact CB-CB 4.13Å; L1032-R1142 HydrophobicContact CD1-CB 4.14Å; L1032-R1142 WeakPolarHBondContact O-CD 3.5Å; L1032-R1142 PolarHBondContact O-NH1 2.93Å; L1032-V1143 HydrophobicContact CD1-CG1 4.05Å; L1032-F1146 HydrophobicContact CD1-CB 3.63Å; L1032-F1146 HydrophobicContact CD1-CD2 4.44Å; L1032-F1146 HydrophobicContact CD1-CG 4.01Å; L1032-F1146 HydrophobicContact CD2-CD2 4.38Å
1033	S	93.3	Very high	89.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.244	C	C	.	.			trans	-83.7	151.5	-176.6	-71.3	0	0	0	0	113	H1008 H1090 D1136 N1137	H1008-S1033 VanDerWaalsContact ND1-CB 3.26Å; H1008-S1033 WeakPolarHBondContact ND1-CB 3.28Å; H1008-S1033 PolarHBondContact ND1-OG 3.06Å; S1033-H1090 PolarHBondContact O-NE2 3.25Å; S1033-D1136 VanDerWaalsContact OG-C 3.27Å; S1033-N1137 WeakPolarHBondContact CA-OD1 3.26Å; S1033-N1137 WeakPolarHBondContact CB-OD1 3.31Å; S1033-N1137 PolarHBondContact OG-N 3.34Å; S1033-N1137 PolarHBondContact OG-OD1 3.19Å
1034	D	87.7	Confident	89.8	Confident	50 Å²	50	46.3 Å²	46.3	27%	0.267	24%	0.244	S	C	.	.			trans	-65.2	146.6	175	-58.1	-40.3	0	0	0	111.7	N1036 L1037 N1137 R1142	D1034-N1036 PolarHBondContact O-N 3.23Å; D1034-L1037 PolarHBondContact O-N 2.78Å; D1034-N1137 PolarHBondContact N-OD1 3.47Å; D1034-N1137 VanDerWaalsContact N-OD1 3.14Å; D1034-N1137 PolarHBondContact OD2-ND2 3.13Å; D1034-R1142 IonicContact OD1-CZ 3.99Å; D1034-R1142 IonicContact OD1-NH1 3.15Å; D1034-R1142 PolarHBondContact OD1-NH1 2.81Å; D1034-R1142 IonicContact OD1-NH2 3.2Å; D1034-R1142 PolarHBondContact OD1-NH2 3.42Å; D1034-R1142 IonicContact OD2-NH1 3.9Å; D1034-R1142 IonicContact OD2-NH2 3.51Å; D1034-R1142 PolarHBondContact OD2-NH2 2.88Å
1035	Q	82.5	Confident	89.7	Confident	138 Å²	138	48.5 Å²	48.5	65%	0.645	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-13.2	178.2	-58.5	-176.1	-3.8	0	0	114.3	L1037 S1092	Q1035-L1037 VanDerWaalsContact C-N 3.3Å; Q1035-L1037 PolarHBondContact O-N 2.75Å; Q1035-S1092 PolarHBondContact NE2-OG 2.98Å
1036	N	83.7	Confident	89.4	Confident	156 Å²	156	53.1 Å²	53.1	83%	0.834	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-4.7	-178.7	-62.2	-33.7	0	0	0	113.9	D1034	D1034-N1036 PolarHBondContact O-N 3.23Å
1037	L	86.7	Confident	89.3	Confident	57 Å²	57	56.6 Å²	56.6	30%	0.298	29%	0.29	S	S	.	.	S	Bend	trans	-93.6	143.1	176.3	-63.6	-178.5	0	0	0	111.2	H1008 D1034 Q1035 N1137	H1008-L1037 HydrophobicContact CB-CD1 3.78Å; D1034-L1037 PolarHBondContact O-N 2.78Å; Q1035-L1037 VanDerWaalsContact C-N 3.3Å; Q1035-L1037 PolarHBondContact O-N 2.75Å; L1037-N1137 HydrophobicContact CD1-CB 4.28Å; L1037-N1137 WeakPolarHBondContact CD1-OD1 3.49Å
1038	L	87.2	Confident	89.2	Confident	139 Å²	139	58.9 Å²	58.9	73%	0.728	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-68.6	131	-179.1	-70.1	171.7	0	0	0	111	H1008 F1040	H1008-L1038 PolarHBondContact NE2-O 3.43Å; H1008-L1038 VanDerWaalsContact NE2-O 3.13Å; L1038-F1040 PolarHBondContact O-N 3.41Å
1039	P	89.2	Confident	89.1	Confident	42 Å²	42	62.4 Å²	62.4	27%	0.273	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-61.4	134.8	-178.1	25.3	-35	0	0	0	112.6	W1041 D1043	P1039-W1041 VanDerWaalsContact C-N 3.33Å; P1039-W1041 HydrophobicContact CB-CD2 3.73Å; P1039-W1041 HydrophobicContact CB-CE3 4.17Å; P1039-W1041 HydrophobicContact CB-CG 4.17Å; P1039-W1041 HydrophobicContact CB-CH2 4.31Å; P1039-W1041 HydrophobicContact CB-CZ2 3.87Å; P1039-W1041 HydrophobicContact CB-CZ3 4.44Å; P1039-D1043 WeakPolarHBondContact CG-OD1 3.21Å
1040	F	91.5	Very high	88.9	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.34	C	S	.	.	S	Bend	trans	-86.6	-5.4	173.4	57.7	-98.6	0	0	0	113.2	H1008 P1009 V1014 F1017 W1018 I1029 L1038 R1049 L1088 V1135	H1008-F1040 AromaticContact CE1-CD1 3.75Å; H1008-F1040 AromaticContact CE1-CE1 3.81Å; H1008-F1040 AromaticContact NE2-CD1 3.6Å; P1009-F1040 HydrophobicContact CB-CB 4.04Å; P1009-F1040 HydrophobicContact CB-CG 4.37Å; P1009-F1040 HydrophobicContact CG-CB 4.24Å; P1009-F1040 HydrophobicContact CG-CD1 4.09Å; P1009-F1040 HydrophobicContact CG-CD2 4.44Å; P1009-F1040 HydrophobicContact CG-CG 4.02Å; V1014-F1040 HydrophobicContact CB-CB 4.49Å; V1014-F1040 HydrophobicContact CG1-CB 3.98Å; V1014-F1040 VanDerWaalsContact CG1-O 3.23Å; V1014-F1040 WeakPolarHBondContact CG1-O 3.49Å; V1014-F1040 HydrophobicContact CG2-CB 3.87Å; F1017-F1040 AromaticContact CD1-CD2 3.83Å; F1017-F1040 HydrophobicContact CD1-CD2 3.83Å; F1017-F1040 AromaticContact CD1-CE2 3.95Å; F1017-F1040 HydrophobicContact CD1-CE2 3.95Å; F1017-F1040 AromaticContact CE1-CD2 3.61Å; F1017-F1040 HydrophobicContact CE1-CD2 3.61Å; F1017-F1040 AromaticContact CE1-CE2 3.25Å; F1017-F1040 HydrophobicContact CE1-CE2 3.25Å; F1017-F1040 HydrophobicContact CE1-CZ 4.09Å; F1017-F1040 HydrophobicContact CZ-CD2 4.32Å; F1017-F1040 AromaticContact CZ-CE2 3.62Å; F1017-F1040 HydrophobicContact CZ-CE2 3.62Å; F1017-F1040 HydrophobicContact CZ-CZ 4Å; W1018-F1040 AromaticContact CZ2-CD2 3.98Å; W1018-F1040 HydrophobicContact CZ2-CD2 3.98Å; W1018-F1040 HydrophobicContact CZ2-CE2 4.22Å; W1018-F1040 PolarHBondContact NE1-O 3Å; I1029-F1040 HydrophobicContact CG2-CZ 4.45Å; L1038-F1040 PolarHBondContact O-N 3.41Å; F1040-R1049 PolarHBondContact O-NH1 3.21Å; F1040-L1088 HydrophobicContact CE2-CD1 3.71Å; F1040-L1088 HydrophobicContact CZ-CD1 3.7Å; F1040-V1135 HydrophobicContact CE1-CG1 4.29Å; F1040-V1135 HydrophobicContact CZ-CG2 4.39Å
1041	W	91.9	Very high	88.4	Confident	17 Å²	17	66.9 Å²	66.9	6%	0.064	34%	0.343	C	S	.	.	S	Bend	trans	-92.1	179.9	174.8	52.4	97.7	0	0	0	111.7	W1018 P1039 R1049 F1071 F1073 L1088	W1018-W1041 HydrophobicContact CZ2-CB 3.98Å; P1039-W1041 VanDerWaalsContact C-N 3.33Å; P1039-W1041 HydrophobicContact CB-CD2 3.73Å; P1039-W1041 HydrophobicContact CB-CE3 4.17Å; P1039-W1041 HydrophobicContact CB-CG 4.17Å; P1039-W1041 HydrophobicContact CB-CH2 4.31Å; P1039-W1041 HydrophobicContact CB-CZ2 3.87Å; P1039-W1041 HydrophobicContact CB-CZ3 4.44Å; W1041-R1049 PolarHBondContact O-NH1 3.02Å; W1041-F1071 HydrophobicContact CZ2-CE1 4.33Å; W1041-F1071 HydrophobicContact CZ2-CE2 4.29Å; W1041-F1071 AromaticContact CZ2-CZ 3.97Å; W1041-F1071 HydrophobicContact CZ2-CZ 3.97Å; W1041-F1071 AromaticContact NE1-CD1 3.68Å; W1041-F1071 AromaticContact NE1-CE1 3.35Å; W1041-F1071 VanDerWaalsContact NE1-CE1 3.35Å; W1041-F1071 AromaticContact NE1-CZ 3.89Å; W1041-F1073 HydrophobicContact CB-CE1 3.85Å; W1041-F1073 HydrophobicContact CB-CE2 4.14Å; W1041-F1073 HydrophobicContact CB-CZ 3.46Å; W1041-F1073 VanDerWaalsContact CB-CZ 3.46Å; W1041-F1073 AromaticContact CD1-CZ 3.76Å; W1041-F1073 HydrophobicContact CG-CE1 4.38Å; W1041-F1073 AromaticContact CG-CZ 3.73Å; W1041-F1073 HydrophobicContact CG-CZ 3.73Å; W1041-L1088 HydrophobicContact CD2-CD1 4.25Å; W1041-L1088 HydrophobicContact CE3-CD1 3.67Å; W1041-L1088 HydrophobicContact CH2-CD2 4.38Å; W1041-L1088 HydrophobicContact CZ3-CD1 3.94Å; W1041-L1088 HydrophobicContact CZ3-CD2 4.36Å
1042	P	90.2	Very high	87.9	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.006	38%	0.376	C	S	.	.			trans	-71.9	145.9	165.8	-10.3	25.9	0	0	0	111.2	Q1047 R1049 I1056 F1058 F1073	P1042-Q1047 HydrophobicContact CB-CB 4.1Å; P1042-Q1047 HydrophobicContact CB-CG 4.29Å; P1042-Q1047 VanDerWaalsContact CB-OE1 3.26Å; P1042-R1049 HydrophobicContact CB-CB 4.3Å; P1042-R1049 HydrophobicContact CG-CB 3.82Å; P1042-I1056 HydrophobicContact CG-CG2 4.25Å; P1042-I1056 WeakPolarHBondContact CG-O 3.48Å; P1042-F1058 HydrophobicContact CB-CB 4.01Å; P1042-F1058 HydrophobicContact CB-CD1 4.48Å; P1042-F1058 HydrophobicContact CG-CB 4.04Å; P1042-F1058 VanDerWaalsContact O-CD1 3.22Å; P1042-F1058 WeakPolarHBondContact O-CD1 3.48Å; P1042-F1073 HydrophobicContact CG-CE1 4.46Å
1043	D	81.2	Confident	87.6	Confident	102 Å²	102	72.1 Å²	72.1	55%	0.545	38%	0.384	S	S	.	.	S	Bend	trans	-82.8	-33.9	-172.2	-62.7	-60.9	0	0	0	113.6	P1039	P1039-D1043 WeakPolarHBondContact CG-OD1 3.21Å
1044	E	87	Confident	87.5	Confident	137 Å²	137	72.1 Å²	72.1	64%	0.64	38%	0.384	S	S	*	.	S	Bend	trans	-112.6	142.9	-173.4	-66.4	-177.6	162.8	0	0	112.1	Q1047 F1058	E1044-Q1047 HydrophobicContact CB-CB 4.15Å; E1044-Q1047 WeakPolarHBondContact O-CB 3.38Å; E1044-Q1047 PolarHBondContact O-N 3Å; E1044-F1058 WeakPolarHBondContact O-CD1 3.43Å
1045	V	85.3	Confident	87.8	Confident	73 Å²	73	71.7 Å²	71.7	44%	0.442	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	142.9	174.6	-174.2	0	0	0	0	109.5	Q1047 F1058 A1059	V1045-Q1047 PolarHBondContact O-N 3.46Å; V1045-F1058 HydrophobicContact CG2-CD1 4.41Å; V1045-F1058 HydrophobicContact CG2-CE1 4.03Å; V1045-F1058 HydrophobicContact CG2-CE2 4.21Å; V1045-F1058 HydrophobicContact CG2-CZ 3.9Å; V1045-A1059 WeakPolarHBondContact CG1-O 3.49Å
1046	E	84.9	Confident	88.4	Confident	174 Å²	174	65.1 Å²	65.1	81%	0.813	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	-1.3	-166.8	-48.9	-172.6	164.8	0	0	115.1	F1058	E1046-F1058 PolarHBondContact N-O 3.5Å
1047	Q	88.2	Confident	88.8	Confident	72 Å²	72	60.1 Å²	60.1	34%	0.336	32%	0.322	S	S	.	.			trans	-75.5	133.8	173.2	-163.9	-173.4	56.9	0	0	111.5	P1042 E1044 V1045 F1058	P1042-Q1047 HydrophobicContact CB-CB 4.1Å; P1042-Q1047 HydrophobicContact CB-CG 4.29Å; P1042-Q1047 VanDerWaalsContact CB-OE1 3.26Å; E1044-Q1047 HydrophobicContact CB-CB 4.15Å; E1044-Q1047 WeakPolarHBondContact O-CB 3.38Å; E1044-Q1047 PolarHBondContact O-N 3Å; V1045-Q1047 PolarHBondContact O-N 3.46Å; Q1047-F1058 PolarHBondContact O-N 3.03Å
1048	T	89.2	Confident	89.2	Confident	69 Å²	69	57.4 Å²	57.4	42%	0.423	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	117.7	173.9	-63.2	0	0	0	0	111.4	H1055 I1056 N1057	T1048-H1055 HydrophobicContact CG2-CB 3.81Å; T1048-I1056 CarbonylContact C-O 3.58Å; T1048-I1056 WeakPolarHBondContact CA-O 3.09Å; T1048-N1057 HydrophobicContact CG2-CB 4.47Å; T1048-N1057 WeakPolarHBondContact OG1-CB 3.2Å; T1048-N1057 VanDerWaalsContact OG1-CG 3.32Å; T1048-N1057 PolarHBondContact OG1-OD1 2.85Å
1049	R	89.6	Confident	89.4	Confident	84 Å²	84	53.6 Å²	53.6	32%	0.317	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	116.6	173.8	-172.2	172.9	-174.9	154.4	2.1	109.1	F1040 W1041 P1042 I1051 I1056	F1040-R1049 PolarHBondContact O-NH1 3.21Å; W1041-R1049 PolarHBondContact O-NH1 3.02Å; P1042-R1049 HydrophobicContact CB-CB 4.3Å; P1042-R1049 HydrophobicContact CG-CB 3.82Å; R1049-I1051 HydrophobicContact CG-CG1 4.4Å; R1049-I1056 PolarHBondContact N-O 2.71Å; R1049-I1056 WeakPolarHBondContact O-CD1 3.35Å; R1049-I1056 PolarHBondContact O-N 3.33Å
1050	T	89.8	Confident	89.6	Confident	82 Å²	82	57.7 Å²	57.7	50%	0.503	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	132.1	179.7	-63.5	0	0	0	0	111.1	H1055	T1050-H1055 WeakPolarHBondContact CG2-ND1 3.46Å; T1050-H1055 PolarHBondContact OG1-ND1 3Å
1051	I	84.9	Confident	89.6	Confident	12 Å²	12	62.2 Å²	62.2	6%	0.062	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	77.7	-173.1	-58.4	-168.7	0	0	0	108.1	V1014 T1015 W1018 R1049 W1053 L1054 I1056	V1014-I1051 HydrophobicContact CG1-CD1 4.45Å; T1015-I1051 HydrophobicContact CG2-CG2 3.47Å; T1015-I1051 VanDerWaalsContact CG2-CG2 3.47Å; W1018-I1051 HydrophobicContact CB-CD1 4.1Å; W1018-I1051 VanDerWaalsContact CD1-CD1 3.49Å; W1018-I1051 HydrophobicContact CG-CD1 4.04Å; R1049-I1051 HydrophobicContact CG-CG1 4.4Å; I1051-W1053 PolarHBondContact O-N 3.06Å; I1051-L1054 PolarHBondContact N-O 3.44Å; I1051-L1054 PolarHBondContact O-N 3.36Å; I1051-I1056 HydrophobicContact CB-CD1 4.19Å; I1051-I1056 HydrophobicContact CD1-CD1 3.55Å; I1051-I1056 HydrophobicContact CG1-CD1 3.7Å
1052	G	85	Confident	89.6	Confident	68 Å²	68	63.3 Å²	63.3	70%	0.701	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	-103	-174.4	0	0	0	0	0	111.4
1053	W	90	Very high	89.6	Confident	42 Å²	42	69.2 Å²	69.2	16%	0.159	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-1.8	179.9	53.4	-94.3	0	0	0	113.5	K1019 W1022 I1051 S1077 D1078 R1079	K1019-W1053 HydrophobicContact CG-CZ2 4.4Å; W1022-W1053 AromaticContact CD1-CH2 3.62Å; W1022-W1053 AromaticContact CD1-CZ3 3.77Å; W1022-W1053 HydrophobicContact CG-CH2 4.2Å; W1022-W1053 HydrophobicContact CG-CZ3 4.22Å; W1022-W1053 AromaticContact NE1-CZ3 3.77Å; I1051-W1053 PolarHBondContact O-N 3.06Å; W1053-S1077 CarbonylContact O-C 3.48Å; W1053-S1077 WeakPolarHBondContact O-CA 3.49Å; W1053-D1078 HydrophobicContact CB-CB 4.09Å; W1053-D1078 PolarHBondContact O-N 3.24Å; W1053-R1079 HydrophobicContact CB-CG 4.24Å; W1053-R1079 HydrophobicContact CG-CG 4.43Å
1054	L	92.4	Very high	89.9	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	130.1	-176.4	-178.9	68.1	0	0	0	109.6	W1018 W1022 I1051 I1056 L1075	W1018-L1054 HydrophobicContact CB-CD2 3.82Å; W1018-L1054 WeakPolarHBondContact O-CD2 3.23Å; W1022-L1054 HydrophobicContact CB-CD1 4.29Å; W1022-L1054 HydrophobicContact CB-CD2 4.22Å; W1022-L1054 HydrophobicContact CD2-CD1 3.71Å; W1022-L1054 HydrophobicContact CE3-CD1 3.5Å; W1022-L1054 VanDerWaalsContact CE3-CD1 3.5Å; W1022-L1054 HydrophobicContact CG-CD1 4.07Å; W1022-L1054 HydrophobicContact CZ3-CD1 4.09Å; I1051-L1054 PolarHBondContact N-O 3.44Å; I1051-L1054 PolarHBondContact O-N 3.36Å; L1054-I1056 HydrophobicContact CD2-CD1 4.26Å; L1054-I1056 HydrophobicContact CG-CD1 4.13Å; L1054-L1075 HydrophobicContact CD1-CB 4.36Å
1055	H	93.4	Very high	89.8	Confident	40 Å²	40	61.9 Å²	61.9	19%	0.185	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	127.2	177.1	-44.1	-84.1	0	0	0	109.9	T1048 T1050 L1075 T1076 D1078	T1048-H1055 HydrophobicContact CG2-CB 3.81Å; T1050-H1055 WeakPolarHBondContact CG2-ND1 3.46Å; T1050-H1055 PolarHBondContact OG1-ND1 3Å; H1055-L1075 CarbonylContact O-C 3.54Å; H1055-L1075 VanDerWaalsContact O-CA 3.3Å; H1055-L1075 WeakPolarHBondContact O-CA 3.13Å; H1055-T1076 PolarHBondContact N-O 2.85Å; H1055-T1076 PolarHBondContact O-N 2.98Å; H1055-D1078 IonicContact NE2-OD1 2.78Å; H1055-D1078 IonicContact NE2-OD2 3.62Å
1056	I	94.5	Very high	89.8	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	102.5	179.3	-54.1	88.2	0	0	0	107.7	W1018 P1042 T1048 R1049 I1051 L1054 F1073 L1075	W1018-I1056 HydrophobicContact CB-CD1 4.14Å; W1018-I1056 HydrophobicContact CB-CG1 4.4Å; W1018-I1056 HydrophobicContact CD2-CD1 4.39Å; W1018-I1056 HydrophobicContact CD2-CG1 3.86Å; W1018-I1056 HydrophobicContact CE3-CG1 4.06Å; W1018-I1056 HydrophobicContact CE3-CG2 4.44Å; W1018-I1056 HydrophobicContact CG-CD1 4.01Å; W1018-I1056 HydrophobicContact CG-CG1 4.02Å; W1018-I1056 HydrophobicContact CH2-CG2 4.06Å; W1018-I1056 HydrophobicContact CZ2-CG2 4.14Å; W1018-I1056 HydrophobicContact CZ3-CG2 4.22Å; P1042-I1056 HydrophobicContact CG-CG2 4.25Å; P1042-I1056 WeakPolarHBondContact CG-O 3.48Å; T1048-I1056 CarbonylContact C-O 3.58Å; T1048-I1056 WeakPolarHBondContact CA-O 3.09Å; R1049-I1056 PolarHBondContact N-O 2.71Å; R1049-I1056 WeakPolarHBondContact O-CD1 3.35Å; R1049-I1056 PolarHBondContact O-N 3.33Å; I1051-I1056 HydrophobicContact CB-CD1 4.19Å; I1051-I1056 HydrophobicContact CD1-CD1 3.55Å; I1051-I1056 HydrophobicContact CG1-CD1 3.7Å; L1054-I1056 HydrophobicContact CD2-CD1 4.26Å; L1054-I1056 HydrophobicContact CG-CD1 4.13Å; I1056-F1073 HydrophobicContact CG2-CB 4.12Å; I1056-F1073 HydrophobicContact CG2-CD1 4.1Å; I1056-F1073 HydrophobicContact CG2-CG 4.2Å; I1056-L1075 HydrophobicContact CG1-CG 4.2Å; I1056-L1075 HydrophobicContact CG2-CD1 4.19Å
1057	N	93.8	Very high	90	Very high	51 Å²	51	55.7 Å²	55.7	27%	0.273	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	127.4	178.7	-175.6	6	0	0	0	110.6	T1048 A1059 F1073 L1074	T1048-N1057 HydrophobicContact CG2-CB 4.47Å; T1048-N1057 WeakPolarHBondContact OG1-CB 3.2Å; T1048-N1057 VanDerWaalsContact OG1-CG 3.32Å; T1048-N1057 PolarHBondContact OG1-OD1 2.85Å; N1057-A1059 PolarHBondContact O-N 2.93Å; N1057-F1073 CarbonylContact O-C 3.59Å; N1057-F1073 VanDerWaalsContact O-CA 3.22Å; N1057-F1073 WeakPolarHBondContact O-CA 3.48Å; N1057-L1074 PolarHBondContact N-O 2.65Å; N1057-L1074 PolarHBondContact O-N 2.81Å
1058	F	94.8	Very high	90.2	Very high	1 Å²	1	53.2 Å²	53.2	0%	0.004	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	105.6	180	-175.8	-171.1	0	0	0	111.1	P1042 E1044 V1045 E1046 Q1047 R1060 M1061 F1071 F1073	P1042-F1058 HydrophobicContact CB-CB 4.01Å; P1042-F1058 HydrophobicContact CB-CD1 4.48Å; P1042-F1058 HydrophobicContact CG-CB 4.04Å; P1042-F1058 VanDerWaalsContact O-CD1 3.22Å; P1042-F1058 WeakPolarHBondContact O-CD1 3.48Å; E1044-F1058 WeakPolarHBondContact O-CD1 3.43Å; V1045-F1058 HydrophobicContact CG2-CD1 4.41Å; V1045-F1058 HydrophobicContact CG2-CE1 4.03Å; V1045-F1058 HydrophobicContact CG2-CE2 4.21Å; V1045-F1058 HydrophobicContact CG2-CZ 3.9Å; E1046-F1058 PolarHBondContact N-O 3.5Å; Q1047-F1058 PolarHBondContact O-N 3.03Å; F1058-R1060 WeakPolarHBondContact CE2-O 3.49Å; F1058-M1061 HydrophobicContact CE1-CE 4.41Å; F1058-M1061 HydrophobicContact CE2-CB 4.29Å; F1058-M1061 HydrophobicContact CZ-CB 4.05Å; F1058-M1061 HydrophobicContact CZ-CE 3.89Å; F1058-F1071 HydrophobicContact CE1-CD1 4.36Å; F1058-F1071 HydrophobicContact CE2-CB 4.16Å; F1058-F1071 AromaticContact CE2-CD1 3.78Å; F1058-F1071 HydrophobicContact CE2-CD1 3.78Å; F1058-F1071 HydrophobicContact CE2-CG 4.45Å; F1058-F1071 AromaticContact CZ-CD1 3.51Å; F1058-F1071 HydrophobicContact CZ-CD1 3.51Å; F1058-F1071 HydrophobicContact CZ-CE1 4.11Å; F1058-F1073 HydrophobicContact CB-CD1 3.92Å; F1058-F1073 HydrophobicContact CB-CE1 3.8Å; F1058-F1073 HydrophobicContact CD1-CE1 4.31Å; F1058-F1073 AromaticContact CD2-CD1 4Å; F1058-F1073 HydrophobicContact CD2-CD1 4Å; F1058-F1073 AromaticContact CD2-CE1 3.48Å; F1058-F1073 HydrophobicContact CD2-CE1 3.48Å; F1058-F1073 VanDerWaalsContact CD2-CE1 3.48Å; F1058-F1073 HydrophobicContact CD2-CZ 4.22Å; F1058-F1073 HydrophobicContact CE2-CE1 4.14Å; F1058-F1073 HydrophobicContact CE2-CZ 4.47Å; F1058-F1073 HydrophobicContact CG-CD1 4.16Å; F1058-F1073 AromaticContact CG-CE1 3.61Å; F1058-F1073 HydrophobicContact CG-CE1 3.61Å
1059	A	91.6	Very high	90.4	Very high	59 Å²	59	50.8 Å²	50.8	49%	0.488	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-36.5	-170.7	0	0	0	0	0	114.4	V1045 N1057 Q1072	V1045-A1059 WeakPolarHBondContact CG1-O 3.49Å; N1057-A1059 PolarHBondContact O-N 2.93Å; A1059-Q1072 PolarHBondContact N-O 2.88Å
1060	R	91.8	Very high	90.5	Very high	128 Å²	128	49.8 Å²	49.8	48%	0.483	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165	146.6	-175.5	-179.2	172	171.3	-163.6	-5.5	113.6	F1058 D1062 F1071 Q1072	F1058-R1060 WeakPolarHBondContact CE2-O 3.49Å; R1060-D1062 IonicContact CZ-OD1 2.68Å; R1060-D1062 IonicContact CZ-OD2 2.65Å; R1060-D1062 VanDerWaalsContact NE-CG 3.31Å; R1060-D1062 IonicContact NE-OD1 2.69Å; R1060-D1062 PolarHBondContact NE-OD1 2.88Å; R1060-D1062 IonicContact NE-OD2 3.14Å; R1060-D1062 PolarHBondContact NE-OD2 2.87Å; R1060-D1062 VanDerWaalsContact NE-OD2 3.08Å; R1060-D1062 IonicContact NH1-OD2 3.33Å; R1060-D1062 IonicContact NH2-OD1 2.86Å; R1060-D1062 PolarHBondContact NH2-OD1 2.87Å; R1060-D1062 IonicContact NH2-OD2 3.08Å; R1060-D1062 PolarHBondContact NH2-OD2 2.79Å; R1060-F1071 CarbonylContact O-C 3.5Å; R1060-F1071 WeakPolarHBondContact O-CA 3.49Å; R1060-Q1072 HydrophobicContact CB-CB 4.29Å; R1060-Q1072 HydrophobicContact CB-CG 4.45Å; R1060-Q1072 PolarHBondContact N-O 2.86Å; R1060-Q1072 PolarHBondContact O-N 3.08Å
1061	M	92.6	Very high	90.8	Very high	94 Å²	94	46.7 Å²	46.7	46%	0.463	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	141.5	165.8	-164.7	-165.9	-59.8	0	0	110.2	F1058 V1069 R1070 F1071	F1058-M1061 HydrophobicContact CE1-CE 4.41Å; F1058-M1061 HydrophobicContact CE2-CB 4.29Å; F1058-M1061 HydrophobicContact CZ-CB 4.05Å; F1058-M1061 HydrophobicContact CZ-CE 3.89Å; M1061-V1069 HydrophobicContact CG-CG1 3.82Å; M1061-V1069 HydrophobicContact SD-CG1 4.14Å; M1061-R1070 CarbonylContact C-O 3.5Å; M1061-R1070 WeakPolarHBondContact CA-O 3.39Å; M1061-F1071 HydrophobicContact CE-CD1 4.4Å; M1061-F1071 HydrophobicContact CE-CE1 3.83Å; M1061-F1071 HydrophobicContact CG-CD1 4.22Å; M1061-F1071 HydrophobicContact CG-CE1 4.18Å; M1061-F1071 HydrophobicContact SD-CE1 4.34Å
1062	D	91.5	Very high	91.2	Very high	40 Å²	40	49.1 Å²	49.1	21%	0.214	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	136.4	172	-68.6	-47.9	0	0	0	110.1	R1060 R1070	R1060-D1062 IonicContact CZ-OD1 2.68Å; R1060-D1062 IonicContact CZ-OD2 2.65Å; R1060-D1062 VanDerWaalsContact NE-CG 3.31Å; R1060-D1062 IonicContact NE-OD1 2.69Å; R1060-D1062 PolarHBondContact NE-OD1 2.88Å; R1060-D1062 IonicContact NE-OD2 3.14Å; R1060-D1062 PolarHBondContact NE-OD2 2.87Å; R1060-D1062 VanDerWaalsContact NE-OD2 3.08Å; R1060-D1062 IonicContact NH1-OD2 3.33Å; R1060-D1062 IonicContact NH2-OD1 2.86Å; R1060-D1062 PolarHBondContact NH2-OD1 2.87Å; R1060-D1062 IonicContact NH2-OD2 3.08Å; R1060-D1062 PolarHBondContact NH2-OD2 2.79Å; D1062-R1070 HydrophobicContact CB-CB 4.28Å; D1062-R1070 PolarHBondContact N-O 3.19Å; D1062-R1070 PolarHBondContact O-N 2.82Å
