A0A060VP09_ONCMY Loading...

Leucine-rich repeats and immunoglobulin-like domains 2

AlphaFold DB , UniProt , Accession A0A060VP09, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene lrig2, Length 1,073 aa.

						>A0A060VP09_ONCMY|A0A060VP09|lrig2
MAEAWPRPPALFLLLSLSACWEVDSCPAPCSCMRGSDEIQILDCNRKRLSSAPLDPPHGITHLTMNHNDLTTVPYLGEVTSNITTLLLVHNLISELWMHQLQLYISLETLDLSSNSISEIKAGAFPPMQLKYLNLSNNKISVLEPGCFDNISSSLLVLKLNRNRITLLPCKVFRLPQLQFLELKRNKIKIVDSLTFKGMDLLKSLKMQRNGITKLMDGAFFGLNNMEELELEHNNLTEVNKGWLYGLHMLRVLRFSQNAIGIIRPDAWEFCQKLEELDLSFNHLTRLEETAFSGLGLLENLNLGDNSVSHLGEGVFSSLANLRSLDIRDNEISWAIEDSIGVFVGMKKLNTLILQQNKIKSITKKAFEGLEALEHLDLSKNGIMSIHPDSLSHMKLKVFVLNTSSLLCDCQLQWLGPWLTDNHFLQSVSVMCAHPASLLGRNVVSVSLEELVCDDFPKPRITEHPETATALRGTNVTLSCLASSSSDSPMTTAWRKDGEVLYDAEVQNYARYQEGELVYTTVLHLLNVNFTDEGRYQCVVSNHFGANYSNRAKLTVNELPSFLKTPMDLTIRTGTMARLECAAEGHPSPQIAWQKDGGTDFPAARERRMHVMPDDDIFFIANVKTEDMGVYSCTAQNVAGSLSANATLTVLETPSLMRPMEDRTVARGETAVLQCIAGGSPAPRLNWTKDDGPLVLTERHFFAAANQLLIIVDTGPADTGKYTCIMSNTLGTERGHIYLSVSPSPNCDTAGGYDQDGWTTVGIVVIVVVCCVVGTSLVWVIVIYHMRRKSEDYSITNTDELNLPADIPSYLSSQRTLSEPQEGYSNSEAGSHQQLMPPLSNGYVHKGTDGVCYGDTGSEVDTEANGMLHCRVGSLFTGRSSFHPGEPREGLAGVPTGGAGPLVICSDCYDNANIYSRTREYCPYAYLAEDDSLDKSLSGIMAHFPKESYREQHTQHEDTALESLINNQDSSVFLTSHDLTKRLSTALSPPEQHYSTDVPSRLFWGKGEDLSTVPQPGLSQQPVNVHKTPLVSSVGMGGEERSGKGDASLSQSTQDHISASYRTKPQEHTHSPT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.6	Very low	30.6	Very low	235 Å²	235	147.7 Å²	147.7	100%	1.158	82%	0.818	S	S	*	*				0	90.3	0	-66.5	152.8	165.6	0	0	106.3
2	A	29	Very low	30.6	Very low	92 Å²	92	151.3 Å²	151.3	76%	0.76	82%	0.819	S	S	*	*			cis	59.9	93.1	17.6	0	0	0	0	0	113.7
3	E	27.8	Very low	30.5	Very low	174 Å²	174	149.4 Å²	149.4	81%	0.813	81%	0.807	S	S	*	*				-150	143.7	116.4	-108.5	-179.6	168.1	0	0	109.5
4	A	35.8	Very low	30.5	Very low	97 Å²	97	151.6 Å²	151.6	80%	0.802	82%	0.817	S	S	*	*			trans	-131.1	128.3	177.3	0	0	0	0	0	108.3
5	W	28.4	Very low	30.5	Very low	211 Å²	211	149.7 Å²	149.7	80%	0.799	81%	0.805	S	S	*	*			trans	-129	152.7	-171.6	-92.2	77.2	0	0	0	109.9
6	P	34.4	Very low	31.3	Very low	99 Å²	99	147.2 Å²	147.2	64%	0.643	80%	0.803	S	S	*	*				-128.3	174.9	-97.4	24.5	-3.7	0	0	0	114.3
7	R	29.7	Very low	31.5	Very low	230 Å²	230	146.7 Å²	146.7	87%	0.868	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-59.7	135.7	162.5	-63.1	175.5	179.6	168.1	-0.9	109.3	P9	R7-P9 WeakPolarHBondContact O-CD 3.19Å
8	P	29.6	Very low	32	Very low	121 Å²	121	145.5 Å²	145.5	79%	0.786	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67.1	123.8	171	27.4	-32.9	0	0	0	109.9
9	P	30.8	Very low	32.2	Very low	106 Å²	106	141.8 Å²	141.8	69%	0.688	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-74.1	126.5	169.3	30.2	-31.6	0	0	0	109.2	R7 L11	R7-P9 WeakPolarHBondContact O-CD 3.19Å; P9-L11 VanDerWaalsContact C-N 3.28Å; P9-L11 PolarHBondContact O-N 2.71Å
10	A	30.1	Very low	32.5	Very low	104 Å²	104	140.9 Å²	140.9	86%	0.86	80%	0.795	S	S	*	*			trans	-71.4	85.3	171.9	0	0	0	0	0	109.8	F12	A10-F12 PolarHBondContact O-N 3.35Å
11	L	29.8	Very low	32.7	Very low	156 Å²	156	145.5 Å²	145.5	82%	0.817	80%	0.8	S	S	*	*			trans	-78.6	64.7	-175.1	-157.3	100.4	0	0	0	112.2	P9	P9-L11 VanDerWaalsContact C-N 3.28Å; P9-L11 PolarHBondContact O-N 2.71Å
12	F	30.2	Very low	33.1	Very low	190 Å²	190	142.9 Å²	142.9	83%	0.833	79%	0.785	S	S	*	*			trans	-97.8	84.8	167.8	-102.4	-82.1	0	0	0	111.3	A10 L14	A10-F12 PolarHBondContact O-N 3.35Å; F12-L14 PolarHBondContact O-N 3.14Å
13	L	29.6	Very low	33.9	Very low	127 Å²	127	141.2 Å²	141.2	67%	0.665	77%	0.766	S	S	*	*			trans	38.8	73.2	147.9	-66.7	163.8	0	0	0	116.9	L15	L13-L15 HydrophobicContact CD2-CD1 4.02Å; L13-L15 HydrophobicContact CD2-CG 4.02Å; L13-L15 PolarHBondContact O-N 3.2Å
14	L	30.4	Very low	35	Very low	181 Å²	181	141 Å²	141	95%	0.948	77%	0.77	S	S	*	*			trans	-68.1	69.2	142.7	-88.3	168.6	0	0	0	109.3	F12 S16	F12-L14 PolarHBondContact O-N 3.14Å; L14-S16 PolarHBondContact O-N 2.9Å; L14-S16 VanDerWaalsContact O-N 3.12Å
15	L	31	Very low	36.1	Very low	122 Å²	122	140.2 Å²	140.2	64%	0.639	76%	0.759	S	S	*	*			trans	-74.9	96.2	164.5	-102.7	174.4	0	0	0	108.2	L13 L17	L13-L15 HydrophobicContact CD2-CD1 4.02Å; L13-L15 HydrophobicContact CD2-CG 4.02Å; L13-L15 PolarHBondContact O-N 3.2Å; L15-L17 PolarHBondContact O-N 3.3Å
16	S	42.6	Very low	38.3	Very low	110 Å²	110	131.9 Å²	131.9	77%	0.769	73%	0.732	S	S	*	*			trans	-69.6	74	170.6	60.2	0	0	0	0	110.9	L14 S18	L14-S16 PolarHBondContact O-N 2.9Å; L14-S16 VanDerWaalsContact O-N 3.12Å; S16-S18 PolarHBondContact O-N 3.29Å
17	L	34.1	Very low	40.4	Very low	139 Å²	139	128 Å²	128	73%	0.728	71%	0.707	S	S	*	*			trans	-93.4	84.2	165.3	-81	169.9	0	0	0	109	L15 A19	L15-L17 PolarHBondContact O-N 3.3Å; L17-A19 PolarHBondContact O-N 3.25Å
18	S	41	Very low	42.7	Very low	125 Å²	125	121.5 Å²	121.5	87%	0.874	70%	0.702	S	S	*	*			trans	-69.1	73.9	173.2	55	0	0	0	0	110.9	S16	S16-S18 PolarHBondContact O-N 3.29Å
19	A	36.2	Very low	45.2	Very low	75 Å²	75	118.8 Å²	118.8	62%	0.62	69%	0.685	S	S	*	*			trans	-153.8	38.1	177.9	0	0	0	0	0	112.3	L17 W21	L17-A19 PolarHBondContact O-N 3.25Å; A19-W21 PolarHBondContact O-N 3.18Å
20	C	37.2	Very low	47.9	Very low	124 Å²	124	114.3 Å²	114.3	84%	0.838	66%	0.656	S	S	*	*			trans	-62.7	107.6	159.4	-68.1	0	0	0	0	107.8	E22	C20-E22 PolarHBondContact O-N 2.68Å
21	W	37.1	Very low	50.6	Low	237 Å²	237	112.2 Å²	112.2	90%	0.898	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-64.9	120.7	152.4	-74.2	22.2	0	0	0	105.8	A19 V23	A19-W21 PolarHBondContact O-N 3.18Å; W21-V23 PolarHBondContact O-N 3.27Å; W21-V23 VanDerWaalsContact O-N 3.1Å
22	E	40.1	Very low	53.2	Low	180 Å²	180	106.3 Å²	106.3	84%	0.841	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-59.2	116.9	168.7	-70.7	178.5	119.1	0	0	107.3	C20	C20-E22 PolarHBondContact O-N 2.68Å
23	V	47.1	Very low	55.5	Low	58 Å²	58	101.7 Å²	101.7	35%	0.352	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-83	118.4	169.4	-177.3	0	0	0	0	105.5	W21 S25 C26 I39	W21-V23 PolarHBondContact O-N 3.27Å; W21-V23 VanDerWaalsContact O-N 3.1Å; V23-S25 PolarHBondContact O-N 2.94Å; V23-C26 PolarHBondContact O-N 3.45Å; V23-C26 VanDerWaalsContact O-N 3.14Å; V23-I39 HydrophobicContact CG1-CD1 4.33Å
24	D	49.7	Very low	57.3	Low	170 Å²	170	103.6 Å²	103.6	91%	0.909	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	16.6	-177.6	-62	-61.3	0	0	0	115
25	S	60.1	Low	58.9	Low	80 Å²	80	96.8 Å²	96.8	56%	0.559	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.8	5.8	-174.2	-29.5	0	0	0	0	112.9	V23	V23-S25 PolarHBondContact O-N 2.94Å
26	C	73.6	Confident	59.7	Low	36 Å²	36	96.1 Å²	96.1	24%	0.243	57%	0.566	C	S	.	*	S	Bend	trans	-87.2	125.5	175.1	-166.8	0	0	0	0	111	V23 A28 C32	V23-C26 PolarHBondContact O-N 3.45Å; V23-C26 VanDerWaalsContact O-N 3.14Å; C26-A28 PolarHBondContact O-N 3.1Å; C26-C32 VanDerWaalsContact CA-SG 3.58Å; C26-C32 HydrophobicContact CB-CB 3.86Å; C26-C32 WeakPolarHBondContact CB-SG 3.02Å; C26-C32 WeakPolarHBondContact SG-CB 3.24Å; C26-C32 PolarHBondContact SG-N 3.36Å; C26-C32 CovalentContact SG-SG 2.04Å; C26-C32 PolarHBondContact SG-SG 3.44Å