1063	Q	89.9	Confident	91.6	Very high	125 Å²	125	46.1 Å²	46.1	58%	0.584	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	128.4	166.8	-164.9	79.5	30	0	0	109.2	S1065	Q1063-S1065 PolarHBondContact NE2-O 3.02Å
1064	C	87.2	Confident	91.8	Very high	58 Å²	58	47.5 Å²	47.5	39%	0.392	25%	0.245	S	C	.	.			trans	-98.8	-47.7	178.1	-62.2	0	0	0	0	112	L1068	C1064-L1068 HydrophobicContact CB-CB 4.18Å; C1064-L1068 HydrophobicContact CB-CD2 3.88Å; C1064-L1068 HydrophobicContact CB-CG 3.83Å; C1064-L1068 WeakPolarHBondContact CB-O 3.17Å; C1064-L1068 PolarHBondContact N-O 3.29Å
1065	S	85.7	Confident	91.9	Very high	28 Å²	28	47.5 Å²	47.5	20%	0.196	25%	0.245	C	C	.	.	S	Bend	trans	-145.2	175.7	173.1	79.1	0	0	0	0	109.4	Q1063 S1067 L1068 D1110	Q1063-S1065 PolarHBondContact NE2-O 3.02Å; S1065-S1067 PolarHBondContact O-N 3.42Å; S1065-S1067 VanDerWaalsContact O-N 3.15Å; S1065-S1067 PolarHBondContact OG-N 3.01Å; S1065-S1067 VanDerWaalsContact OG-N 3.15Å; S1065-L1068 PolarHBondContact N-O 3.46Å; S1065-L1068 PolarHBondContact O-N 2.85Å; S1065-L1068 PolarHBondContact OG-N 3.14Å; S1065-D1110 VanDerWaalsContact CB-OD2 3.3Å; S1065-D1110 WeakPolarHBondContact CB-OD2 3.41Å; S1065-D1110 PolarHBondContact OG-OD2 3.38Å
1066	D	84.8	Confident	91.9	Very high	109 Å²	109	48 Å²	48	58%	0.583	25%	0.25	S	S	*	.	S	Bend	trans	-54.9	-29.9	172.9	-57	32.7	0	0	0	112.2	R1106	D1066-R1106 IonicContact OD1-CZ 2.68Å; D1066-R1106 IonicContact OD1-NH1 2.74Å; D1066-R1106 IonicContact OD1-NH2 3.15Å; D1066-R1106 PolarHBondContact OD1-NH2 2.86Å; D1066-R1106 IonicContact OD2-CZ 3.1Å; D1066-R1106 VanDerWaalsContact OD2-CZ 3.29Å; D1066-R1106 IonicContact OD2-NH1 2.7Å; D1066-R1106 PolarHBondContact OD2-NH1 3.18Å; D1066-R1106 IonicContact OD2-NH2 3.04Å; D1066-R1106 PolarHBondContact OD2-NH2 3.02Å; D1066-R1106 VanDerWaalsContact OD2-NH2 3.12Å
1067	S	90	Very high	91.8	Very high	8 Å²	8	48.9 Å²	48.9	6%	0.056	26%	0.256	C	S	.	.	S	Bend	trans	-89.9	-26	-179.4	-45.1	0	0	0	0	114	S1065 S1092 D1110	S1065-S1067 PolarHBondContact O-N 3.42Å; S1065-S1067 VanDerWaalsContact O-N 3.15Å; S1065-S1067 PolarHBondContact OG-N 3.01Å; S1065-S1067 VanDerWaalsContact OG-N 3.15Å; S1067-S1092 PolarHBondContact O-N 3.4Å; S1067-S1092 PolarHBondContact O-OG 3.32Å; S1067-S1092 VanDerWaalsContact O-OG 3.07Å; S1067-D1110 WeakPolarHBondContact CB-OD2 3.48Å; S1067-D1110 PolarHBondContact OG-OD2 3.19Å
1068	L	91.9	Very high	91.6	Very high	20 Å²	20	52.1 Å²	52.1	11%	0.105	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.5	-160.9	178.5	60.7	0	0	0	113.4	C1064 S1065 L1089 H1090 F1091 L1114	C1064-L1068 HydrophobicContact CB-CB 4.18Å; C1064-L1068 HydrophobicContact CB-CD2 3.88Å; C1064-L1068 HydrophobicContact CB-CG 3.83Å; C1064-L1068 WeakPolarHBondContact CB-O 3.17Å; C1064-L1068 PolarHBondContact N-O 3.29Å; S1065-L1068 PolarHBondContact N-O 3.46Å; S1065-L1068 PolarHBondContact O-N 2.85Å; S1065-L1068 PolarHBondContact OG-N 3.14Å; L1068-L1089 HydrophobicContact CD1-CB 4.11Å; L1068-H1090 WeakPolarHBondContact CA-O 3.28Å; L1068-F1091 HydrophobicContact CB-CD2 4.16Å; L1068-F1091 HydrophobicContact CD1-CB 4.36Å; L1068-F1091 HydrophobicContact CD1-CD2 4.28Å; L1068-L1114 HydrophobicContact CD1-CD1 4.45Å; L1068-L1114 HydrophobicContact CD1-CD2 4.36Å; L1068-L1114 HydrophobicContact CD2-CD1 4.11Å
1069	V	92.6	Very high	91.3	Very high	18 Å²	18	60.3 Å²	60.3	11%	0.109	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141.3	173.7	-168.7	0	0	0	0	110.3	M1061 F1071 L1089 H1090	M1061-V1069 HydrophobicContact CG-CG1 3.82Å; M1061-V1069 HydrophobicContact SD-CG1 4.14Å; V1069-F1071 HydrophobicContact CB-CE2 3.79Å; V1069-F1071 HydrophobicContact CB-CZ 4.37Å; V1069-F1071 HydrophobicContact CG1-CD2 4.12Å; V1069-F1071 HydrophobicContact CG1-CE2 3.53Å; V1069-F1071 HydrophobicContact CG1-CZ 3.82Å; V1069-L1089 CarbonylContact O-C 3.55Å; V1069-L1089 WeakPolarHBondContact O-CA 3.49Å; V1069-H1090 PolarHBondContact N-O 3.27Å; V1069-H1090 PolarHBondContact O-N 3Å
1070	R	93.4	Very high	91	Very high	63 Å²	63	61.5 Å²	61.5	24%	0.238	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.2	176.4	175.1	-176.1	-68.6	168.3	-4.6	109.7	M1061 D1062 T1087 L1088 L1089 D1121	M1061-R1070 CarbonylContact C-O 3.5Å; M1061-R1070 WeakPolarHBondContact CA-O 3.39Å; D1062-R1070 HydrophobicContact CB-CB 4.28Å; D1062-R1070 PolarHBondContact N-O 3.19Å; D1062-R1070 PolarHBondContact O-N 2.82Å; R1070-T1087 HydrophobicContact CG-CG2 3.86Å; R1070-L1088 CarbonylContact C-O 3.55Å; R1070-L1088 WeakPolarHBondContact CA-O 3.26Å; R1070-L1089 HydrophobicContact CB-CD2 3.76Å; R1070-L1089 HydrophobicContact CG-CD2 3.82Å; R1070-D1121 IonicContact NH2-OD2 3.7Å; R1070-D1121 PolarHBondContact NH2-OD2 3.49Å
1071	F	94.2	Very high	90.5	Very high	16 Å²	16	64.3 Å²	64.3	7%	0.07	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	142.8	174.4	-55	-111.7	0	0	0	108.5	W1041 F1058 R1060 M1061 V1069 F1073 T1087 L1088 H1090	W1041-F1071 HydrophobicContact CZ2-CE1 4.33Å; W1041-F1071 HydrophobicContact CZ2-CE2 4.29Å; W1041-F1071 AromaticContact CZ2-CZ 3.97Å; W1041-F1071 HydrophobicContact CZ2-CZ 3.97Å; W1041-F1071 AromaticContact NE1-CD1 3.68Å; W1041-F1071 AromaticContact NE1-CE1 3.35Å; W1041-F1071 VanDerWaalsContact NE1-CE1 3.35Å; W1041-F1071 AromaticContact NE1-CZ 3.89Å; F1058-F1071 HydrophobicContact CE1-CD1 4.36Å; F1058-F1071 HydrophobicContact CE2-CB 4.16Å; F1058-F1071 AromaticContact CE2-CD1 3.78Å; F1058-F1071 HydrophobicContact CE2-CD1 3.78Å; F1058-F1071 HydrophobicContact CE2-CG 4.45Å; F1058-F1071 AromaticContact CZ-CD1 3.51Å; F1058-F1071 HydrophobicContact CZ-CD1 3.51Å; F1058-F1071 HydrophobicContact CZ-CE1 4.11Å; R1060-F1071 CarbonylContact O-C 3.5Å; R1060-F1071 WeakPolarHBondContact O-CA 3.49Å; M1061-F1071 HydrophobicContact CE-CD1 4.4Å; M1061-F1071 HydrophobicContact CE-CE1 3.83Å; M1061-F1071 HydrophobicContact CG-CD1 4.22Å; M1061-F1071 HydrophobicContact CG-CE1 4.18Å; M1061-F1071 HydrophobicContact SD-CE1 4.34Å; V1069-F1071 HydrophobicContact CB-CE2 3.79Å; V1069-F1071 HydrophobicContact CB-CZ 4.37Å; V1069-F1071 HydrophobicContact CG1-CD2 4.12Å; V1069-F1071 HydrophobicContact CG1-CE2 3.53Å; V1069-F1071 HydrophobicContact CG1-CZ 3.82Å; F1071-F1073 HydrophobicContact CB-CE2 3.64Å; F1071-F1073 HydrophobicContact CB-CZ 3.58Å; F1071-F1073 HydrophobicContact CD1-CZ 4.29Å; F1071-F1073 HydrophobicContact CG-CZ 4.25Å; F1071-T1087 CarbonylContact O-C 3.58Å; F1071-T1087 WeakPolarHBondContact O-CA 3.5Å; F1071-L1088 HydrophobicContact CB-CB 4.27Å; F1071-L1088 HydrophobicContact CD2-CD2 3.74Å; F1071-L1088 HydrophobicContact CE2-CD2 4.22Å; F1071-L1088 HydrophobicContact CG-CD2 4.46Å; F1071-L1088 PolarHBondContact N-O 3.41Å; F1071-L1088 PolarHBondContact O-N 2.88Å; F1071-H1090 HydrophobicContact CD2-CB 4.5Å; F1071-H1090 HydrophobicContact CE2-CB 3.85Å
1072	Q	93.8	Very high	90.3	Very high	63 Å²	63	64.5 Å²	64.5	29%	0.294	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.3	176.5	-54.8	-164.8	-72.5	0	0	109.9	A1059 R1060	A1059-Q1072 PolarHBondContact N-O 2.88Å; R1060-Q1072 HydrophobicContact CB-CB 4.29Å; R1060-Q1072 HydrophobicContact CB-CG 4.45Å; R1060-Q1072 PolarHBondContact N-O 2.86Å; R1060-Q1072 PolarHBondContact O-N 3.08Å
1073	F	94.6	Very high	90.2	Very high	6 Å²	6	65.1 Å²	65.1	3%	0.026	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	145.9	179	-54.4	-73.5	0	0	0	110.8	W1018 W1041 P1042 I1056 N1057 F1058 F1071 L1075 C1086 L1088	W1018-F1073 HydrophobicContact CH2-CD2 4.06Å; W1018-F1073 HydrophobicContact CH2-CE2 4.36Å; W1018-F1073 HydrophobicContact CH2-CG 4.43Å; W1041-F1073 HydrophobicContact CB-CE1 3.85Å; W1041-F1073 HydrophobicContact CB-CE2 4.14Å; W1041-F1073 HydrophobicContact CB-CZ 3.46Å; W1041-F1073 VanDerWaalsContact CB-CZ 3.46Å; W1041-F1073 AromaticContact CD1-CZ 3.76Å; W1041-F1073 HydrophobicContact CG-CE1 4.38Å; W1041-F1073 AromaticContact CG-CZ 3.73Å; W1041-F1073 HydrophobicContact CG-CZ 3.73Å; P1042-F1073 HydrophobicContact CG-CE1 4.46Å; I1056-F1073 HydrophobicContact CG2-CB 4.12Å; I1056-F1073 HydrophobicContact CG2-CD1 4.1Å; I1056-F1073 HydrophobicContact CG2-CG 4.2Å; N1057-F1073 CarbonylContact O-C 3.59Å; N1057-F1073 VanDerWaalsContact O-CA 3.22Å; N1057-F1073 WeakPolarHBondContact O-CA 3.48Å; F1058-F1073 HydrophobicContact CB-CD1 3.92Å; F1058-F1073 HydrophobicContact CB-CE1 3.8Å; F1058-F1073 HydrophobicContact CD1-CE1 4.31Å; F1058-F1073 AromaticContact CD2-CD1 4Å; F1058-F1073 HydrophobicContact CD2-CD1 4Å; F1058-F1073 AromaticContact CD2-CE1 3.48Å; F1058-F1073 HydrophobicContact CD2-CE1 3.48Å; F1058-F1073 VanDerWaalsContact CD2-CE1 3.48Å; F1058-F1073 HydrophobicContact CD2-CZ 4.22Å; F1058-F1073 HydrophobicContact CE2-CE1 4.14Å; F1058-F1073 HydrophobicContact CE2-CZ 4.47Å; F1058-F1073 HydrophobicContact CG-CD1 4.16Å; F1058-F1073 AromaticContact CG-CE1 3.61Å; F1058-F1073 HydrophobicContact CG-CE1 3.61Å; F1071-F1073 HydrophobicContact CB-CE2 3.64Å; F1071-F1073 HydrophobicContact CB-CZ 3.58Å; F1071-F1073 HydrophobicContact CD1-CZ 4.29Å; F1071-F1073 HydrophobicContact CG-CZ 4.25Å; F1073-L1075 HydrophobicContact CB-CD1 3.8Å; F1073-C1086 PolarHBondContact N-O 3.48Å; F1073-C1086 PolarHBondContact O-N 2.86Å; F1073-L1088 HydrophobicContact CD2-CB 4.38Å; F1073-L1088 HydrophobicContact CE2-CB 3.75Å; F1073-L1088 HydrophobicContact CE2-CD1 4.34Å
1074	L	94.2	Very high	90.2	Very high	71 Å²	71	59.8 Å²	59.8	37%	0.372	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	114.8	166.5	-172.3	67.6	0	0	0	108.2	N1057 T1076 A1083	N1057-L1074 PolarHBondContact N-O 2.65Å; N1057-L1074 PolarHBondContact O-N 2.81Å; L1074-T1076 HydrophobicContact CG-CG2 4.48Å; L1074-A1083 HydrophobicContact CD1-CB 3.77Å; L1074-A1083 HydrophobicContact CG-CB 4.25Å
1075	L	93.9	Very high	90.4	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	136.8	176.1	-73.6	63.1	0	0	0	108.7	W1018 V1021 W1022 L1054 H1055 I1056 F1073 A1083 L1084 C1086	W1018-L1075 HydrophobicContact CE3-CD2 3.98Å; W1018-L1075 HydrophobicContact CZ3-CD1 4.17Å; W1018-L1075 HydrophobicContact CZ3-CD2 4.21Å; V1021-L1075 HydrophobicContact CG1-CD2 4.09Å; W1022-L1075 HydrophobicContact CE3-CB 3.74Å; W1022-L1075 HydrophobicContact CE3-CD2 4.14Å; W1022-L1075 HydrophobicContact CZ3-CB 3.66Å; L1054-L1075 HydrophobicContact CD1-CB 4.36Å; H1055-L1075 CarbonylContact O-C 3.54Å; H1055-L1075 VanDerWaalsContact O-CA 3.3Å; H1055-L1075 WeakPolarHBondContact O-CA 3.13Å; I1056-L1075 HydrophobicContact CG1-CG 4.2Å; I1056-L1075 HydrophobicContact CG2-CD1 4.19Å; F1073-L1075 HydrophobicContact CB-CD1 3.8Å; L1075-A1083 CarbonylContact O-C 3.52Å; L1075-A1083 VanDerWaalsContact O-CA 3.23Å; L1075-A1083 WeakPolarHBondContact O-CA 3.38Å; L1075-L1084 HydrophobicContact CB-CB 4.22Å; L1075-L1084 HydrophobicContact CD2-CD2 4.44Å; L1075-L1084 PolarHBondContact N-O 2.77Å; L1075-L1084 PolarHBondContact O-N 2.84Å; L1075-C1086 HydrophobicContact CD1-CB 3.67Å
1076	T	93.9	Very high	90.7	Very high	50 Å²	50	58.8 Å²	58.8	31%	0.307	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	152.2	177.1	51.1	0	0	0	0	110.8	H1055 L1074 A1083	H1055-T1076 PolarHBondContact N-O 2.85Å; H1055-T1076 PolarHBondContact O-N 2.98Å; L1074-T1076 HydrophobicContact CG-CG2 4.48Å; T1076-A1083 HydrophobicContact CG2-CB 3.77Å
1077	S	90.9	Very high	91.1	Very high	18 Å²	18	54.1 Å²	54.1	13%	0.126	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.8	-171	175.5	0	0	0	0	111.7	W1022 W1053 R1079	W1022-S1077 VanDerWaalsContact CZ2-CB 3.45Å; W1053-S1077 CarbonylContact O-C 3.48Å; W1053-S1077 WeakPolarHBondContact O-CA 3.49Å; S1077-R1079 PolarHBondContact O-N 2.72Å; S1077-R1079 PolarHBondContact OG-N 2.79Å; S1077-R1079 VanDerWaalsContact OG-N 3.15Å
1078	D	90.3	Very high	91.4	Very high	119 Å²	119	53.8 Å²	53.8	64%	0.636	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-7.4	168.6	-81.5	-39.4	0	0	0	113.3	W1053 H1055	W1053-D1078 HydrophobicContact CB-CB 4.09Å; W1053-D1078 PolarHBondContact O-N 3.24Å; H1055-D1078 IonicContact NE2-OD1 2.78Å; H1055-D1078 IonicContact NE2-OD2 3.62Å
1079	R	88.4	Confident	91.5	Very high	174 Å²	174	53.3 Å²	53.3	66%	0.657	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.7	-17.4	-169	-59.7	175.2	171.3	-168	-5	114.3	W1053 S1077	W1053-R1079 HydrophobicContact CB-CG 4.24Å; W1053-R1079 HydrophobicContact CG-CG 4.43Å; S1077-R1079 PolarHBondContact O-N 2.72Å; S1077-R1079 PolarHBondContact OG-N 2.79Å; S1077-R1079 VanDerWaalsContact OG-N 3.15Å
1080	E	84.8	Confident	91.6	Very high	84 Å²	84	53.5 Å²	53.5	39%	0.393	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	124.6	-165.9	-63.1	178.8	125.3	0	0	110.2	W1022 Y1082	W1022-E1080 HydrophobicContact CZ2-CB 4.41Å; W1022-E1080 PolarHBondContact NE1-OE2 2.82Å; E1080-Y1082 HydrophobicContact CB-CD1 3.9Å; E1080-Y1082 HydrophobicContact CB-CE1 3.75Å; E1080-Y1082 HydrophobicContact CG-CE1 4.36Å; E1080-Y1082 PolarHBondContact O-N 3.47Å
1081	D	82.3	Confident	91.7	Very high	186 Å²	186	50.5 Å²	50.5	100%	0.995	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	24.9	-169.7	-58.2	-45.1	0	0	0	115
1082	Y	88	Confident	91.4	Very high	99 Å²	99	50.4 Å²	50.4	39%	0.388	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	162.2	178.1	74.8	-91.5	0	0	0	112.3	W1022 E1080	W1022-Y1082 AromaticContact CE2-CZ 3.92Å; W1022-Y1082 AromaticContact CH2-CD2 3.94Å; W1022-Y1082 HydrophobicContact CH2-CD2 3.94Å; W1022-Y1082 AromaticContact CH2-CE2 3.58Å; W1022-Y1082 HydrophobicContact CH2-CE2 3.58Å; W1022-Y1082 AromaticContact CH2-CZ 3.97Å; W1022-Y1082 HydrophobicContact CZ2-CD2 4.2Å; W1022-Y1082 AromaticContact CZ2-CE1 3.97Å; W1022-Y1082 HydrophobicContact CZ2-CE1 3.97Å; W1022-Y1082 AromaticContact CZ2-CE2 3.54Å; W1022-Y1082 HydrophobicContact CZ2-CE2 3.54Å; W1022-Y1082 AromaticContact CZ2-CZ 3.4Å; W1022-Y1082 VanDerWaalsContact CZ2-CZ 3.4Å; W1022-Y1082 HydrophobicContact CZ3-CE2 4.26Å; E1080-Y1082 HydrophobicContact CB-CD1 3.9Å; E1080-Y1082 HydrophobicContact CB-CE1 3.75Å; E1080-Y1082 HydrophobicContact CG-CE1 4.36Å; E1080-Y1082 PolarHBondContact O-N 3.47Å
1083	A	88.6	Confident	91.2	Very high	53 Å²	53	48.6 Å²	48.6	44%	0.438	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	137.5	175.2	0	0	0	0	0	109.8	L1074 L1075 T1076	L1074-A1083 HydrophobicContact CD1-CB 3.77Å; L1074-A1083 HydrophobicContact CG-CB 4.25Å; L1075-A1083 CarbonylContact O-C 3.52Å; L1075-A1083 VanDerWaalsContact O-CA 3.23Å; L1075-A1083 WeakPolarHBondContact O-CA 3.38Å; T1076-A1083 HydrophobicContact CG2-CB 3.77Å
1084	L	91	Very high	91.1	Very high	13 Å²	13	50.3 Å²	50.3	7%	0.068	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	112.7	178.2	173.4	58.1	0	0	0	109.4	W1022 L1075 C1086	W1022-L1084 HydrophobicContact CE3-CB 4.05Å; W1022-L1084 HydrophobicContact CE3-CD2 4.3Å; W1022-L1084 HydrophobicContact CZ3-CB 3.7Å; L1075-L1084 HydrophobicContact CB-CB 4.22Å; L1075-L1084 HydrophobicContact CD2-CD2 4.44Å; L1075-L1084 PolarHBondContact N-O 2.77Å; L1075-L1084 PolarHBondContact O-N 2.84Å; L1084-C1086 PolarHBondContact O-N 2.87Å
1085	A	91.7	Very high	91.1	Very high	62 Å²	62	47 Å²	47	51%	0.512	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	118.1	168.2	0	0	0	0	0	109.1	S1027	S1027-A1085 WeakPolarHBondContact CA-O 3.49Å; S1027-A1085 VanDerWaalsContact CB-O 3.31Å; S1027-A1085 WeakPolarHBondContact CB-O 3.31Å
1086	C	92.5	Very high	90.9	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.014	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.2	-178	-168.9	0	0	0	0	110	S1026 S1027 F1073 L1075 L1084	S1026-C1086 PolarHBondContact O-SG 3.3Å; S1027-C1086 WeakPolarHBondContact O-CA 3.27Å; F1073-C1086 PolarHBondContact N-O 3.48Å; F1073-C1086 PolarHBondContact O-N 2.86Å; L1075-C1086 HydrophobicContact CD1-CB 3.67Å; L1084-C1086 PolarHBondContact O-N 2.87Å
1087	T	93.3	Very high	90.7	Very high	12 Å²	12	50.9 Å²	50.9	7%	0.074	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	130.6	175.2	-61.4	0	0	0	0	109.6	S1027 L1028 I1029 R1070 F1071 L1089	S1027-T1087 PolarHBondContact O-N 3.17Å; L1028-T1087 WeakPolarHBondContact CA-O 3.42Å; I1029-T1087 PolarHBondContact N-O 2.74Å; R1070-T1087 HydrophobicContact CG-CG2 3.86Å; F1071-T1087 CarbonylContact O-C 3.58Å; F1071-T1087 WeakPolarHBondContact O-CA 3.5Å; T1087-L1089 HydrophobicContact CG2-CD2 4.2Å; T1087-L1089 HydrophobicContact CG2-CG 4.4Å
1088	L	94.5	Very high	90.7	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	128.2	171.1	-174.4	154	0	0	0	109.5	I1029 C1031 F1040 W1041 R1070 F1071 F1073 H1090	I1029-L1088 HydrophobicContact CB-CB 4.15Å; I1029-L1088 HydrophobicContact CB-CD1 4.27Å; I1029-L1088 HydrophobicContact CB-CG 4.05Å; I1029-L1088 HydrophobicContact CD1-CD1 4.32Å; I1029-L1088 HydrophobicContact CG2-CD1 3.88Å; I1029-L1088 HydrophobicContact CG2-CG 3.92Å; I1029-L1088 CarbonylContact O-C 3.53Å; I1029-L1088 WeakPolarHBondContact O-CA 3.43Å; C1031-L1088 HydrophobicContact CB-CD2 4.15Å; F1040-L1088 HydrophobicContact CE2-CD1 3.71Å; F1040-L1088 HydrophobicContact CZ-CD1 3.7Å; W1041-L1088 HydrophobicContact CD2-CD1 4.25Å; W1041-L1088 HydrophobicContact CE3-CD1 3.67Å; W1041-L1088 HydrophobicContact CH2-CD2 4.38Å; W1041-L1088 HydrophobicContact CZ3-CD1 3.94Å; W1041-L1088 HydrophobicContact CZ3-CD2 4.36Å; R1070-L1088 CarbonylContact C-O 3.55Å; R1070-L1088 WeakPolarHBondContact CA-O 3.26Å; F1071-L1088 HydrophobicContact CB-CB 4.27Å; F1071-L1088 HydrophobicContact CD2-CD2 3.74Å; F1071-L1088 HydrophobicContact CE2-CD2 4.22Å; F1071-L1088 HydrophobicContact CG-CD2 4.46Å; F1071-L1088 PolarHBondContact N-O 3.41Å; F1071-L1088 PolarHBondContact O-N 2.88Å; F1073-L1088 HydrophobicContact CD2-CB 4.38Å; F1073-L1088 HydrophobicContact CE2-CB 3.75Å; F1073-L1088 HydrophobicContact CE2-CD1 4.34Å; L1088-H1090 HydrophobicContact CD2-CB 3.95Å
1089	L	94.4	Very high	90.7	Very high	11 Å²	11	49 Å²	49	6%	0.058	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	105.2	174.8	-65.2	178.8	0	0	0	108.7	L1028 I1029 I1030 C1031 L1068 V1069 R1070 T1087 F1091 L1114 L1118	L1028-L1089 HydrophobicContact CD1-CD1 4.04Å; L1028-L1089 HydrophobicContact CD1-CG 4.28Å; I1029-L1089 PolarHBondContact O-N 2.55Å; I1030-L1089 CarbonylContact C-O 3.6Å; I1030-L1089 WeakPolarHBondContact CA-O 3.35Å; C1031-L1089 PolarHBondContact N-O 2.85Å; L1068-L1089 HydrophobicContact CD1-CB 4.11Å; V1069-L1089 CarbonylContact O-C 3.55Å; V1069-L1089 WeakPolarHBondContact O-CA 3.49Å; R1070-L1089 HydrophobicContact CB-CD2 3.76Å; R1070-L1089 HydrophobicContact CG-CD2 3.82Å; T1087-L1089 HydrophobicContact CG2-CD2 4.2Å; T1087-L1089 HydrophobicContact CG2-CG 4.4Å; L1089-F1091 PolarHBondContact O-N 3.38Å; L1089-L1114 HydrophobicContact CD1-CD1 3.82Å; L1089-L1118 HydrophobicContact CD1-CD2 3.48Å; L1089-L1118 VanDerWaalsContact CD1-CD2 3.48Å
1090	H	94.8	Very high	90.6	Very high	21 Å²	21	49.4 Å²	49.4	10%	0.097	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	101.6	177	-172.6	-171.9	0	0	0	109.5	C1031 S1033 L1068 V1069 F1071 L1088	C1031-H1090 HydrophobicContact CB-CB 4.5Å; C1031-H1090 CarbonylContact O-C 3.56Å; C1031-H1090 WeakPolarHBondContact O-CA 3.32Å; C1031-H1090 PolarHBondContact O-CD2 3Å; S1033-H1090 PolarHBondContact O-NE2 3.25Å; L1068-H1090 WeakPolarHBondContact CA-O 3.28Å; V1069-H1090 PolarHBondContact N-O 3.27Å; V1069-H1090 PolarHBondContact O-N 3Å; F1071-H1090 HydrophobicContact CD2-CB 4.5Å; F1071-H1090 HydrophobicContact CE2-CB 3.85Å; L1088-H1090 HydrophobicContact CD2-CB 3.95Å
1091	F	95	Very high	90.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	105.6	167.5	-163.3	-92.3	0	0	0	108.5	C1031 L1032 L1068 L1089 A1093 I1107 D1110 L1111 L1114	C1031-F1091 PolarHBondContact O-N 3.48Å; L1032-F1091 WeakPolarHBondContact CA-O 3.3Å; L1032-F1091 HydrophobicContact CD2-CB 3.87Å; L1068-F1091 HydrophobicContact CB-CD2 4.16Å; L1068-F1091 HydrophobicContact CD1-CB 4.36Å; L1068-F1091 HydrophobicContact CD1-CD2 4.28Å; L1089-F1091 PolarHBondContact O-N 3.38Å; F1091-A1093 WeakPolarHBondContact CD1-O 3.33Å; F1091-A1093 WeakPolarHBondContact CE1-O 3.39Å; F1091-I1107 HydrophobicContact CE1-CG2 4.08Å; F1091-I1107 HydrophobicContact CZ-CG2 4.03Å; F1091-D1110 HydrophobicContact CE2-CB 3.67Å; F1091-D1110 HydrophobicContact CZ-CB 4Å; F1091-L1111 HydrophobicContact CD1-CD1 3.97Å; F1091-L1111 HydrophobicContact CE1-CB 4.02Å; F1091-L1111 HydrophobicContact CE1-CD1 3.86Å; F1091-L1111 HydrophobicContact CE1-CG 4.44Å; F1091-L1111 HydrophobicContact CE2-CB 4.27Å; F1091-L1111 HydrophobicContact CG-CD1 4.41Å; F1091-L1111 HydrophobicContact CZ-CB 3.67Å; F1091-L1111 HydrophobicContact CZ-CD1 4.21Å; F1091-L1114 HydrophobicContact CB-CD2 3.89Å; F1091-L1114 HydrophobicContact CD2-CD2 3.74Å; F1091-L1114 HydrophobicContact CG-CD2 4.02Å
1092	S	88.1	Confident	91.3	Very high	14 Å²	14	44.6 Å²	44.6	10%	0.098	25%	0.252	C	S	.	.			trans	-103.3	-11.8	-161.1	68.9	0	0	0	0	114.9	Q1035 S1067	Q1035-S1092 PolarHBondContact NE2-OG 2.98Å; S1067-S1092 PolarHBondContact O-N 3.4Å; S1067-S1092 PolarHBondContact O-OG 3.32Å; S1067-S1092 VanDerWaalsContact O-OG 3.07Å
1093	A	89.4	Confident	91.5	Very high	25 Å²	25	45.7 Å²	45.7	21%	0.207	26%	0.26	C	S	.	.			trans	-95	167.1	167.1	0	0	0	0	0	110.4	F1091 I1107	F1091-A1093 WeakPolarHBondContact CD1-O 3.33Å; F1091-A1093 WeakPolarHBondContact CE1-O 3.39Å; A1093-I1107 HydrophobicContact CB-CD1 4.05Å; A1093-I1107 HydrophobicContact CB-CG1 4.12Å; A1093-I1107 HydrophobicContact CB-CG2 3.69Å
1094	W	92.7	Very high	91.7	Very high	42 Å²	42	44.4 Å²	44.4	16%	0.159	25%	0.245	C	C	.	.			trans	-144	125.7	167.4	-167.5	-90.5	0	0	0	110.1	L1032 L1111 R1142 I1145 F1187	L1032-W1094 HydrophobicContact CB-CZ3 4.26Å; L1032-W1094 HydrophobicContact CD1-CH2 4.45Å; L1032-W1094 HydrophobicContact CD1-CZ3 4.04Å; L1032-W1094 HydrophobicContact CD2-CZ3 4.36Å; L1032-W1094 HydrophobicContact CG-CZ3 4.45Å; W1094-L1111 HydrophobicContact CH2-CD1 4.47Å; W1094-L1111 HydrophobicContact CH2-CD2 4.19Å; W1094-L1111 HydrophobicContact CZ2-CD2 4.5Å; W1094-L1111 HydrophobicContact CZ3-CD1 4.03Å; W1094-L1111 HydrophobicContact CZ3-CD2 4.27Å; W1094-R1142 HydrophobicContact CD2-CB 4.33Å; W1094-R1142 HydrophobicContact CD2-CG 3.8Å; W1094-R1142 HydrophobicContact CE3-CB 4.03Å; W1094-R1142 HydrophobicContact CE3-CG 3.92Å; W1094-R1142 HydrophobicContact CG-CG 4.44Å; W1094-R1142 HydrophobicContact CH2-CB 3.66Å; W1094-R1142 HydrophobicContact CH2-CG 4.15Å; W1094-R1142 WeakPolarHBondContact CH2-O 3.36Å; W1094-R1142 HydrophobicContact CZ2-CB 3.98Å; W1094-R1142 HydrophobicContact CZ2-CG 4.03Å; W1094-R1142 HydrophobicContact CZ3-CB 3.7Å; W1094-R1142 HydrophobicContact CZ3-CG 4.1Å; W1094-I1145 HydrophobicContact CH2-CB 4.34Å; W1094-I1145 HydrophobicContact CH2-CG2 4.31Å; W1094-I1145 HydrophobicContact CZ2-CB 4.02Å; W1094-I1145 HydrophobicContact CZ2-CD1 3.99Å; W1094-I1145 HydrophobicContact CZ2-CG2 3.94Å; W1094-F1187 HydrophobicContact CZ2-CE1 4.31Å; W1094-F1187 AromaticContact NE1-CE1 3.8Å
1095	P	93.6	Very high	91.8	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.019	25%	0.249	C	C	.	.			trans	-75.6	147.2	-175.8	19.4	-13.2	0	0	0	111.6	I1107 A1108 L1111 F1187	P1095-I1107 HydrophobicContact CB-CB 4.16Å; P1095-I1107 HydrophobicContact CB-CG2 3.9Å; P1095-I1107 HydrophobicContact CG-CG2 3.86Å; P1095-A1108 HydrophobicContact CB-CB 4.1Å; P1095-A1108 HydrophobicContact CG-CB 4.17Å; P1095-L1111 HydrophobicContact CG-CD2 3.73Å; P1095-F1187 HydrophobicContact CB-CZ 4.28Å; P1095-F1187 HydrophobicContact CG-CZ 4.05Å; P1095-F1187 WeakPolarHBondContact O-CZ 3.34Å
1096	S	91	Very high	91.8	Very high	52 Å²	52	47.9 Å²	47.9	36%	0.364	25%	0.248	S	C	.	.			trans	-84.2	175.3	164.9	69	0	0	0	0	111.8	D1098 L1099 E1104 F1187	S1096-D1098 VanDerWaalsContact C-N 3.25Å; S1096-D1098 PolarHBondContact O-N 3.44Å; S1096-L1099 WeakPolarHBondContact O-CD2 3.35Å; S1096-E1104 VanDerWaalsContact CB-OE2 3.24Å; S1096-E1104 WeakPolarHBondContact CB-OE2 3.32Å; S1096-E1104 PolarHBondContact N-OE2 3.17Å; S1096-E1104 WeakPolarHBondContact OG-CG 3.38Å; S1096-E1104 PolarHBondContact OG-OE2 2.87Å; S1096-F1187 VanDerWaalsContact O-CE2 3.29Å; S1096-F1187 WeakPolarHBondContact O-CE2 3.21Å
1097	I	90.2	Very high	91.8	Very high	78 Å²	78	48.4 Å²	48.4	40%	0.4	25%	0.25	S	S	.	.	S	Bend	trans	-74.1	-13.6	-179.8	-164.4	162.2	0	0	0	113.6	L1099 E1186 F1187 T1190	I1097-L1099 VanDerWaalsContact C-N 3.27Å; I1097-L1099 PolarHBondContact O-N 3.1Å; I1097-E1186 HydrophobicContact CD1-CB 4.31Å; I1097-E1186 HydrophobicContact CD1-CG 3.91Å; I1097-F1187 HydrophobicContact CB-CD2 4.01Å; I1097-F1187 HydrophobicContact CD1-CB 4.49Å; I1097-F1187 HydrophobicContact CG1-CD2 4.13Å; I1097-T1190 HydrophobicContact CG1-CG2 4.09Å
1098	D	90.4	Very high	91.9	Very high	81 Å²	81	47.9 Å²	47.9	43%	0.433	25%	0.247	S	C	.	.			trans	-79.2	69.4	178.4	-178.9	16.3	0	0	0	111.4	S1096 E1100 N1101 E1104	S1096-D1098 VanDerWaalsContact C-N 3.25Å; S1096-D1098 PolarHBondContact O-N 3.44Å; D1098-E1100 PolarHBondContact O-N 2.96Å; D1098-N1101 WeakPolarHBondContact O-CB 3.36Å; D1098-N1101 PolarHBondContact O-N 3.39Å; D1098-N1101 PolarHBondContact OD1-N 2.89Å; D1098-E1104 VanDerWaalsContact O-CB 3.31Å; D1098-E1104 WeakPolarHBondContact O-CB 3.19Å
1099	L	89.6	Confident	91.8	Very high	16 Å²	16	50.1 Å²	50.1	8%	0.084	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-0.2	-180	-55.6	-171.9	0	0	0	113.8	S1096 I1097 S1105 A1108 T1190 L1191 Y1194	S1096-L1099 WeakPolarHBondContact O-CD2 3.35Å; I1097-L1099 VanDerWaalsContact C-N 3.27Å; I1097-L1099 PolarHBondContact O-N 3.1Å; L1099-S1105 WeakPolarHBondContact O-CB 3.29Å; L1099-S1105 PolarHBondContact O-OG 2.83Å; L1099-A1108 HydrophobicContact CD1-CB 4.27Å; L1099-A1108 HydrophobicContact CD2-CB 3.57Å; L1099-T1190 HydrophobicContact CD1-CG2 3.91Å; L1099-T1190 HydrophobicContact CG-CG2 4.25Å; L1099-L1191 HydrophobicContact CD1-CD2 4.21Å; L1099-Y1194 HydrophobicContact CB-CD2 4.08Å; L1099-Y1194 HydrophobicContact CB-CE2 4.37Å; L1099-Y1194 HydrophobicContact CD1-CD1 4.41Å; L1099-Y1194 HydrophobicContact CD1-CD2 3.94Å; L1099-Y1194 HydrophobicContact CD1-CG 3.76Å
1100	E	87.3	Confident	91.7	Very high	184 Å²	184	50.4 Å²	50.4	86%	0.86	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-26.5	168.8	-59.7	-165.9	171.4	0	0	111.4	D1098 P1102	D1098-E1100 PolarHBondContact O-N 2.96Å; E1100-P1102 WeakPolarHBondContact O-CD 3.38Å
1101	N	90.6	Very high	91.6	Very high	64 Å²	64	49.4 Å²	49.4	34%	0.342	26%	0.26	S	S	.	.	S	Bend	trans	-67.5	120.7	169.5	-179.9	-18.1	0	0	0	110.6	D1098 H1103 E1104 S1105	D1098-N1101 WeakPolarHBondContact O-CB 3.36Å; D1098-N1101 PolarHBondContact O-N 3.39Å; D1098-N1101 PolarHBondContact OD1-N 2.89Å; N1101-H1103 PolarHBondContact O-N 3.29Å; N1101-H1103 VanDerWaalsContact O-N 3.11Å; N1101-H1103 WeakPolarHBondContact OD1-CB 3.48Å; N1101-H1103 PolarHBondContact OD1-N 3.04Å; N1101-H1103 VanDerWaalsContact OD1-N 3.09Å; N1101-E1104 HydrophobicContact CB-CB 4.21Å; N1101-E1104 HydrophobicContact CB-CG 3.86Å; N1101-E1104 PolarHBondContact O-N 3.04Å; N1101-E1104 VanDerWaalsContact O-N 3.14Å; N1101-S1105 WeakPolarHBondContact O-CB 2.86Å; N1101-S1105 PolarHBondContact O-N 3.5Å
1102	P	91	Very high	91.6	Very high	105 Å²	105	49.7 Å²	49.7	68%	0.682	26%	0.261	S	S	*	.	H	α-helix	trans	-58.1	-28.2	-176.3	-27.4	35.9	0	0	0	115.4	E1100 R1106	E1100-P1102 WeakPolarHBondContact O-CD 3.38Å; P1102-R1106 PolarHBondContact O-N 2.96Å; P1102-R1106 VanDerWaalsContact O-N 3.14Å
1103	H	91.5	Very high	91.7	Very high	121 Å²	121	54 Å²	54	56%	0.56	28%	0.28	S	S	*	.	H	α-helix	trans	-68.4	-50.5	176.7	-179.6	-97.7	0	0	0	111.2	N1101 R1106 I1107	N1101-H1103 PolarHBondContact O-N 3.29Å; N1101-H1103 VanDerWaalsContact O-N 3.11Å; N1101-H1103 WeakPolarHBondContact OD1-CB 3.48Å; N1101-H1103 PolarHBondContact OD1-N 3.04Å; N1101-H1103 VanDerWaalsContact OD1-N 3.09Å; H1103-R1106 PolarHBondContact O-N 2.94Å; H1103-I1107 WeakPolarHBondContact CE1-CD1 3.21Å; H1103-I1107 PolarHBondContact O-N 3.29Å; H1103-I1107 VanDerWaalsContact O-N 3.09Å
1104	E	93.4	Very high	91.8	Very high	26 Å²	26	53.4 Å²	53.4	12%	0.121	27%	0.273	C	S	.	.	H	α-helix	trans	-66.6	-40	179.2	-54.3	-59	106.8	0	0	111.2	S1096 D1098 N1101 R1106 I1107 A1108	S1096-E1104 VanDerWaalsContact CB-OE2 3.24Å; S1096-E1104 WeakPolarHBondContact CB-OE2 3.32Å; S1096-E1104 PolarHBondContact N-OE2 3.17Å; S1096-E1104 WeakPolarHBondContact OG-CG 3.38Å; S1096-E1104 PolarHBondContact OG-OE2 2.87Å; D1098-E1104 VanDerWaalsContact O-CB 3.31Å; D1098-E1104 WeakPolarHBondContact O-CB 3.19Å; N1101-E1104 HydrophobicContact CB-CB 4.21Å; N1101-E1104 HydrophobicContact CB-CG 3.86Å; N1101-E1104 PolarHBondContact O-N 3.04Å; N1101-E1104 VanDerWaalsContact O-N 3.14Å; E1104-R1106 VanDerWaalsContact C-N 3.29Å; E1104-R1106 PolarHBondContact O-N 2.73Å; E1104-I1107 PolarHBondContact O-N 2.88Å; E1104-A1108 WeakPolarHBondContact O-CB 3.38Å; E1104-A1108 PolarHBondContact O-N 2.84Å
1105	S	92	Very high	91.7	Very high	22 Å²	22	51.4 Å²	51.4	15%	0.154	27%	0.265	C	S	.	.	H	α-helix	trans	-54.3	-43.9	171.4	-127.9	0	0	0	0	111.8	L1099 N1101 A1108 S1109 Y1194	L1099-S1105 WeakPolarHBondContact O-CB 3.29Å; L1099-S1105 PolarHBondContact O-OG 2.83Å; N1101-S1105 WeakPolarHBondContact O-CB 2.86Å; N1101-S1105 PolarHBondContact O-N 3.5Å; S1105-A1108 PolarHBondContact O-N 2.83Å; S1105-S1109 PolarHBondContact O-N 2.85Å; S1105-Y1194 PolarHBondContact O-OH 3.49Å; S1105-Y1194 WeakPolarHBondContact OG-CE2 3.47Å; S1105-Y1194 PolarHBondContact OG-OH 3.48Å
1106	R	91.7	Very high	91.5	Very high	126 Å²	126	52 Å²	52	48%	0.475	27%	0.269	S	S	.	.	H	α-helix	trans	-67.8	-46.4	178.2	-171.9	177.1	178.8	-146.5	-5.8	111.9	D1066 P1102 H1103 E1104 A1108 S1109 D1110	D1066-R1106 IonicContact OD1-CZ 2.68Å; D1066-R1106 IonicContact OD1-NH1 2.74Å; D1066-R1106 IonicContact OD1-NH2 3.15Å; D1066-R1106 PolarHBondContact OD1-NH2 2.86Å; D1066-R1106 IonicContact OD2-CZ 3.1Å; D1066-R1106 VanDerWaalsContact OD2-CZ 3.29Å; D1066-R1106 IonicContact OD2-NH1 2.7Å; D1066-R1106 PolarHBondContact OD2-NH1 3.18Å; D1066-R1106 IonicContact OD2-NH2 3.04Å; D1066-R1106 PolarHBondContact OD2-NH2 3.02Å; D1066-R1106 VanDerWaalsContact OD2-NH2 3.12Å; P1102-R1106 PolarHBondContact O-N 2.96Å; P1102-R1106 VanDerWaalsContact O-N 3.14Å; H1103-R1106 PolarHBondContact O-N 2.94Å; E1104-R1106 VanDerWaalsContact C-N 3.29Å; E1104-R1106 PolarHBondContact O-N 2.73Å; R1106-A1108 VanDerWaalsContact C-N 3.28Å; R1106-A1108 PolarHBondContact O-N 2.85Å; R1106-S1109 WeakPolarHBondContact O-CA 3.31Å; R1106-S1109 WeakPolarHBondContact O-CB 3.5Å; R1106-S1109 PolarHBondContact O-N 2.9Å; R1106-S1109 VanDerWaalsContact O-N 3.08Å; R1106-D1110 PolarHBondContact O-N 3.45Å
1107	I	93.7	Very high	90.9	Very high	14 Å²	14	52.4 Å²	52.4	7%	0.072	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-38.1	176.8	-62.2	164	0	0	0	110.9	F1091 A1093 P1095 H1103 E1104 D1110 L1111	F1091-I1107 HydrophobicContact CE1-CG2 4.08Å; F1091-I1107 HydrophobicContact CZ-CG2 4.03Å; A1093-I1107 HydrophobicContact CB-CD1 4.05Å; A1093-I1107 HydrophobicContact CB-CG1 4.12Å; A1093-I1107 HydrophobicContact CB-CG2 3.69Å; P1095-I1107 HydrophobicContact CB-CB 4.16Å; P1095-I1107 HydrophobicContact CB-CG2 3.9Å; P1095-I1107 HydrophobicContact CG-CG2 3.86Å; H1103-I1107 WeakPolarHBondContact CE1-CD1 3.21Å; H1103-I1107 PolarHBondContact O-N 3.29Å; H1103-I1107 VanDerWaalsContact O-N 3.09Å; E1104-I1107 PolarHBondContact O-N 2.88Å; I1107-D1110 PolarHBondContact O-N 3.35Å; I1107-L1111 WeakPolarHBondContact O-CB 3.25Å; I1107-L1111 PolarHBondContact O-N 3.14Å
1108	A	94.1	Very high	90.1	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.7	-37.4	173.7	0	0	0	0	0	112.3	P1095 L1099 E1104 S1105 R1106 L1111 L1112 L1191 Y1194	P1095-A1108 HydrophobicContact CB-CB 4.1Å; P1095-A1108 HydrophobicContact CG-CB 4.17Å; L1099-A1108 HydrophobicContact CD1-CB 4.27Å; L1099-A1108 HydrophobicContact CD2-CB 3.57Å; E1104-A1108 WeakPolarHBondContact O-CB 3.38Å; E1104-A1108 PolarHBondContact O-N 2.84Å; S1105-A1108 PolarHBondContact O-N 2.83Å; R1106-A1108 VanDerWaalsContact C-N 3.28Å; R1106-A1108 PolarHBondContact O-N 2.85Å; A1108-L1111 PolarHBondContact O-N 3.49Å; A1108-L1112 WeakPolarHBondContact O-CB 3.4Å; A1108-L1112 WeakPolarHBondContact O-CD1 3.35Å; A1108-L1112 WeakPolarHBondContact O-CG 3.2Å; A1108-L1112 PolarHBondContact O-N 3.28Å; A1108-L1191 HydrophobicContact CB-CD2 3.91Å; A1108-Y1194 HydrophobicContact CB-CE1 4.44Å
1109	S	92.7	Very high	88.6	Confident	48 Å²	48	48.4 Å²	48.4	34%	0.336	24%	0.243	S	C	.	.	H	α-helix	trans	-61.4	-51.8	172.1	-166.3	0	0	0	0	111.6	S1105 R1106 L1111 L1112 E1113	S1105-S1109 PolarHBondContact O-N 2.85Å; R1106-S1109 WeakPolarHBondContact O-CA 3.31Å; R1106-S1109 WeakPolarHBondContact O-CB 3.5Å; R1106-S1109 PolarHBondContact O-N 2.9Å; R1106-S1109 VanDerWaalsContact O-N 3.08Å; S1109-L1111 VanDerWaalsContact C-N 3.28Å; S1109-L1111 PolarHBondContact O-N 3.17Å; S1109-L1112 PolarHBondContact O-N 3.01Å; S1109-E1113 WeakPolarHBondContact O-CB 3.35Å; S1109-E1113 PolarHBondContact O-N 3.16Å
1110	D	92	Very high	86.8	Confident	16 Å²	16	53 Å²	53	9%	0.086	27%	0.267	C	S	.	.	H	α-helix	trans	-58.1	-39.8	177.4	-66.5	17.7	0	0	0	111.5	S1065 S1067 F1091 R1106 I1107 L1114	S1065-D1110 VanDerWaalsContact CB-OD2 3.3Å; S1065-D1110 WeakPolarHBondContact CB-OD2 3.41Å; S1065-D1110 PolarHBondContact OG-OD2 3.38Å; S1067-D1110 WeakPolarHBondContact CB-OD2 3.48Å; S1067-D1110 PolarHBondContact OG-OD2 3.19Å; F1091-D1110 HydrophobicContact CE2-CB 3.67Å; F1091-D1110 HydrophobicContact CZ-CB 4Å; R1106-D1110 PolarHBondContact O-N 3.45Å; I1107-D1110 PolarHBondContact O-N 3.35Å; D1110-L1114 WeakPolarHBondContact O-CB 3.28Å; D1110-L1114 PolarHBondContact O-N 3.35Å
1111	L	94.4	Very high	84.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.2	-39	178.4	-177.3	65.1	0	0	0	112.4	F1091 W1094 P1095 I1107 A1108 S1109 A1115 F1146 I1149 L1191	F1091-L1111 HydrophobicContact CD1-CD1 3.97Å; F1091-L1111 HydrophobicContact CE1-CB 4.02Å; F1091-L1111 HydrophobicContact CE1-CD1 3.86Å; F1091-L1111 HydrophobicContact CE1-CG 4.44Å; F1091-L1111 HydrophobicContact CE2-CB 4.27Å; F1091-L1111 HydrophobicContact CG-CD1 4.41Å; F1091-L1111 HydrophobicContact CZ-CB 3.67Å; F1091-L1111 HydrophobicContact CZ-CD1 4.21Å; W1094-L1111 HydrophobicContact CH2-CD1 4.47Å; W1094-L1111 HydrophobicContact CH2-CD2 4.19Å; W1094-L1111 HydrophobicContact CZ2-CD2 4.5Å; W1094-L1111 HydrophobicContact CZ3-CD1 4.03Å; W1094-L1111 HydrophobicContact CZ3-CD2 4.27Å; P1095-L1111 HydrophobicContact CG-CD2 3.73Å; I1107-L1111 WeakPolarHBondContact O-CB 3.25Å; I1107-L1111 PolarHBondContact O-N 3.14Å; A1108-L1111 PolarHBondContact O-N 3.49Å; S1109-L1111 VanDerWaalsContact C-N 3.28Å; S1109-L1111 PolarHBondContact O-N 3.17Å; L1111-A1115 WeakPolarHBondContact O-CB 3.4Å; L1111-A1115 PolarHBondContact O-N 2.99Å; L1111-F1146 HydrophobicContact CD1-CD2 3.89Å; L1111-F1146 HydrophobicContact CD1-CE2 4.17Å; L1111-I1149 HydrophobicContact CD2-CD1 4.27Å; L1111-I1149 HydrophobicContact CG-CD1 4.09Å; L1111-L1191 HydrophobicContact CD2-CD1 4.45Å
1112	L	93.2	Very high	82.8	Confident	7 Å²	7	48.6 Å²	48.6	4%	0.037	25%	0.25	C	C	.	.	H	α-helix	trans	-76.2	-34.9	178.7	-73.5	165.6	0	0	0	112.1	A1108 S1109 A1115 T1116 I1149 I1153 L1191 Y1194 Y1195	A1108-L1112 WeakPolarHBondContact O-CB 3.4Å; A1108-L1112 WeakPolarHBondContact O-CD1 3.35Å; A1108-L1112 WeakPolarHBondContact O-CG 3.2Å; A1108-L1112 PolarHBondContact O-N 3.28Å; S1109-L1112 PolarHBondContact O-N 3.01Å; L1112-A1115 PolarHBondContact O-N 2.96Å; L1112-T1116 VanDerWaalsContact O-CB 3.32Å; L1112-T1116 WeakPolarHBondContact O-CB 3.33Å; L1112-T1116 PolarHBondContact O-N 3.19Å; L1112-T1116 PolarHBondContact O-OG1 3.06Å; L1112-I1149 HydrophobicContact CD2-CD1 4.31Å; L1112-I1153 HydrophobicContact CD2-CD1 3.97Å; L1112-L1191 HydrophobicContact CD1-CD2 4.48Å; L1112-Y1194 HydrophobicContact CD1-CD1 3.69Å; L1112-Y1194 HydrophobicContact CD1-CE1 4.33Å; L1112-Y1195 HydrophobicContact CB-CD2 4.3Å; L1112-Y1195 HydrophobicContact CD1-CD2 4.49Å; L1112-Y1195 HydrophobicContact CD2-CD2 4.38Å; L1112-Y1195 HydrophobicContact CD2-CG 4.4Å
1113	E	90.3	Very high	80.5	Confident	105 Å²	105	48 Å²	48	49%	0.491	25%	0.248	S	C	.	.	H	α-helix	trans	-62.8	-47.9	171.1	-174.6	172.4	-174.3	0	0	110.2	S1109 A1115 T1116 H1117	S1109-E1113 WeakPolarHBondContact O-CB 3.35Å; S1109-E1113 PolarHBondContact O-N 3.16Å; E1113-A1115 PolarHBondContact O-N 3.18Å; E1113-T1116 PolarHBondContact O-N 3.12Å; E1113-T1116 VanDerWaalsContact O-N 3.12Å; E1113-H1117 WeakPolarHBondContact O-CB 3.33Å; E1113-H1117 PolarHBondContact O-CD2 3.32Å; E1113-H1117 PolarHBondContact O-N 2.86Å
1114	L	91.7	Very high	78.2	Confident	11 Å²	11	49.5 Å²	49.5	6%	0.058	26%	0.255	C	S	.	.	H	α-helix	trans	-55.5	-50.5	170.9	177.5	64	0	0	0	111.4	I1030 L1068 L1089 F1091 D1110 T1116 H1117 L1118 F1146	I1030-L1114 HydrophobicContact CG2-CD2 4.28Å; L1068-L1114 HydrophobicContact CD1-CD1 4.45Å; L1068-L1114 HydrophobicContact CD1-CD2 4.36Å; L1068-L1114 HydrophobicContact CD2-CD1 4.11Å; L1089-L1114 HydrophobicContact CD1-CD1 3.82Å; F1091-L1114 HydrophobicContact CB-CD2 3.89Å; F1091-L1114 HydrophobicContact CD2-CD2 3.74Å; F1091-L1114 HydrophobicContact CG-CD2 4.02Å; D1110-L1114 WeakPolarHBondContact O-CB 3.28Å; D1110-L1114 PolarHBondContact O-N 3.35Å; L1114-T1116 PolarHBondContact O-N 3.49Å; L1114-H1117 PolarHBondContact O-N 3.34Å; L1114-L1118 HydrophobicContact CD1-CD2 3.85Å; L1114-L1118 HydrophobicContact CD1-CG 4.4Å; L1114-L1118 VanDerWaalsContact O-CG 3.31Å; L1114-L1118 WeakPolarHBondContact O-CG 3.4Å; L1114-F1146 HydrophobicContact CD2-CE2 3.96Å; L1114-F1146 HydrophobicContact CD2-CZ 4.28Å; L1114-F1146 HydrophobicContact CG-CE2 3.97Å; L1114-F1146 HydrophobicContact CG-CZ 4.01Å
1115	A	91.7	Very high	76.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.4	-26	179.1	0	0	0	0	0	113.4	L1111 L1112 E1113 F1146 I1149 R1150 I1153	L1111-A1115 WeakPolarHBondContact O-CB 3.4Å; L1111-A1115 PolarHBondContact O-N 2.99Å; L1112-A1115 PolarHBondContact O-N 2.96Å; E1113-A1115 PolarHBondContact O-N 3.18Å; A1115-F1146 HydrophobicContact CB-CE2 3.96Å; A1115-F1146 HydrophobicContact CB-CZ 4.27Å; A1115-I1149 HydrophobicContact CB-CD1 3.97Å; A1115-I1149 HydrophobicContact CB-CG1 3.93Å; A1115-R1150 HydrophobicContact CB-CB 4.42Å; A1115-R1150 PolarHBondContact O-NH1 2.99Å; A1115-I1153 HydrophobicContact CB-CD1 3.78Å
1116	T	89.1	Confident	74.1	Confident	16 Å²	16	52 Å²	52	10%	0.098	27%	0.271	C	S	.	.	H	α-helix	trans	-84.6	-47.6	179.5	-58.6	0	0	0	0	112.7	L1112 E1113 L1114 I1153 L1157	L1112-T1116 VanDerWaalsContact O-CB 3.32Å; L1112-T1116 WeakPolarHBondContact O-CB 3.33Å; L1112-T1116 PolarHBondContact O-N 3.19Å; L1112-T1116 PolarHBondContact O-OG1 3.06Å; E1113-T1116 PolarHBondContact O-N 3.12Å; E1113-T1116 VanDerWaalsContact O-N 3.12Å; L1114-T1116 PolarHBondContact O-N 3.49Å; T1116-I1153 HydrophobicContact CG2-CG2 4.4Å; T1116-L1157 HydrophobicContact CG2-CD1 4.35Å
1117	H	78.6	Confident	71.9	Confident	60 Å²	60	52.8 Å²	52.8	28%	0.278	29%	0.285	S	S	.	.	H	α-helix	trans	-94.5	-6.3	-159.1	-79.5	-90.4	0	0	0	117.6	E1113 L1114 E1119 N1120	E1113-H1117 WeakPolarHBondContact O-CB 3.33Å; E1113-H1117 PolarHBondContact O-CD2 3.32Å; E1113-H1117 PolarHBondContact O-N 2.86Å; L1114-H1117 PolarHBondContact O-N 3.34Å; H1117-E1119 PolarHBondContact O-N 3.39Å; H1117-N1120 PolarHBondContact O-N 3.36Å
1118	L	72.5	Confident	70.2	Confident	12 Å²	12	54.2 Å²	54.2	6%	0.063	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.6	-34.6	-174.1	-72	159.1	0	0	0	116.8	L1028 I1030 L1089 L1114 F1146	L1028-L1118 HydrophobicContact CD2-CD2 4.16Å; I1030-L1118 HydrophobicContact CD1-CD1 3.54Å; I1030-L1118 HydrophobicContact CD1-CD2 3.6Å; I1030-L1118 HydrophobicContact CD1-CG 4.23Å; I1030-L1118 HydrophobicContact CG1-CD2 4.34Å; L1089-L1118 HydrophobicContact CD1-CD2 3.48Å; L1089-L1118 VanDerWaalsContact CD1-CD2 3.48Å; L1114-L1118 HydrophobicContact CD1-CD2 3.85Å; L1114-L1118 HydrophobicContact CD1-CG 4.4Å; L1114-L1118 VanDerWaalsContact O-CG 3.31Å; L1114-L1118 WeakPolarHBondContact O-CG 3.4Å; L1118-F1146 HydrophobicContact CD1-CE1 4.1Å; L1118-F1146 HydrophobicContact CD1-CZ 3.93Å
1119	E	59.7	Low	69.1	Low	64 Å²	64	59.6 Å²	59.6	30%	0.299	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-15.1	-178.9	-76.9	168.3	-149.2	0	0	114.1	H1117 R1150	H1117-E1119 PolarHBondContact O-N 3.39Å; E1119-R1150 IonicContact OE1-CZ 2.72Å; E1119-R1150 IonicContact OE1-NH2 3.67Å; E1119-R1150 PolarHBondContact OE1-NH2 2.68Å; E1119-R1150 IonicContact OE2-NH2 2.59Å
1120	N	51.5	Low	68.7	Low	113 Å²	113	58.5 Å²	58.5	60%	0.604	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-31	-172.6	-72.1	-45.4	0	0	0	113.2	H1117	H1117-N1120 PolarHBondContact O-N 3.36Å
1121	D	46.9	Very low	68.5	Low	97 Å²	97	58.8 Å²	58.8	52%	0.519	33%	0.33	S	S	.	.	S	Bend	trans	-73.7	-27.3	-173	-88.7	23.1	0	0	0	114.1	R1070	R1070-D1121 IonicContact NH2-OD2 3.7Å; R1070-D1121 PolarHBondContact NH2-OD2 3.49Å
1122	N	47.7	Very low	68.4	Low	58 Å²	58	59.6 Å²	59.6	31%	0.31	33%	0.334	S	S	.	.			trans	-137.7	120	-178	-78.3	-46.3	0	0	0	112	E1124 F1125	N1122-E1124 PolarHBondContact O-N 2.94Å; N1122-F1125 HydrophobicContact CB-CD2 3.76Å; N1122-F1125 HydrophobicContact CB-CE2 3.99Å; N1122-F1125 HydrophobicContact CB-CG 4.38Å; N1122-F1125 PolarHBondContact O-N 2.92Å; N1122-F1125 VanDerWaalsContact O-N 3.16Å
1123	S	41.2	Very low	68.5	Low	92 Å²	92	59.3 Å²	59.3	64%	0.643	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-10.2	176.3	52.5	0	0	0	0	115.1	S1126 N1127	S1123-S1126 PolarHBondContact O-OG 2.84Å; S1123-N1127 PolarHBondContact O-ND2 2.85Å