27	P	79	Confident	60	Low	17 Å²	17	96.8 Å²	96.8	11%	0.11	56%	0.561	C	S	.	*			trans	-73.9	113.7	-172.9	27.7	-35.8	0	0	0	111.8	C30 L42 P53 L54	P27-C30 WeakPolarHBondContact O-CA 3.4Å; P27-C30 VanDerWaalsContact O-CB 3.24Å; P27-C30 WeakPolarHBondContact O-CB 3.27Å; P27-C30 PolarHBondContact O-N 3.02Å; P27-L42 HydrophobicContact CG-CD1 4.38Å; P27-P53 HydrophobicContact CB-CB 4.1Å; P27-P53 HydrophobicContact CG-CB 4.02Å; P27-L54 WeakPolarHBondContact CB-O 3.32Å
28	A	77.1	Confident	61.3	Low	93 Å²	93	96.1 Å²	96.1	77%	0.769	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	139.3	171.9	0	0	0	0	0	110.6	C26	C26-A28 PolarHBondContact O-N 3.1Å
29	P	83.5	Confident	62.3	Low	64 Å²	64	91.2 Å²	91.2	42%	0.416	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	cis	-94.6	15.8	9.8	39.8	-39.2	0	0	0	114.5	K47 L49	P29-K47 HydrophobicContact CB-CD 4.24Å; P29-K47 HydrophobicContact CG-CB 3.84Å; P29-K47 HydrophobicContact CG-CD 4.33Å; P29-K47 HydrophobicContact CG-CG 4.13Å; P29-K47 WeakPolarHBondContact O-CD 3.17Å; P29-K47 WeakPolarHBondContact O-CE 3.41Å; P29-K47 PolarHBondContact O-NZ 2.8Å; P29-L49 HydrophobicContact CG-CD2 4.18Å
30	C	87.1	Confident	64.1	Low	12 Å²	12	91.2 Å²	91.2	8%	0.081	51%	0.505	C	S	.	.			trans	-75.3	-179.6	-179.3	-53.5	0	0	0	0	112.4	P27 L42 D43 C44	P27-C30 WeakPolarHBondContact O-CA 3.4Å; P27-C30 VanDerWaalsContact O-CB 3.24Å; P27-C30 WeakPolarHBondContact O-CB 3.27Å; P27-C30 PolarHBondContact O-N 3.02Å; C30-L42 HydrophobicContact CB-CD1 3.65Å; C30-L42 HydrophobicContact CB-CG 4.49Å; C30-D43 CarbonylContact C-O 3.23Å; C30-D43 WeakPolarHBondContact CA-O 3.13Å; C30-D43 WeakPolarHBondContact CB-O 3.43Å; C30-C44 HydrophobicContact CB-CB 4.01Å; C30-C44 WeakPolarHBondContact CB-SG 3.22Å; C30-C44 WeakPolarHBondContact SG-CB 3.35Å; C30-C44 CovalentContact SG-SG 2.04Å; C30-C44 PolarHBondContact SG-SG 3.49Å
31	S	86.7	Confident	66.4	Low	61 Å²	61	88 Å²	88	43%	0.427	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	137.2	-179.9	-56.5	0	0	0	0	109.8	D43	S31-D43 PolarHBondContact N-O 2.83Å; S31-D43 PolarHBondContact O-N 2.74Å
32	C	84.4	Confident	68.8	Low	31 Å²	31	76.8 Å²	76.8	21%	0.209	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	131.7	-171	-63.2	0	0	0	0	109.9	C26 I39	C26-C32 VanDerWaalsContact CA-SG 3.58Å; C26-C32 HydrophobicContact CB-CB 3.86Å; C26-C32 WeakPolarHBondContact CB-SG 3.02Å; C26-C32 WeakPolarHBondContact SG-CB 3.24Å; C26-C32 PolarHBondContact SG-N 3.36Å; C26-C32 CovalentContact SG-SG 2.04Å; C26-C32 PolarHBondContact SG-SG 3.44Å; C32-I39 HydrophobicContact CB-CD1 4.08Å; C32-I39 HydrophobicContact CB-CG1 4.47Å; C32-I39 HydrophobicContact CB-CG2 3.76Å
33	M	77.1	Confident	71.1	Confident	94 Å²	94	70.2 Å²	70.2	46%	0.463	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.6	174.6	-63.9	-179.5	-75.1	0	0	110.3	Q40 I41	M33-Q40 PolarHBondContact O-N 3.28Å; M33-I41 HydrophobicContact CB-CB 4.24Å; M33-I41 HydrophobicContact CE-CB 4.18Å; M33-I41 HydrophobicContact CE-CD1 4.21Å; M33-I41 HydrophobicContact CE-CG2 3.82Å; M33-I41 PolarHBondContact N-O 3.28Å; M33-I41 PolarHBondContact O-N 2.04Å
34	R	67.7	Low	73.2	Confident	166 Å²	166	67.5 Å²	67.5	63%	0.626	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	137.9	-179.5	-140.1	168.2	178.9	164.5	-3.9	109.6	D37 E38	R34-D37 PolarHBondContact NE-O 2.84Å; R34-D37 PolarHBondContact NH2-O 2.78Å; R34-E38 WeakPolarHBondContact CA-O 3.35Å; R34-E38 VanDerWaalsContact CG-O 3.31Å; R34-E38 WeakPolarHBondContact CG-O 3.47Å
35	G	65.3	Low	75.2	Confident	38 Å²	38	61.1 Å²	61.1	39%	0.392	36%	0.357	S	S	.	.			trans	-82.1	-128.3	168.1	0	0	0	0	0	110.1	E38	G35-E38 PolarHBondContact N-O 3.19Å
36	S	47.9	Very low	76.7	Confident	109 Å²	109	66.3 Å²	66.3	76%	0.762	36%	0.364	S	S	*	.	S	Bend	trans	-79.2	-17.8	179.7	55.9	0	0	0	0	115.3
37	D	47.8	Very low	77.5	Confident	123 Å²	123	68.1 Å²	68.1	66%	0.658	37%	0.367	S	S	*	.	S	Bend	trans	-168.4	-23	171.1	-105.9	-39.2	0	0	0	113.2	R34	R34-D37 PolarHBondContact NE-O 2.84Å; R34-D37 PolarHBondContact NH2-O 2.78Å
38	E	61.6	Low	78	Confident	126 Å²	126	77.3 Å²	77.3	59%	0.589	40%	0.4	S	S	*	.	S	Bend	trans	-106	165.1	176.5	-65	-175.1	154.8	0	0	112.8	R34 G35 Q40	R34-E38 WeakPolarHBondContact CA-O 3.35Å; R34-E38 VanDerWaalsContact CG-O 3.31Å; R34-E38 WeakPolarHBondContact CG-O 3.47Å; G35-E38 PolarHBondContact N-O 3.19Å; E38-Q40 PolarHBondContact O-N 2.73Å
39	I	61	Low	78.6	Confident	21 Å²	21	74.1 Å²	74.1	11%	0.108	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	110.1	173.2	-62.8	172.6	0	0	0	108.5	V23 C32 P57 G59 I60	V23-I39 HydrophobicContact CG1-CD1 4.33Å; C32-I39 HydrophobicContact CB-CD1 4.08Å; C32-I39 HydrophobicContact CB-CG1 4.47Å; C32-I39 HydrophobicContact CB-CG2 3.76Å; I39-P57 HydrophobicContact CB-CB 4.41Å; I39-P57 HydrophobicContact CD1-CB 4.1Å; I39-P57 HydrophobicContact CD1-CG 4.13Å; I39-P57 HydrophobicContact CG2-CB 4.37Å; I39-G59 CarbonylContact O-C 3.59Å; I39-G59 VanDerWaalsContact O-C 3.23Å; I39-I60 HydrophobicContact CG2-CG1 4.08Å; I39-I60 WeakPolarHBondContact O-CA 3.32Å; I39-I60 PolarHBondContact O-N 2.04Å
40	Q	75.8	Confident	78.9	Confident	76 Å²	76	75.3 Å²	75.3	36%	0.355	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-22.2	-177.7	-70.7	-178.7	-17.3	0	0	113.2	M33 E38 T61 H62	M33-Q40 PolarHBondContact O-N 3.28Å; E38-Q40 PolarHBondContact O-N 2.73Å; Q40-T61 PolarHBondContact O-N 3.28Å; Q40-T61 PolarHBondContact O-OG1 3.31Å; Q40-H62 PolarHBondContact O-N 3.14Å
41	I	83.8	Confident	79	Confident	57 Å²	57	78.1 Å²	78.1	29%	0.292	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.6	-176.9	-42.5	176	0	0	0	110.6	M33 H62	M33-I41 HydrophobicContact CB-CB 4.24Å; M33-I41 HydrophobicContact CE-CB 4.18Å; M33-I41 HydrophobicContact CE-CD1 4.21Å; M33-I41 HydrophobicContact CE-CG2 3.82Å; M33-I41 PolarHBondContact N-O 3.28Å; M33-I41 PolarHBondContact O-N 2.04Å; I41-H62 WeakPolarHBondContact CA-O 3.35Å; I41-H62 HydrophobicContact CB-CB 4.22Å; I41-H62 HydrophobicContact CG1-CB 4.03Å; I41-H62 HydrophobicContact CG2-CB 3.94Å
42	L	88.6	Confident	78.9	Confident	0 Å²	0	76 Å²	76	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	116.9	170.4	179.4	59.3	0	0	0	110.2	P27 C30 P53 P56 I60 H62 L63 T64	P27-L42 HydrophobicContact CG-CD1 4.38Å; C30-L42 HydrophobicContact CB-CD1 3.65Å; C30-L42 HydrophobicContact CB-CG 4.49Å; L42-P53 HydrophobicContact CD2-CG 4.09Å; L42-P56 HydrophobicContact CD2-CB 4.41Å; L42-I60 HydrophobicContact CB-CD1 3.72Å; L42-I60 HydrophobicContact CB-CG1 4.38Å; L42-I60 HydrophobicContact CB-CG2 4.14Å; L42-I60 HydrophobicContact CD2-CD1 3.77Å; L42-I60 HydrophobicContact CG-CD1 4.3Å; L42-H62 PolarHBondContact N-O 3.32Å; L42-L63 HydrophobicContact CB-CD1 4.11Å; L42-L63 HydrophobicContact CD2-CD1 3.96Å; L42-L63 HydrophobicContact CG-CD1 4.01Å; L42-T64 PolarHBondContact O-N 3.49Å
43	D	88.8	Confident	78.9	Confident	43 Å²	43	75.2 Å²	75.2	23%	0.23	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	112.1	177.9	-172	-38.5	0	0	0	110.5	C30 S31 N45	C30-D43 CarbonylContact C-O 3.23Å; C30-D43 WeakPolarHBondContact CA-O 3.13Å; C30-D43 WeakPolarHBondContact CB-O 3.43Å; S31-D43 PolarHBondContact N-O 2.83Å; S31-D43 PolarHBondContact O-N 2.74Å; D43-N45 WeakPolarHBondContact OD1-CB 3.44Å; D43-N45 VanDerWaalsContact OD1-CG 3.25Å; D43-N45 PolarHBondContact OD1-N 2.94Å; D43-N45 PolarHBondContact OD1-ND2 3.1Å; D43-N45 PolarHBondContact OD2-ND2 3.16Å