1124	E	44.2	Very low	68.7	Low	153 Å²	153	54.3 Å²	54.3	72%	0.715	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-34.8	176.5	-62.2	-177.2	156.7	0	0	111.4	N1122	N1122-E1124 PolarHBondContact O-N 2.94Å
1125	F	52.6	Low	68.9	Low	34 Å²	34	53.8 Å²	53.8	15%	0.149	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-73.5	-39	175.4	-59.5	-37.7	0	0	0	112.2	L1028 N1122 N1127 S1128	L1028-F1125 HydrophobicContact CB-CE1 4.4Å; L1028-F1125 HydrophobicContact CD1-CE2 4.42Å; L1028-F1125 HydrophobicContact CD1-CZ 4.32Å; L1028-F1125 HydrophobicContact CD2-CD2 4.47Å; N1122-F1125 HydrophobicContact CB-CD2 3.76Å; N1122-F1125 HydrophobicContact CB-CE2 3.99Å; N1122-F1125 HydrophobicContact CB-CG 4.38Å; N1122-F1125 PolarHBondContact O-N 2.92Å; N1122-F1125 VanDerWaalsContact O-N 3.16Å; F1125-N1127 PolarHBondContact O-N 3.12Å; F1125-S1128 PolarHBondContact O-N 3.14Å
1126	S	46.4	Very low	68.9	Low	67 Å²	67	53.8 Å²	53.8	47%	0.469	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-67	-3.5	-175.2	61.9	0	0	0	0	115.9	S1123	S1123-S1126 PolarHBondContact O-OG 2.84Å
1127	N	46.3	Very low	69	Low	142 Å²	142	55.6 Å²	55.6	76%	0.759	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-114.2	-4.4	172.2	-67.2	-75.2	0	0	0	113.5	S1123 F1125	S1123-N1127 PolarHBondContact O-ND2 2.85Å; F1125-N1127 PolarHBondContact O-N 3.12Å
1128	S	58.4	Low	69.5	Low	43 Å²	43	56.3 Å²	56.3	30%	0.301	33%	0.325	S	S	.	.			trans	-82.1	131.2	179.3	-169.3	0	0	0	0	110.8	F1125 A1130	F1125-S1128 PolarHBondContact O-N 3.14Å; S1128-A1130 VanDerWaalsContact C-N 3.32Å; S1128-A1130 WeakPolarHBondContact OG-CB 3.48Å; S1128-A1130 PolarHBondContact OG-N 2.59Å
1129	S	69.8	Low	70	Confident	114 Å²	114	55.9 Å²	55.9	80%	0.797	32%	0.323	S	S	*	.			trans	-93.8	12.2	168.5	66.5	0	0	0	0	112.7
1130	A	83.9	Confident	71.4	Confident	25 Å²	25	53.2 Å²	53.2	21%	0.207	31%	0.312	C	S	.	.	S	Bend	trans	-78.3	147.6	177.1	0	0	0	0	0	111.2	N1025 S1128	N1025-A1130 WeakPolarHBondContact O-CB 3.4Å; S1128-A1130 VanDerWaalsContact C-N 3.32Å; S1128-A1130 WeakPolarHBondContact OG-CB 3.48Å; S1128-A1130 PolarHBondContact OG-N 2.59Å
1131	P	89.1	Confident	73.4	Confident	21 Å²	21	50 Å²	50	14%	0.136	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-67.8	148.3	177.9	27.6	-34.9	0	0	0	112.4	C1001 E1002 I1004 A1024 S1026	C1001-P1131 WeakPolarHBondContact O-CB 3.49Å; E1002-P1131 WeakPolarHBondContact O-CA 3.18Å; I1004-P1131 HydrophobicContact CD1-CB 4.08Å; I1004-P1131 HydrophobicContact CD1-CG 3.48Å; I1004-P1131 VanDerWaalsContact CD1-CG 3.48Å; I1004-P1131 HydrophobicContact CG1-CB 3.88Å; I1004-P1131 HydrophobicContact CG1-CG 3.86Å; A1024-P1131 HydrophobicContact CB-CG 3.91Å; S1026-P1131 WeakPolarHBondContact CB-O 3.35Å; S1026-P1131 PolarHBondContact OG-O 3.04Å
1132	I	92.2	Very high	75.7	Confident	17 Å²	17	46.3 Å²	46.3	9%	0.087	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	125	167.8	-58.2	178.1	0	0	0	108.5	E1002 Y1003 I1004 L1028 I1030 L1134	E1002-I1132 PolarHBondContact O-N 2.57Å; Y1003-I1132 CarbonylContact C-O 3.26Å; Y1003-I1132 VanDerWaalsContact CA-O 3.29Å; Y1003-I1132 WeakPolarHBondContact CA-O 3.3Å; Y1003-I1132 HydrophobicContact CD1-CB 3.92Å; Y1003-I1132 HydrophobicContact CD1-CG2 4.41Å; Y1003-I1132 HydrophobicContact CE1-CB 4.21Å; Y1003-I1132 HydrophobicContact CE1-CD1 4.07Å; I1004-I1132 PolarHBondContact N-O 2.96Å; L1028-I1132 HydrophobicContact CD2-CD1 4.12Å; L1028-I1132 HydrophobicContact CD2-CG1 4.19Å; L1028-I1132 HydrophobicContact CD2-CG2 4.38Å; L1028-I1132 HydrophobicContact CG-CG2 4.19Å; I1030-I1132 HydrophobicContact CD1-CG2 3.88Å; I1030-I1132 HydrophobicContact CG1-CG2 3.99Å; I1132-L1134 HydrophobicContact CG2-CD2 3.76Å; I1132-L1134 PolarHBondContact O-N 3.48Å
1133	V	94	Very high	77.9	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	112.4	177.9	171.8	0	0	0	0	109.5	I1004 F1017 V1021 S1026 L1028 I1029 I1030 V1135	I1004-V1133 HydrophobicContact CB-CG2 4.13Å; I1004-V1133 HydrophobicContact CD1-CG2 4.32Å; I1004-V1133 HydrophobicContact CG2-CG2 4.48Å; I1004-V1133 CarbonylContact O-C 3.53Å; I1004-V1133 WeakPolarHBondContact O-CA 3.45Å; F1017-V1133 HydrophobicContact CE2-CG1 3.65Å; F1017-V1133 HydrophobicContact CZ-CG1 3.81Å; V1021-V1133 HydrophobicContact CG2-CG2 4.33Å; S1026-V1133 WeakPolarHBondContact OG-CG2 3.47Å; L1028-V1133 PolarHBondContact O-N 2.59Å; I1029-V1133 CarbonylContact C-O 3.6Å; I1029-V1133 VanDerWaalsContact CA-O 3.26Å; I1029-V1133 WeakPolarHBondContact CA-O 3.33Å; I1029-V1133 HydrophobicContact CG1-CB 4.14Å; I1029-V1133 HydrophobicContact CG1-CG1 4.37Å; I1029-V1133 HydrophobicContact CG2-CG1 4.36Å; I1030-V1133 PolarHBondContact N-O 3.37Å; V1133-V1135 HydrophobicContact CG1-CG2 4.15Å
1134	L	95.5	Very high	80.5	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	131.2	176.8	-53.6	-177.8	0	0	0	110.6	Y1003 I1004 V1005 T1006 I1030 I1132 V1143 F1146 C1147	Y1003-L1134 HydrophobicContact CD1-CD1 3.61Å; Y1003-L1134 HydrophobicContact CD1-CD2 4.22Å; Y1003-L1134 HydrophobicContact CD1-CG 3.89Å; Y1003-L1134 HydrophobicContact CE1-CD1 4.35Å; Y1003-L1134 HydrophobicContact CG-CD1 4.1Å; I1004-L1134 PolarHBondContact O-N 3.17Å; V1005-L1134 WeakPolarHBondContact CA-O 3.34Å; V1005-L1134 HydrophobicContact CG1-CB 4.17Å; V1005-L1134 HydrophobicContact CG1-CD1 4.2Å; T1006-L1134 PolarHBondContact N-O 3.5Å; I1030-L1134 HydrophobicContact CB-CD2 3.73Å; I1030-L1134 HydrophobicContact CD1-CD2 3.77Å; I1030-L1134 HydrophobicContact CG1-CD2 3.98Å; I1030-L1134 WeakPolarHBondContact O-CA 3.45Å; I1132-L1134 HydrophobicContact CG2-CD2 3.76Å; I1132-L1134 PolarHBondContact O-N 3.48Å; L1134-V1143 HydrophobicContact CB-CB 4.04Å; L1134-V1143 HydrophobicContact CB-CG1 3.67Å; L1134-V1143 HydrophobicContact CD1-CB 4.4Å; L1134-F1146 HydrophobicContact CD1-CD1 4.17Å; L1134-F1146 HydrophobicContact CD2-CD1 4.05Å; L1134-F1146 HydrophobicContact CD2-CE1 4.2Å; L1134-C1147 WeakPolarHBondContact CD1-SG 3.47Å
1135	V	94.9	Very high	83	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	130.6	179.8	-175	0	0	0	0	109.7	T1006 H1008 F1017 I1029 I1030 L1032 F1040 V1133	T1006-V1135 HydrophobicContact CG2-CG2 4.07Å; H1008-V1135 HydrophobicContact CB-CG1 4.21Å; F1017-V1135 HydrophobicContact CE2-CG2 3.72Å; F1017-V1135 HydrophobicContact CZ-CG2 4.06Å; I1029-V1135 HydrophobicContact CG2-CG2 4.28Å; I1030-V1135 PolarHBondContact O-N 3.17Å; L1032-V1135 PolarHBondContact N-O 2.89Å; F1040-V1135 HydrophobicContact CE1-CG1 4.29Å; F1040-V1135 HydrophobicContact CZ-CG2 4.39Å; V1133-V1135 HydrophobicContact CG1-CG2 4.15Å
1136	D	92.5	Very high	85.1	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	-179.6	158.9	75.4	31	0	0	0	110.9	T1006 R1007 H1008 L1032 S1033 T1138 G1139 G1140 R1142 V1143	T1006-D1136 PolarHBondContact O-N 2.81Å; R1007-D1136 CarbonylContact C-O 3.57Å; R1007-D1136 WeakPolarHBondContact CA-O 3.19Å; H1008-D1136 PolarHBondContact N-O 3.41Å; L1032-D1136 HydrophobicContact CB-CB 4.19Å; S1033-D1136 VanDerWaalsContact OG-C 3.27Å; D1136-T1138 PolarHBondContact O-N 3.39Å; D1136-T1138 PolarHBondContact OD1-N 3.42Å; D1136-G1139 WeakPolarHBondContact OD1-CA 3.39Å; D1136-G1139 PolarHBondContact OD1-N 3.03Å; D1136-G1140 PolarHBondContact OD1-N 3.21Å; D1136-G1140 VanDerWaalsContact OD1-N 3.09Å; D1136-G1140 VanDerWaalsContact OD2-C 3.3Å; D1136-G1140 PolarHBondContact OD2-N 3.27Å; D1136-R1142 HydrophobicContact CB-CB 3.82Å; D1136-R1142 HydrophobicContact CB-CG 4.42Å; D1136-R1142 WeakPolarHBondContact OD2-CA 3.21Å; D1136-R1142 WeakPolarHBondContact OD2-CB 3.23Å; D1136-R1142 PolarHBondContact OD2-N 3.26Å; D1136-V1143 HydrophobicContact CB-CG1 3.89Å; D1136-V1143 PolarHBondContact OD2-N 2.87Å
1137	N	91.5	Very high	87.5	Confident	53 Å²	53	27 Å²	27	28%	0.283	16%	0.162	S	C	.	.	S	Bend	trans	-51	-31.4	-178	-62.4	-0	0	0	0	114.3	S1033 D1034 L1037	S1033-N1137 WeakPolarHBondContact CA-OD1 3.26Å; S1033-N1137 WeakPolarHBondContact CB-OD1 3.31Å; S1033-N1137 PolarHBondContact OG-N 3.34Å; S1033-N1137 PolarHBondContact OG-OD1 3.19Å; D1034-N1137 PolarHBondContact N-OD1 3.47Å; D1034-N1137 VanDerWaalsContact N-OD1 3.14Å; D1034-N1137 PolarHBondContact OD2-ND2 3.13Å; L1037-N1137 HydrophobicContact CD1-CB 4.28Å; L1037-N1137 WeakPolarHBondContact CD1-OD1 3.49Å
1138	T	87.8	Confident	89.9	Confident	76 Å²	76	20.3 Å²	20.3	47%	0.466	13%	0.126	S	C	.	.	S	Bend	trans	-129.7	-7.7	-171.2	61.9	0	0	0	0	114.6	R1007 D1136	R1007-T1138 PolarHBondContact NH2-O 3.33Å; D1136-T1138 PolarHBondContact O-N 3.39Å; D1136-T1138 PolarHBondContact OD1-N 3.42Å
1139	G	84.3	Confident	91.7	Very high	3 Å²	3	18.2 Å²	18.2	3%	0.031	11%	0.112	C	C	.	.	S	Bend	trans	71.2	45.2	-169.3	0	0	0	0	0	111.1	T1006 D1136 R1175	T1006-G1139 VanDerWaalsContact O-CA 3.31Å; T1006-G1139 WeakPolarHBondContact O-CA 3.41Å; D1136-G1139 WeakPolarHBondContact OD1-CA 3.39Å; D1136-G1139 PolarHBondContact OD1-N 3.03Å; G1139-R1175 PolarHBondContact O-NE 2.75Å; G1139-R1175 PolarHBondContact O-NH2 2.88Å; G1139-R1175 VanDerWaalsContact O-NH2 3.11Å
1140	G	88.3	Confident	92.8	Very high	7 Å²	7	13.1 Å²	13.1	7%	0.072	8%	0.075	C	C	.	.	S	Bend	trans	-137	-121.4	-166.7	0	0	0	0	0	114.3	D1136 R1142 V1143 G1144 L1178	D1136-G1140 PolarHBondContact OD1-N 3.21Å; D1136-G1140 VanDerWaalsContact OD1-N 3.09Å; D1136-G1140 VanDerWaalsContact OD2-C 3.3Å; D1136-G1140 PolarHBondContact OD2-N 3.27Å; G1140-R1142 PolarHBondContact O-N 3.29Å; G1140-V1143 WeakPolarHBondContact O-CG2 3.32Å; G1140-V1143 PolarHBondContact O-N 3.09Å; G1140-G1144 PolarHBondContact O-N 2.84Å; G1140-L1178 CarbonylContact C-O 3.26Å; G1140-L1178 VanDerWaalsContact O-CD1 3.25Å; G1140-L1178 WeakPolarHBondContact O-CD1 3.43Å
1141	Y	93.4	Very high	93.3	Very high	45 Å²	45	12.3 Å²	12.3	18%	0.176	7%	0.067	C	C	.	.	H	α-helix	trans	-70.4	-29.4	-159.1	81.6	-76.7	0	0	0	114.3	G1144 I1145 L1178 R1180	Y1141-G1144 PolarHBondContact O-N 2.79Å; Y1141-I1145 HydrophobicContact CD2-CD1 3.7Å; Y1141-I1145 HydrophobicContact CE2-CD1 4.35Å; Y1141-I1145 WeakPolarHBondContact O-CB 3.41Å; Y1141-I1145 VanDerWaalsContact O-CD1 3.27Å; Y1141-I1145 WeakPolarHBondContact O-CD1 3.45Å; Y1141-I1145 WeakPolarHBondContact O-CG1 3.3Å; Y1141-I1145 PolarHBondContact O-N 2.83Å; Y1141-L1178 WeakPolarHBondContact CA-O 3.24Å; Y1141-L1178 PolarHBondContact N-O 2.63Å; Y1141-R1180 HydrophobicContact CD1-CG 4.37Å; Y1141-R1180 VanDerWaalsContact CD2-CZ 3.41Å; Y1141-R1180 VanDerWaalsContact CE2-CZ 3.45Å; Y1141-R1180 HydrophobicContact CG-CG 4.14Å
1142	R	95.3	Very high	93.6	Very high	20 Å²	20	11.3 Å²	11.3	8%	0.075	6%	0.061	C	C	.	.	H	α-helix	trans	-72.5	-46.9	179.5	-59.7	-173.9	-177	-178.4	1.2	110.4	L1032 D1034 W1094 D1136 G1140 G1144 I1145 F1146	L1032-R1142 HydrophobicContact CB-CB 4.13Å; L1032-R1142 HydrophobicContact CD1-CB 4.14Å; L1032-R1142 WeakPolarHBondContact O-CD 3.5Å; L1032-R1142 PolarHBondContact O-NH1 2.93Å; D1034-R1142 IonicContact OD1-CZ 3.99Å; D1034-R1142 IonicContact OD1-NH1 3.15Å; D1034-R1142 PolarHBondContact OD1-NH1 2.81Å; D1034-R1142 IonicContact OD1-NH2 3.2Å; D1034-R1142 PolarHBondContact OD1-NH2 3.42Å; D1034-R1142 IonicContact OD2-NH1 3.9Å; D1034-R1142 IonicContact OD2-NH2 3.51Å; D1034-R1142 PolarHBondContact OD2-NH2 2.88Å; W1094-R1142 HydrophobicContact CD2-CB 4.33Å; W1094-R1142 HydrophobicContact CD2-CG 3.8Å; W1094-R1142 HydrophobicContact CE3-CB 4.03Å; W1094-R1142 HydrophobicContact CE3-CG 3.92Å; W1094-R1142 HydrophobicContact CG-CG 4.44Å; W1094-R1142 HydrophobicContact CH2-CB 3.66Å; W1094-R1142 HydrophobicContact CH2-CG 4.15Å; W1094-R1142 WeakPolarHBondContact CH2-O 3.36Å; W1094-R1142 HydrophobicContact CZ2-CB 3.98Å; W1094-R1142 HydrophobicContact CZ2-CG 4.03Å; W1094-R1142 HydrophobicContact CZ3-CB 3.7Å; W1094-R1142 HydrophobicContact CZ3-CG 4.1Å; D1136-R1142 HydrophobicContact CB-CB 3.82Å; D1136-R1142 HydrophobicContact CB-CG 4.42Å; D1136-R1142 WeakPolarHBondContact OD2-CA 3.21Å; D1136-R1142 WeakPolarHBondContact OD2-CB 3.23Å; D1136-R1142 PolarHBondContact OD2-N 3.26Å; G1140-R1142 PolarHBondContact O-N 3.29Å; R1142-G1144 VanDerWaalsContact C-N 3.28Å; R1142-G1144 PolarHBondContact O-N 3.45Å; R1142-I1145 PolarHBondContact O-N 3.02Å; R1142-F1146 WeakPolarHBondContact O-CB 3.45Å; R1142-F1146 PolarHBondContact O-N 2.66Å
1143	V	95.1	Very high	93.7	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-63.4	-35.7	173.7	-62.3	0	0	0	0	111.6	V1005 L1032 L1134 D1136 G1140 F1146 C1147 L1178	V1005-V1143 HydrophobicContact CB-CG2 3.99Å; V1005-V1143 HydrophobicContact CG1-CB 3.97Å; V1005-V1143 HydrophobicContact CG1-CG2 3.86Å; L1032-V1143 HydrophobicContact CD1-CG1 4.05Å; L1134-V1143 HydrophobicContact CB-CB 4.04Å; L1134-V1143 HydrophobicContact CB-CG1 3.67Å; L1134-V1143 HydrophobicContact CD1-CB 4.4Å; D1136-V1143 HydrophobicContact CB-CG1 3.89Å; D1136-V1143 PolarHBondContact OD2-N 2.87Å; G1140-V1143 WeakPolarHBondContact O-CG2 3.32Å; G1140-V1143 PolarHBondContact O-N 3.09Å; V1143-F1146 PolarHBondContact O-N 3.04Å; V1143-C1147 WeakPolarHBondContact O-CB 3.49Å; V1143-C1147 PolarHBondContact O-N 3.4Å; V1143-C1147 PolarHBondContact O-SG 3.16Å; V1143-C1147 VanDerWaalsContact O-SG 3.38Å; V1143-L1178 HydrophobicContact CG2-CD1 4.2Å
1144	G	95.1	Very high	93.5	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-63.9	-47	174.5	0	0	0	0	0	114	G1140 Y1141 R1142 F1146 A1148 F1179	G1140-G1144 PolarHBondContact O-N 2.84Å; Y1141-G1144 PolarHBondContact O-N 2.79Å; R1142-G1144 VanDerWaalsContact C-N 3.28Å; R1142-G1144 PolarHBondContact O-N 3.45Å; G1144-F1146 VanDerWaalsContact C-N 3.34Å; G1144-A1148 WeakPolarHBondContact O-CB 3.3Å; G1144-A1148 PolarHBondContact O-N 3.39Å; G1144-F1179 VanDerWaalsContact C-CE1 3.45Å
1145	I	97	Very high	93.3	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-63.8	-42.1	175.4	-70	156.9	0	0	0	110.2	W1094 Y1141 R1142 A1148 I1149 F1179 D1184 F1187 V1188 L1191	W1094-I1145 HydrophobicContact CH2-CB 4.34Å; W1094-I1145 HydrophobicContact CH2-CG2 4.31Å; W1094-I1145 HydrophobicContact CZ2-CB 4.02Å; W1094-I1145 HydrophobicContact CZ2-CD1 3.99Å; W1094-I1145 HydrophobicContact CZ2-CG2 3.94Å; Y1141-I1145 HydrophobicContact CD2-CD1 3.7Å; Y1141-I1145 HydrophobicContact CE2-CD1 4.35Å; Y1141-I1145 WeakPolarHBondContact O-CB 3.41Å; Y1141-I1145 VanDerWaalsContact O-CD1 3.27Å; Y1141-I1145 WeakPolarHBondContact O-CD1 3.45Å; Y1141-I1145 WeakPolarHBondContact O-CG1 3.3Å; Y1141-I1145 PolarHBondContact O-N 2.83Å; R1142-I1145 PolarHBondContact O-N 3.02Å; I1145-A1148 WeakPolarHBondContact O-CB 3.25Å; I1145-A1148 PolarHBondContact O-N 2.89Å; I1145-A1148 VanDerWaalsContact O-N 3.14Å; I1145-I1149 HydrophobicContact CG2-CG2 4.44Å; I1145-I1149 WeakPolarHBondContact O-CG1 3.45Å; I1145-I1149 PolarHBondContact O-N 3.48Å; I1145-F1179 HydrophobicContact CG1-CD1 4.43Å; I1145-F1179 HydrophobicContact CG1-CE1 4.16Å; I1145-D1184 HydrophobicContact CD1-CB 4.42Å; I1145-F1187 HydrophobicContact CD1-CD1 3.91Å; I1145-F1187 HydrophobicContact CD1-CE1 4.4Å; I1145-F1187 HydrophobicContact CG2-CD1 4.17Å; I1145-F1187 HydrophobicContact CG2-CE1 4.29Å; I1145-V1188 HydrophobicContact CB-CG2 4.46Å; I1145-V1188 HydrophobicContact CG1-CG2 4.23Å; I1145-V1188 HydrophobicContact CG2-CG2 4.14Å; I1145-L1191 HydrophobicContact CG2-CD1 3.99Å
1146	F	96.5	Very high	93.2	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.7	-45.9	179.3	-169.6	-96.1	0	0	0	112.4	I1030 L1032 L1111 L1114 A1115 L1118 L1134 R1142 V1143 G1144 A1148 I1149 R1150	I1030-F1146 HydrophobicContact CD1-CE1 3.61Å; I1030-F1146 HydrophobicContact CD1-CZ 3.91Å; L1032-F1146 HydrophobicContact CD1-CB 3.63Å; L1032-F1146 HydrophobicContact CD1-CD2 4.44Å; L1032-F1146 HydrophobicContact CD1-CG 4.01Å; L1032-F1146 HydrophobicContact CD2-CD2 4.38Å; L1111-F1146 HydrophobicContact CD1-CD2 3.89Å; L1111-F1146 HydrophobicContact CD1-CE2 4.17Å; L1114-F1146 HydrophobicContact CD2-CE2 3.96Å; L1114-F1146 HydrophobicContact CD2-CZ 4.28Å; L1114-F1146 HydrophobicContact CG-CE2 3.97Å; L1114-F1146 HydrophobicContact CG-CZ 4.01Å; A1115-F1146 HydrophobicContact CB-CE2 3.96Å; A1115-F1146 HydrophobicContact CB-CZ 4.27Å; L1118-F1146 HydrophobicContact CD1-CE1 4.1Å; L1118-F1146 HydrophobicContact CD1-CZ 3.93Å; L1134-F1146 HydrophobicContact CD1-CD1 4.17Å; L1134-F1146 HydrophobicContact CD2-CD1 4.05Å; L1134-F1146 HydrophobicContact CD2-CE1 4.2Å; R1142-F1146 WeakPolarHBondContact O-CB 3.45Å; R1142-F1146 PolarHBondContact O-N 2.66Å; V1143-F1146 PolarHBondContact O-N 3.04Å; G1144-F1146 VanDerWaalsContact C-N 3.34Å; F1146-A1148 VanDerWaalsContact C-N 3.32Å; F1146-A1148 PolarHBondContact O-N 3.29Å; F1146-I1149 HydrophobicContact CD2-CD1 4.45Å; F1146-I1149 WeakPolarHBondContact O-CG1 3.35Å; F1146-R1150 WeakPolarHBondContact O-CB 3.38Å; F1146-R1150 PolarHBondContact O-N 3.25Å
1147	C	95.6	Very high	92.9	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-54.8	-48.7	169.1	-77.1	0	0	0	0	111.4	L1134 V1143 R1150 I1151 L1171	L1134-C1147 WeakPolarHBondContact CD1-SG 3.47Å; V1143-C1147 WeakPolarHBondContact O-CB 3.49Å; V1143-C1147 PolarHBondContact O-N 3.4Å; V1143-C1147 PolarHBondContact O-SG 3.16Å; V1143-C1147 VanDerWaalsContact O-SG 3.38Å; C1147-R1150 PolarHBondContact O-N 2.81Å; C1147-I1151 HydrophobicContact CB-CD1 4.47Å; C1147-I1151 WeakPolarHBondContact O-CB 3.3Å; C1147-I1151 WeakPolarHBondContact O-CD1 3.15Å; C1147-I1151 WeakPolarHBondContact O-CG1 3.37Å; C1147-I1151 PolarHBondContact O-N 2.94Å; C1147-L1171 HydrophobicContact CB-CD1 4Å; C1147-L1171 HydrophobicContact CB-CD2 3.78Å
1148	A	97	Very high	92.6	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-60.1	-52.4	-176.8	0	0	0	0	0	112	G1144 I1145 F1146 R1150 I1151 L1152 V1167 L1171 V1188	G1144-A1148 WeakPolarHBondContact O-CB 3.3Å; G1144-A1148 PolarHBondContact O-N 3.39Å; I1145-A1148 WeakPolarHBondContact O-CB 3.25Å; I1145-A1148 PolarHBondContact O-N 2.89Å; I1145-A1148 VanDerWaalsContact O-N 3.14Å; F1146-A1148 VanDerWaalsContact C-N 3.32Å; F1146-A1148 PolarHBondContact O-N 3.29Å; A1148-R1150 PolarHBondContact O-N 2.77Å; A1148-I1151 PolarHBondContact O-N 2.89Å; A1148-L1152 WeakPolarHBondContact O-CB 3.35Å; A1148-L1152 VanDerWaalsContact O-CD1 3.32Å; A1148-L1152 WeakPolarHBondContact O-CD1 3.41Å; A1148-L1152 WeakPolarHBondContact O-CG 3.35Å; A1148-L1152 PolarHBondContact O-N 2.69Å; A1148-V1167 HydrophobicContact CB-CG1 4.1Å; A1148-L1171 HydrophobicContact CB-CD1 3.83Å; A1148-V1188 HydrophobicContact CB-CG1 4.14Å; A1148-V1188 HydrophobicContact CB-CG2 3.88Å
1149	I	96.3	Very high	92.4	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-64.9	-40.2	179.6	66.2	-177.2	0	0	0	111.8	L1111 L1112 A1115 I1145 F1146 I1151 L1152 I1153 V1188 L1191 M1192	L1111-I1149 HydrophobicContact CD2-CD1 4.27Å; L1111-I1149 HydrophobicContact CG-CD1 4.09Å; L1112-I1149 HydrophobicContact CD2-CD1 4.31Å; A1115-I1149 HydrophobicContact CB-CD1 3.97Å; A1115-I1149 HydrophobicContact CB-CG1 3.93Å; I1145-I1149 HydrophobicContact CG2-CG2 4.44Å; I1145-I1149 WeakPolarHBondContact O-CG1 3.45Å; I1145-I1149 PolarHBondContact O-N 3.48Å; F1146-I1149 HydrophobicContact CD2-CD1 4.45Å; F1146-I1149 WeakPolarHBondContact O-CG1 3.35Å; I1149-I1151 PolarHBondContact O-N 3.39Å; I1149-L1152 PolarHBondContact O-N 3.42Å; I1149-I1153 WeakPolarHBondContact O-CB 3.34Å; I1149-I1153 WeakPolarHBondContact O-CD1 3.35Å; I1149-I1153 WeakPolarHBondContact O-CG1 3.48Å; I1149-I1153 PolarHBondContact O-N 3.33Å; I1149-V1188 HydrophobicContact CG2-CG1 4.49Å; I1149-L1191 HydrophobicContact CD1-CD1 4.39Å; I1149-L1191 HydrophobicContact CG2-CB 4.18Å; I1149-L1191 HydrophobicContact CG2-CD1 3.97Å; I1149-M1192 HydrophobicContact CB-SD 4.31Å; I1149-M1192 HydrophobicContact CG2-SD 4.41Å
1150	R	94.2	Very high	92.6	Very high	6 Å²	6	17.9 Å²	17.9	2%	0.023	9%	0.092	C	C	.	.	H	α-helix	trans	-65.4	-41.3	178.5	178.7	162.4	175.7	72.4	5.7	112.4	Y1003 A1115 E1119 F1146 C1147 A1148 L1152 S1154	Y1003-R1150 VanDerWaalsContact OH-CD 3.24Å; Y1003-R1150 WeakPolarHBondContact OH-CD 3.38Å; Y1003-R1150 PolarHBondContact OH-NE 3.09Å; A1115-R1150 HydrophobicContact CB-CB 4.42Å; A1115-R1150 PolarHBondContact O-NH1 2.99Å; E1119-R1150 IonicContact OE1-CZ 2.72Å; E1119-R1150 IonicContact OE1-NH2 3.67Å; E1119-R1150 PolarHBondContact OE1-NH2 2.68Å; E1119-R1150 IonicContact OE2-NH2 2.59Å; F1146-R1150 WeakPolarHBondContact O-CB 3.38Å; F1146-R1150 PolarHBondContact O-N 3.25Å; C1147-R1150 PolarHBondContact O-N 2.81Å; A1148-R1150 PolarHBondContact O-N 2.77Å; R1150-L1152 VanDerWaalsContact C-N 3.35Å; R1150-S1154 VanDerWaalsContact O-CB 3.29Å; R1150-S1154 WeakPolarHBondContact O-CB 3.4Å; R1150-S1154 PolarHBondContact O-N 3.24Å; R1150-S1154 PolarHBondContact O-OG 2.79Å