44	C	90.7	Very high	78.9	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	40%	0.396	C	S	.	.			trans	-115	30.6	173.6	-58.9	0	0	0	0	111.3	C30 K47 L49 T64 M65 N68	C30-C44 HydrophobicContact CB-CB 4.01Å; C30-C44 WeakPolarHBondContact CB-SG 3.22Å; C30-C44 WeakPolarHBondContact SG-CB 3.35Å; C30-C44 CovalentContact SG-SG 2.04Å; C30-C44 PolarHBondContact SG-SG 3.49Å; C44-K47 VanDerWaalsContact O-CG 3.31Å; C44-K47 WeakPolarHBondContact O-CG 3.4Å; C44-L49 HydrophobicContact CB-CD1 3.74Å; C44-T64 PolarHBondContact N-O 3.14Å; C44-M65 HydrophobicContact CB-CB 4.42Å; C44-M65 HydrophobicContact CB-CE 4.09Å; C44-M65 HydrophobicContact CB-CG 4.01Å; C44-N68 PolarHBondContact O-ND2 3.38Å
45	N	91.4	Very high	79.4	Confident	37 Å²	37	76.9 Å²	76.9	20%	0.198	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	138.7	-176.8	-74	-53.2	0	0	0	112.9	D43 K47 T64 N66	D43-N45 WeakPolarHBondContact OD1-CB 3.44Å; D43-N45 VanDerWaalsContact OD1-CG 3.25Å; D43-N45 PolarHBondContact OD1-N 2.94Å; D43-N45 PolarHBondContact OD1-ND2 3.1Å; D43-N45 PolarHBondContact OD2-ND2 3.16Å; N45-K47 VanDerWaalsContact C-N 3.3Å; N45-K47 WeakPolarHBondContact O-CD 3.34Å; N45-K47 WeakPolarHBondContact O-CE 3.05Å; N45-K47 WeakPolarHBondContact O-CG 3.2Å; N45-K47 PolarHBondContact O-N 3.32Å; N45-T64 VanDerWaalsContact ND2-CG2 3.31Å; N45-T64 WeakPolarHBondContact ND2-CG2 3.43Å; N45-T64 WeakPolarHBondContact OD1-CG2 3.3Å; N45-N66 WeakPolarHBondContact CA-O 3.31Å; N45-N66 WeakPolarHBondContact OD1-CA 3.2Å; N45-N66 WeakPolarHBondContact OD1-CB 3.47Å; N45-N66 PolarHBondContact OD1-N 3.44Å; N45-N66 PolarHBondContact OD1-ND2 3.11Å
46	R	91.2	Very high	80.2	Confident	189 Å²	189	76.1 Å²	76.1	71%	0.713	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	33.8	172.1	-62.6	175.3	175.9	-173	-2.1	114.4	N66 H67	R46-N66 PolarHBondContact N-O 2.87Å; R46-H67 VanDerWaalsContact CA-O 3.31Å; R46-H67 WeakPolarHBondContact CA-O 3.05Å; R46-H67 HydrophobicContact CG-CB 3.59Å
47	K	90.6	Very high	81.8	Confident	73 Å²	73	71.6 Å²	71.6	32%	0.317	36%	0.359	S	S	.	.	S	Bend	trans	-101.6	-3.2	-174.9	-54.6	-58.9	175.7	147.6	0	114.5	P29 C44 N45 L49 N68	P29-K47 HydrophobicContact CB-CD 4.24Å; P29-K47 HydrophobicContact CG-CB 3.84Å; P29-K47 HydrophobicContact CG-CD 4.33Å; P29-K47 HydrophobicContact CG-CG 4.13Å; P29-K47 WeakPolarHBondContact O-CD 3.17Å; P29-K47 WeakPolarHBondContact O-CE 3.41Å; P29-K47 PolarHBondContact O-NZ 2.8Å; C44-K47 VanDerWaalsContact O-CG 3.31Å; C44-K47 WeakPolarHBondContact O-CG 3.4Å; N45-K47 VanDerWaalsContact C-N 3.3Å; N45-K47 WeakPolarHBondContact O-CD 3.34Å; N45-K47 WeakPolarHBondContact O-CE 3.05Å; N45-K47 WeakPolarHBondContact O-CG 3.2Å; N45-K47 PolarHBondContact O-N 3.32Å; K47-L49 VanDerWaalsContact C-N 3.33Å; K47-L49 HydrophobicContact CB-CD1 3.97Å; K47-L49 HydrophobicContact CB-CG 3.85Å; K47-N68 WeakPolarHBondContact CA-OD1 3.45Å; K47-N68 PolarHBondContact N-OD1 2.95Å
48	R	89.8	Confident	83.3	Confident	210 Å²	210	73.1 Å²	73.1	79%	0.792	36%	0.362	S	S	*	.			trans	56.8	41.5	-173.6	-60.8	-170.4	-177.3	-157.5	0.5	113.8	N68 D69	R48-N68 PolarHBondContact N-OD1 3.39Å; R48-D69 WeakPolarHBondContact CA-OD2 3.37Å; R48-D69 VanDerWaalsContact CB-OD2 3.3Å; R48-D69 WeakPolarHBondContact CB-OD2 3.39Å
49	L	90	Very high	84.1	Confident	26 Å²	26	68 Å²	68	14%	0.136	34%	0.343	C	S	.	.			trans	-80.9	128.7	178.1	-66.3	168.6	0	0	0	110.8	P29 C44 K47 M65 N68 D69 L70	P29-L49 HydrophobicContact CG-CD2 4.18Å; C44-L49 HydrophobicContact CB-CD1 3.74Å; K47-L49 VanDerWaalsContact C-N 3.33Å; K47-L49 HydrophobicContact CB-CD1 3.97Å; K47-L49 HydrophobicContact CB-CG 3.85Å; L49-M65 HydrophobicContact CB-CE 4.32Å; L49-M65 HydrophobicContact CD1-CE 3.69Å; L49-N68 HydrophobicContact CB-CB 4.4Å; L49-N68 PolarHBondContact N-OD1 3.11Å; L49-N68 VanDerWaalsContact N-OD1 3.11Å; L49-D69 CarbonylContact O-C 3.48Å; L49-D69 PolarHBondContact O-N 3.2Å; L49-L70 WeakPolarHBondContact O-CD2 3.05Å; L49-L70 PolarHBondContact O-N 2.94Å
50	S	90.4	Very high	85.4	Confident	89 Å²	89	67.1 Å²	67.1	62%	0.622	34%	0.338	S	S	*	.	S	Bend	trans	-95.5	-5	171	55.8	0	0	0	0	113.3
51	S	87.7	Confident	86.1	Confident	71 Å²	71	65.3 Å²	65.3	50%	0.497	33%	0.333	S	S	.	.	S	Bend	trans	-141.9	173.8	178.8	67.9	0	0	0	0	111.9
52	A	85.1	Confident	86.4	Confident	18 Å²	18	65.7 Å²	65.7	15%	0.149	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-57.6	153.6	163.1	0	0	0	0	0	111.4	P74 Y75 L76	A52-P74 HydrophobicContact CB-CB 3.83Å; A52-Y75 WeakPolarHBondContact CB-O 3.35Å; A52-L76 HydrophobicContact CB-CG 4.42Å
53	P	84	Confident	86.7	Confident	14 Å²	14	65.8 Å²	65.8	9%	0.091	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-65.8	146.4	166.5	29.3	-33.8	0	0	0	110.7	P27 L42 L76	P27-P53 HydrophobicContact CB-CB 4.1Å; P27-P53 HydrophobicContact CG-CB 4.02Å; L42-P53 HydrophobicContact CD2-CG 4.09Å; P53-L76 HydrophobicContact CG-CD2 4.49Å
54	L	78.6	Confident	86.9	Confident	149 Å²	149	64.5 Å²	64.5	78%	0.78	33%	0.327	S	S	*	.	S	Bend	trans	-71.2	150.3	168.8	-65.4	168.8	0	0	0	109.9	P27	P27-L54 WeakPolarHBondContact CB-O 3.32Å
55	D	78	Confident	87	Confident	145 Å²	145	64.5 Å²	64.5	78%	0.775	33%	0.327	S	S	*	.	S	Bend	trans	44.2	61.8	174	-53.4	-29.4	0	0	0	115.3
56	P	81.6	Confident	87.2	Confident	22 Å²	22	63.8 Å²	63.8	14%	0.143	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-69.7	140.9	178.5	29.1	-34.2	0	0	0	112.4	L42 L76 V79	L42-P56 HydrophobicContact CD2-CB 4.41Å; P56-L76 HydrophobicContact CB-CD2 3.99Å; P56-L76 HydrophobicContact CG-CB 3.96Å; P56-L76 HydrophobicContact CG-CD2 4.19Å; P56-L76 HydrophobicContact CG-CG 4.5Å; P56-V79 HydrophobicContact CG-CB 4.44Å; P56-V79 HydrophobicContact CG-CG2 4.22Å
57	P	80.8	Confident	87.4	Confident	14 Å²	14	58.5 Å²	58.5	9%	0.091	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-54.9	138.3	178	-27.8	30.6	0	0	0	114.7	I39 I60	I39-P57 HydrophobicContact CB-CB 4.41Å; I39-P57 HydrophobicContact CD1-CB 4.1Å; I39-P57 HydrophobicContact CD1-CG 4.13Å; I39-P57 HydrophobicContact CG2-CB 4.37Å; P57-I60 HydrophobicContact CB-CD1 3.83Å; P57-I60 HydrophobicContact CB-CG1 4.17Å; P57-I60 HydrophobicContact CG-CD1 4.01Å; P57-I60 VanDerWaalsContact O-CD1 3.27Å; P57-I60 WeakPolarHBondContact O-CD1 3.43Å; P57-I60 WeakPolarHBondContact O-CG1 3.31Å
58	H	79.4	Confident	87.6	Confident	156 Å²	156	55.3 Å²	55.3	72%	0.722	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	146.9	166.1	-55.8	-74.4	0	0	0	110.6
59	G	79.6	Confident	87.9	Confident	19 Å²	19	48.7 Å²	48.7	20%	0.196	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	93	-8.4	177.8	0	0	0	0	0	116.1	I39 T61	I39-G59 CarbonylContact O-C 3.59Å; I39-G59 VanDerWaalsContact O-C 3.23Å; G59-T61 PolarHBondContact O-N 3.21Å
60	I	88	Confident	88.2	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	27%	0.268	C	S	.	.			trans	-63	134.8	177	-61.3	163.6	0	0	0	110.5	I39 L42 P57 H62 V79 I83	I39-I60 HydrophobicContact CG2-CG1 4.08Å; I39-I60 WeakPolarHBondContact O-CA 3.32Å; I39-I60 PolarHBondContact O-N 2.04Å; L42-I60 HydrophobicContact CB-CD1 3.72Å; L42-I60 HydrophobicContact CB-CG1 4.38Å; L42-I60 HydrophobicContact CB-CG2 4.14Å; L42-I60 HydrophobicContact CD2-CD1 3.77Å; L42-I60 HydrophobicContact CG-CD1 4.3Å; P57-I60 HydrophobicContact CB-CD1 3.83Å; P57-I60 HydrophobicContact CB-CG1 4.17Å; P57-I60 HydrophobicContact CG-CD1 4.01Å; P57-I60 VanDerWaalsContact O-CD1 3.27Å; P57-I60 WeakPolarHBondContact O-CD1 3.43Å; P57-I60 WeakPolarHBondContact O-CG1 3.31Å; I60-H62 WeakPolarHBondContact CG2-O 3.37Å; I60-V79 HydrophobicContact CB-CG1 4.17Å; I60-I83 HydrophobicContact CB-CD1 4.24Å; I60-I83 HydrophobicContact CG2-CD1 3.67Å
61	T	89.3	Confident	88.4	Confident	38 Å²	38	47.1 Å²	47.1	23%	0.233	26%	0.261	C	S	.	.			trans	-118.1	-21.1	171.2	56	0	0	0	0	112.6	Q40 G59 I83 T84 T85	Q40-T61 PolarHBondContact O-N 3.28Å; Q40-T61 PolarHBondContact O-OG1 3.31Å; G59-T61 PolarHBondContact O-N 3.21Å; T61-I83 CarbonylContact O-C 3.46Å; T61-I83 WeakPolarHBondContact O-CA 3.31Å; T61-T84 PolarHBondContact O-N 3.19Å; T61-T84 PolarHBondContact O-OG1 3.28Å; T61-T85 PolarHBondContact O-N 2.97Å; T61-T85 VanDerWaalsContact O-N 3.11Å
62	H	92	Very high	88.6	Confident	66 Å²	66	46.3 Å²	46.3	31%	0.306	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	117.1	-177.7	-69.4	62.2	0	0	0	110.9	Q40 I41 L42 I60 T84 T85	Q40-H62 PolarHBondContact O-N 3.14Å; I41-H62 WeakPolarHBondContact CA-O 3.35Å; I41-H62 HydrophobicContact CB-CB 4.22Å; I41-H62 HydrophobicContact CG1-CB 4.03Å; I41-H62 HydrophobicContact CG2-CB 3.94Å; L42-H62 PolarHBondContact N-O 3.32Å; I60-H62 WeakPolarHBondContact CG2-O 3.37Å; H62-T84 PolarHBondContact CE1-OG1 2.96Å; H62-T85 WeakPolarHBondContact CD2-CB 3.48Å; H62-T85 PolarHBondContact CD2-OG1 3.34Å; H62-T85 VanDerWaalsContact CD2-OG1 3.27Å; H62-T85 PolarHBondContact NE2-OG1 3.28Å
63	L	92.9	Very high	89.1	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.3	177.2	177.8	60.4	0	0	0	111	L42 M65 P74 L76 I83 T85 L86 L87	L42-L63 HydrophobicContact CB-CD1 4.11Å; L42-L63 HydrophobicContact CD2-CD1 3.96Å; L42-L63 HydrophobicContact CG-CD1 4.01Å; L63-M65 HydrophobicContact CD1-CG 3.76Å; L63-M65 HydrophobicContact CD1-SD 4.17Å; L63-M65 HydrophobicContact CD2-CG 4.33Å; L63-M65 HydrophobicContact CD2-SD 4.09Å; L63-M65 HydrophobicContact CG-CG 3.92Å; L63-M65 HydrophobicContact CG-SD 4.31Å; L63-P74 HydrophobicContact CD2-CG 4.41Å; L63-L76 HydrophobicContact CD1-CD2 4.35Å; L63-L76 HydrophobicContact CD2-CD1 3.43Å; L63-L76 VanDerWaalsContact CD2-CD1 3.43Å; L63-L76 HydrophobicContact CD2-CD2 3.65Å; L63-L76 HydrophobicContact CD2-CG 4.2Å; L63-I83 HydrophobicContact CB-CD1 4.18Å; L63-I83 HydrophobicContact CB-CG2 4.25Å; L63-T85 PolarHBondContact N-O 3.27Å; L63-L86 HydrophobicContact CB-CD1 3.98Å; L63-L86 HydrophobicContact CD2-CD1 3.71Å; L63-L86 HydrophobicContact CG-CD1 3.93Å; L63-L87 PolarHBondContact O-N 2.94Å
64	T	93.3	Very high	89.5	Confident	17 Å²	17	45.2 Å²	45.2	10%	0.104	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	109.2	-177.6	-47.9	0	0	0	0	110	L42 C44 N45 N66 L87	L42-T64 PolarHBondContact O-N 3.49Å; C44-T64 PolarHBondContact N-O 3.14Å; N45-T64 VanDerWaalsContact ND2-CG2 3.31Å; N45-T64 WeakPolarHBondContact ND2-CG2 3.43Å; N45-T64 WeakPolarHBondContact OD1-CG2 3.3Å; T64-N66 WeakPolarHBondContact CG2-ND2 3.21Å; T64-L87 HydrophobicContact CG2-CB 4.09Å; T64-L87 HydrophobicContact CG2-CD1 4.1Å
65	M	94.3	Very high	90.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.233	C	C	.	.			trans	-126.1	41.3	-179.1	-49.5	-168.7	67.5	0	0	111.9	C44 L49 L63 N68 L70 P74 L87 L88 N91	C44-M65 HydrophobicContact CB-CB 4.42Å; C44-M65 HydrophobicContact CB-CE 4.09Å; C44-M65 HydrophobicContact CB-CG 4.01Å; L49-M65 HydrophobicContact CB-CE 4.32Å; L49-M65 HydrophobicContact CD1-CE 3.69Å; L63-M65 HydrophobicContact CD1-CG 3.76Å; L63-M65 HydrophobicContact CD1-SD 4.17Å; L63-M65 HydrophobicContact CD2-CG 4.33Å; L63-M65 HydrophobicContact CD2-SD 4.09Å; L63-M65 HydrophobicContact CG-CG 3.92Å; L63-M65 HydrophobicContact CG-SD 4.31Å; M65-N68 PolarHBondContact O-ND2 3.32Å; M65-L70 HydrophobicContact CB-CD1 3.92Å; M65-L70 HydrophobicContact CE-CD1 4.2Å; M65-L70 HydrophobicContact CE-CD2 4.34Å; M65-L70 HydrophobicContact SD-CD1 4.12Å; M65-P74 HydrophobicContact SD-CB 4.19Å; M65-P74 HydrophobicContact SD-CG 3.92Å; M65-L87 PolarHBondContact N-O 3.39Å; M65-L88 HydrophobicContact CB-CD2 3.94Å; M65-L88 HydrophobicContact CG-CD2 4.35Å; M65-N91 PolarHBondContact O-ND2 2.84Å
66	N	94.8	Very high	90.6	Very high	22 Å²	22	38.1 Å²	38.1	12%	0.118	20%	0.198	C	C	.	.			trans	-73.5	152.6	-177	-46.1	-55.5	0	0	0	112.1	N45 R46 T64 N68 L87 L88 V89	N45-N66 WeakPolarHBondContact CA-O 3.31Å; N45-N66 WeakPolarHBondContact OD1-CA 3.2Å; N45-N66 WeakPolarHBondContact OD1-CB 3.47Å; N45-N66 PolarHBondContact OD1-N 3.44Å; N45-N66 PolarHBondContact OD1-ND2 3.11Å; R46-N66 PolarHBondContact N-O 2.87Å; T64-N66 WeakPolarHBondContact CG2-ND2 3.21Å; N66-N68 PolarHBondContact O-ND2 2.9Å; N66-L87 PolarHBondContact OD1-O 2.9Å; N66-L88 PolarHBondContact OD1-N 2.85Å; N66-V89 CarbonylContact C-O 3.59Å; N66-V89 WeakPolarHBondContact CA-O 3.47Å; N66-V89 HydrophobicContact CB-CB 4.11Å; N66-V89 WeakPolarHBondContact CB-O 3.29Å; N66-V89 VanDerWaalsContact OD1-CB 3.3Å; N66-V89 WeakPolarHBondContact OD1-CB 3.27Å; N66-V89 WeakPolarHBondContact OD1-CG2 3.5Å; N66-V89 PolarHBondContact OD1-N 2.92Å
67	H	96	Very high	90.9	Very high	77 Å²	77	38.5 Å²	38.5	36%	0.356	21%	0.206	S	C	.	.	S	Bend	trans	59.4	52.4	178.4	-48.5	76.6	0	0	0	112.3	R46 V89 H90	R46-H67 VanDerWaalsContact CA-O 3.31Å; R46-H67 WeakPolarHBondContact CA-O 3.05Å; R46-H67 HydrophobicContact CG-CB 3.59Å; H67-V89 PolarHBondContact N-O 3.26Å; H67-H90 WeakPolarHBondContact CA-O 3.47Å; H67-H90 AromaticContact CD2-ND1 3.95Å; H67-H90 AromaticContact CE1-ND1 3.99Å; H67-H90 PolarHBondContact N-O 2.83Å; H67-H90 VanDerWaalsContact N-O 3.1Å; H67-H90 AromaticContact NE2-ND1 3.53Å
68	N	94.9	Very high	91.1	Very high	7 Å²	7	45.8 Å²	45.8	4%	0.037	24%	0.239	C	C	.	.	S	Bend	trans	-127.8	-174.6	177	-73.4	-61.4	0	0	0	110	C44 K47 R48 L49 M65 N66 L70 H90 N91	C44-N68 PolarHBondContact O-ND2 3.38Å; K47-N68 WeakPolarHBondContact CA-OD1 3.45Å; K47-N68 PolarHBondContact N-OD1 2.95Å; R48-N68 PolarHBondContact N-OD1 3.39Å; L49-N68 HydrophobicContact CB-CB 4.4Å; L49-N68 PolarHBondContact N-OD1 3.11Å; L49-N68 VanDerWaalsContact N-OD1 3.11Å; M65-N68 PolarHBondContact O-ND2 3.32Å; N66-N68 PolarHBondContact O-ND2 2.9Å; N68-L70 HydrophobicContact CB-CG 4.29Å; N68-H90 PolarHBondContact N-O 3.23Å; N68-N91 WeakPolarHBondContact CA-OD1 3.44Å; N68-N91 WeakPolarHBondContact CB-OD1 3.43Å; N68-N91 PolarHBondContact N-OD1 3.25Å; N68-N91 PolarHBondContact O-OD1 3.1Å; N68-N91 VanDerWaalsContact O-OD1 3.08Å
69	D	95.9	Very high	91.6	Very high	70 Å²	70	38.7 Å²	38.7	37%	0.374	21%	0.207	S	C	.	.			trans	-108.8	27.5	-173.8	-59.2	-72.7	0	0	0	111.3	R48 L49 T71 L92	R48-D69 WeakPolarHBondContact CA-OD2 3.37Å; R48-D69 VanDerWaalsContact CB-OD2 3.3Å; R48-D69 WeakPolarHBondContact CB-OD2 3.39Å; L49-D69 CarbonylContact O-C 3.48Å; L49-D69 PolarHBondContact O-N 3.2Å; D69-T71 PolarHBondContact O-N 2.78Å; D69-L92 HydrophobicContact CB-CD1 4.13Å