1151	I	94.2	Very high	92.7	Very high	9 Å²	9	20.7 Å²	20.7	5%	0.046	11%	0.105	C	C	.	.	H	α-helix	trans	-65.6	-40	175.8	-65.6	165.1	0	0	0	110.3	F997 C1147 A1148 I1149 S1154 Q1155 V1167 L1171	F997-I1151 HydrophobicContact CB-CG2 4.22Å; C1147-I1151 HydrophobicContact CB-CD1 4.47Å; C1147-I1151 WeakPolarHBondContact O-CB 3.3Å; C1147-I1151 WeakPolarHBondContact O-CD1 3.15Å; C1147-I1151 WeakPolarHBondContact O-CG1 3.37Å; C1147-I1151 PolarHBondContact O-N 2.94Å; A1148-I1151 PolarHBondContact O-N 2.89Å; I1149-I1151 PolarHBondContact O-N 3.39Å; I1151-S1154 WeakPolarHBondContact O-CB 3.29Å; I1151-S1154 PolarHBondContact O-N 3.25Å; I1151-Q1155 WeakPolarHBondContact O-CG 3.25Å; I1151-Q1155 PolarHBondContact O-N 2.97Å; I1151-V1167 HydrophobicContact CB-CG1 4.03Å; I1151-V1167 HydrophobicContact CB-CG2 4.34Å; I1151-V1167 HydrophobicContact CD1-CG1 4.25Å; I1151-V1167 HydrophobicContact CG2-CB 4.44Å; I1151-V1167 HydrophobicContact CG2-CG1 4.01Å; I1151-V1167 HydrophobicContact CG2-CG2 3.51Å; I1151-L1171 HydrophobicContact CD1-CD2 4.39Å
1152	L	95.4	Very high	92.7	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-69.5	-44.3	178.7	-72.6	164.8	0	0	0	113	A1148 I1149 R1150 S1154 Q1155 F1156 L1162 V1164 V1167 V1188 M1192	A1148-L1152 WeakPolarHBondContact O-CB 3.35Å; A1148-L1152 VanDerWaalsContact O-CD1 3.32Å; A1148-L1152 WeakPolarHBondContact O-CD1 3.41Å; A1148-L1152 WeakPolarHBondContact O-CG 3.35Å; A1148-L1152 PolarHBondContact O-N 2.69Å; I1149-L1152 PolarHBondContact O-N 3.42Å; R1150-L1152 VanDerWaalsContact C-N 3.35Å; L1152-S1154 VanDerWaalsContact C-N 3.27Å; L1152-S1154 PolarHBondContact O-N 3.13Å; L1152-Q1155 WeakPolarHBondContact O-CB 3.29Å; L1152-Q1155 PolarHBondContact O-N 2.93Å; L1152-F1156 PolarHBondContact O-N 3.22Å; L1152-L1162 HydrophobicContact CB-CD2 3.9Å; L1152-L1162 HydrophobicContact CD2-CD2 4.06Å; L1152-L1162 WeakPolarHBondContact O-CD2 3.05Å; L1152-V1164 HydrophobicContact CD1-CB 4.44Å; L1152-V1164 HydrophobicContact CD1-CG1 4.35Å; L1152-V1164 HydrophobicContact CD1-CG2 3.89Å; L1152-V1164 HydrophobicContact CD2-CG2 3.92Å; L1152-V1167 HydrophobicContact CD2-CB 4.48Å; L1152-V1167 HydrophobicContact CD2-CG2 4.02Å; L1152-V1167 HydrophobicContact CG-CB 4.46Å; L1152-V1167 HydrophobicContact CG-CG1 4.46Å; L1152-V1167 HydrophobicContact CG-CG2 4.23Å; L1152-V1188 HydrophobicContact CD1-CG1 3.51Å; L1152-M1192 HydrophobicContact CB-CE 4.1Å; L1152-M1192 HydrophobicContact CB-CG 4.2Å; L1152-M1192 HydrophobicContact CB-SD 3.78Å; L1152-M1192 HydrophobicContact CD1-CG 3.97Å
1153	I	93.5	Very high	92.7	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-56.8	-45.7	170.2	-69.2	162.5	0	0	0	109.3	L1112 A1115 T1116 I1149 Q1155 F1156 L1157 M1192 Y1195	L1112-I1153 HydrophobicContact CD2-CD1 3.97Å; A1115-I1153 HydrophobicContact CB-CD1 3.78Å; T1116-I1153 HydrophobicContact CG2-CG2 4.4Å; I1149-I1153 WeakPolarHBondContact O-CB 3.34Å; I1149-I1153 WeakPolarHBondContact O-CD1 3.35Å; I1149-I1153 WeakPolarHBondContact O-CG1 3.48Å; I1149-I1153 PolarHBondContact O-N 3.33Å; I1153-Q1155 PolarHBondContact O-N 2.95Å; I1153-F1156 WeakPolarHBondContact O-CB 3.31Å; I1153-F1156 PolarHBondContact O-N 3.25Å; I1153-F1156 VanDerWaalsContact O-N 3.13Å; I1153-L1157 HydrophobicContact CG2-CD1 3.62Å; I1153-L1157 HydrophobicContact CG2-CG 4.04Å; I1153-L1157 VanDerWaalsContact O-CG 3.27Å; I1153-L1157 WeakPolarHBondContact O-CG 3.34Å; I1153-L1157 PolarHBondContact O-N 3.5Å; I1153-M1192 HydrophobicContact CG1-CE 3.98Å; I1153-M1192 HydrophobicContact CG1-SD 4.06Å; I1153-Y1195 HydrophobicContact CG1-CD1 4.04Å; I1153-Y1195 HydrophobicContact CG1-CE1 3.9Å; I1153-Y1195 HydrophobicContact CG1-CG 4.5Å; I1153-Y1195 HydrophobicContact CG2-CE1 4.27Å
1154	S	90.5	Very high	92.7	Very high	11 Å²	11	17.9 Å²	17.9	8%	0.077	9%	0.094	C	C	.	.	H	α-helix	trans	-61.5	-40.3	178	-58.8	0	0	0	0	113	F997 R1150 I1151 L1152 N1158	F997-S1154 WeakPolarHBondContact CE1-O 3.37Å; R1150-S1154 VanDerWaalsContact O-CB 3.29Å; R1150-S1154 WeakPolarHBondContact O-CB 3.4Å; R1150-S1154 PolarHBondContact O-N 3.24Å; R1150-S1154 PolarHBondContact O-OG 2.79Å; I1151-S1154 WeakPolarHBondContact O-CB 3.29Å; I1151-S1154 PolarHBondContact O-N 3.25Å; L1152-S1154 VanDerWaalsContact C-N 3.27Å; L1152-S1154 PolarHBondContact O-N 3.13Å; S1154-N1158 VanDerWaalsContact O-CB 3.32Å; S1154-N1158 WeakPolarHBondContact O-CB 3.26Å; S1154-N1158 PolarHBondContact O-N 3.14Å; S1154-N1158 PolarHBondContact O-ND2 3Å
1155	Q	91.4	Very high	92.7	Very high	19 Å²	19	18 Å²	18	9%	0.089	10%	0.095	C	C	.	.	H	α-helix	trans	-61.1	-45	171.7	-72.9	175.7	2.9	0	0	111.9	F997 I1151 L1152 I1153 D1159 L1160 L1161 V1167	F997-Q1155 HydrophobicContact CD2-CG 3.58Å; F997-Q1155 HydrophobicContact CE2-CB 4.19Å; F997-Q1155 HydrophobicContact CE2-CG 3.53Å; F997-Q1155 HydrophobicContact CZ-CG 4.47Å; I1151-Q1155 WeakPolarHBondContact O-CG 3.25Å; I1151-Q1155 PolarHBondContact O-N 2.97Å; L1152-Q1155 WeakPolarHBondContact O-CB 3.29Å; L1152-Q1155 PolarHBondContact O-N 2.93Å; I1153-Q1155 PolarHBondContact O-N 2.95Å; Q1155-D1159 WeakPolarHBondContact O-CA 3.4Å; Q1155-D1159 PolarHBondContact O-N 3.21Å; Q1155-L1160 PolarHBondContact O-N 3.44Å; Q1155-L1161 CarbonylContact C-O 3.56Å; Q1155-L1161 VanDerWaalsContact C-O 3.26Å; Q1155-L1161 WeakPolarHBondContact CB-O 3.39Å; Q1155-V1167 VanDerWaalsContact NE2-CG2 3.31Å
1156	F	91.7	Very high	92.5	Very high	3 Å²	3	19 Å²	19	1%	0.013	10%	0.099	C	C	.	.	H	α-helix	trans	-62.8	-52.7	178.6	167.8	-111.7	0	0	0	112.1	P926 L1152 I1153 N1158 L1160 L1161 L1162 Y1195 L1196 Y1213 L1216	P926-F1156 HydrophobicContact CB-CD2 4.42Å; P926-F1156 HydrophobicContact CB-CE2 4.12Å; P926-F1156 HydrophobicContact CG-CD2 3.57Å; P926-F1156 HydrophobicContact CG-CE2 3.65Å; L1152-F1156 PolarHBondContact O-N 3.22Å; I1153-F1156 WeakPolarHBondContact O-CB 3.31Å; I1153-F1156 PolarHBondContact O-N 3.25Å; I1153-F1156 VanDerWaalsContact O-N 3.13Å; F1156-N1158 VanDerWaalsContact C-N 3.25Å; F1156-N1158 PolarHBondContact O-N 3.47Å; F1156-L1160 HydrophobicContact CD2-CD2 4.39Å; F1156-L1160 HydrophobicContact CE2-CD2 4.2Å; F1156-L1160 WeakPolarHBondContact O-CA 3.31Å; F1156-L1160 PolarHBondContact O-N 3.27Å; F1156-L1161 PolarHBondContact N-O 3.25Å; F1156-L1162 HydrophobicContact CB-CD2 4.01Å; F1156-L1162 HydrophobicContact CB-CG 4.4Å; F1156-Y1195 AromaticContact CD1-CE1 3.78Å; F1156-Y1195 HydrophobicContact CD1-CE1 3.78Å; F1156-Y1195 AromaticContact CE1-CE1 3.98Å; F1156-Y1195 HydrophobicContact CE1-CE1 3.98Å; F1156-L1196 HydrophobicContact CD2-CD2 4.03Å; F1156-L1196 HydrophobicContact CE1-CD2 4.36Å; F1156-L1196 HydrophobicContact CE2-CD2 3.73Å; F1156-L1196 HydrophobicContact CG-CD2 4.46Å; F1156-L1196 HydrophobicContact CZ-CD2 3.91Å; F1156-Y1213 HydrophobicContact CE1-CE1 4.34Å; F1156-Y1213 HydrophobicContact CZ-CE1 4.46Å; F1156-L1216 HydrophobicContact CE2-CD2 4.13Å; F1156-L1216 HydrophobicContact CZ-CD2 4.25Å
1157	L	87.3	Confident	92.4	Very high	45 Å²	45	19.2 Å²	19.2	24%	0.236	10%	0.1	C	C	.	.	H	α-helix	trans	-63.1	-29.5	-176.8	-63.3	175.8	0	0	0	113.1	T1116 I1153 Y1213	T1116-L1157 HydrophobicContact CG2-CD1 4.35Å; I1153-L1157 HydrophobicContact CG2-CD1 3.62Å; I1153-L1157 HydrophobicContact CG2-CG 4.04Å; I1153-L1157 VanDerWaalsContact O-CG 3.27Å; I1153-L1157 WeakPolarHBondContact O-CG 3.34Å; I1153-L1157 PolarHBondContact O-N 3.5Å; L1157-Y1213 HydrophobicContact CD2-CE1 4.46Å; L1157-Y1213 WeakPolarHBondContact CD2-OH 3.47Å
1158	N	84.1	Confident	92.4	Very high	75 Å²	75	19.2 Å²	19.2	40%	0.401	10%	0.1	S	C	.	.	H	α-helix	trans	-97.2	-48.2	-177.1	-77.4	-89.3	0	0	0	114.2	F997 S1154 F1156	F997-N1158 HydrophobicContact CE1-CB 3.67Å; F997-N1158 HydrophobicContact CZ-CB 3.83Å; S1154-N1158 VanDerWaalsContact O-CB 3.32Å; S1154-N1158 WeakPolarHBondContact O-CB 3.26Å; S1154-N1158 PolarHBondContact O-N 3.14Å; S1154-N1158 PolarHBondContact O-ND2 3Å; F1156-N1158 VanDerWaalsContact C-N 3.25Å; F1156-N1158 PolarHBondContact O-N 3.47Å
1159	D	85	Confident	92.2	Very high	66 Å²	66	19.6 Å²	19.6	35%	0.353	10%	0.102	S	C	.	.	H	α-helix	trans	-116.1	-2.4	-166.7	-66.1	-28.8	0	0	0	113.1	R791 F997 Q1155 L1161	R791-D1159 IonicContact CZ-OD1 2.74Å; R791-D1159 IonicContact CZ-OD2 3.32Å; R791-D1159 IonicContact NE-OD1 3.16Å; R791-D1159 IonicContact NE-OD2 3.33Å; R791-D1159 PolarHBondContact NE-OD2 2.91Å; R791-D1159 VanDerWaalsContact NH2-CG 3.3Å; R791-D1159 IonicContact NH2-OD1 2.74Å; R791-D1159 PolarHBondContact NH2-OD1 3Å; R791-D1159 IonicContact NH2-OD2 2.7Å; R791-D1159 PolarHBondContact NH2-OD2 3.3Å; F997-D1159 WeakPolarHBondContact CZ-OD2 3.41Å; Q1155-D1159 WeakPolarHBondContact O-CA 3.4Å; Q1155-D1159 PolarHBondContact O-N 3.21Å; D1159-L1161 PolarHBondContact O-N 3.25Å
1160	L	88.4	Confident	91.9	Very high	68 Å²	68	20.2 Å²	20.2	36%	0.356	11%	0.105	S	C	.	.	S	Bend	trans	53.8	33.8	-178.6	-65.9	172.3	0	0	0	113.9	P926 Q1155 F1156 L1216	P926-L1160 VanDerWaalsContact CD-O 3.24Å; P926-L1160 WeakPolarHBondContact CD-O 3.34Å; Q1155-L1160 PolarHBondContact O-N 3.44Å; F1156-L1160 HydrophobicContact CD2-CD2 4.39Å; F1156-L1160 HydrophobicContact CE2-CD2 4.2Å; F1156-L1160 WeakPolarHBondContact O-CA 3.31Å; F1156-L1160 PolarHBondContact O-N 3.27Å; L1160-L1216 HydrophobicContact CD2-CD1 4.35Å
1161	L	90.2	Very high	91.9	Very high	66 Å²	66	20 Å²	20	35%	0.346	10%	0.104	S	C	.	.			trans	-134.7	159.5	177.7	-69.3	171.8	0	0	0	109.7	I924 R925 Q1155 F1156 D1159	I924-L1161 WeakPolarHBondContact O-CA 3.17Å; R925-L1161 HydrophobicContact CG-CD2 3.81Å; Q1155-L1161 CarbonylContact C-O 3.56Å; Q1155-L1161 VanDerWaalsContact C-O 3.26Å; Q1155-L1161 WeakPolarHBondContact CB-O 3.39Å; F1156-L1161 PolarHBondContact N-O 3.25Å; D1159-L1161 PolarHBondContact O-N 3.25Å
1162	L	93.9	Very high	91.7	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.104	C	C	.	.	B	Isolated β-bridge	trans	-134.9	135.5	177	-73.6	168.2	0	0	0	109.3	I924 F929 L1152 F1156 M1192 L1196	I924-L1162 WeakPolarHBondContact CA-O 3.42Å; I924-L1162 HydrophobicContact CB-CB 4.42Å; I924-L1162 VanDerWaalsContact CB-O 3.32Å; I924-L1162 WeakPolarHBondContact CB-O 3.23Å; I924-L1162 PolarHBondContact N-O 2.57Å; I924-L1162 PolarHBondContact O-N 2.02Å; F929-L1162 HydrophobicContact CD2-CB 4.3Å; F929-L1162 HydrophobicContact CD2-CD1 3.6Å; F929-L1162 HydrophobicContact CE2-CB 4.22Å; F929-L1162 HydrophobicContact CE2-CD1 3.75Å; F929-L1162 HydrophobicContact CG-CD1 4.4Å; L1152-L1162 HydrophobicContact CB-CD2 3.9Å; L1152-L1162 HydrophobicContact CD2-CD2 4.06Å; L1152-L1162 WeakPolarHBondContact O-CD2 3.05Å; F1156-L1162 HydrophobicContact CB-CD2 4.01Å; F1156-L1162 HydrophobicContact CB-CG 4.4Å; L1162-M1192 HydrophobicContact CD1-CE 4.44Å; L1162-M1192 HydrophobicContact CD2-CE 3.79Å; L1162-L1196 HydrophobicContact CD1-CD1 3.8Å; L1162-L1196 HydrophobicContact CD1-CD2 4.47Å; L1162-L1196 HydrophobicContact CD1-CG 4.45Å
1163	D	94.5	Very high	91.3	Very high	6 Å²	6	21.4 Å²	21.4	3%	0.032	11%	0.112	C	C	.	.			trans	-139.9	74.5	-175.3	-160.6	-37	0	0	0	111.9	K837 H922 Y1165 F1166 V1167	K837-D1163 WeakPolarHBondContact CE-OD2 3.42Å; K837-D1163 IonicContact NZ-OD2 2.83Å; K837-D1163 PolarHBondContact NZ-OD2 2.71Å; H922-D1163 WeakPolarHBondContact CB-OD1 3.2Å; H922-D1163 IonicContact CE1-OD1 3.51Å; H922-D1163 IonicContact CE1-OD2 2.66Å; H922-D1163 PolarHBondContact CE1-OD2 3.44Å; H922-D1163 IonicContact CG-OD1 3.39Å; H922-D1163 IonicContact CG-OD2 3.92Å; H922-D1163 IonicContact ND1-OD1 2.7Å; H922-D1163 PolarHBondContact ND1-OD1 3.37Å; H922-D1163 IonicContact ND1-OD2 2.88Å; H922-D1163 PolarHBondContact ND1-OD2 3.05Å; D1163-Y1165 VanDerWaalsContact C-N 3.3Å; D1163-Y1165 PolarHBondContact O-N 2.89Å; D1163-F1166 HydrophobicContact CB-CB 4.08Å; D1163-F1166 PolarHBondContact O-N 2.96Å; D1163-F1166 WeakPolarHBondContact OD1-CB 3.47Å; D1163-F1166 PolarHBondContact OD1-N 3.14Å; D1163-V1167 VanDerWaalsContact O-CG2 3.29Å; D1163-V1167 WeakPolarHBondContact O-CG2 3.43Å; D1163-V1167 PolarHBondContact O-N 2.81Å; D1163-V1167 VanDerWaalsContact O-N 3.07Å
1164	V	95.5	Very high	91	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	11%	0.112	C	C	.	.	H	α-helix	trans	-64.1	-36.1	-175.4	-171.5	0	0	0	0	111.3	I924 F929 L1152 V1167 F1168 L1185 V1188 Y1189	I924-V1164 HydrophobicContact CD1-CG2 4.39Å; F929-V1164 HydrophobicContact CE2-CG2 4.26Å; L1152-V1164 HydrophobicContact CD1-CB 4.44Å; L1152-V1164 HydrophobicContact CD1-CG1 4.35Å; L1152-V1164 HydrophobicContact CD1-CG2 3.89Å; L1152-V1164 HydrophobicContact CD2-CG2 3.92Å; V1164-V1167 PolarHBondContact O-N 3.12Å; V1164-F1168 WeakPolarHBondContact O-CB 3.48Å; V1164-F1168 PolarHBondContact O-N 3.06Å; V1164-L1185 HydrophobicContact CG1-CD1 3.67Å; V1164-V1188 HydrophobicContact CG1-CG1 3.92Å; V1164-Y1189 HydrophobicContact CB-CD1 4.5Å; V1164-Y1189 HydrophobicContact CB-CE1 3.73Å; V1164-Y1189 HydrophobicContact CB-CE2 4.22Å; V1164-Y1189 HydrophobicContact CG1-CD2 4.27Å; V1164-Y1189 HydrophobicContact CG1-CE1 4.07Å; V1164-Y1189 HydrophobicContact CG1-CE2 3.78Å; V1164-Y1189 HydrophobicContact CG2-CD1 3.97Å; V1164-Y1189 HydrophobicContact CG2-CE1 3.48Å; V1164-Y1189 VanDerWaalsContact CG2-CE1 3.48Å
1165	Y	93.8	Very high	90.8	Very high	1 Å²	1	22 Å²	22	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-62.8	-48.7	176.6	179.3	-109	0	0	0	112.2	L833 E915 Y919 H922 Q950 M953 D1163 V1167 K1169	L833-Y1165 HydrophobicContact CD2-CD1 4.43Å; L833-Y1165 HydrophobicContact CD2-CE1 4.04Å; E915-Y1165 WeakPolarHBondContact OE1-CE1 3.46Å; E915-Y1165 PolarHBondContact OE1-OH 2.87Å; Y919-Y1165 AromaticContact CD1-CD1 3.96Å; Y919-Y1165 HydrophobicContact CD1-CD1 3.96Å; Y919-Y1165 HydrophobicContact CD1-CE1 4.35Å; Y919-Y1165 HydrophobicContact CD1-CG 4.17Å; Y919-Y1165 HydrophobicContact CE1-CG 4.49Å; Y919-Y1165 HydrophobicContact CG-CD1 4.16Å; Y919-Y1165 HydrophobicContact CG-CE1 4.11Å; Y919-Y1165 HydrophobicContact CG-CG 4.43Å; H922-Y1165 HydrophobicContact CB-CD1 4.15Å; H922-Y1165 HydrophobicContact CB-CG 4.44Å; Q950-Y1165 HydrophobicContact CG-CD2 3.7Å; Q950-Y1165 HydrophobicContact CG-CE2 4.4Å; M953-Y1165 HydrophobicContact CB-CE2 4.09Å; M953-Y1165 HydrophobicContact CE-CE2 4.45Å; D1163-Y1165 VanDerWaalsContact C-N 3.3Å; D1163-Y1165 PolarHBondContact O-N 2.89Å; Y1165-V1167 PolarHBondContact O-N 3.1Å; Y1165-K1169 HydrophobicContact CE1-CD 4.37Å; Y1165-K1169 HydrophobicContact CE2-CD 4.14Å; Y1165-K1169 VanDerWaalsContact O-CB 3.24Å; Y1165-K1169 WeakPolarHBondContact O-CB 3.44Å; Y1165-K1169 PolarHBondContact O-N 3.09Å; Y1165-K1169 WeakPolarHBondContact OH-CD 3.22Å; Y1165-K1169 PolarHBondContact OH-NZ 2.84Å; Y1165-K1169 VanDerWaalsContact OH-NZ 3.14Å
1166	F	93.6	Very high	90.4	Very high	23 Å²	23	22.7 Å²	22.7	10%	0.101	12%	0.119	C	C	.	.	H	α-helix	trans	-58.1	-49.9	176.1	176.2	-84.2	0	0	0	111	F793 L833 P834 K837 D1163 M1170	F793-F1166 HydrophobicContact CD2-CZ 4.28Å; F793-F1166 HydrophobicContact CE2-CE1 4.46Å; F793-F1166 HydrophobicContact CE2-CZ 4.01Å; L833-F1166 HydrophobicContact CB-CD2 3.82Å; L833-F1166 HydrophobicContact CB-CE2 3.9Å; L833-F1166 HydrophobicContact CD2-CD2 4.46Å; P834-F1166 HydrophobicContact CB-CE2 4.41Å; P834-F1166 HydrophobicContact CB-CZ 4.46Å; P834-F1166 HydrophobicContact CG-CE2 4.14Å; P834-F1166 HydrophobicContact CG-CZ 4.15Å; K837-F1166 HydrophobicContact CB-CE2 4.44Å; K837-F1166 HydrophobicContact CG-CD2 3.74Å; K837-F1166 HydrophobicContact CG-CE2 3.7Å; D1163-F1166 HydrophobicContact CB-CB 4.08Å; D1163-F1166 PolarHBondContact O-N 2.96Å; D1163-F1166 WeakPolarHBondContact OD1-CB 3.47Å; D1163-F1166 PolarHBondContact OD1-N 3.14Å; F1166-M1170 HydrophobicContact CD1-CG 4.3Å; F1166-M1170 HydrophobicContact CE1-CG 4.07Å; F1166-M1170 HydrophobicContact CE2-CG 4.35Å; F1166-M1170 HydrophobicContact CZ-CG 4.09Å; F1166-M1170 VanDerWaalsContact O-CB 3.23Å; F1166-M1170 WeakPolarHBondContact O-CB 3.47Å; F1166-M1170 WeakPolarHBondContact O-CG 3.23Å; F1166-M1170 PolarHBondContact O-N 2.95Å
1167	V	94.9	Very high	89.9	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-65.7	-50.3	-174.7	175.3	0	0	0	0	110.9	A1148 I1151 L1152 Q1155 D1163 V1164 Y1165 M1170 L1171	A1148-V1167 HydrophobicContact CB-CG1 4.1Å; I1151-V1167 HydrophobicContact CB-CG1 4.03Å; I1151-V1167 HydrophobicContact CB-CG2 4.34Å; I1151-V1167 HydrophobicContact CD1-CG1 4.25Å; I1151-V1167 HydrophobicContact CG2-CB 4.44Å; I1151-V1167 HydrophobicContact CG2-CG1 4.01Å; I1151-V1167 HydrophobicContact CG2-CG2 3.51Å; L1152-V1167 HydrophobicContact CD2-CB 4.48Å; L1152-V1167 HydrophobicContact CD2-CG2 4.02Å; L1152-V1167 HydrophobicContact CG-CB 4.46Å; L1152-V1167 HydrophobicContact CG-CG1 4.46Å; L1152-V1167 HydrophobicContact CG-CG2 4.23Å; Q1155-V1167 VanDerWaalsContact NE2-CG2 3.31Å; D1163-V1167 VanDerWaalsContact O-CG2 3.29Å; D1163-V1167 WeakPolarHBondContact O-CG2 3.43Å; D1163-V1167 PolarHBondContact O-N 2.81Å; D1163-V1167 VanDerWaalsContact O-N 3.07Å; V1164-V1167 PolarHBondContact O-N 3.12Å; Y1165-V1167 PolarHBondContact O-N 3.1Å; V1167-M1170 PolarHBondContact O-N 2.92Å; V1167-L1171 HydrophobicContact CG1-CD1 3.85Å; V1167-L1171 VanDerWaalsContact O-CG 3.25Å; V1167-L1171 WeakPolarHBondContact O-CG 3.16Å; V1167-L1171 PolarHBondContact O-N 3.43Å
1168	F	94.5	Very high	90	Very high	1 Å²	1	29.3 Å²	29.3	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-64.8	-47.5	-177.5	-157.9	-89.4	0	0	0	111.4	F951 C954 M955 V1164 M1170 L1171 C1172 F1179 L1185	F951-F1168 AromaticContact CD2-CE1 3.7Å; F951-F1168 HydrophobicContact CD2-CE1 3.7Å; F951-F1168 HydrophobicContact CD2-CZ 4.08Å; F951-F1168 AromaticContact CE2-CE1 3.75Å; F951-F1168 HydrophobicContact CE2-CE1 3.75Å; F951-F1168 AromaticContact CE2-CZ 3.98Å; F951-F1168 HydrophobicContact CE2-CZ 3.98Å; C954-F1168 HydrophobicContact CB-CD1 3.9Å; C954-F1168 HydrophobicContact CB-CE1 4.49Å; M955-F1168 HydrophobicContact CE-CD1 4.47Å; M955-F1168 HydrophobicContact CE-CE1 3.85Å; V1164-F1168 WeakPolarHBondContact O-CB 3.48Å; V1164-F1168 PolarHBondContact O-N 3.06Å; F1168-M1170 PolarHBondContact O-N 3.45Å; F1168-L1171 PolarHBondContact O-N 3.23Å; F1168-C1172 PolarHBondContact O-N 3.25Å; F1168-C1172 PolarHBondContact O-SG 3.39Å; F1168-F1179 HydrophobicContact CD1-CD2 4.24Å; F1168-F1179 HydrophobicContact CD1-CE2 4.18Å; F1168-F1179 HydrophobicContact CD2-CD2 4.3Å; F1168-F1179 HydrophobicContact CD2-CE1 4.1Å; F1168-F1179 AromaticContact CD2-CE2 3.83Å; F1168-F1179 HydrophobicContact CD2-CE2 3.83Å; F1168-F1179 AromaticContact CD2-CZ 3.72Å; F1168-F1179 HydrophobicContact CD2-CZ 3.72Å; F1168-F1179 HydrophobicContact CE1-CB 4.39Å; F1168-F1179 AromaticContact CE1-CD2 3.65Å; F1168-F1179 HydrophobicContact CE1-CD2 3.65Å; F1168-F1179 HydrophobicContact CE1-CE2 4.03Å; F1168-F1179 HydrophobicContact CE1-CG 4.05Å; F1168-F1179 AromaticContact CE2-CD1 3.6Å; F1168-F1179 HydrophobicContact CE2-CD1 3.6Å; F1168-F1179 AromaticContact CE2-CD2 3.73Å; F1168-F1179 HydrophobicContact CE2-CD2 3.73Å; F1168-F1179 AromaticContact CE2-CE1 3.52Å; F1168-F1179 HydrophobicContact CE2-CE1 3.52Å; F1168-F1179 AromaticContact CE2-CE2 3.66Å; F1168-F1179 HydrophobicContact CE2-CE2 3.66Å; F1168-F1179 AromaticContact CE2-CG 3.69Å; F1168-F1179 HydrophobicContact CE2-CG 3.69Å; F1168-F1179 AromaticContact CE2-CZ 3.56Å; F1168-F1179 HydrophobicContact CE2-CZ 3.56Å; F1168-F1179 HydrophobicContact CG-CE2 4.09Å; F1168-F1179 HydrophobicContact CG-CZ 4.39Å; F1168-F1179 HydrophobicContact CZ-CB 3.76Å; F1168-F1179 AromaticContact CZ-CD1 3.72Å; F1168-F1179 HydrophobicContact CZ-CD1 3.72Å; F1168-F1179 AromaticContact CZ-CD2 3.37Å; F1168-F1179 HydrophobicContact CZ-CD2 3.37Å; F1168-F1179 HydrophobicContact CZ-CE1 4.08Å; F1168-F1179 AromaticContact CZ-CE2 3.77Å; F1168-F1179 HydrophobicContact CZ-CE2 3.77Å; F1168-F1179 AromaticContact CZ-CG 3.33Å; F1168-F1179 HydrophobicContact CZ-CG 3.33Å; F1168-F1179 HydrophobicContact CZ-CZ 4.11Å; F1168-L1185 HydrophobicContact CB-CD1 4.04Å; F1168-L1185 HydrophobicContact CD1-CD1 4.16Å; F1168-L1185 HydrophobicContact CD2-CB 4.26Å; F1168-L1185 HydrophobicContact CD2-CD1 3.65Å; F1168-L1185 HydrophobicContact CE1-CB 4.16Å; F1168-L1185 HydrophobicContact CE2-CB 3.75Å; F1168-L1185 HydrophobicContact CE2-CD1 4.06Å; F1168-L1185 HydrophobicContact CG-CD1 3.7Å; F1168-L1185 HydrophobicContact CZ-CB 3.7Å; F1168-L1185 HydrophobicContact CZ-CD1 4.47Å
1169	K	92.6	Very high	90.4	Very high	7 Å²	7	26.4 Å²	26.4	3%	0.03	13%	0.132	C	C	.	.	H	α-helix	trans	-63.9	-39.3	177.9	-172.7	164.4	-174.7	172.7	0	112.5	L833 E915 M953 C954 Y1165 C1172 L1173	L833-K1169 HydrophobicContact CD1-CB 3.91Å; L833-K1169 HydrophobicContact CD1-CD 3.93Å; L833-K1169 HydrophobicContact CD1-CG 3.94Å; E915-K1169 VanDerWaalsContact CD-NZ 3.29Å; E915-K1169 IonicContact OE1-NZ 3.29Å; E915-K1169 PolarHBondContact OE1-NZ 2.91Å; E915-K1169 IonicContact OE2-NZ 3.91Å; E915-K1169 PolarHBondContact OE2-NZ 2.98Å; M953-K1169 WeakPolarHBondContact O-CD 3.33Å; M953-K1169 VanDerWaalsContact O-CE 3.25Å; M953-K1169 WeakPolarHBondContact O-CE 3.21Å; M953-K1169 PolarHBondContact O-NZ 2.81Å; C954-K1169 HydrophobicContact CB-CB 4.14Å; Y1165-K1169 HydrophobicContact CE1-CD 4.37Å; Y1165-K1169 HydrophobicContact CE2-CD 4.14Å; Y1165-K1169 VanDerWaalsContact O-CB 3.24Å; Y1165-K1169 WeakPolarHBondContact O-CB 3.44Å; Y1165-K1169 PolarHBondContact O-N 3.09Å; Y1165-K1169 WeakPolarHBondContact OH-CD 3.22Å; Y1165-K1169 PolarHBondContact OH-NZ 2.84Å; Y1165-K1169 VanDerWaalsContact OH-NZ 3.14Å; K1169-C1172 PolarHBondContact O-N 2.84Å; K1169-L1173 HydrophobicContact CG-CD1 4.11Å; K1169-L1173 WeakPolarHBondContact O-CB 3.44Å; K1169-L1173 VanDerWaalsContact O-CG 3.28Å; K1169-L1173 WeakPolarHBondContact O-CG 3.21Å; K1169-L1173 PolarHBondContact O-N 2.85Å
1170	M	91.5	Very high	90.6	Very high	14 Å²	14	29.9 Å²	29.9	7%	0.069	14%	0.14	C	C	.	.	H	α-helix	trans	-63.9	-41.2	174.7	-74.7	-60.2	-57.5	0	0	112	F793 S831 L833 P834 F1166 V1167 F1168 L1173 Q1174	F793-M1170 HydrophobicContact CE1-CE 4.32Å; F793-M1170 HydrophobicContact CZ-CE 3.81Å; S831-M1170 PolarHBondContact OG-SD 3.02Å; S831-M1170 VanDerWaalsContact OG-SD 3.42Å; L833-M1170 HydrophobicContact CB-SD 4.18Å; L833-M1170 HydrophobicContact CD1-CG 4.26Å; L833-M1170 HydrophobicContact CD1-SD 4.34Å; P834-M1170 HydrophobicContact CG-CE 4Å; P834-M1170 HydrophobicContact CG-SD 3.98Å; F1166-M1170 HydrophobicContact CD1-CG 4.3Å; F1166-M1170 HydrophobicContact CE1-CG 4.07Å; F1166-M1170 HydrophobicContact CE2-CG 4.35Å; F1166-M1170 HydrophobicContact CZ-CG 4.09Å; F1166-M1170 VanDerWaalsContact O-CB 3.23Å; F1166-M1170 WeakPolarHBondContact O-CB 3.47Å; F1166-M1170 WeakPolarHBondContact O-CG 3.23Å; F1166-M1170 PolarHBondContact O-N 2.95Å; V1167-M1170 PolarHBondContact O-N 2.92Å; F1168-M1170 PolarHBondContact O-N 3.45Å; M1170-L1173 PolarHBondContact O-N 3.13Å; M1170-L1173 HydrophobicContact SD-CD1 4.19Å; M1170-Q1174 WeakPolarHBondContact O-CB 3.38Å; M1170-Q1174 WeakPolarHBondContact O-CG 3.06Å; M1170-Q1174 PolarHBondContact O-N 3.03Å; M1170-Q1174 VanDerWaalsContact O-N 3.08Å
1171	L	93.1	Very high	90.7	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-64.5	-39.4	176.4	-68.9	167.7	0	0	0	112	L994 C1147 A1148 I1151 V1167 F1168 Q1174 R1175 L1178 F1179	L994-L1171 HydrophobicContact CB-CD2 4.37Å; L994-L1171 HydrophobicContact CD1-CD2 3.87Å; C1147-L1171 HydrophobicContact CB-CD1 4Å; C1147-L1171 HydrophobicContact CB-CD2 3.78Å; A1148-L1171 HydrophobicContact CB-CD1 3.83Å; I1151-L1171 HydrophobicContact CD1-CD2 4.39Å; V1167-L1171 HydrophobicContact CG1-CD1 3.85Å; V1167-L1171 VanDerWaalsContact O-CG 3.25Å; V1167-L1171 WeakPolarHBondContact O-CG 3.16Å; V1167-L1171 PolarHBondContact O-N 3.43Å; F1168-L1171 PolarHBondContact O-N 3.23Å; L1171-Q1174 PolarHBondContact O-N 3.5Å; L1171-R1175 PolarHBondContact O-N 3.48Å; L1171-L1178 HydrophobicContact CB-CD2 3.84Å; L1171-F1179 HydrophobicContact CB-CE2 4.02Å; L1171-F1179 HydrophobicContact CB-CZ 4.31Å; L1171-F1179 HydrophobicContact CD1-CZ 4.15Å
1172	C	90.5	Very high	90.8	Very high	5 Å²	5	28.2 Å²	28.2	3%	0.034	13%	0.127	C	C	.	.	H	α-helix	trans	-64.2	-41.5	174.3	-60.9	0	0	0	0	113.2	M955 F957 F1168 K1169 Q1174 R1175 F1179	M955-C1172 HydrophobicContact CE-CB 4.32Å; M955-C1172 WeakPolarHBondContact CE-SG 3.43Å; F957-C1172 HydrophobicContact CE1-CB 3.8Å; F957-C1172 HydrophobicContact CZ-CB 4.25Å; F957-C1172 WeakPolarHBondContact CZ-O 3.44Å; F1168-C1172 PolarHBondContact O-N 3.25Å; F1168-C1172 PolarHBondContact O-SG 3.39Å; K1169-C1172 PolarHBondContact O-N 2.84Å; C1172-Q1174 PolarHBondContact O-N 2.63Å; C1172-R1175 CarbonylContact O-C 3.59Å; C1172-R1175 VanDerWaalsContact O-C 3.32Å; C1172-F1179 VanDerWaalsContact SG-CD2 3.59Å
1173	L	86.7	Confident	90.7	Very high	33 Å²	33	33.7 Å²	33.7	17%	0.173	15%	0.148	C	C	.	.	H	α-helix	trans	-65.1	-21.8	174	-74.9	165.9	0	0	0	112.9	F957 K1169 M1170	F957-L1173 HydrophobicContact CB-CD2 3.51Å; F957-L1173 HydrophobicContact CD1-CD2 4.06Å; F957-L1173 HydrophobicContact CD1-CG 4.44Å; F957-L1173 HydrophobicContact CD2-CD2 3.98Å; F957-L1173 HydrophobicContact CG-CD2 3.61Å; F957-L1173 HydrophobicContact CG-CG 4.46Å; K1169-L1173 HydrophobicContact CG-CD1 4.11Å; K1169-L1173 WeakPolarHBondContact O-CB 3.44Å; K1169-L1173 VanDerWaalsContact O-CG 3.28Å; K1169-L1173 WeakPolarHBondContact O-CG 3.21Å; K1169-L1173 PolarHBondContact O-N 2.85Å; M1170-L1173 PolarHBondContact O-N 3.13Å; M1170-L1173 HydrophobicContact SD-CD1 4.19Å
1174	Q	86.5	Confident	90.7	Very high	3 Å²	3	33.4 Å²	33.4	1%	0.014	15%	0.146	C	C	.	.	H	α-helix	trans	-92.4	-33.1	-179.2	-74	-178.4	-21.9	0	0	113.9	L977 L994 H995 M1170 L1171 C1172	L977-Q1174 HydrophobicContact CD1-CG 3.57Å; L977-Q1174 HydrophobicContact CD2-CB 4.1Å; L977-Q1174 HydrophobicContact CD2-CG 3.68Å; L977-Q1174 HydrophobicContact CG-CG 4.26Å; L994-Q1174 HydrophobicContact CD2-CB 3.55Å; H995-Q1174 VanDerWaalsContact CB-NE2 3.33Å; H995-Q1174 PolarHBondContact CD2-NE2 3.37Å; H995-Q1174 PolarHBondContact ND1-NE2 3.15Å; M1170-Q1174 WeakPolarHBondContact O-CB 3.38Å; M1170-Q1174 WeakPolarHBondContact O-CG 3.06Å; M1170-Q1174 PolarHBondContact O-N 3.03Å; M1170-Q1174 VanDerWaalsContact O-N 3.08Å; L1171-Q1174 PolarHBondContact O-N 3.5Å; C1172-Q1174 PolarHBondContact O-N 2.63Å
1175	R	87.3	Confident	90.7	Very high	22 Å²	22	33.3 Å²	33.3	8%	0.083	15%	0.146	C	C	.	.	S	Bend	trans	-142.9	100	171.1	-173.7	163.6	172.7	85.9	2.4	109.1	D990 S992 L994 G1139 L1171 C1172 L1178	D990-R1175 VanDerWaalsContact CG-NH2 3.32Å; D990-R1175 IonicContact OD1-CZ 2.73Å; D990-R1175 VanDerWaalsContact OD1-CZ 3.29Å; D990-R1175 IonicContact OD1-NH1 2.8Å; D990-R1175 PolarHBondContact OD1-NH1 2.8Å; D990-R1175 IonicContact OD1-NH2 2.73Å; D990-R1175 PolarHBondContact OD1-NH2 2.8Å; D990-R1175 IonicContact OD2-NH2 3.19Å; D990-R1175 PolarHBondContact OD2-NH2 3.15Å; D990-R1175 VanDerWaalsContact OD2-NH2 3.16Å; S992-R1175 PolarHBondContact OG-NH1 3.45Å; L994-R1175 HydrophobicContact CD2-CB 4.08Å; G1139-R1175 PolarHBondContact O-NE 2.75Å; G1139-R1175 PolarHBondContact O-NH2 2.88Å; G1139-R1175 VanDerWaalsContact O-NH2 3.11Å; L1171-R1175 PolarHBondContact O-N 3.48Å; C1172-R1175 CarbonylContact O-C 3.59Å; C1172-R1175 VanDerWaalsContact O-C 3.32Å; R1175-L1178 HydrophobicContact CB-CB 4.32Å; R1175-L1178 HydrophobicContact CB-CD1 4.43Å; R1175-L1178 HydrophobicContact CG-CB 4.48Å; R1175-L1178 HydrophobicContact CG-CD1 4.39Å; R1175-L1178 WeakPolarHBondContact O-CB 3.48Å; R1175-L1178 PolarHBondContact O-N 2.75Å
1176	P	82.1	Confident	90.8	Very high	34 Å²	34	35.2 Å²	35.2	22%	0.221	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	145.2	172.3	-26.9	35.5	0	0	0	111.3	F957 Y979 L1178	F957-P1176 HydrophobicContact CE2-CG 4.27Å; Y979-P1176 WeakPolarHBondContact O-CD 2.98Å; P1176-L1178 PolarHBondContact O-N 3.44Å
1177	H	81.8	Confident	90.9	Very high	184 Å²	184	34.7 Å²	34.7	85%	0.852	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	62	16.9	-176.6	-43.5	-71	0	0	0	116.1	F1179	H1177-F1179 VanDerWaalsContact C-N 3.28Å; H1177-F1179 PolarHBondContact O-N 2.78Å
1178	L	89.5	Confident	91	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.016	15%	0.152	C	C	.	.			trans	-57.2	-39.5	172.9	-175.4	71.2	0	0	0	112.4	L994 G1140 Y1141 V1143 L1171 R1175 P1176	L994-L1178 HydrophobicContact CD1-CD2 4.48Å; G1140-L1178 CarbonylContact C-O 3.26Å; G1140-L1178 VanDerWaalsContact O-CD1 3.25Å; G1140-L1178 WeakPolarHBondContact O-CD1 3.43Å; Y1141-L1178 WeakPolarHBondContact CA-O 3.24Å; Y1141-L1178 PolarHBondContact N-O 2.63Å; V1143-L1178 HydrophobicContact CG2-CD1 4.2Å; L1171-L1178 HydrophobicContact CB-CD2 3.84Å; R1175-L1178 HydrophobicContact CB-CB 4.32Å; R1175-L1178 HydrophobicContact CB-CD1 4.43Å; R1175-L1178 HydrophobicContact CG-CB 4.48Å; R1175-L1178 HydrophobicContact CG-CD1 4.39Å; R1175-L1178 WeakPolarHBondContact O-CB 3.48Å; R1175-L1178 PolarHBondContact O-N 2.75Å; P1176-L1178 PolarHBondContact O-N 3.44Å
1179	F	92.2	Very high	91.1	Very high	14 Å²	14	34.5 Å²	34.5	6%	0.061	15%	0.151	C	C	.	.	S	Bend	trans	-107.8	151.8	178.1	-54.8	-78.5	0	0	0	111.9	G1144 I1145 F1168 L1171 C1172 H1177 D1184	G1144-F1179 VanDerWaalsContact C-CE1 3.45Å; I1145-F1179 HydrophobicContact CG1-CD1 4.43Å; I1145-F1179 HydrophobicContact CG1-CE1 4.16Å; F1168-F1179 HydrophobicContact CD1-CD2 4.24Å; F1168-F1179 HydrophobicContact CD1-CE2 4.18Å; F1168-F1179 HydrophobicContact CD2-CD2 4.3Å; F1168-F1179 HydrophobicContact CD2-CE1 4.1Å; F1168-F1179 AromaticContact CD2-CE2 3.83Å; F1168-F1179 HydrophobicContact CD2-CE2 3.83Å; F1168-F1179 AromaticContact CD2-CZ 3.72Å; F1168-F1179 HydrophobicContact CD2-CZ 3.72Å; F1168-F1179 HydrophobicContact CE1-CB 4.39Å; F1168-F1179 AromaticContact CE1-CD2 3.65Å; F1168-F1179 HydrophobicContact CE1-CD2 3.65Å; F1168-F1179 HydrophobicContact CE1-CE2 4.03Å; F1168-F1179 HydrophobicContact CE1-CG 4.05Å; F1168-F1179 AromaticContact CE2-CD1 3.6Å; F1168-F1179 HydrophobicContact CE2-CD1 3.6Å; F1168-F1179 AromaticContact CE2-CD2 3.73Å; F1168-F1179 HydrophobicContact CE2-CD2 3.73Å; F1168-F1179 AromaticContact CE2-CE1 3.52Å; F1168-F1179 HydrophobicContact CE2-CE1 3.52Å; F1168-F1179 AromaticContact CE2-CE2 3.66Å; F1168-F1179 HydrophobicContact CE2-CE2 3.66Å; F1168-F1179 AromaticContact CE2-CG 3.69Å; F1168-F1179 HydrophobicContact CE2-CG 3.69Å; F1168-F1179 AromaticContact CE2-CZ 3.56Å; F1168-F1179 HydrophobicContact CE2-CZ 3.56Å; F1168-F1179 HydrophobicContact CG-CE2 4.09Å; F1168-F1179 HydrophobicContact CG-CZ 4.39Å; F1168-F1179 HydrophobicContact CZ-CB 3.76Å; F1168-F1179 AromaticContact CZ-CD1 3.72Å; F1168-F1179 HydrophobicContact CZ-CD1 3.72Å; F1168-F1179 AromaticContact CZ-CD2 3.37Å; F1168-F1179 HydrophobicContact CZ-CD2 3.37Å; F1168-F1179 HydrophobicContact CZ-CE1 4.08Å; F1168-F1179 AromaticContact CZ-CE2 3.77Å; F1168-F1179 HydrophobicContact CZ-CE2 3.77Å; F1168-F1179 AromaticContact CZ-CG 3.33Å; F1168-F1179 HydrophobicContact CZ-CG 3.33Å; F1168-F1179 HydrophobicContact CZ-CZ 4.11Å; L1171-F1179 HydrophobicContact CB-CE2 4.02Å; L1171-F1179 HydrophobicContact CB-CZ 4.31Å; L1171-F1179 HydrophobicContact CD1-CZ 4.15Å; C1172-F1179 VanDerWaalsContact SG-CD2 3.59Å; H1177-F1179 VanDerWaalsContact C-N 3.28Å; H1177-F1179 PolarHBondContact O-N 2.78Å; F1179-D1184 HydrophobicContact CB-CB 4.16Å; F1179-D1184 HydrophobicContact CD1-CB 3.93Å; F1179-D1184 HydrophobicContact CG-CB 4.46Å
1180	R	90	Very high	91.2	Very high	138 Å²	138	35.5 Å²	35.5	52%	0.521	16%	0.158	S	C	.	.			trans	-88.9	-28.3	-172.3	-52.1	168.8	-67.6	174.1	0.1	113.3	Y1141 W1183 D1184	Y1141-R1180 HydrophobicContact CD1-CG 4.37Å; Y1141-R1180 VanDerWaalsContact CD2-CZ 3.41Å; Y1141-R1180 VanDerWaalsContact CE2-CZ 3.45Å; Y1141-R1180 HydrophobicContact CG-CG 4.14Å; R1180-W1183 HydrophobicContact CB-CZ2 3.83Å; R1180-W1183 WeakPolarHBondContact O-CZ2 3.38Å; R1180-D1184 WeakPolarHBondContact CA-OD2 3.37Å; R1180-D1184 VanDerWaalsContact CB-OD2 3.22Å; R1180-D1184 WeakPolarHBondContact CB-OD2 3.34Å; R1180-D1184 WeakPolarHBondContact CG-OD2 3.4Å; R1180-D1184 IonicContact CZ-OD1 3.2Å; R1180-D1184 IonicContact CZ-OD2 3.89Å; R1180-D1184 PolarHBondContact N-OD2 3.5Å; R1180-D1184 IonicContact NE-OD1 3.29Å; R1180-D1184 PolarHBondContact NE-OD1 2.56Å; R1180-D1184 VanDerWaalsContact NE-OD1 3.16Å; R1180-D1184 IonicContact NE-OD2 2.73Å; R1180-D1184 PolarHBondContact NE-OD2 3.44Å; R1180-D1184 IonicContact NH2-OD1 2.75Å; R1180-D1184 PolarHBondContact NH2-OD1 3.15Å
1181	G	89.4	Confident	91.5	Very high	6 Å²	6	34.8 Å²	34.8	6%	0.062	16%	0.155	C	C	.	.	S	Bend	trans	173.2	-178.7	-174.7	0	0	0	0	0	112.6	F951 W1183 D1184	F951-G1181 VanDerWaalsContact CE2-O 3.28Å; F951-G1181 WeakPolarHBondContact CE2-O 3.19Å; F951-G1181 VanDerWaalsContact CZ-C 3.41Å; F951-G1181 VanDerWaalsContact CZ-CA 3.42Å; G1181-W1183 PolarHBondContact O-N 3.32Å; G1181-W1183 VanDerWaalsContact O-N 3.14Å; G1181-D1184 PolarHBondContact O-N 3.07Å
1182	Y	92	Very high	91.6	Very high	93 Å²	93	34.8 Å²	34.8	37%	0.365	16%	0.155	S	C	.	.	H	α-helix	trans	-61.5	-24.4	-175	73.9	-95.6	0	0	0	113.8	L947 D1184 L1185 E1186	L947-Y1182 HydrophobicContact CD2-CD2 4.36Å; Y1182-D1184 PolarHBondContact O-N 3.4Å; Y1182-L1185 WeakPolarHBondContact O-CB 3.45Å; Y1182-L1185 PolarHBondContact O-N 3.15Å; Y1182-L1185 VanDerWaalsContact O-N 3.1Å; Y1182-E1186 PolarHBondContact O-N 3.23Å
1183	W	92.9	Very high	91.8	Very high	115 Å²	115	36.4 Å²	36.4	44%	0.436	16%	0.162	S	C	.	.	H	α-helix	trans	-63.8	-25.3	175	54	79	0	0	0	113	R1180 G1181 E1186 F1187	R1180-W1183 HydrophobicContact CB-CZ2 3.83Å; R1180-W1183 WeakPolarHBondContact O-CZ2 3.38Å; G1181-W1183 PolarHBondContact O-N 3.32Å; G1181-W1183 VanDerWaalsContact O-N 3.14Å; W1183-E1186 WeakPolarHBondContact O-CB 3.43Å; W1183-F1187 VanDerWaalsContact O-CB 3.26Å; W1183-F1187 WeakPolarHBondContact O-CB 3.39Å; W1183-F1187 PolarHBondContact O-N 3.03Å
1184	D	95.1	Very high	92.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-74.9	-31.8	173.8	-68.1	-30.7	0	0	0	111.1	I1145 F1179 R1180 G1181 Y1182 V1188	I1145-D1184 HydrophobicContact CD1-CB 4.42Å; F1179-D1184 HydrophobicContact CB-CB 4.16Å; F1179-D1184 HydrophobicContact CD1-CB 3.93Å; F1179-D1184 HydrophobicContact CG-CB 4.46Å; R1180-D1184 WeakPolarHBondContact CA-OD2 3.37Å; R1180-D1184 VanDerWaalsContact CB-OD2 3.22Å; R1180-D1184 WeakPolarHBondContact CB-OD2 3.34Å; R1180-D1184 WeakPolarHBondContact CG-OD2 3.4Å; R1180-D1184 IonicContact CZ-OD1 3.2Å; R1180-D1184 IonicContact CZ-OD2 3.89Å; R1180-D1184 PolarHBondContact N-OD2 3.5Å; R1180-D1184 IonicContact NE-OD1 3.29Å; R1180-D1184 PolarHBondContact NE-OD1 2.56Å; R1180-D1184 VanDerWaalsContact NE-OD1 3.16Å; R1180-D1184 IonicContact NE-OD2 2.73Å; R1180-D1184 PolarHBondContact NE-OD2 3.44Å; R1180-D1184 IonicContact NH2-OD1 2.75Å; R1180-D1184 PolarHBondContact NH2-OD1 3.15Å; G1181-D1184 PolarHBondContact O-N 3.07Å; Y1182-D1184 PolarHBondContact O-N 3.4Å; D1184-V1188 WeakPolarHBondContact O-CG2 3.48Å; D1184-V1188 PolarHBondContact O-N 2.68Å
1185	L	95.4	Very high	92.4	Very high	0 Å²	0	37 Å²	37	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-70.2	-44.1	169.8	175.4	65.8	0	0	0	110.8	L947 Q950 F951 V1164 F1168 Y1182 F1187 V1188 Y1189	L947-L1185 HydrophobicContact CD1-CD2 3.86Å; L947-L1185 HydrophobicContact CD1-CG 3.94Å; Q950-L1185 HydrophobicContact CB-CD2 4.46Å; Q950-L1185 HydrophobicContact CG-CD2 4.39Å; F951-L1185 HydrophobicContact CB-CD2 3.89Å; F951-L1185 HydrophobicContact CD2-CB 4.23Å; F951-L1185 HydrophobicContact CD2-CD2 4.45Å; V1164-L1185 HydrophobicContact CG1-CD1 3.67Å; F1168-L1185 HydrophobicContact CB-CD1 4.04Å; F1168-L1185 HydrophobicContact CD1-CD1 4.16Å; F1168-L1185 HydrophobicContact CD2-CB 4.26Å; F1168-L1185 HydrophobicContact CD2-CD1 3.65Å; F1168-L1185 HydrophobicContact CE1-CB 4.16Å; F1168-L1185 HydrophobicContact CE2-CB 3.75Å; F1168-L1185 HydrophobicContact CE2-CD1 4.06Å; F1168-L1185 HydrophobicContact CG-CD1 3.7Å; F1168-L1185 HydrophobicContact CZ-CB 3.7Å; F1168-L1185 HydrophobicContact CZ-CD1 4.47Å; Y1182-L1185 WeakPolarHBondContact O-CB 3.45Å; Y1182-L1185 PolarHBondContact O-N 3.15Å; Y1182-L1185 VanDerWaalsContact O-N 3.1Å; L1185-F1187 VanDerWaalsContact C-N 3.31Å; L1185-F1187 PolarHBondContact O-N 2.81Å; L1185-V1188 PolarHBondContact O-N 3.22Å; L1185-Y1189 HydrophobicContact CD1-CD2 4.2Å; L1185-Y1189 HydrophobicContact CD1-CE2 3.72Å; L1185-Y1189 HydrophobicContact CD2-CE2 4.44Å; L1185-Y1189 HydrophobicContact CG-CD2 4.14Å; L1185-Y1189 HydrophobicContact CG-CE2 3.85Å; L1185-Y1189 VanDerWaalsContact O-CD2 3.27Å; L1185-Y1189 WeakPolarHBondContact O-CD2 3.36Å; L1185-Y1189 PolarHBondContact O-N 3.24Å; L1185-Y1189 VanDerWaalsContact O-N 3.08Å
1186	E	95.6	Very high	92.6	Very high	40 Å²	40	37.2 Å²	37.2	19%	0.187	16%	0.164	C	C	.	.	H	α-helix	trans	-55.2	-46.6	174	-161.5	177.8	170.2	0	0	111.5	Y937 L947 I1097 Y1182 W1183 V1188 Y1189 T1190	Y937-E1186 HydrophobicContact CE1-CG 4.19Å; Y937-E1186 WeakPolarHBondContact CE1-OE1 3.43Å; Y937-E1186 VanDerWaalsContact OH-CG 3.28Å; Y937-E1186 WeakPolarHBondContact OH-CG 3.48Å; Y937-E1186 PolarHBondContact OH-OE1 2.68Å; Y937-E1186 VanDerWaalsContact OH-OE1 3.13Å; L947-E1186 HydrophobicContact CD2-CB 3.82Å; L947-E1186 HydrophobicContact CD2-CG 3.71Å; I1097-E1186 HydrophobicContact CD1-CB 4.31Å; I1097-E1186 HydrophobicContact CD1-CG 3.91Å; Y1182-E1186 PolarHBondContact O-N 3.23Å; W1183-E1186 WeakPolarHBondContact O-CB 3.43Å; E1186-V1188 PolarHBondContact O-N 3.13Å; E1186-Y1189 WeakPolarHBondContact O-CB 3.49Å; E1186-Y1189 PolarHBondContact O-N 3.29Å; E1186-Y1189 VanDerWaalsContact O-N 3.11Å; E1186-T1190 PolarHBondContact O-N 3.37Å; E1186-T1190 PolarHBondContact O-OG1 2.74Å; E1186-T1190 VanDerWaalsContact O-OG1 3.1Å
1187	F	96.3	Very high	92.9	Very high	12 Å²	12	41 Å²	41	5%	0.053	18%	0.178	C	C	.	.	H	α-helix	trans	-65.9	-35.8	179.7	-174.6	-126.5	0	0	0	112.8	W1094 P1095 S1096 I1097 I1145 W1183 L1185 T1190 L1191	W1094-F1187 HydrophobicContact CZ2-CE1 4.31Å; W1094-F1187 AromaticContact NE1-CE1 3.8Å; P1095-F1187 HydrophobicContact CB-CZ 4.28Å; P1095-F1187 HydrophobicContact CG-CZ 4.05Å; P1095-F1187 WeakPolarHBondContact O-CZ 3.34Å; S1096-F1187 VanDerWaalsContact O-CE2 3.29Å; S1096-F1187 WeakPolarHBondContact O-CE2 3.21Å; I1097-F1187 HydrophobicContact CB-CD2 4.01Å; I1097-F1187 HydrophobicContact CD1-CB 4.49Å; I1097-F1187 HydrophobicContact CG1-CD2 4.13Å; I1145-F1187 HydrophobicContact CD1-CD1 3.91Å; I1145-F1187 HydrophobicContact CD1-CE1 4.4Å; I1145-F1187 HydrophobicContact CG2-CD1 4.17Å; I1145-F1187 HydrophobicContact CG2-CE1 4.29Å; W1183-F1187 VanDerWaalsContact O-CB 3.26Å; W1183-F1187 WeakPolarHBondContact O-CB 3.39Å; W1183-F1187 PolarHBondContact O-N 3.03Å; L1185-F1187 VanDerWaalsContact C-N 3.31Å; L1185-F1187 PolarHBondContact O-N 2.81Å; F1187-T1190 PolarHBondContact O-N 3.24Å; F1187-L1191 HydrophobicContact CD1-CD1 3.95Å; F1187-L1191 HydrophobicContact CD2-CD1 4.49Å; F1187-L1191 HydrophobicContact CD2-CG 4.24Å; F1187-L1191 HydrophobicContact CE1-CD1 3.63Å; F1187-L1191 HydrophobicContact CE1-CG 4.29Å; F1187-L1191 HydrophobicContact CE2-CD1 4.18Å; F1187-L1191 HydrophobicContact CE2-CD2 4.12Å; F1187-L1191 HydrophobicContact CE2-CG 3.92Å; F1187-L1191 HydrophobicContact CG-CD1 4.39Å; F1187-L1191 HydrophobicContact CZ-CD1 3.77Å; F1187-L1191 HydrophobicContact CZ-CD2 4.09Å; F1187-L1191 HydrophobicContact CZ-CG 3.98Å; F1187-L1191 WeakPolarHBondContact O-CB 3.48Å; F1187-L1191 WeakPolarHBondContact O-CG 3.2Å; F1187-L1191 PolarHBondContact O-N 3.13Å
1188	V	97	Very high	92.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.8	-42.6	170	170.1	0	0	0	0	111.2	I1145 A1148 I1149 L1152 V1164 D1184 L1185 E1186 M1192	I1145-V1188 HydrophobicContact CB-CG2 4.46Å; I1145-V1188 HydrophobicContact CG1-CG2 4.23Å; I1145-V1188 HydrophobicContact CG2-CG2 4.14Å; A1148-V1188 HydrophobicContact CB-CG1 4.14Å; A1148-V1188 HydrophobicContact CB-CG2 3.88Å; I1149-V1188 HydrophobicContact CG2-CG1 4.49Å; L1152-V1188 HydrophobicContact CD1-CG1 3.51Å; V1164-V1188 HydrophobicContact CG1-CG1 3.92Å; D1184-V1188 WeakPolarHBondContact O-CG2 3.48Å; D1184-V1188 PolarHBondContact O-N 2.68Å; L1185-V1188 PolarHBondContact O-N 3.22Å; E1186-V1188 PolarHBondContact O-N 3.13Å; V1188-M1192 WeakPolarHBondContact O-CB 3.38Å; V1188-M1192 VanDerWaalsContact O-CG 3.31Å; V1188-M1192 WeakPolarHBondContact O-CG 3.4Å; V1188-M1192 PolarHBondContact O-N 3.29Å
1189	Y	96.2	Very high	91.9	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.8	-42.5	173.4	-80.8	-72	0	0	0	112.6	I924 F929 Y932 L933 L936 L947 Q950 V1164 L1185 E1186 M1192 Q1193	I924-Y1189 HydrophobicContact CD1-CE1 4.31Å; F929-Y1189 HydrophobicContact CE1-CD1 4.24Å; F929-Y1189 HydrophobicContact CE2-CD1 4.25Å; F929-Y1189 HydrophobicContact CE2-CE1 4.47Å; F929-Y1189 AromaticContact CZ-CD1 3.64Å; F929-Y1189 HydrophobicContact CZ-CD1 3.64Å; F929-Y1189 HydrophobicContact CZ-CE1 4.29Å; Y932-Y1189 HydrophobicContact CD1-CE1 4.21Å; Y932-Y1189 AromaticContact CE1-CE1 3.82Å; Y932-Y1189 HydrophobicContact CE1-CE1 3.82Å; L933-Y1189 HydrophobicContact CD1-CD1 4.16Å; L933-Y1189 HydrophobicContact CD1-CD2 4.47Å; L933-Y1189 HydrophobicContact CD1-CG 3.88Å; L936-Y1189 HydrophobicContact CD1-CD1 4.21Å; L936-Y1189 HydrophobicContact CD1-CD2 4.06Å; L936-Y1189 HydrophobicContact CD1-CE1 3.66Å; L936-Y1189 HydrophobicContact CD1-CE2 3.47Å; L936-Y1189 VanDerWaalsContact CD1-CE2 3.47Å; L936-Y1189 HydrophobicContact CD1-CG 4.41Å; L936-Y1189 WeakPolarHBondContact CD1-OH 3.38Å; L947-Y1189 HydrophobicContact CD1-CD2 3.83Å; L947-Y1189 HydrophobicContact CD1-CE2 3.82Å; Q950-Y1189 PolarHBondContact NE2-OH 2.82Å; Q950-Y1189 PolarHBondContact OE1-OH 3.11Å; V1164-Y1189 HydrophobicContact CB-CD1 4.5Å; V1164-Y1189 HydrophobicContact CB-CE1 3.73Å; V1164-Y1189 HydrophobicContact CB-CE2 4.22Å; V1164-Y1189 HydrophobicContact CG1-CD2 4.27Å; V1164-Y1189 HydrophobicContact CG1-CE1 4.07Å; V1164-Y1189 HydrophobicContact CG1-CE2 3.78Å; V1164-Y1189 HydrophobicContact CG2-CD1 3.97Å; V1164-Y1189 HydrophobicContact CG2-CE1 3.48Å; V1164-Y1189 VanDerWaalsContact CG2-CE1 3.48Å; L1185-Y1189 HydrophobicContact CD1-CD2 4.2Å; L1185-Y1189 HydrophobicContact CD1-CE2 3.72Å; L1185-Y1189 HydrophobicContact CD2-CE2 4.44Å; L1185-Y1189 HydrophobicContact CG-CD2 4.14Å; L1185-Y1189 HydrophobicContact CG-CE2 3.85Å; L1185-Y1189 VanDerWaalsContact O-CD2 3.27Å; L1185-Y1189 WeakPolarHBondContact O-CD2 3.36Å; L1185-Y1189 PolarHBondContact O-N 3.24Å; L1185-Y1189 VanDerWaalsContact O-N 3.08Å; E1186-Y1189 WeakPolarHBondContact O-CB 3.49Å; E1186-Y1189 PolarHBondContact O-N 3.29Å; E1186-Y1189 VanDerWaalsContact O-N 3.11Å; Y1189-M1192 PolarHBondContact O-N 3.43Å; Y1189-Q1193 PolarHBondContact O-N 3.2Å