70	L	95.2	Very high	92.2	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.016	20%	0.198	C	C	.	.			trans	-68.3	128.8	-178.2	-58.7	173.2	0	0	0	110.9	L49 M65 N68 L88 N91 L92 I93	L49-L70 WeakPolarHBondContact O-CD2 3.05Å; L49-L70 PolarHBondContact O-N 2.94Å; M65-L70 HydrophobicContact CB-CD1 3.92Å; M65-L70 HydrophobicContact CE-CD1 4.2Å; M65-L70 HydrophobicContact CE-CD2 4.34Å; M65-L70 HydrophobicContact SD-CD1 4.12Å; N68-L70 HydrophobicContact CB-CG 4.29Å; L70-L88 HydrophobicContact CD1-CD2 3.93Å; L70-N91 HydrophobicContact CB-CB 4.2Å; L70-N91 VanDerWaalsContact CB-OD1 3.27Å; L70-N91 WeakPolarHBondContact CB-OD1 3.15Å; L70-N91 VanDerWaalsContact CG-OD1 3.29Å; L70-N91 WeakPolarHBondContact CG-OD1 3.34Å; L70-N91 PolarHBondContact N-OD1 2.83Å; L70-N91 VanDerWaalsContact N-OD1 3.17Å; L70-L92 CarbonylContact O-C 3.58Å; L70-L92 VanDerWaalsContact O-C 3.25Å; L70-L92 VanDerWaalsContact O-CA 3.3Å; L70-L92 WeakPolarHBondContact O-CA 3.44Å; L70-L92 PolarHBondContact O-N 2.87Å; L70-I93 WeakPolarHBondContact O-CG1 3.31Å; L70-I93 PolarHBondContact O-N 3.19Å; L70-I93 VanDerWaalsContact O-N 3.14Å
71	T	94.6	Very high	92.3	Very high	79 Å²	79	39.6 Å²	39.6	49%	0.485	21%	0.21	S	C	.	.	S	Bend	trans	-100.3	-15.2	177.6	53.6	0	0	0	0	113.9	D69 L92 I93	D69-T71 PolarHBondContact O-N 2.78Å; T71-L92 HydrophobicContact CG2-CB 4.24Å; T71-I93 WeakPolarHBondContact O-CA 3.31Å
72	T	93.4	Very high	92.4	Very high	55 Å²	55	41.2 Å²	41.2	34%	0.337	22%	0.217	S	C	.	.	S	Bend	trans	-135.1	171.5	173.4	67.1	0	0	0	0	110.8
73	V	94.5	Very high	92.5	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.018	20%	0.203	C	C	.	.			trans	-63.3	133.8	167.7	-176	0	0	0	0	108.3	L86 L88 L96 Q100 L101 Y104	V73-L86 HydrophobicContact CG1-CD2 4.08Å; V73-L88 HydrophobicContact CG1-CD1 4.32Å; V73-L96 HydrophobicContact CG2-CD2 4.28Å; V73-Q100 HydrophobicContact CB-CB 4.48Å; V73-L101 HydrophobicContact CG1-CD2 4.29Å; V73-L101 HydrophobicContact CG2-CD2 4.3Å; V73-Y104 HydrophobicContact CG1-CD2 4.5Å; V73-Y104 HydrophobicContact CG1-CE2 3.73Å
74	P	92.9	Very high	92.6	Very high	6 Å²	6	39.8 Å²	39.8	4%	0.039	21%	0.213	C	C	.	.			trans	-68.2	163.1	179.2	26.8	-33.3	0	0	0	112.2	A52 L63 M65 L76 L88 Y104	A52-P74 HydrophobicContact CB-CB 3.83Å; L63-P74 HydrophobicContact CD2-CG 4.41Å; M65-P74 HydrophobicContact SD-CB 4.19Å; M65-P74 HydrophobicContact SD-CG 3.92Å; P74-L76 HydrophobicContact CB-CD1 4.17Å; P74-L76 HydrophobicContact CG-CD1 4.34Å; P74-L88 HydrophobicContact CG-CD2 4.09Å; P74-Y104 WeakPolarHBondContact O-CE2 3.49Å; P74-Y104 PolarHBondContact O-OH 2.86Å
75	Y	91.5	Very high	92.7	Very high	137 Å²	137	39.9 Å²	39.9	54%	0.537	21%	0.214	S	C	.	.			trans	-129.2	134	170.4	172.5	-121.5	0	0	0	108.9	A52 G77 T80 L103	A52-Y75 WeakPolarHBondContact CB-O 3.35Å; Y75-G77 WeakPolarHBondContact CE2-O 3.31Å; Y75-G77 VanDerWaalsContact CZ-CA 3.48Å; Y75-T80 HydrophobicContact CD2-CG2 4.11Å; Y75-T80 VanDerWaalsContact CD2-OG1 3.22Å; Y75-T80 WeakPolarHBondContact CD2-OG1 3.45Å; Y75-T80 WeakPolarHBondContact CE2-OG1 3.08Å; Y75-L103 HydrophobicContact CD2-CD1 3.57Å; Y75-L103 HydrophobicContact CE2-CD1 3.71Å; Y75-L103 HydrophobicContact CG-CD1 4.36Å
76	L	88.6	Confident	92.8	Very high	8 Å²	8	39.9 Å²	39.9	4%	0.042	21%	0.214	C	C	.	.			trans	-121.6	31.6	-168.7	-68.9	97.5	0	0	0	111.9	A52 P53 P56 L63 P74 V79 T80 Y104	A52-L76 HydrophobicContact CB-CG 4.42Å; P53-L76 HydrophobicContact CG-CD2 4.49Å; P56-L76 HydrophobicContact CB-CD2 3.99Å; P56-L76 HydrophobicContact CG-CB 3.96Å; P56-L76 HydrophobicContact CG-CD2 4.19Å; P56-L76 HydrophobicContact CG-CG 4.5Å; L63-L76 HydrophobicContact CD1-CD2 4.35Å; L63-L76 HydrophobicContact CD2-CD1 3.43Å; L63-L76 VanDerWaalsContact CD2-CD1 3.43Å; L63-L76 HydrophobicContact CD2-CD2 3.65Å; L63-L76 HydrophobicContact CD2-CG 4.2Å; P74-L76 HydrophobicContact CB-CD1 4.17Å; P74-L76 HydrophobicContact CG-CD1 4.34Å; L76-V79 PolarHBondContact O-N 3.19Å; L76-T80 WeakPolarHBondContact CA-OG1 3.3Å; L76-T80 PolarHBondContact N-OG1 2.97Å; L76-Y104 WeakPolarHBondContact CD1-OH 3.39Å
77	G	87.8	Confident	92.9	Very high	30 Å²	30	41 Å²	41	31%	0.309	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	61.3	-140.6	-176.3	0	0	0	0	0	111.6	Y75 V79 T80	Y75-G77 WeakPolarHBondContact CE2-O 3.31Å; Y75-G77 VanDerWaalsContact CZ-CA 3.48Å; G77-V79 PolarHBondContact O-N 2.93Å; G77-T80 PolarHBondContact N-OG1 3.25Å; G77-T80 WeakPolarHBondContact O-CB 3.35Å; G77-T80 PolarHBondContact O-N 2.78Å; G77-T80 PolarHBondContact O-OG1 2.79Å
78	E	85.2	Confident	93	Very high	166 Å²	166	37.3 Å²	37.3	78%	0.776	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-63.3	-25.3	178.2	-60.1	-176.3	161.6	0	0	113.3	T80 S81	E78-T80 PolarHBondContact O-N 2.8Å; E78-S81 PolarHBondContact O-OG 2.91Å
79	V	88.9	Confident	93.1	Very high	7 Å²	7	38.2 Å²	38.2	4%	0.042	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-67.5	-22.3	-179.8	-173.3	0	0	0	0	111.8	P56 I60 L76 G77 S81 N82	P56-V79 HydrophobicContact CG-CB 4.44Å; P56-V79 HydrophobicContact CG-CG2 4.22Å; I60-V79 HydrophobicContact CB-CG1 4.17Å; L76-V79 PolarHBondContact O-N 3.19Å; G77-V79 PolarHBondContact O-N 2.93Å; V79-S81 PolarHBondContact O-N 2.88Å; V79-S81 VanDerWaalsContact O-N 3.16Å; V79-N82 PolarHBondContact O-N 3.25Å; V79-N82 VanDerWaalsContact O-N 3.1Å
80	T	91.4	Very high	93.2	Very high	2 Å²	2	39 Å²	39	1%	0.012	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-54	-36.8	-177.1	-44.8	0	0	0	0	113.3	Y75 L76 G77 E78 N82 I83 L103 Y104	Y75-T80 HydrophobicContact CD2-CG2 4.11Å; Y75-T80 VanDerWaalsContact CD2-OG1 3.22Å; Y75-T80 WeakPolarHBondContact CD2-OG1 3.45Å; Y75-T80 WeakPolarHBondContact CE2-OG1 3.08Å; L76-T80 WeakPolarHBondContact CA-OG1 3.3Å; L76-T80 PolarHBondContact N-OG1 2.97Å; G77-T80 PolarHBondContact N-OG1 3.25Å; G77-T80 WeakPolarHBondContact O-CB 3.35Å; G77-T80 PolarHBondContact O-N 2.78Å; G77-T80 PolarHBondContact O-OG1 2.79Å; E78-T80 PolarHBondContact O-N 2.8Å; T80-N82 PolarHBondContact O-N 3.09Å; T80-I83 PolarHBondContact O-N 2.94Å; T80-L103 CarbonylContact C-O 3.42Å; T80-L103 HydrophobicContact CG2-CB 3.83Å; T80-Y104 HydrophobicContact CG2-CD1 3.92Å; T80-Y104 HydrophobicContact CG2-CD2 3.66Å; T80-Y104 HydrophobicContact CG2-CE1 3.74Å; T80-Y104 HydrophobicContact CG2-CE2 3.48Å; T80-Y104 VanDerWaalsContact CG2-CE2 3.48Å; T80-Y104 HydrophobicContact CG2-CG 3.89Å
81	S	91.8	Very high	93.2	Very high	37 Å²	37	39.2 Å²	39.2	26%	0.259	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-64.9	-28.2	-177.7	53.8	0	0	0	0	113.7	E78 V79 L103 S106	E78-S81 PolarHBondContact O-OG 2.91Å; V79-S81 PolarHBondContact O-N 2.88Å; V79-S81 VanDerWaalsContact O-N 3.16Å; S81-L103 VanDerWaalsContact CA-O 3.31Å; S81-L103 WeakPolarHBondContact CA-O 3.11Å; S81-L103 PolarHBondContact N-O 3.37Å; S81-S106 VanDerWaalsContact O-CB 3.3Å; S81-S106 WeakPolarHBondContact O-CB 3.3Å; S81-S106 PolarHBondContact O-N 2.81Å; S81-S106 VanDerWaalsContact O-N 3.09Å; S81-S106 PolarHBondContact O-OG 2.83Å
82	N	91.3	Very high	93.3	Very high	73 Å²	73	39.6 Å²	39.6	39%	0.39	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-89.2	-8.5	-170.4	-61.7	10	0	0	0	112.9	V79 T80 T84	V79-N82 PolarHBondContact O-N 3.25Å; V79-N82 VanDerWaalsContact O-N 3.1Å; T80-N82 PolarHBondContact O-N 3.09Å; N82-T84 PolarHBondContact O-N 3.36Å
83	I	93.4	Very high	93.5	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.			trans	-71.8	110.8	-178	-56.6	-59.7	0	0	0	110.1	I60 T61 L63 T80 T85 L86 Y104 S106 L107	I60-I83 HydrophobicContact CB-CD1 4.24Å; I60-I83 HydrophobicContact CG2-CD1 3.67Å; T61-I83 CarbonylContact O-C 3.46Å; T61-I83 WeakPolarHBondContact O-CA 3.31Å; L63-I83 HydrophobicContact CB-CD1 4.18Å; L63-I83 HydrophobicContact CB-CG2 4.25Å; T80-I83 PolarHBondContact O-N 2.94Å; I83-T85 WeakPolarHBondContact CG2-O 3.1Å; I83-L86 HydrophobicContact CG2-CB 4.21Å; I83-Y104 HydrophobicContact CB-CD1 3.9Å; I83-Y104 HydrophobicContact CB-CE1 3.91Å; I83-Y104 HydrophobicContact CG1-CD1 4.47Å; I83-Y104 HydrophobicContact CG1-CE1 4.08Å; I83-Y104 HydrophobicContact CG2-CD1 4.19Å; I83-Y104 HydrophobicContact CG2-CE1 4.03Å; I83-S106 CarbonylContact O-C 3.39Å; I83-L107 HydrophobicContact CG2-CD1 4.29Å; I83-L107 VanDerWaalsContact O-CA 3.31Å; I83-L107 WeakPolarHBondContact O-CA 3.29Å; I83-L107 PolarHBondContact O-N 2.97Å