1190	T	95.2	Very high	90	Very high	28 Å²	28	39.8 Å²	39.8	17%	0.172	18%	0.18	C	C	.	.	H	α-helix	trans	-65.8	-46.6	-179.4	-61.3	0	0	0	0	111.7	I1097 L1099 E1186 F1187 M1192 Q1193 Y1194	I1097-T1190 HydrophobicContact CG1-CG2 4.09Å; L1099-T1190 HydrophobicContact CD1-CG2 3.91Å; L1099-T1190 HydrophobicContact CG-CG2 4.25Å; E1186-T1190 PolarHBondContact O-N 3.37Å; E1186-T1190 PolarHBondContact O-OG1 2.74Å; E1186-T1190 VanDerWaalsContact O-OG1 3.1Å; F1187-T1190 PolarHBondContact O-N 3.24Å; T1190-M1192 PolarHBondContact O-N 2.93Å; T1190-Q1193 PolarHBondContact O-N 2.56Å; T1190-Y1194 WeakPolarHBondContact O-CB 3.27Å; T1190-Y1194 PolarHBondContact O-N 2.87Å
1191	L	96.2	Very high	87.6	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.9	-43.7	173.4	-74.6	173.1	0	0	0	111.8	L1099 A1108 L1111 L1112 I1145 I1149 F1187 Y1194 Y1195	L1099-L1191 HydrophobicContact CD1-CD2 4.21Å; A1108-L1191 HydrophobicContact CB-CD2 3.91Å; L1111-L1191 HydrophobicContact CD2-CD1 4.45Å; L1112-L1191 HydrophobicContact CD1-CD2 4.48Å; I1145-L1191 HydrophobicContact CG2-CD1 3.99Å; I1149-L1191 HydrophobicContact CD1-CD1 4.39Å; I1149-L1191 HydrophobicContact CG2-CB 4.18Å; I1149-L1191 HydrophobicContact CG2-CD1 3.97Å; F1187-L1191 HydrophobicContact CD1-CD1 3.95Å; F1187-L1191 HydrophobicContact CD2-CD1 4.49Å; F1187-L1191 HydrophobicContact CD2-CG 4.24Å; F1187-L1191 HydrophobicContact CE1-CD1 3.63Å; F1187-L1191 HydrophobicContact CE1-CG 4.29Å; F1187-L1191 HydrophobicContact CE2-CD1 4.18Å; F1187-L1191 HydrophobicContact CE2-CD2 4.12Å; F1187-L1191 HydrophobicContact CE2-CG 3.92Å; F1187-L1191 HydrophobicContact CG-CD1 4.39Å; F1187-L1191 HydrophobicContact CZ-CD1 3.77Å; F1187-L1191 HydrophobicContact CZ-CD2 4.09Å; F1187-L1191 HydrophobicContact CZ-CG 3.98Å; F1187-L1191 WeakPolarHBondContact O-CB 3.48Å; F1187-L1191 WeakPolarHBondContact O-CG 3.2Å; F1187-L1191 PolarHBondContact O-N 3.13Å; L1191-Y1194 PolarHBondContact O-N 2.92Å; L1191-Y1195 WeakPolarHBondContact O-CB 3.43Å; L1191-Y1195 PolarHBondContact O-N 3.36Å
1192	M	95.7	Very high	85	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-69.9	-34	177.7	-69.8	-50.9	-50.5	0	0	113.1	F929 I1149 L1152 I1153 L1162 V1188 Y1189 T1190 Y1195 L1196	F929-M1192 HydrophobicContact CE1-CB 4.07Å; F929-M1192 HydrophobicContact CE2-CB 4.4Å; F929-M1192 HydrophobicContact CZ-CB 3.63Å; I1149-M1192 HydrophobicContact CB-SD 4.31Å; I1149-M1192 HydrophobicContact CG2-SD 4.41Å; L1152-M1192 HydrophobicContact CB-CE 4.1Å; L1152-M1192 HydrophobicContact CB-CG 4.2Å; L1152-M1192 HydrophobicContact CB-SD 3.78Å; L1152-M1192 HydrophobicContact CD1-CG 3.97Å; I1153-M1192 HydrophobicContact CG1-CE 3.98Å; I1153-M1192 HydrophobicContact CG1-SD 4.06Å; L1162-M1192 HydrophobicContact CD1-CE 4.44Å; L1162-M1192 HydrophobicContact CD2-CE 3.79Å; V1188-M1192 WeakPolarHBondContact O-CB 3.38Å; V1188-M1192 VanDerWaalsContact O-CG 3.31Å; V1188-M1192 WeakPolarHBondContact O-CG 3.4Å; V1188-M1192 PolarHBondContact O-N 3.29Å; Y1189-M1192 PolarHBondContact O-N 3.43Å; T1190-M1192 PolarHBondContact O-N 2.93Å; M1192-Y1195 HydrophobicContact CE-CD1 3.8Å; M1192-L1196 VanDerWaalsContact O-CG 3.31Å; M1192-L1196 WeakPolarHBondContact O-CG 3.27Å; M1192-L1196 PolarHBondContact O-N 3.2Å; M1192-L1196 VanDerWaalsContact O-N 3.08Å
1193	Q	94.1	Very high	82.2	Confident	40 Å²	40	39.4 Å²	39.4	19%	0.187	21%	0.209	C	C	.	.	H	α-helix	trans	-67	-40.6	172.8	-165.4	-168.7	83.3	0	0	111.1	F929 S930 L933 Y1189 T1190 L1196 K1197	F929-Q1193 HydrophobicContact CD1-CB 4.19Å; F929-Q1193 HydrophobicContact CD1-CG 4.45Å; F929-Q1193 HydrophobicContact CE1-CB 3.99Å; S930-Q1193 PolarHBondContact OG-NE2 3.26Å; L933-Q1193 HydrophobicContact CD2-CB 4.4Å; Y1189-Q1193 PolarHBondContact O-N 3.2Å; T1190-Q1193 PolarHBondContact O-N 2.56Å; Q1193-L1196 PolarHBondContact O-N 2.9Å; Q1193-K1197 HydrophobicContact CG-CD 4.36Å; Q1193-K1197 WeakPolarHBondContact O-CG 3.38Å; Q1193-K1197 PolarHBondContact O-N 3.37Å
1194	Y	93.9	Very high	79.5	Confident	37 Å²	37	40.6 Å²	40.6	15%	0.145	21%	0.214	C	C	.	.	H	α-helix	trans	-62.1	-47.3	175.7	-176.6	-94.3	0	0	0	111.6	L1099 S1105 A1108 L1112 T1190 L1191 L1196 K1197 N1198	L1099-Y1194 HydrophobicContact CB-CD2 4.08Å; L1099-Y1194 HydrophobicContact CB-CE2 4.37Å; L1099-Y1194 HydrophobicContact CD1-CD1 4.41Å; L1099-Y1194 HydrophobicContact CD1-CD2 3.94Å; L1099-Y1194 HydrophobicContact CD1-CG 3.76Å; S1105-Y1194 PolarHBondContact O-OH 3.49Å; S1105-Y1194 WeakPolarHBondContact OG-CE2 3.47Å; S1105-Y1194 PolarHBondContact OG-OH 3.48Å; A1108-Y1194 HydrophobicContact CB-CE1 4.44Å; L1112-Y1194 HydrophobicContact CD1-CD1 3.69Å; L1112-Y1194 HydrophobicContact CD1-CE1 4.33Å; T1190-Y1194 WeakPolarHBondContact O-CB 3.27Å; T1190-Y1194 PolarHBondContact O-N 2.87Å; L1191-Y1194 PolarHBondContact O-N 2.92Å; Y1194-L1196 PolarHBondContact O-N 2.86Å; Y1194-K1197 WeakPolarHBondContact O-CB 3.17Å; Y1194-K1197 PolarHBondContact O-N 2.94Å; Y1194-K1197 VanDerWaalsContact O-N 3.17Å; Y1194-N1198 WeakPolarHBondContact CE1-ND2 3.1Å; Y1194-N1198 VanDerWaalsContact CZ-ND2 3.28Å; Y1194-N1198 PolarHBondContact O-N 3.36Å; Y1194-N1198 PolarHBondContact OH-ND2 2.76Å
1195	Y	93.2	Very high	76.6	Confident	12 Å²	12	48.7 Å²	48.7	5%	0.047	25%	0.251	C	S	.	.	H	α-helix	trans	-54.8	-50	174.5	-178	-112.8	0	0	0	112.2	L1112 I1153 F1156 L1191 M1192 K1197 N1198 E1199	L1112-Y1195 HydrophobicContact CB-CD2 4.3Å; L1112-Y1195 HydrophobicContact CD1-CD2 4.49Å; L1112-Y1195 HydrophobicContact CD2-CD2 4.38Å; L1112-Y1195 HydrophobicContact CD2-CG 4.4Å; I1153-Y1195 HydrophobicContact CG1-CD1 4.04Å; I1153-Y1195 HydrophobicContact CG1-CE1 3.9Å; I1153-Y1195 HydrophobicContact CG1-CG 4.5Å; I1153-Y1195 HydrophobicContact CG2-CE1 4.27Å; F1156-Y1195 AromaticContact CD1-CE1 3.78Å; F1156-Y1195 HydrophobicContact CD1-CE1 3.78Å; F1156-Y1195 AromaticContact CE1-CE1 3.98Å; F1156-Y1195 HydrophobicContact CE1-CE1 3.98Å; L1191-Y1195 WeakPolarHBondContact O-CB 3.43Å; L1191-Y1195 PolarHBondContact O-N 3.36Å; M1192-Y1195 HydrophobicContact CE-CD1 3.8Å; Y1195-K1197 VanDerWaalsContact C-N 3.32Å; Y1195-K1197 PolarHBondContact O-N 2.67Å; Y1195-N1198 PolarHBondContact O-N 2.86Å; Y1195-E1199 HydrophobicContact CD1-CG 4.37Å; Y1195-E1199 HydrophobicContact CD2-CG 4.12Å; Y1195-E1199 HydrophobicContact CE1-CG 3.92Å; Y1195-E1199 HydrophobicContact CE2-CG 3.61Å; Y1195-E1199 VanDerWaalsContact CE2-OE1 3.26Å; Y1195-E1199 WeakPolarHBondContact CE2-OE1 3.44Å; Y1195-E1199 HydrophobicContact CG-CG 4.44Å; Y1195-E1199 VanDerWaalsContact CZ-CG 3.48Å; Y1195-E1199 WeakPolarHBondContact O-CB 3.2Å; Y1195-E1199 WeakPolarHBondContact O-CG 3.48Å; Y1195-E1199 PolarHBondContact O-N 2.84Å; Y1195-E1199 VanDerWaalsContact OH-CD 3.27Å; Y1195-E1199 PolarHBondContact OH-OE1 2.97Å
1196	L	91.1	Very high	73.6	Confident	25 Å²	25	53.5 Å²	53.5	13%	0.131	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-32.6	178.1	-70.3	176.5	0	0	0	113.8	P926 F929 F1156 L1162 M1192 Q1193 Y1194 S1200	P926-L1196 HydrophobicContact CB-CD1 4.31Å; P926-L1196 HydrophobicContact CB-CD2 4.03Å; F929-L1196 HydrophobicContact CB-CD1 3.82Å; F929-L1196 HydrophobicContact CD1-CD1 4.04Å; F929-L1196 HydrophobicContact CD2-CD1 4.31Å; F929-L1196 HydrophobicContact CG-CD1 3.8Å; F1156-L1196 HydrophobicContact CD2-CD2 4.03Å; F1156-L1196 HydrophobicContact CE1-CD2 4.36Å; F1156-L1196 HydrophobicContact CE2-CD2 3.73Å; F1156-L1196 HydrophobicContact CG-CD2 4.46Å; F1156-L1196 HydrophobicContact CZ-CD2 3.91Å; L1162-L1196 HydrophobicContact CD1-CD1 3.8Å; L1162-L1196 HydrophobicContact CD1-CD2 4.47Å; L1162-L1196 HydrophobicContact CD1-CG 4.45Å; M1192-L1196 VanDerWaalsContact O-CG 3.31Å; M1192-L1196 WeakPolarHBondContact O-CG 3.27Å; M1192-L1196 PolarHBondContact O-N 3.2Å; M1192-L1196 VanDerWaalsContact O-N 3.08Å; Q1193-L1196 PolarHBondContact O-N 2.9Å; Y1194-L1196 PolarHBondContact O-N 2.86Å; L1196-S1200 PolarHBondContact O-N 2.57Å; L1196-S1200 PolarHBondContact O-OG 3.47Å
1197	K	87.8	Confident	70.7	Confident	115 Å²	115	56.7 Å²	56.7	50%	0.5	30%	0.303	S	S	.	.	H	α-helix	trans	-69.6	-38.1	174.2	-76.4	165.6	166.5	173.3	0	111.9	Q1193 Y1194 Y1195 S1200	Q1193-K1197 HydrophobicContact CG-CD 4.36Å; Q1193-K1197 WeakPolarHBondContact O-CG 3.38Å; Q1193-K1197 PolarHBondContact O-N 3.37Å; Y1194-K1197 WeakPolarHBondContact O-CB 3.17Å; Y1194-K1197 PolarHBondContact O-N 2.94Å; Y1194-K1197 VanDerWaalsContact O-N 3.17Å; Y1195-K1197 VanDerWaalsContact C-N 3.32Å; Y1195-K1197 PolarHBondContact O-N 2.67Å; K1197-S1200 PolarHBondContact O-OG 2.84Å
1198	N	81.4	Confident	67.7	Low	62 Å²	62	62.3 Å²	62.3	33%	0.332	35%	0.345	S	S	.	.	H	α-helix	trans	-78.5	-40	-179.1	-72.6	8.8	0	0	0	112.1	Y1194 Y1195 S1200 S1201	Y1194-N1198 WeakPolarHBondContact CE1-ND2 3.1Å; Y1194-N1198 VanDerWaalsContact CZ-ND2 3.28Å; Y1194-N1198 PolarHBondContact O-N 3.36Å; Y1194-N1198 PolarHBondContact OH-ND2 2.76Å; Y1195-N1198 PolarHBondContact O-N 2.86Å; N1198-S1200 PolarHBondContact O-N 2.77Å; N1198-S1200 VanDerWaalsContact O-N 3.15Å; N1198-S1201 WeakPolarHBondContact O-CB 3.34Å; N1198-S1201 PolarHBondContact O-N 3.19Å
1199	E	68.5	Low	65	Low	62 Å²	62	67.5 Å²	67.5	29%	0.29	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-17.8	173	-76.6	-76.7	164.5	0	0	113.7	Y1195	Y1195-E1199 HydrophobicContact CD1-CG 4.37Å; Y1195-E1199 HydrophobicContact CD2-CG 4.12Å; Y1195-E1199 HydrophobicContact CE1-CG 3.92Å; Y1195-E1199 HydrophobicContact CE2-CG 3.61Å; Y1195-E1199 VanDerWaalsContact CE2-OE1 3.26Å; Y1195-E1199 WeakPolarHBondContact CE2-OE1 3.44Å; Y1195-E1199 HydrophobicContact CG-CG 4.44Å; Y1195-E1199 VanDerWaalsContact CZ-CG 3.48Å; Y1195-E1199 WeakPolarHBondContact O-CB 3.2Å; Y1195-E1199 WeakPolarHBondContact O-CG 3.48Å; Y1195-E1199 PolarHBondContact O-N 2.84Å; Y1195-E1199 VanDerWaalsContact OH-CD 3.27Å; Y1195-E1199 PolarHBondContact OH-OE1 2.97Å
1200	S	53.3	Low	62.2	Low	50 Å²	50	69.6 Å²	69.6	35%	0.35	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	2.1	173.8	39.6	0	0	0	0	114.2	L1196 K1197 N1198	L1196-S1200 PolarHBondContact O-N 2.57Å; L1196-S1200 PolarHBondContact O-OG 3.47Å; K1197-S1200 PolarHBondContact O-OG 2.84Å; N1198-S1200 PolarHBondContact O-N 2.77Å; N1198-S1200 VanDerWaalsContact O-N 3.15Å
1201	S	39.2	Very low	59.4	Low	58 Å²	58	73.4 Å²	73.4	41%	0.406	42%	0.42	S	S	.	.	S	Bend	trans	-81	134.2	172.9	-68.4	0	0	0	0	112.5	N1198 S1203	N1198-S1201 WeakPolarHBondContact O-CB 3.34Å; N1198-S1201 PolarHBondContact O-N 3.19Å; S1201-S1203 PolarHBondContact O-N 2.84Å
1202	P	34.8	Very low	56.8	Low	79 Å²	79	82.1 Å²	82.1	51%	0.513	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-74	10.5	-168.7	28.7	-36.4	0	0	0	116.4	Y1217	P1202-Y1217 HydrophobicContact CB-CE2 4.18Å
1203	S	34	Very low	54.5	Low	92 Å²	92	84.7 Å²	84.7	64%	0.643	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-74.5	-21.9	-174.8	46.4	0	0	0	0	115.2	S1201 Q1205	S1201-S1203 PolarHBondContact O-N 2.84Å; S1203-Q1205 VanDerWaalsContact C-N 3.29Å; S1203-Q1205 PolarHBondContact O-N 2.9Å
1204	W	35.7	Very low	51.9	Low	140 Å²	140	85 Å²	85	53%	0.53	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-82.1	15.4	-170.5	-76.1	94.9	0	0	0	116.1	S1206	W1204-S1206 PolarHBondContact O-N 3.42Å; W1204-S1206 VanDerWaalsContact O-N 3.13Å
1205	Q	33.4	Very low	49.6	Very low	170 Å²	170	86.5 Å²	86.5	79%	0.794	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-4.6	-175.1	-66.4	-168.9	3.9	0	0	115.6	S1203	S1203-Q1205 VanDerWaalsContact C-N 3.29Å; S1203-Q1205 PolarHBondContact O-N 2.9Å
1206	S	33.9	Very low	47.1	Very low	102 Å²	102	87.6 Å²	87.6	71%	0.713	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-24	-175.5	54.8	0	0	0	0	115.2	W1204	W1204-S1206 PolarHBondContact O-N 3.42Å; W1204-S1206 VanDerWaalsContact O-N 3.13Å
1207	N	33	Very low	44.6	Very low	106 Å²	106	89.7 Å²	89.7	57%	0.567	50%	0.499	S	S	*	.	S	Bend	trans	-108.4	152.2	-175.3	-79	-33.1	0	0	0	112.9	I1209	N1207-I1209 PolarHBondContact O-N 3.09Å
1208	S	34.9	Very low	42.4	Very low	131 Å²	131	93.1 Å²	93.1	92%	0.916	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	27.6	-158.4	62.9	0	0	0	0	117.2
1209	I	38.5	Very low	40.5	Very low	109 Å²	109	95.4 Å²	95.4	56%	0.559	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-18.6	-173.9	-64.6	174.8	0	0	0	112.2	N1207 S1211 Y1213	N1207-I1209 PolarHBondContact O-N 3.09Å; I1209-S1211 PolarHBondContact O-N 3.33Å; I1209-Y1213 HydrophobicContact CG2-CD2 3.82Å; I1209-Y1213 HydrophobicContact CG2-CE2 3.42Å; I1209-Y1213 VanDerWaalsContact CG2-CE2 3.42Å
1210	G	37.4	Very low	39.1	Very low	43 Å²	43	96.6 Å²	96.6	44%	0.443	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-11.5	-164.3	0	0	0	0	0	119.1	R1212 A1214	G1210-R1212 PolarHBondContact O-N 3.49Å; G1210-A1214 PolarHBondContact O-N 2.95Å
1211	S	36.9	Very low	38.5	Very low	109 Å²	109	99.8 Å²	99.8	76%	0.762	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-27.1	-177.6	178.4	0	0	0	0	114.9	I1209	I1209-S1211 PolarHBondContact O-N 3.33Å
1212	R	41.6	Very low	38.1	Very low	182 Å²	182	100.4 Å²	100.4	69%	0.687	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-45.3	179	-61.8	-173.5	-167.9	170.8	8.3	111.3	G1210 A1214 T1215	G1210-R1212 PolarHBondContact O-N 3.49Å; R1212-A1214 PolarHBondContact O-N 3.46Å; R1212-T1215 WeakPolarHBondContact O-CB 3.47Å; R1212-T1215 PolarHBondContact O-N 2.82Å; R1212-T1215 PolarHBondContact O-OG1 2.82Å
1213	Y	47.6	Very low	38	Very low	55 Å²	55	108 Å²	108	22%	0.216	57%	0.571	C	S	.	*	H	α-helix	trans	-70	-31	-171.3	-63.6	-96.8	0	0	0	112.9	F1156 L1157 I1209 T1215 L1216 Y1217	F1156-Y1213 HydrophobicContact CE1-CE1 4.34Å; F1156-Y1213 HydrophobicContact CZ-CE1 4.46Å; L1157-Y1213 HydrophobicContact CD2-CE1 4.46Å; L1157-Y1213 WeakPolarHBondContact CD2-OH 3.47Å; I1209-Y1213 HydrophobicContact CG2-CD2 3.82Å; I1209-Y1213 HydrophobicContact CG2-CE2 3.42Å; I1209-Y1213 VanDerWaalsContact CG2-CE2 3.42Å; Y1213-T1215 PolarHBondContact O-N 2.91Å; Y1213-L1216 WeakPolarHBondContact O-CA 3.17Å; Y1213-L1216 WeakPolarHBondContact O-CB 3.24Å; Y1213-L1216 PolarHBondContact O-N 3.33Å; Y1213-Y1217 PolarHBondContact O-N 3.08Å
1214	A	39.8	Very low	37.8	Very low	45 Å²	45	111 Å²	111	37%	0.372	58%	0.58	S	S	.	*	H	α-helix	trans	-52.2	-38.1	170.9	0	0	0	0	0	112.6	G1210 R1212 L1216 Y1217 Y1218	G1210-A1214 PolarHBondContact O-N 2.95Å; R1212-A1214 PolarHBondContact O-N 3.46Å; A1214-L1216 VanDerWaalsContact C-N 3.31Å; A1214-L1216 PolarHBondContact O-N 2.92Å; A1214-Y1217 PolarHBondContact O-N 3.48Å; A1214-Y1218 WeakPolarHBondContact O-CD2 3.47Å; A1214-Y1218 PolarHBondContact O-N 3.46Å
1215	T	44.7	Very low	37.5	Very low	70 Å²	70	111.7 Å²	111.7	43%	0.429	59%	0.594	S	S	.	*	H	α-helix	trans	-67.2	-30.3	176.4	-19.5	0	0	0	0	113.1	R1212 Y1213 M1219	R1212-T1215 WeakPolarHBondContact O-CB 3.47Å; R1212-T1215 PolarHBondContact O-N 2.82Å; R1212-T1215 PolarHBondContact O-OG1 2.82Å; Y1213-T1215 PolarHBondContact O-N 2.91Å; T1215-M1219 HydrophobicContact CG2-CE 4.09Å; T1215-M1219 WeakPolarHBondContact O-CG 3.27Å; T1215-M1219 PolarHBondContact O-N 2.68Å
1216	L	40.8	Very low	37.3	Very low	35 Å²	35	108.1 Å²	108.1	18%	0.183	59%	0.588	C	S	.	*	H	α-helix	trans	-75.7	-44.2	176.2	-147.2	80.5	0	0	0	110	F1156 L1160 Y1213 A1214 Y1218 M1219 L1220	F1156-L1216 HydrophobicContact CE2-CD2 4.13Å; F1156-L1216 HydrophobicContact CZ-CD2 4.25Å; L1160-L1216 HydrophobicContact CD2-CD1 4.35Å; Y1213-L1216 WeakPolarHBondContact O-CA 3.17Å; Y1213-L1216 WeakPolarHBondContact O-CB 3.24Å; Y1213-L1216 PolarHBondContact O-N 3.33Å; A1214-L1216 VanDerWaalsContact C-N 3.31Å; A1214-L1216 PolarHBondContact O-N 2.92Å; L1216-Y1218 PolarHBondContact O-N 2.89Å; L1216-M1219 CarbonylContact O-C 3.54Å; L1216-M1219 WeakPolarHBondContact O-CA 3.28Å; L1216-M1219 PolarHBondContact O-N 2.83Å; L1216-L1220 HydrophobicContact CD2-CD1 4.31Å; L1216-L1220 HydrophobicContact CG-CD1 4.23Å; L1216-L1220 WeakPolarHBondContact O-CG 3.49Å; L1216-L1220 PolarHBondContact O-N 3.38Å
1217	Y	38.8	Very low	37	Very low	68 Å²	68	108.1 Å²	108.1	27%	0.267	59%	0.588	S	S	.	*	H	α-helix	trans	-55.1	-49.8	175.9	-164.7	-86.4	0	0	0	111.6	P1202 Y1213 A1214 M1219 L1220 E1221	P1202-Y1217 HydrophobicContact CB-CE2 4.18Å; Y1213-Y1217 PolarHBondContact O-N 3.08Å; A1214-Y1217 PolarHBondContact O-N 3.48Å; Y1217-M1219 PolarHBondContact O-N 3.37Å; Y1217-L1220 PolarHBondContact O-N 3.31Å; Y1217-E1221 HydrophobicContact CD1-CG 4.33Å; Y1217-E1221 HydrophobicContact CE1-CG 3.89Å; Y1217-E1221 WeakPolarHBondContact CE1-OE1 3.42Å; Y1217-E1221 WeakPolarHBondContact CE1-OE2 3.16Å; Y1217-E1221 VanDerWaalsContact CZ-OE1 3.23Å; Y1217-E1221 PolarHBondContact O-N 2.93Å; Y1217-E1221 PolarHBondContact OH-OE1 3.24Å
1218	Y	41.2	Very low	36.7	Very low	187 Å²	187	112.3 Å²	112.3	73%	0.733	60%	0.601	S	S	*	*	H	α-helix	trans	-64.7	-18.5	175	-75.5	-57.1	0	0	0	114.9	A1214 L1216	A1214-Y1218 WeakPolarHBondContact O-CD2 3.47Å; A1214-Y1218 PolarHBondContact O-N 3.46Å; L1216-Y1218 PolarHBondContact O-N 2.89Å
1219	M	41.6	Very low	36.5	Very low	110 Å²	110	113.1 Å²	113.1	54%	0.542	60%	0.6	S	S	.	*	H	α-helix	trans	-89.1	-17.9	171.3	-69.8	-178.4	-157.7	0	0	113.1	T1215 L1216 Y1217	T1215-M1219 HydrophobicContact CG2-CE 4.09Å; T1215-M1219 WeakPolarHBondContact O-CG 3.27Å; T1215-M1219 PolarHBondContact O-N 2.68Å; L1216-M1219 CarbonylContact O-C 3.54Å; L1216-M1219 WeakPolarHBondContact O-CA 3.28Å; L1216-M1219 PolarHBondContact O-N 2.83Å; Y1217-M1219 PolarHBondContact O-N 3.37Å
1220	L	39.4	Very low	35.9	Very low	87 Å²	87	112.5 Å²	112.5	46%	0.455	61%	0.605	S	S	.	*	H	α-helix	trans	-91.4	-35.9	-178.7	-76.2	160.5	0	0	0	112.7	L927 L1216 Y1217 G1222	L927-L1220 HydrophobicContact CD2-CD2 3.5Å; L927-L1220 VanDerWaalsContact CD2-CD2 3.5Å; L927-L1220 HydrophobicContact CD2-CG 4.03Å; L927-L1220 HydrophobicContact CG-CD2 4.35Å; L1216-L1220 HydrophobicContact CD2-CD1 4.31Å; L1216-L1220 HydrophobicContact CG-CD1 4.23Å; L1216-L1220 WeakPolarHBondContact O-CG 3.49Å; L1216-L1220 PolarHBondContact O-N 3.38Å; Y1217-L1220 PolarHBondContact O-N 3.31Å; L1220-G1222 VanDerWaalsContact C-N 3.29Å; L1220-G1222 PolarHBondContact O-N 2.96Å
1221	E	40.8	Very low	35.3	Very low	118 Å²	118	117.1 Å²	117.1	55%	0.551	63%	0.625	S	S	*	*	S	Bend	trans	-83.6	9.6	-180	-72.2	-161.8	151.7	0	0	115.2	Y1217 R1223	Y1217-E1221 HydrophobicContact CD1-CG 4.33Å; Y1217-E1221 HydrophobicContact CE1-CG 3.89Å; Y1217-E1221 WeakPolarHBondContact CE1-OE1 3.42Å; Y1217-E1221 WeakPolarHBondContact CE1-OE2 3.16Å; Y1217-E1221 VanDerWaalsContact CZ-OE1 3.23Å; Y1217-E1221 PolarHBondContact O-N 2.93Å; Y1217-E1221 PolarHBondContact OH-OE1 3.24Å; E1221-R1223 VanDerWaalsContact C-N 3.32Å; E1221-R1223 PolarHBondContact O-N 2.86Å
1222	G	32.2	Very low	34.8	Very low	71 Å²	71	115.4 Å²	115.4	73%	0.732	63%	0.625	S	S	*	*			trans	-68.3	70.6	-171.1	0	0	0	0	0	116	L1220	L1220-G1222 VanDerWaalsContact C-N 3.29Å; L1220-G1222 PolarHBondContact O-N 2.96Å
1223	R	32.6	Very low	34.2	Very low	239 Å²	239	113.8 Å²	113.8	90%	0.902	63%	0.63	S	S	*	*			trans	-60	152.9	175.9	-79.3	-176.8	172.1	167.4	-0.1	113.6	E1221	E1221-R1223 VanDerWaalsContact C-N 3.32Å; E1221-R1223 PolarHBondContact O-N 2.86Å
1224	D	28.3	Very low	33	Very low	153 Å²	153	118.9 Å²	118.9	82%	0.818	66%	0.655	S	S	*	*			trans	-49.4	137	178.9	-63.2	-85.7	0	0	0	115
1225	N	30.3	Very low	32.4	Very low	156 Å²	156	125.5 Å²	125.5	83%	0.834	68%	0.678	S	S	*	*			trans	-154.3	109	143.4	-108.6	-54.8	0	0	0	113.6
1226	S	29.1	Very low	31.5	Very low	95 Å²	95	128.8 Å²	128.8	66%	0.664	70%	0.699	S	S	*	*			trans	53	92.3	147.4	59.4	0	0	0	0	122
1227	S	26.6	Very low	30.8	Very low	102 Å²	102	131 Å²	131	71%	0.713	72%	0.717	S	S	*	*				85.5	146.9	118.9	82.6	0	0	0	0	122.2
1228	K	27.8	Very low	30.2	Very low	194 Å²	194	133 Å²	133	84%	0.843	74%	0.738	S	S	*	*			trans	64.1	101.6	163.5	-60.1	177.5	-176.9	175.3	0	118.1
1229	V	30	Very low	29.6	Very low	148 Å²	148	130.1 Å²	130.1	90%	0.897	73%	0.726	S	S	*	*				-167.6	159.6	101.6	145.8	0	0	0	0	109.4
1230	S	27.1	Very low	28.9	Very low	95 Å²	95	136.4 Å²	136.4	66%	0.664	74%	0.744	S	S	*	*			trans	-91.9	143	-164.5	52.7	0	0	0	0	115.9
1231	T	25.2	Very low	28.4	Very low	140 Å²	140	139.2 Å²	139.2	86%	0.859	76%	0.758	S	S	*	*			trans	19.1	117.6	145.3	57.1	0	0	0	0	119.5