84	T	94.6	Very high	93.5	Very high	36 Å²	36	39.4 Å²	39.4	22%	0.221	21%	0.21	C	C	.	.	S	Bend	trans	-86.3	-26.6	173.7	62.7	0	0	0	0	112.6	T61 H62 N82 S106 E108 T109	T61-T84 PolarHBondContact O-N 3.19Å; T61-T84 PolarHBondContact O-OG1 3.28Å; H62-T84 PolarHBondContact CE1-OG1 2.96Å; N82-T84 PolarHBondContact O-N 3.36Å; T84-S106 WeakPolarHBondContact CA-O 3.41Å; T84-E108 PolarHBondContact O-N 3.2Å; T84-T109 PolarHBondContact O-N 3.28Å
85	T	95.6	Very high	93.4	Very high	20 Å²	20	42.2 Å²	42.2	12%	0.123	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	119.3	-174.9	-56.3	0	0	0	0	110.4	T61 H62 L63 I83 L87 T109	T61-T85 PolarHBondContact O-N 2.97Å; T61-T85 VanDerWaalsContact O-N 3.11Å; H62-T85 WeakPolarHBondContact CD2-CB 3.48Å; H62-T85 PolarHBondContact CD2-OG1 3.34Å; H62-T85 VanDerWaalsContact CD2-OG1 3.27Å; H62-T85 PolarHBondContact NE2-OG1 3.28Å; L63-T85 PolarHBondContact N-O 3.27Å; I83-T85 WeakPolarHBondContact CG2-O 3.1Å; T85-L87 HydrophobicContact CG2-CD2 4.32Å; T85-L87 HydrophobicContact CG2-CG 4.2Å; T85-T109 WeakPolarHBondContact CA-O 3.38Å; T85-T109 HydrophobicContact CG2-CG2 4.08Å
86	L	96.6	Very high	93.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115.8	-178.9	-176.9	58.8	0	0	0	111.2	L63 V73 I83 L88 Y104 L107 T109 L110 D111	L63-L86 HydrophobicContact CB-CD1 3.98Å; L63-L86 HydrophobicContact CD2-CD1 3.71Å; L63-L86 HydrophobicContact CG-CD1 3.93Å; V73-L86 HydrophobicContact CG1-CD2 4.08Å; I83-L86 HydrophobicContact CG2-CB 4.21Å; L86-L88 HydrophobicContact CD1-CD1 4.34Å; L86-L88 HydrophobicContact CD1-CD2 3.98Å; L86-L88 HydrophobicContact CD1-CG 4.1Å; L86-L88 HydrophobicContact CD2-CD1 4.02Å; L86-L88 HydrophobicContact CG-CD1 4.01Å; L86-L88 HydrophobicContact CG-CD2 4.43Å; L86-L88 HydrophobicContact CG-CG 3.99Å; L86-Y104 HydrophobicContact CD1-CE1 4.39Å; L86-Y104 HydrophobicContact CD2-CD1 4.16Å; L86-Y104 HydrophobicContact CD2-CE1 3.65Å; L86-Y104 HydrophobicContact CD2-CE2 4.21Å; L86-L107 HydrophobicContact CB-CD1 3.64Å; L86-T109 PolarHBondContact N-O 2.95Å; L86-L110 HydrophobicContact CB-CD1 4.05Å; L86-L110 HydrophobicContact CD2-CD1 3.91Å; L86-L110 HydrophobicContact CG-CD1 4.02Å; L86-L110 WeakPolarHBondContact O-CA 3.46Å; L86-D111 PolarHBondContact O-N 2.84Å
87	L	97.4	Very high	93.4	Very high	45 Å²	45	41.2 Å²	41.2	24%	0.236	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	114.5	-177.6	-53.5	177.2	0	0	0	110.2	L63 T64 M65 N66 T85 D111	L63-L87 PolarHBondContact O-N 2.94Å; T64-L87 HydrophobicContact CG2-CB 4.09Å; T64-L87 HydrophobicContact CG2-CD1 4.1Å; M65-L87 PolarHBondContact N-O 3.39Å; N66-L87 PolarHBondContact OD1-O 2.9Å; T85-L87 HydrophobicContact CG2-CD2 4.32Å; T85-L87 HydrophobicContact CG2-CG 4.2Å; L87-D111 HydrophobicContact CD2-CB 3.59Å
88	L	97.1	Very high	93.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.225	C	C	.	.			trans	-126.4	30.9	-173.7	-58.1	176.1	0	0	0	111.6	M65 N66 L70 V73 P74 L86 N91 I93 D111 L112 N115	M65-L88 HydrophobicContact CB-CD2 3.94Å; M65-L88 HydrophobicContact CG-CD2 4.35Å; N66-L88 PolarHBondContact OD1-N 2.85Å; L70-L88 HydrophobicContact CD1-CD2 3.93Å; V73-L88 HydrophobicContact CG1-CD1 4.32Å; P74-L88 HydrophobicContact CG-CD2 4.09Å; L86-L88 HydrophobicContact CD1-CD1 4.34Å; L86-L88 HydrophobicContact CD1-CD2 3.98Å; L86-L88 HydrophobicContact CD1-CG 4.1Å; L86-L88 HydrophobicContact CD2-CD1 4.02Å; L86-L88 HydrophobicContact CG-CD1 4.01Å; L86-L88 HydrophobicContact CG-CD2 4.43Å; L86-L88 HydrophobicContact CG-CG 3.99Å; L88-N91 VanDerWaalsContact C-ND2 3.3Å; L88-N91 PolarHBondContact O-ND2 2.92Å; L88-I93 HydrophobicContact CB-CD1 4.23Å; L88-I93 HydrophobicContact CD1-CD1 3.93Å; L88-D111 PolarHBondContact N-O 3.01Å; L88-L112 HydrophobicContact CB-CD2 4.23Å; L88-L112 HydrophobicContact CD1-CD2 3.94Å; L88-N115 PolarHBondContact O-ND2 2.94Å
89	V	97.5	Very high	93.6	Very high	25 Å²	25	41.1 Å²	41.1	15%	0.152	21%	0.211	C	C	.	.			trans	-67	138.1	-173.2	-174.5	0	0	0	0	111.8	N66 H67 D111 S113	N66-V89 CarbonylContact C-O 3.59Å; N66-V89 WeakPolarHBondContact CA-O 3.47Å; N66-V89 HydrophobicContact CB-CB 4.11Å; N66-V89 WeakPolarHBondContact CB-O 3.29Å; N66-V89 VanDerWaalsContact OD1-CB 3.3Å; N66-V89 WeakPolarHBondContact OD1-CB 3.27Å; N66-V89 WeakPolarHBondContact OD1-CG2 3.5Å; N66-V89 PolarHBondContact OD1-N 2.92Å; H67-V89 PolarHBondContact N-O 3.26Å; V89-D111 HydrophobicContact CG2-CB 3.91Å; V89-D111 WeakPolarHBondContact CG2-OD1 3.08Å; V89-S113 VanDerWaalsContact CA-O 3.28Å; V89-S113 WeakPolarHBondContact CA-O 3.38Å
90	H	97.2	Very high	93.6	Very high	88 Å²	88	42.6 Å²	42.6	41%	0.407	22%	0.217	S	C	.	.	S	Bend	trans	55.1	69.9	-173.5	-67	105.5	0	0	0	111.9	H67 N68 S113 S114	H67-H90 WeakPolarHBondContact CA-O 3.47Å; H67-H90 AromaticContact CD2-ND1 3.95Å; H67-H90 AromaticContact CE1-ND1 3.99Å; H67-H90 PolarHBondContact N-O 2.83Å; H67-H90 VanDerWaalsContact N-O 3.1Å; H67-H90 AromaticContact NE2-ND1 3.53Å; N68-H90 PolarHBondContact N-O 3.23Å; H90-S113 PolarHBondContact N-O 3.02Å; H90-S114 WeakPolarHBondContact CA-O 3.5Å; H90-S114 WeakPolarHBondContact CD2-CB 3.3Å; H90-S114 PolarHBondContact CE1-OG 3.08Å; H90-S114 VanDerWaalsContact NE2-CB 3.31Å; H90-S114 WeakPolarHBondContact NE2-CB 3.33Å; H90-S114 PolarHBondContact NE2-OG 3.5Å
91	N	96.8	Very high	93.7	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.037	22%	0.217	C	C	.	.			trans	-130.9	-173.6	170.1	-83.9	-81.9	0	0	0	109.4	M65 N68 L70 L88 I93 N115	M65-N91 PolarHBondContact O-ND2 2.84Å; N68-N91 WeakPolarHBondContact CA-OD1 3.44Å; N68-N91 WeakPolarHBondContact CB-OD1 3.43Å; N68-N91 PolarHBondContact N-OD1 3.25Å; N68-N91 PolarHBondContact O-OD1 3.1Å; N68-N91 VanDerWaalsContact O-OD1 3.08Å; L70-N91 HydrophobicContact CB-CB 4.2Å; L70-N91 VanDerWaalsContact CB-OD1 3.27Å; L70-N91 WeakPolarHBondContact CB-OD1 3.15Å; L70-N91 VanDerWaalsContact CG-OD1 3.29Å; L70-N91 WeakPolarHBondContact CG-OD1 3.34Å; L70-N91 PolarHBondContact N-OD1 2.83Å; L70-N91 VanDerWaalsContact N-OD1 3.17Å; L88-N91 VanDerWaalsContact C-ND2 3.3Å; L88-N91 PolarHBondContact O-ND2 2.92Å; N91-I93 HydrophobicContact CB-CG1 4.28Å; N91-N115 WeakPolarHBondContact CA-OD1 3.38Å; N91-N115 WeakPolarHBondContact CB-OD1 3.28Å; N91-N115 PolarHBondContact O-OD1 3.17Å
92	L	96.6	Very high	93.7	Very high	87 Å²	87	45.6 Å²	45.6	46%	0.455	23%	0.227	S	C	.	.			trans	-105.3	16.6	-176.3	-57.6	174.2	0	0	0	112.7	D69 L70 T71 S94	D69-L92 HydrophobicContact CB-CD1 4.13Å; L70-L92 CarbonylContact O-C 3.58Å; L70-L92 VanDerWaalsContact O-C 3.25Å; L70-L92 VanDerWaalsContact O-CA 3.3Å; L70-L92 WeakPolarHBondContact O-CA 3.44Å; L70-L92 PolarHBondContact O-N 2.87Å; T71-L92 HydrophobicContact CG2-CB 4.24Å; L92-S94 PolarHBondContact O-N 3.18Å
93	I	96.4	Very high	93.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.224	C	C	.	.			trans	-63.9	125.1	-174.7	-55.4	173.7	0	0	0	110	L70 T71 L88 N91 L96 L112 N115 S116 I117	L70-I93 WeakPolarHBondContact O-CG1 3.31Å; L70-I93 PolarHBondContact O-N 3.19Å; L70-I93 VanDerWaalsContact O-N 3.14Å; T71-I93 WeakPolarHBondContact O-CA 3.31Å; L88-I93 HydrophobicContact CB-CD1 4.23Å; L88-I93 HydrophobicContact CD1-CD1 3.93Å; N91-I93 HydrophobicContact CB-CG1 4.28Å; I93-L96 HydrophobicContact CG2-CD2 4.34Å; I93-L112 HydrophobicContact CD1-CD2 3.86Å; I93-N115 HydrophobicContact CB-CB 4.28Å; I93-N115 VanDerWaalsContact CB-OD1 3.28Å; I93-N115 WeakPolarHBondContact CB-OD1 3.22Å; I93-N115 WeakPolarHBondContact CG1-OD1 3.37Å; I93-N115 PolarHBondContact N-OD1 2.81Å; I93-S116 CarbonylContact O-C 3.49Å; I93-S116 VanDerWaalsContact O-CA 3.31Å; I93-S116 WeakPolarHBondContact O-CA 3.45Å; I93-S116 PolarHBondContact O-N 3.03Å; I93-I117 HydrophobicContact CG2-CG1 4.45Å; I93-I117 WeakPolarHBondContact O-CG1 3.21Å; I93-I117 PolarHBondContact O-N 3.14Å
94	S	94.7	Very high	93.9	Very high	54 Å²	54	45.1 Å²	45.1	38%	0.378	22%	0.224	S	C	.	.			trans	-108.6	-26.2	-178.3	59.1	0	0	0	0	114.3	L92 I117	L92-S94 PolarHBondContact O-N 3.18Å; S94-I117 WeakPolarHBondContact O-CA 3.42Å
95	E	91.1	Very high	93.7	Very high	65 Å²	65	49.2 Å²	49.2	30%	0.304	24%	0.244	S	C	.	.			trans	-138.4	152	-177.6	-68.5	-166	-113.2	0	0	111.5	K121	E95-K121 IonicContact OE2-NZ 3.62Å; E95-K121 PolarHBondContact OE2-NZ 3.32Å
96	L	92.9	Very high	93.6	Very high	16 Å²	16	51 Å²	51	8%	0.084	26%	0.257	C	S	.	.			trans	-112.1	123.2	176.7	-61.4	-179.3	0	0	0	109.9	V73 I93 L101 L112 I117 I120 A124 F125 L135	V73-L96 HydrophobicContact CG2-CD2 4.28Å; I93-L96 HydrophobicContact CG2-CD2 4.34Å; L96-L101 HydrophobicContact CB-CD1 4.41Å; L96-L112 HydrophobicContact CD1-CD1 4.03Å; L96-L112 HydrophobicContact CD2-CD1 3.72Å; L96-L112 HydrophobicContact CD2-CD2 4.28Å; L96-I117 HydrophobicContact CD1-CD1 4.23Å; L96-I117 HydrophobicContact CD2-CD1 3.97Å; L96-I117 HydrophobicContact CG-CD1 4.1Å; L96-I120 HydrophobicContact CD1-CD1 4.06Å; L96-A124 HydrophobicContact CB-CB 4.41Å; L96-F125 HydrophobicContact CD1-CE1 4.21Å; L96-F125 HydrophobicContact CD1-CE2 4.49Å; L96-F125 HydrophobicContact CD1-CZ 3.75Å; L96-L135 HydrophobicContact CD1-CD2 4.32Å
97	W	88.1	Confident	93.6	Very high	108 Å²	108	51 Å²	51	41%	0.409	26%	0.257	S	S	.	.			trans	-108.8	119.2	-175.1	-63.2	94.6	0	0	0	111.2	H99 Q100 L101	W97-H99 AromaticContact CD2-CE1 3.93Å; W97-H99 AromaticContact CE3-CE1 3.81Å; W97-H99 AromaticContact CG-CE1 3.88Å; W97-H99 PolarHBondContact O-N 3.2Å; W97-H99 VanDerWaalsContact O-N 3.14Å; W97-Q100 HydrophobicContact CB-CB 4.35Å; W97-Q100 HydrophobicContact CB-CG 3.96Å; W97-Q100 WeakPolarHBondContact O-CB 2.83Å; W97-Q100 PolarHBondContact O-N 2.83Å; W97-L101 PolarHBondContact O-N 2.85Å; W97-L101 VanDerWaalsContact O-N 3.14Å
98	M	88.4	Confident	93.5	Very high	90 Å²	90	52.4 Å²	52.4	44%	0.443	26%	0.262	S	S	.	.	H	α-helix	trans	-49.8	-41.5	176.5	-174.5	-167.3	172.7	0	0	112.2	Q100 L101 Q102 G123 P126	M98-Q100 VanDerWaalsContact C-N 3.25Å; M98-Q100 PolarHBondContact O-N 2.74Å; M98-L101 PolarHBondContact O-N 3.12Å; M98-Q102 WeakPolarHBondContact O-CB 3.31Å; M98-Q102 PolarHBondContact O-N 3.02Å; M98-G123 WeakPolarHBondContact CB-O 3.38Å; M98-G123 WeakPolarHBondContact CG-O 3.27Å; M98-P126 HydrophobicContact CE-CB 3.96Å; M98-P126 HydrophobicContact CG-CB 3.86Å; M98-P126 HydrophobicContact CG-CG 4.19Å
99	H	87.5	Confident	93.6	Very high	104 Å²	104	54.3 Å²	54.3	48%	0.481	27%	0.274	S	S	.	.	H	α-helix	trans	-69.7	-17.4	-177.8	72.6	-104	0	0	0	114.5	W97 Q102	W97-H99 AromaticContact CD2-CE1 3.93Å; W97-H99 AromaticContact CE3-CE1 3.81Å; W97-H99 AromaticContact CG-CE1 3.88Å; W97-H99 PolarHBondContact O-N 3.2Å; W97-H99 VanDerWaalsContact O-N 3.14Å; H99-Q102 WeakPolarHBondContact O-CG 3.16Å; H99-Q102 PolarHBondContact O-NE2 3.5Å
100	Q	88.9	Confident	93.6	Very high	37 Å²	37	53.1 Å²	53.1	17%	0.173	27%	0.267	C	S	.	.	H	α-helix	trans	-87.1	-48.2	171.3	-63.5	179.9	-21.8	0	0	109.9	V73 W97 M98 Q102 L103	V73-Q100 HydrophobicContact CB-CB 4.48Å; W97-Q100 HydrophobicContact CB-CB 4.35Å; W97-Q100 HydrophobicContact CB-CG 3.96Å; W97-Q100 WeakPolarHBondContact O-CB 2.83Å; W97-Q100 PolarHBondContact O-N 2.83Å; M98-Q100 VanDerWaalsContact C-N 3.25Å; M98-Q100 PolarHBondContact O-N 2.74Å; Q100-Q102 VanDerWaalsContact C-N 3.3Å; Q100-Q102 PolarHBondContact O-N 2.81Å; Q100-L103 WeakPolarHBondContact O-CB 3.41Å; Q100-L103 PolarHBondContact O-N 3.27Å
101	L	93.3	Very high	93.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.7	-23.6	-176.8	-72.9	170.2	0	0	0	113.7	V73 L96 W97 M98 L103 Y104 L110 A124 F125 P126 M128	V73-L101 HydrophobicContact CG1-CD2 4.29Å; V73-L101 HydrophobicContact CG2-CD2 4.3Å; L96-L101 HydrophobicContact CB-CD1 4.41Å; W97-L101 PolarHBondContact O-N 2.85Å; W97-L101 VanDerWaalsContact O-N 3.14Å; M98-L101 PolarHBondContact O-N 3.12Å; L101-L103 PolarHBondContact O-N 2.88Å; L101-Y104 PolarHBondContact O-N 3.33Å; L101-L110 HydrophobicContact CD2-CD2 4.24Å; L101-A124 WeakPolarHBondContact CD1-O 3.34Å; L101-F125 HydrophobicContact CD1-CD1 4.01Å; L101-F125 HydrophobicContact CD1-CE1 4.2Å; L101-P126 HydrophobicContact CB-CG 4.08Å; L101-M128 HydrophobicContact CB-CE 4.21Å; L101-M128 WeakPolarHBondContact O-CE 3.43Å
102	Q	92.8	Very high	93.7	Very high	103 Å²	103	49.4 Å²	49.4	48%	0.481	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-16.8	176.6	70.3	-174.9	-1	0	0	113.7	M98 H99 Q100 Y104 P126	M98-Q102 WeakPolarHBondContact O-CB 3.31Å; M98-Q102 PolarHBondContact O-N 3.02Å; H99-Q102 WeakPolarHBondContact O-CG 3.16Å; H99-Q102 PolarHBondContact O-NE2 3.5Å; Q100-Q102 VanDerWaalsContact C-N 3.3Å; Q100-Q102 PolarHBondContact O-N 2.81Å; Q102-Y104 VanDerWaalsContact C-N 3.3Å; Q102-P126 HydrophobicContact CB-CB 4.15Å; Q102-P126 HydrophobicContact CB-CG 3.82Å
103	L	93.3	Very high	93.8	Very high	62 Å²	62	45.9 Å²	45.9	33%	0.325	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-15.3	-179.6	-54	172.7	0	0	0	111.8	Y75 T80 S81 Q100 L101 I105	Y75-L103 HydrophobicContact CD2-CD1 3.57Å; Y75-L103 HydrophobicContact CE2-CD1 3.71Å; Y75-L103 HydrophobicContact CG-CD1 4.36Å; T80-L103 CarbonylContact C-O 3.42Å; T80-L103 HydrophobicContact CG2-CB 3.83Å; S81-L103 VanDerWaalsContact CA-O 3.31Å; S81-L103 WeakPolarHBondContact CA-O 3.11Å; S81-L103 PolarHBondContact N-O 3.37Å; Q100-L103 WeakPolarHBondContact O-CB 3.41Å; Q100-L103 PolarHBondContact O-N 3.27Å; L101-L103 PolarHBondContact O-N 2.88Å; L103-I105 PolarHBondContact O-N 3.02Å
104	Y	94.5	Very high	93.9	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	24%	0.24	C	C	.	.			trans	-93.3	61.7	-178	-78.7	-84.6	0	0	0	111.3	V73 P74 L76 T80 I83 L86 L101 Q102 S106 L107	V73-Y104 HydrophobicContact CG1-CD2 4.5Å; V73-Y104 HydrophobicContact CG1-CE2 3.73Å; P74-Y104 WeakPolarHBondContact O-CE2 3.49Å; P74-Y104 PolarHBondContact O-OH 2.86Å; L76-Y104 WeakPolarHBondContact CD1-OH 3.39Å; T80-Y104 HydrophobicContact CG2-CD1 3.92Å; T80-Y104 HydrophobicContact CG2-CD2 3.66Å; T80-Y104 HydrophobicContact CG2-CE1 3.74Å; T80-Y104 HydrophobicContact CG2-CE2 3.48Å; T80-Y104 VanDerWaalsContact CG2-CE2 3.48Å; T80-Y104 HydrophobicContact CG2-CG 3.89Å; I83-Y104 HydrophobicContact CB-CD1 3.9Å; I83-Y104 HydrophobicContact CB-CE1 3.91Å; I83-Y104 HydrophobicContact CG1-CD1 4.47Å; I83-Y104 HydrophobicContact CG1-CE1 4.08Å; I83-Y104 HydrophobicContact CG2-CD1 4.19Å; I83-Y104 HydrophobicContact CG2-CE1 4.03Å; L86-Y104 HydrophobicContact CD1-CE1 4.39Å; L86-Y104 HydrophobicContact CD2-CD1 4.16Å; L86-Y104 HydrophobicContact CD2-CE1 3.65Å; L86-Y104 HydrophobicContact CD2-CE2 4.21Å; L101-Y104 PolarHBondContact O-N 3.33Å; Q102-Y104 VanDerWaalsContact C-N 3.3Å; Y104-S106 PolarHBondContact O-N 3.38Å; Y104-L107 HydrophobicContact CG-CD2 4.44Å; Y104-L107 VanDerWaalsContact O-CB 3.29Å; Y104-L107 WeakPolarHBondContact O-CB 3.21Å; Y104-L107 PolarHBondContact O-N 2.94Å