1232	G	26.4	Very low	27.8	Very low	73 Å²	73	138.4 Å²	138.4	75%	0.753	76%	0.757	S	S	*	*			trans	-175.1	119.3	164.2	0	0	0	0	0	114.2
1233	D	27.2	Very low	27.8	Very low	148 Å²	148	138.4 Å²	138.4	79%	0.791	76%	0.756	S	S	*	*			trans	36.1	109.5	158.1	-57.6	-26.4	0	0	0	123.1
1234	Q	23.8	Very low	27.6	Very low	162 Å²	162	134 Å²	134	76%	0.757	75%	0.751	S	S	*	*				40.8	132.4	122.5	-58.3	-171.9	7.9	0	0	122.2
1235	H	25.6	Very low	27.6	Very low	184 Å²	184	131.8 Å²	131.8	85%	0.852	74%	0.738	S	S	*	*			trans	48.9	73.2	150.1	-71.5	-71	0	0	0	119
1236	T	26.5	Very low	27.7	Very low	140 Å²	140	131.6 Å²	131.6	86%	0.859	73%	0.73	S	S	*	*			trans	-132	147.8	160	55.1	0	0	0	0	113.4
1237	S	25.4	Very low	27.6	Very low	81 Å²	81	132.3 Å²	132.3	57%	0.566	74%	0.735	S	S	*	*			trans	-82.3	145.2	-173.9	64.1	0	0	0	0	113.2	R1239	S1237-R1239 PolarHBondContact O-N 3.04Å
1238	P	27.8	Very low	27.5	Very low	110 Å²	110	131 Å²	131	71%	0.714	74%	0.738	S	S	*	*			trans	-75.5	55	178.9	32.6	-37.1	0	0	0	114.2	R1240	P1238-R1240 PolarHBondContact O-N 3.17Å
1239	R	28.2	Very low	27.5	Very low	127 Å²	127	132.2 Å²	132.2	48%	0.479	74%	0.737	S	S	.	*			trans	-87.1	92.7	173	-84.4	179.7	155.4	170.8	-3.5	111.1	W846 S1237	W846-R1239 PolarHBondContact O-NH2 3.43Å; S1237-R1239 PolarHBondContact O-N 3.04Å
1240	R	26.9	Very low	27.4	Very low	242 Å²	242	136.9 Å²	136.9	91%	0.913	74%	0.738	S	S	*	*	S	Bend	trans	-167.7	-16.4	152.7	-114.3	162.1	-167.7	-173.9	3.3	119.7	P1238	P1238-R1240 PolarHBondContact O-N 3.17Å
1241	I	28	Very low	27.2	Very low	145 Å²	145	143.8 Å²	143.8	74%	0.744	75%	0.75	S	S	*	*	S	Bend	trans	-94.3	-28.9	-164.4	-62.2	176.9	0	0	0	115	G1243	I1241-G1243 PolarHBondContact O-N 2.83Å
1242	L	29.8	Very low	27.3	Very low	102 Å²	102	145.5 Å²	145.5	53%	0.534	75%	0.753	S	S	.	*	G	3₁₀ helix	trans	-64.8	-10	-174.7	-88.8	150	0	0	0	116.1	N1244	L1242-N1244 VanDerWaalsContact C-N 3.32Å; L1242-N1244 PolarHBondContact O-N 2.83Å
1243	G	30.2	Very low	27.3	Very low	70 Å²	70	148 Å²	148	72%	0.722	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-68.7	-19.9	-173	0	0	0	0	0	116.2	I1241	I1241-G1243 PolarHBondContact O-N 2.83Å
1244	N	29.2	Very low	27.1	Very low	148 Å²	148	152 Å²	152	79%	0.791	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-99.3	-15.4	-172.1	-71.3	-5.8	0	0	0	114.5	L1242	L1242-N1244 VanDerWaalsContact C-N 3.32Å; L1242-N1244 PolarHBondContact O-N 2.83Å
1245	L	29	Very low	27.4	Very low	105 Å²	105	149.9 Å²	149.9	55%	0.55	76%	0.76	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	-24.2	-170.2	-75.3	162.8	0	0	0	114.3	S1247	L1245-S1247 PolarHBondContact O-N 2.97Å
1246	F	32	Very low	27.5	Very low	152 Å²	152	150.6 Å²	150.6	67%	0.667	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	14.4	-176	-68.9	-77.9	0	0	0	114.8
1247	S	26.6	Very low	27.4	Very low	110 Å²	110	149.4 Å²	149.4	77%	0.769	76%	0.756	S	S	*	*			trans	-112.9	55.6	-174.1	-177.6	0	0	0	0	113.3	L1245	L1245-S1247 PolarHBondContact O-N 2.97Å
1248	G	25.6	Very low	27.5	Very low	74 Å²	74	154.9 Å²	154.9	76%	0.763	77%	0.773	S	S	*	*			trans	-133.2	27.3	-164.7	0	0	0	0	0	118.5
1249	R	27.1	Very low	27.4	Very low	220 Å²	220	160.8 Å²	160.8	83%	0.83	78%	0.781	S	S	*	*			trans	-94.7	98.6	176	-88.9	-177.6	166.8	172.8	-6.7	112.6	I786	I786-R1249 PolarHBondContact O-NH1 3.38Å
1250	R	27.3	Very low	27.5	Very low	246 Å²	246	160.8 Å²	160.8	93%	0.928	80%	0.797	S	S	*	*			trans	-99.4	139.1	151.9	-79.9	-170.3	176.2	-171.4	0.6	109.2
1251	R	23.7	Very low	27.5	Very low	240 Å²	240	155.3 Å²	155.3	91%	0.906	79%	0.791	S	S	*	*			trans	-77.5	133.8	173.1	-66.3	173.4	173.7	172.3	-6.1	109.5
1252	L	26.5	Very low	27.6	Very low	176 Å²	176	159.3 Å²	159.3	92%	0.921	80%	0.797	S	S	*	*			trans	-132.7	147.1	148.7	-79.8	175.1	0	0	0	109.2
1253	T	27.2	Very low	27.7	Very low	125 Å²	125	160.8 Å²	160.8	77%	0.767	81%	0.805	S	S	*	*			trans	-111.5	131.5	-171.4	43.3	0	0	0	0	110.9	P1255	T1253-P1255 WeakPolarHBondContact O-CD 3.39Å
1254	Y	23.7	Very low	27.8	Very low	233 Å²	233	163.4 Å²	163.4	91%	0.914	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-74.1	125.4	172	-76.2	-82.4	0	0	0	112.3
1255	P	29.9	Very low	28	Very low	118 Å²	118	162 Å²	162	77%	0.766	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-87.2	166.1	155.8	34.9	-29.7	0	0	0	111.1	T1253	T1253-P1255 WeakPolarHBondContact O-CD 3.39Å
1256	K	27.4	Very low	28.2	Very low	198 Å²	198	163 Å²	163	86%	0.861	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-88.8	154.6	-171.2	-68.6	-177.9	176	-177	0	114.5
1257	C	23.5	Very low	28	Very low	115 Å²	115	160.7 Å²	160.7	78%	0.777	80%	0.804	S	S	*	*			trans	9.8	131.6	147.6	-46.8	0	0	0	0	119.9
1258	Q	29	Very low	28.3	Very low	196 Å²	196	163.3 Å²	163.3	92%	0.916	81%	0.808	S	S	*	*				-168.9	149.1	109.2	-103.4	169.3	-2.4	0	0	111.9
1259	R	25.2	Very low	28.5	Very low	234 Å²	234	166.4 Å²	166.4	88%	0.883	81%	0.807	S	S	*	*			trans	-80.7	152.7	162.9	-71.8	179.6	174.1	170.4	-2.5	108.7
1260	P	29.5	Very low	28.8	Very low	127 Å²	127	165.9 Å²	165.9	83%	0.825	81%	0.811	S	S	*	*				-138.2	164.7	109	37.6	-27.3	0	0	0	114.1
1261	T	28.1	Very low	29	Very low	127 Å²	127	160.1 Å²	160.1	78%	0.779	80%	0.798	S	S	*	*			trans	-98.6	134.1	177.1	41.8	0	0	0	0	111.8
1262	R	30.3	Very low	29.5	Very low	230 Å²	230	157.5 Å²	157.5	87%	0.868	80%	0.797	S	S	*	*				179.5	130.4	122.6	-107.3	-179.6	165.4	168.4	-3.9	114
1263	N	30.7	Very low	29.9	Very low	132 Å²	132	154 Å²	154	71%	0.706	78%	0.783	S	S	*	*				40.8	136.5	127	-79.4	69.5	0	0	0	123.4
1264	N	33	Very low	30.2	Very low	126 Å²	126	155.4 Å²	155.4	67%	0.674	79%	0.791	S	S	*	*			trans	93.2	114.6	140	-73.2	28	0	0	0	119.9
1265	N	32.8	Very low	30.6	Very low	118 Å²	118	150 Å²	150	63%	0.631	78%	0.783	S	S	*	*				93.6	134.7	128	-78.8	56.3	0	0	0	121.3
1266	D	32.6	Very low	30.9	Very low	126 Å²	126	151.9 Å²	151.9	67%	0.674	78%	0.784	S	S	*	*			trans	57.6	90.3	140.5	-48.5	-21.1	0	0	0	117.2
1267	S	29	Very low	31.2	Very low	104 Å²	104	146.9 Å²	146.9	73%	0.727	77%	0.774	S	S	*	*				78.1	114.3	76.2	74.4	0	0	0	0	114.8
1268	L	33.2	Very low	31.7	Very low	164 Å²	164	152.1 Å²	152.1	86%	0.859	78%	0.778	S	S	*	*			trans	-176.8	98	154.8	-98.9	155.7	0	0	0	106.2
1269	L	29.6	Very low	31.9	Very low	139 Å²	139	149.8 Å²	149.8	73%	0.728	77%	0.772	S	S	*	*				50.3	106.9	89	-86.8	167.4	0	0	0	115.1
1270	F	32.5	Very low	32.5	Very low	210 Å²	210	145.9 Å²	145.9	92%	0.921	77%	0.768	S	S	*	*				-149	141.2	129.2	-112.1	-77.9	0	0	0	109.7
1271	N	31.5	Very low	32.7	Very low	124 Å²	124	143.9 Å²	143.9	66%	0.663	76%	0.757	S	S	*	*			trans	-121	149.2	-176.4	-93.9	-23.5	0	0	0	109.9
1272	E	35.4	Very low	33	Very low	186 Å²	186	146 Å²	146	87%	0.869	76%	0.756	S	S	*	*			trans	-167.2	83.3	146.5	-111.7	169.4	-147.4	0	0	108.4
1273	T	34.8	Very low	33.3	Very low	103 Å²	103	145 Å²	145	63%	0.632	75%	0.752	S	S	*	*				60.3	109.2	87.7	64.6	0	0	0	0	116.7
1274	T	33.5	Very low	33.5	Very low	153 Å²	153	144.8 Å²	144.8	94%	0.939	75%	0.751	S	S	*	*			trans	-153	145.9	131.4	-0.5	0	0	0	0	109.6
1275	T	31.7	Very low	33.7	Very low	120 Å²	120	146.5 Å²	146.5	74%	0.736	76%	0.755	S	S	*	*			trans	-134.8	153	-161.3	53	0	0	0	0	112.9
1276	I	35.8	Very low	33.8	Very low	157 Å²	157	146.2 Å²	146.2	81%	0.805	76%	0.762	S	S	*	*			trans	-179.3	110	144	-95	148.2	0	0	0	107.3
1277	S	33.9	Very low	33.8	Very low	93 Å²	93	146.1 Å²	146.1	65%	0.65	76%	0.762	S	S	*	*				64.4	131.6	94.2	123	0	0	0	0	114.1
1278	R	33.5	Very low	34.1	Very low	226 Å²	226	152.4 Å²	152.4	85%	0.853	77%	0.771	S	S	*	*			cis	-149.7	139.8	17.4	-93	155.9	176.3	173.5	-1.7	109.4
1279	N	34.3	Very low	34.3	Very low	147 Å²	147	150.3 Å²	150.3	79%	0.786	76%	0.761	S	S	*	*				62	109.3	84.8	-90.8	21.4	0	0	0	117.6
1280	N	37.2	Very low	34.6	Very low	151 Å²	151	150.8 Å²	150.8	81%	0.807	76%	0.764	S	S	*	*				158.8	135.2	127.9	-80.5	-5	0	0	0	109.6
1281	S	34	Very low	34.8	Very low	85 Å²	85	144.7 Å²	144.7	59%	0.594	75%	0.747	S	S	*	*			cis	133.3	123.3	-7.3	59.2	0	0	0	0	109.4
1282	F	34.5	Very low	34.8	Very low	173 Å²	173	147.8 Å²	147.8	76%	0.759	76%	0.755	S	S	*	*			trans	170	107.2	146.8	-94.9	-67.7	0	0	0	107.9
1283	R	35.6	Very low	34.6	Very low	207 Å²	207	145.5 Å²	145.5	78%	0.781	75%	0.748	S	S	*	*				67.6	139.2	100.9	-69.1	-163.8	-176.4	164.6	-1.9	114.9
1284	N	35.6	Very low	34.5	Very low	128 Å²	128	148.3 Å²	148.3	68%	0.684	75%	0.754	S	S	*	*			cis	-156.1	170.4	12.1	-122.3	7.4	0	0	0	114.5
1285	H	36	Very low	34.6	Very low	162 Å²	162	148.3 Å²	148.3	75%	0.75	74%	0.743	S	S	*	*			trans	-54	166.4	176.4	-56.8	-84.5	0	0	0	115.6
1286	S	35.7	Very low	34.5	Very low	112 Å²	112	148 Å²	148	78%	0.783	74%	0.741	S	S	*	*			cis	-159	153.4	38	43.4	0	0	0	0	111.7
1287	N	33.2	Very low	34.2	Very low	125 Å²	125	145.8 Å²	145.8	67%	0.668	74%	0.74	S	S	*	*			cis	80.7	102.4	43.4	-95.3	29.1	0	0	0	116.6
1288	Y	35.6	Very low	34.2	Very low	235 Å²	235	148.9 Å²	148.9	92%	0.922	74%	0.744	S	S	*	*			trans	-153.6	157.9	136.7	-116.3	-79.4	0	0	0	110.5
1289	N	36.8	Very low	34.1	Very low	120 Å²	120	146 Å²	146	64%	0.642	74%	0.74	S	S	*	*			trans	-124.7	174.4	-158.1	-77	-20	0	0	0	115.1
1290	N	35.8	Very low	33.9	Very low	150 Å²	150	147 Å²	147	80%	0.802	75%	0.745	S	S	*	*			trans	90.9	146.4	152.4	-64.3	-20.9	0	0	0	119.1
1291	S	35.7	Very low	33.3	Very low	81 Å²	81	144.8 Å²	144.8	57%	0.566	74%	0.739	S	S	*	*			cis	-178.7	155.8	-19.9	55.8	0	0	0	0	112.9
1292	F	32.4	Very low	33.1	Very low	189 Å²	189	147.9 Å²	147.9	83%	0.829	75%	0.749	S	S	*	*			trans	63.6	167.4	166.5	-68.5	-89.3	0	0	0	118.2
1293	L	30.9	Very low	32.9	Very low	139 Å²	139	144.1 Å²	144.1	73%	0.728	74%	0.744	S	S	*	*				178	152	-57.6	-112.8	165.9	0	0	0	110.4
1294	Q	33.5	Very low	32.7	Very low	161 Å²	161	141.5 Å²	141.5	75%	0.752	74%	0.744	S	S	*	*			trans	76.2	112.8	158.9	-63.9	-165.9	-40.4	0	0	122.5
1295	H	34	Very low	32.5	Very low	153 Å²	153	140 Å²	140	71%	0.708	74%	0.744	S	S	*	*				77.8	98.9	125.1	-81.1	-74	0	0	0	124.7
1296	T	30.2	Very low	32.1	Very low	114 Å²	114	139.6 Å²	139.6	70%	0.699	75%	0.747	S	S	*	*				55.3	114.3	121.8	55.4	0	0	0	0	121.7
1297	S	30.3	Very low	31.9	Very low	110 Å²	110	146.2 Å²	146.2	77%	0.769	76%	0.755	S	S	*	*				148.2	149.1	98.8	61.4	0	0	0	0	116.5
1298	Q	33.1	Very low	31.7	Very low	159 Å²	159	145.8 Å²	145.8	74%	0.743	76%	0.757	S	S	*	*			trans	67	105.3	155.2	-70.8	-176.9	-17	0	0	123.2
1299	H	30.7	Very low	31.4	Very low	165 Å²	165	140.8 Å²	140.8	76%	0.764	76%	0.755	S	S	*	*				76.6	151.9	127.2	-69.8	-53.6	0	0	0	124.2
1300	L	31	Very low	31.1	Very low	169 Å²	169	141 Å²	141	89%	0.885	76%	0.755	S	S	*	*			trans	89.6	120.8	156.2	-77.2	155.5	0	0	0	120.2
1301	C	24.9	Very low	30.8	Very low	103 Å²	103	144 Å²	144	70%	0.696	76%	0.761	S	S	*	*			trans	-58.9	146.9	-178.4	-44.5	0	0	0	0	114.6
1302	N	30.2	Very low	30.7	Very low	150 Å²	150	145.2 Å²	145.2	80%	0.802	77%	0.765	S	S	*	*				177.1	156	101.3	-93.9	-44.2	0	0	0	115.4
1303	S	30.5	Very low	30.8	Very low	94 Å²	94	142.8 Å²	142.8	66%	0.657	76%	0.761	S	S	*	*			trans	61.8	121	143.6	64.2	0	0	0	0	123.3
1304	I	31.3	Very low	31.1	Very low	152 Å²	152	139.8 Å²	139.8	78%	0.779	75%	0.75	S	S	*	*				80.2	108.7	125.2	-63	170.9	0	0	0	120.1
1305	S	30.4	Very low	31.2	Very low	96 Å²	96	143.4 Å²	143.4	67%	0.671	76%	0.758	S	S	*	*			trans	78.4	128.1	142.6	76.9	0	0	0	0	122.6
1306	N	28	Very low	31.3	Very low	154 Å²	154	143.2 Å²	143.2	82%	0.824	76%	0.758	S	S	*	*			trans	33	119.5	135.1	-58.4	-1.3	0	0	0	120.4
1307	R	31.1	Very low	31.5	Very low	252 Å²	252	144.4 Å²	144.4	95%	0.951	76%	0.755	S	S	*	*				-155.8	161.7	120.9	-111	164.1	-164	-143.3	0.8	112.6
1308	T	28.6	Very low	31.7	Very low	116 Å²	116	147.2 Å²	147.2	71%	0.712	76%	0.756	S	S	*	*			trans	-122.9	151.6	-167.3	42.3	0	0	0	0	112.5
1309	C	29.4	Very low	31.5	Very low	130 Å²	130	148.2 Å²	148.2	88%	0.878	76%	0.761	S	S	*	*			trans	-125.3	102.9	155.5	-62.1	0	0	0	0	105.8
1310	I	30.7	Very low	31.8	Very low	124 Å²	124	144.8 Å²	144.8	64%	0.636	75%	0.753	S	S	*	*				69.7	98.1	70	-59.1	169.1	0	0	0	111.5
1311	F	28.9	Very low	31.7	Very low	212 Å²	212	144.4 Å²	144.4	93%	0.93	75%	0.751	S	S	*	*			trans	-134.2	121.8	135.4	-109	-83.9	0	0	0	107.2
1312	T	34.9	Very low	32	Very low	107 Å²	107	147.7 Å²	147.7	66%	0.656	76%	0.761	S	S	*	*			trans	-104	178.5	172.3	56.3	0	0	0	0	107.6
1313	D	33.6	Very low	31.8	Very low	138 Å²	138	145 Å²	145	74%	0.738	75%	0.753	S	S	*	*			cis	-159.2	-161.7	15.5	-150.9	28.2	0	0	0	110
1314	P	38.1	Very low	32	Very low	76 Å²	76	147.7 Å²	147.7	49%	0.494	76%	0.761	S	S	.	*				-119.8	-177.6	-100.4	41.1	-26.1	0	0	0	114.7
1315	Y	35.2	Very low	31.9	Very low	237 Å²	237	148.2 Å²	148.2	93%	0.929	76%	0.76	S	S	*	*			trans	-149.9	132.9	132.9	-114	-77.4	0	0	0	111.5
1316	H	36.1	Very low	32	Very low	150 Å²	150	153.9 Å²	153.9	69%	0.694	77%	0.773	S	S	*	*			trans	-80.9	174.6	173.7	-75.2	-96.3	0	0	0	110.6
1317	Q	34.1	Very low	31.9	Very low	138 Å²	138	150.8 Å²	150.8	65%	0.645	76%	0.763	S	S	*	*			cis	-163.8	155.2	19	-145.4	154.6	-32.9	0	0	113.6
1318	E	34.2	Very low	31.8	Very low	170 Å²	170	145.6 Å²	145.6	79%	0.794	75%	0.754	S	S	*	*			trans	67.4	148.8	145.3	-89.1	152.2	-136.1	0	0	125.6
1319	E	30.6	Very low	31.9	Very low	180 Å²	180	147.7 Å²	147.7	84%	0.841	76%	0.761	S	S	*	*			trans	-113.2	-169.7	-167.2	-104.9	-162.4	142.5	0	0	110
1320	P	36.1	Very low	31.8	Very low	93 Å²	93	153 Å²	153	60%	0.604	76%	0.762	S	S	*	*			cis	-142.2	-161.8	-42.6	41.4	-23.3	0	0	0	113.4
1321	L	27.9	Very low	31.8	Very low	160 Å²	160	150.7 Å²	150.7	84%	0.838	77%	0.77	S	S	*	*			trans	60.1	111.3	150.1	-71.1	174.3	0	0	0	121.1
1322	L	31.1	Very low	31.7	Very low	173 Å²	173	149.8 Å²	149.8	91%	0.906	77%	0.768	S	S	*	*				-159	144.8	127.3	-117.8	161.2	0	0	0	111.9
1323	S	27.3	Very low	31.5	Very low	92 Å²	92	149 Å²	149	64%	0.643	77%	0.772	S	S	*	*			trans	-106.4	146.9	-178	56.8	0	0	0	0	112.3
1324	N	33.4	Very low	31.2	Very low	151 Å²	151	148.3 Å²	148.3	81%	0.807	77%	0.773	S	S	*	*			trans	-165.7	160.5	134.9	-108.3	-40.5	0	0	0	115.4
1325	H	30.3	Very low	30.7	Very low	164 Å²	164	155 Å²	155	76%	0.759	79%	0.789	S	S	*	*			trans	-62.5	156	178.3	-60.8	-102.2	0	0	0	113.9
1326	F	31.5	Very low	30.3	Very low	215 Å²	215	154.2 Å²	154.2	94%	0.943	79%	0.785	S	S	*	*				-159.7	157.3	109.9	-110.5	-73	0	0	0	112.1
1327	S	27.4	Very low	30	Very low	88 Å²	88	155 Å²	155	62%	0.615	79%	0.793	S	S	*	*			trans	-121.2	154.6	-171.1	61.8	0	0	0	0	113.2
1328	N	27.7	Very low	29.6	Very low	143 Å²	143	156.3 Å²	156.3	77%	0.765	80%	0.804	S	S	*	*			trans	60.7	119.9	160.3	-62.8	-30.5	0	0	0	117.9
1329	N	31.5	Very low	29.4	Very low	161 Å²	161	154 Å²	154	86%	0.861	81%	0.806	S	S	*	*				-161	169.7	98.7	-115.8	-53.9	0	0	0	115.5
1330	R	27.4	Very low	29.3	Very low	240 Å²	240	154.6 Å²	154.6	91%	0.906	81%	0.806	S	S	*	*			trans	-77.4	150.2	-179.1	-60.5	167.5	174.5	163.8	-4	112
1331	G	30	Very low	29	Very low	77 Å²	77	158.2 Å²	158.2	79%	0.794	82%	0.815	S	S	*	*			trans	-154.8	104.8	166.8	0	0	0	0	0	112.3
1332	H	26.9	Very low	29	Very low	192 Å²	192	158.6 Å²	158.6	89%	0.889	81%	0.812	S	S	*	*			trans	-77.4	130.8	167.9	-83.2	-93.2	0	0	0	109.8
1333	A	31.4	Very low	28.8	Very low	91 Å²	91	155.2 Å²	155.2	75%	0.752	80%	0.803	S	S	*	*			trans	-134.9	117.8	163.4	0	0	0	0	0	109.3
1334	V	26.4	Very low	28.9	Very low	123 Å²	123	157.7 Å²	157.7	75%	0.745	81%	0.814	S	S	*	*			trans	-94.7	121.9	178.9	174	0	0	0	0	109.1
1335	Y	29.5	Very low	28.7	Very low	216 Å²	216	158.5 Å²	158.5	85%	0.847	81%	0.813	S	S	*	*			trans	-118.4	98.5	162.6	-92.2	-83.5	0	0	0	110.8
1336	R	25.8	Very low	28.5	Very low	221 Å²	221	160.7 Å²	160.7	83%	0.834	82%	0.821	S	S	*	*			trans	-78.6	125.4	158.1	-86.3	-179.7	168.4	172.4	-3.5	108.2
1337	L	29.3	Very low	28.3	Very low	167 Å²	167	158.1 Å²	158.1	87%	0.874	82%	0.816	S	S	*	*			trans	-130.6	126.6	153.6	-99.2	167.6	0	0	0	108.9
1338	L	26.3	Very low	28.4	Very low	165 Å²	165	158 Å²	158	86%	0.864	82%	0.815	S	S	*	*			trans	-103	122.6	179.5	-83.2	154.9	0	0	0	109
1339	S	29.9	Very low	28.3	Very low	121 Å²	121	161.8 Å²	161.8	85%	0.846	83%	0.825	S	S	*	*			trans	-141	149	149.5	63.3	0	0	0	0	109.1
1340	K	27.6	Very low	28.2	Very low	194 Å²	194	162.8 Å²	162.8	84%	0.843	83%	0.825	S	S	*	*			trans	-92.8	144.7	-173.7	-59.4	165.7	179.6	173.9	0	109.1
1341	H	30	Very low	28.2	Very low	168 Å²	168	156.2 Å²	156.2	78%	0.778	82%	0.816	S	S	*	*				-165.7	120.9	115.7	-106.8	-77.7	0	0	0	112
1342	Q	28.3	Very low	28.4	Very low	168 Å²	168	160.7 Å²	160.7	79%	0.785	82%	0.82	S	S	*	*			trans	33.5	91.5	155.3	-70.5	157.9	-68.6	0	0	119.1
1343	S	26.5	Very low	28.7	Very low	102 Å²	102	157.7 Å²	157.7	71%	0.713	81%	0.81	S	S	*	*			trans	-72.5	145.6	140.6	49.1	0	0	0	0	110.5
1344	V	29.2	Very low	28.8	Very low	145 Å²	145	159.7 Å²	159.7	88%	0.879	81%	0.808	S	S	*	*			trans	-117.2	128.6	156.9	175.5	0	0	0	0	106.4
1345	E	29.9	Very low	29.3	Very low	168 Å²	168	161.6 Å²	161.6	79%	0.785	81%	0.809	S	S	*	*			trans	-97.2	168.3	-167	-66.7	177.5	112.8	0	0	113.6	L1347	E1345-L1347 PolarHBondContact O-N 3.11Å
1346	F	26.5	Very low	29.7	Very low	210 Å²	210	157.1 Å²	157.1	92%	0.921	80%	0.799	S	S	*	*			trans	-59.8	126.3	167.9	-78.7	-116.3	0	0	0	111.8
1347	L	27.8	Very low	30.2	Very low	160 Å²	160	152.3 Å²	152.3	84%	0.838	79%	0.79	S	S	*	*			trans	-144.3	103.1	153.5	-80	-178.8	0	0	0	107.4	E1345	E1345-L1347 PolarHBondContact O-N 3.11Å
1348	S	27.8	Very low	30.5	Very low	86 Å²	86	150.4 Å²	150.4	60%	0.601	78%	0.781	S	S	*	*				88.1	104.8	80.2	71.8	0	0	0	0	113	Q1350	S1348-Q1350 PolarHBondContact O-N 2.61Å
1349	F	25.9	Very low	31	Very low	223 Å²	223	149.8 Å²	149.8	98%	0.978	78%	0.778	S	S	*	*			trans	-66.6	113.3	165	-97.3	-100.4	0	0	0	109.6
1350	Q	30.7	Very low	31.1	Very low	181 Å²	181	154.2 Å²	154.2	85%	0.846	78%	0.777	S	S	*	*			trans	-137.3	137.2	164.6	-78.9	-165.3	-20.8	0	0	111.1	S1348	S1348-Q1350 PolarHBondContact O-N 2.61Å
1351	S	27.5	Very low	31.4	Very low	103 Å²	103	151.5 Å²	151.5	72%	0.72	77%	0.765	S	S	*	*			trans	-82.9	142	177.2	55.4	0	0	0	0	112.2
1352	I	34.3	Very low	31.7	Very low	171 Å²	171	150.9 Å²	150.9	88%	0.877	76%	0.757	S	S	*	*			trans	-122.6	144.7	161.7	-63.8	-176.9	0	0	0	108.8
1353	N	32.5	Very low	32	Very low	129 Å²	129	151 Å²	151	69%	0.69	76%	0.755	S	S	*	*			trans	-104.9	168.2	-159.5	-84.4	-50	0	0	0	115.2
1354	N	33.1	Very low	32.3	Very low	133 Å²	133	151.9 Å²	151.9	71%	0.711	76%	0.756	S	S	*	*			trans	65.7	117.7	156.9	-60.6	-22.3	0	0	0	116.9
1355	H	37.5	Very low	32.6	Very low	163 Å²	163	148.4 Å²	148.4	76%	0.755	75%	0.75	S	S	*	*				-160.6	162.8	61.1	-82.9	-79.4	0	0	0	109.9
1356	N	37.9	Very low	32.9	Very low	121 Å²	121	147.6 Å²	147.6	65%	0.647	75%	0.751	S	S	*	*			cis	-155.3	142.8	4.5	-122.4	-14	0	0	0	112
1357	N	35.2	Very low	33.1	Very low	120 Å²	120	144.9 Å²	144.9	64%	0.642	74%	0.741	S	S	*	*			trans	49.3	118.3	148.1	-70.1	-23.5	0	0	0	124.1
1358	N	35.7	Very low	33.3	Very low	128 Å²	128	145 Å²	145	68%	0.684	74%	0.739	S	S	*	*				66.2	127.3	126.8	-54.9	-24	0	0	0	119.8
1359	N	37.4	Very low	33.5	Very low	151 Å²	151	146.7 Å²	146.7	81%	0.807	74%	0.738	S	S	*	*			cis	-150.4	139.2	33.7	-100.8	-38.8	0	0	0	116.9
1360	R	32.6	Very low	33.8	Very low	215 Å²	215	145.1 Å²	145.1	81%	0.811	73%	0.726	S	S	*	*			trans	-51.2	177.4	156.9	-78.2	164.4	160.1	174.9	-5.2	114.3
1361	K	32.8	Very low	34	Very low	137 Å²	137	142.1 Å²	142.1	60%	0.596	72%	0.723	S	S	*	*			cis	-164.5	174.3	15	-130.3	166	173.6	-162.6	0	107
1362	Y	36.5	Very low	34	Very low	154 Å²	154	143.8 Å²	143.8	60%	0.604	73%	0.729	S	S	*	*			cis	-126.9	-146.1	-2.4	-84.4	-83.3	0	0	0	107.1
1363	F	35.3	Very low	33.8	Very low	170 Å²	170	147.1 Å²	147.1	75%	0.746	75%	0.747	S	S	*	*			cis	-146	113.6	-3.7	-87.4	-65.3	0	0	0	106.5
1364	T	33.2	Very low	33.9	Very low	122 Å²	122	148 Å²	148	75%	0.748	75%	0.75	S	S	*	*				71.6	122.5	87.2	61.9	0	0	0	0	117
1365	G	34.6	Very low	33.9	Very low	71 Å²	71	148.8 Å²	148.8	73%	0.732	75%	0.752	S	S	*	*			trans	-170.2	20.3	179.5	0	0	0	0	0	119.6
1366	N	36.3	Very low	33.7	Very low	152 Å²	152	148 Å²	148	81%	0.813	75%	0.752	S	S	*	*			trans	61.9	163.1	165.9	-57.4	-0.6	0	0	0	120
1367	Q	30.1	Very low	33.5	Very low	152 Å²	152	149.6 Å²	149.6	71%	0.71	76%	0.758	S	S	*	*				-163.2	173.5	-52.7	-145.8	179.8	-26.5	0	0	110.3
1368	M	32.9	Very low	33.4	Very low	164 Å²	164	151.4 Å²	151.4	81%	0.808	77%	0.765	S	S	*	*			trans	73.8	118.3	179.1	-58.1	179.2	172.3	0	0	114.6
1369	E	32	Very low	33.2	Very low	121 Å²	121	153 Å²	153	57%	0.565	77%	0.77	S	S	*	*			cis	73.2	133.8	39.3	-54	178.5	113.9	0	0	112.6
1370	Y	32.7	Very low	32.9	Very low	189 Å²	189	153.1 Å²	153.1	74%	0.741	77%	0.768	S	S	*	*			cis	-148.5	-170.5	11.8	-78.5	-68.9	0	0	0	109.5
1371	P	33.5	Very low	32.9	Very low	119 Å²	119	148.4 Å²	148.4	77%	0.773	76%	0.764	S	S	*	*				-124.2	-170.9	-55.3	37.9	-22.2	0	0	0	112.2
1372	T	28.5	Very low	32.9	Very low	137 Å²	137	149.3 Å²	149.3	84%	0.84	78%	0.779	S	S	*	*			trans	-68.5	147.2	178.4	48	0	0	0	0	116.1
1373	L	29.8	Very low	32.6	Very low	241 Å²	241	148.9 Å²	148.9	100%	1.262	79%	0.794	S	S	*	*			trans	-143.4	0	138.7	-142.7	175.2	0	0	0	108

Retrieved 1,373 of 1,373 residues in 1476.9 ms (Link to these results)

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