105	I	91.2	Very high	94	Very high	122 Å²	122	44.7 Å²	44.7	63%	0.626	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-39.4	-167.3	-56.4	175.6	0	0	0	112.8	L103	L103-I105 PolarHBondContact O-N 3.02Å
106	S	93.8	Very high	94.3	Very high	58 Å²	58	43 Å²	43	41%	0.406	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	10.4	-179.1	-62.9	0	0	0	0	115	S81 I83 T84 Y104 E108	S81-S106 VanDerWaalsContact O-CB 3.3Å; S81-S106 WeakPolarHBondContact O-CB 3.3Å; S81-S106 PolarHBondContact O-N 2.81Å; S81-S106 VanDerWaalsContact O-N 3.09Å; S81-S106 PolarHBondContact O-OG 2.83Å; I83-S106 CarbonylContact O-C 3.39Å; T84-S106 WeakPolarHBondContact CA-O 3.41Å; Y104-S106 PolarHBondContact O-N 3.38Å; S106-E108 PolarHBondContact O-N 3.32Å
107	L	96.1	Very high	94.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.215	C	C	.	.			trans	-72.4	118.6	-169.8	-171.9	70.6	0	0	0	113.4	I83 L86 Y104 T109 L110 Q129 L130	I83-L107 HydrophobicContact CG2-CD1 4.29Å; I83-L107 VanDerWaalsContact O-CA 3.31Å; I83-L107 WeakPolarHBondContact O-CA 3.29Å; I83-L107 PolarHBondContact O-N 2.97Å; L86-L107 HydrophobicContact CB-CD1 3.64Å; Y104-L107 HydrophobicContact CG-CD2 4.44Å; Y104-L107 VanDerWaalsContact O-CB 3.29Å; Y104-L107 WeakPolarHBondContact O-CB 3.21Å; Y104-L107 PolarHBondContact O-N 2.94Å; L107-T109 WeakPolarHBondContact CD1-O 3.47Å; L107-L110 HydrophobicContact CD2-CB 4.24Å; L107-L110 HydrophobicContact CD2-CD1 4.47Å; L107-L110 HydrophobicContact CD2-CD2 4.28Å; L107-Q129 CarbonylContact O-C 3.51Å; L107-L130 HydrophobicContact CD2-CD1 4.14Å; L107-L130 HydrophobicContact CG-CD1 3.95Å
108	E	96.4	Very high	94.9	Very high	73 Å²	73	39.5 Å²	39.5	34%	0.341	21%	0.212	S	C	.	.			trans	-107.4	-28.7	177.4	-54.6	-158.8	152.6	0	0	113.2	T84 S106 K131 Y132	T84-E108 PolarHBondContact O-N 3.2Å; S106-E108 PolarHBondContact O-N 3.32Å; E108-K131 HydrophobicContact CB-CD 4.37Å; E108-K131 VanDerWaalsContact CD-CE 3.45Å; E108-K131 PolarHBondContact O-N 3.04Å; E108-K131 VanDerWaalsContact OE1-CE 3.31Å; E108-K131 WeakPolarHBondContact OE1-CE 3.35Å; E108-K131 IonicContact OE1-NZ 2.81Å; E108-K131 PolarHBondContact OE1-NZ 3.27Å; E108-K131 WeakPolarHBondContact OE2-CE 3.46Å; E108-K131 IonicContact OE2-NZ 2.77Å; E108-K131 PolarHBondContact OE2-NZ 3.03Å; E108-Y132 PolarHBondContact O-N 3.16Å
109	T	97.7	Very high	95.2	Very high	40 Å²	40	38.4 Å²	38.4	25%	0.245	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	121.3	-175.8	-64.9	0	0	0	0	111.4	T84 T85 L86 L107 Y132	T84-T109 PolarHBondContact O-N 3.28Å; T85-T109 WeakPolarHBondContact CA-O 3.38Å; T85-T109 HydrophobicContact CG2-CG2 4.08Å; L86-T109 PolarHBondContact N-O 2.95Å; L107-T109 WeakPolarHBondContact CD1-O 3.47Å; T109-Y132 HydrophobicContact CG2-CD1 3.85Å; T109-Y132 HydrophobicContact CG2-CG 4.32Å
110	L	98.1	Very high	95.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	118.8	178.8	-179.1	55.1	0	0	0	111.2	L86 L101 L107 L112 F125 L130 Y132 L133 N134	L86-L110 HydrophobicContact CB-CD1 4.05Å; L86-L110 HydrophobicContact CD2-CD1 3.91Å; L86-L110 HydrophobicContact CG-CD1 4.02Å; L86-L110 WeakPolarHBondContact O-CA 3.46Å; L101-L110 HydrophobicContact CD2-CD2 4.24Å; L107-L110 HydrophobicContact CD2-CB 4.24Å; L107-L110 HydrophobicContact CD2-CD1 4.47Å; L107-L110 HydrophobicContact CD2-CD2 4.28Å; L110-L112 HydrophobicContact CD1-CD1 4.15Å; L110-L112 HydrophobicContact CD1-CG 3.97Å; L110-L112 HydrophobicContact CD2-CD1 3.78Å; L110-L112 HydrophobicContact CD2-CG 4.49Å; L110-L112 HydrophobicContact CG-CD1 3.86Å; L110-L112 HydrophobicContact CG-CG 4.06Å; L110-F125 HydrophobicContact CD2-CE1 4.09Å; L110-L130 HydrophobicContact CB-CD1 3.69Å; L110-L130 HydrophobicContact CB-CD2 4.29Å; L110-L130 HydrophobicContact CD2-CD2 4.48Å; L110-Y132 PolarHBondContact N-O 3.4Å; L110-L133 HydrophobicContact CB-CD1 4.24Å; L110-L133 HydrophobicContact CD2-CD1 4.07Å; L110-L133 HydrophobicContact CG-CD1 4.13Å; L110-L133 WeakPolarHBondContact O-CA 3.34Å; L110-N134 PolarHBondContact O-N 2.92Å
111	D	98.4	Very high	95.7	Very high	18 Å²	18	35.2 Å²	35.2	10%	0.096	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	111.2	171.8	-154.2	-40.9	0	0	0	111.5	L86 L87 L88 V89 S113 N134	L86-D111 PolarHBondContact O-N 2.84Å; L87-D111 HydrophobicContact CD2-CB 3.59Å; L88-D111 PolarHBondContact N-O 3.01Å; V89-D111 HydrophobicContact CG2-CB 3.91Å; V89-D111 WeakPolarHBondContact CG2-OD1 3.08Å; D111-S113 WeakPolarHBondContact OD1-CB 3.23Å; D111-S113 PolarHBondContact OD1-N 3.21Å; D111-S113 PolarHBondContact OD1-OG 3.32Å; D111-N134 HydrophobicContact CB-CB 4.39Å; D111-N134 VanDerWaalsContact CG-ND2 3.26Å; D111-N134 PolarHBondContact OD1-ND2 3.02Å; D111-N134 WeakPolarHBondContact OD2-CB 3.28Å; D111-N134 PolarHBondContact OD2-ND2 3.36Å
112	L	98.1	Very high	95.5	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.			trans	-112.9	18.1	178.7	-75.7	161.8	0	0	0	110.9	L88 I93 L96 L110 N115 I117 N134 L135 N138	L88-L112 HydrophobicContact CB-CD2 4.23Å; L88-L112 HydrophobicContact CD1-CD2 3.94Å; I93-L112 HydrophobicContact CD1-CD2 3.86Å; L96-L112 HydrophobicContact CD1-CD1 4.03Å; L96-L112 HydrophobicContact CD2-CD1 3.72Å; L96-L112 HydrophobicContact CD2-CD2 4.28Å; L110-L112 HydrophobicContact CD1-CD1 4.15Å; L110-L112 HydrophobicContact CD1-CG 3.97Å; L110-L112 HydrophobicContact CD2-CD1 3.78Å; L110-L112 HydrophobicContact CD2-CG 4.49Å; L110-L112 HydrophobicContact CG-CD1 3.86Å; L110-L112 HydrophobicContact CG-CG 4.06Å; L112-N115 WeakPolarHBondContact O-CB 3.08Å; L112-N115 PolarHBondContact O-ND2 3.07Å; L112-I117 HydrophobicContact CB-CD1 4.24Å; L112-I117 HydrophobicContact CD1-CD1 4.46Å; L112-N134 CarbonylContact C-O 3.53Å; L112-N134 WeakPolarHBondContact CA-O 3.5Å; L112-N134 PolarHBondContact N-O 3.01Å; L112-L135 HydrophobicContact CB-CD2 3.94Å; L112-L135 HydrophobicContact CD1-CD2 3.99Å; L112-N138 PolarHBondContact O-ND2 3.39Å
113	S	98.3	Very high	95.1	Very high	13 Å²	13	34.1 Å²	34.1	9%	0.091	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	154.4	-175	60	0	0	0	0	113.9	V89 H90 D111 N115 N134 S136	V89-S113 VanDerWaalsContact CA-O 3.28Å; V89-S113 WeakPolarHBondContact CA-O 3.38Å; H90-S113 PolarHBondContact N-O 3.02Å; D111-S113 WeakPolarHBondContact OD1-CB 3.23Å; D111-S113 PolarHBondContact OD1-N 3.21Å; D111-S113 PolarHBondContact OD1-OG 3.32Å; S113-N115 VanDerWaalsContact C-N 3.33Å; S113-N115 PolarHBondContact O-N 2.92Å; S113-N115 PolarHBondContact O-ND2 2.82Å; S113-N134 WeakPolarHBondContact CB-ND2 3.31Å; S113-N134 PolarHBondContact N-O 2.97Å; S113-N134 PolarHBondContact OG-ND2 3.43Å; S113-S136 CarbonylContact C-O 3.57Å; S113-S136 WeakPolarHBondContact CA-O 3.49Å; S113-S136 WeakPolarHBondContact CB-O 3.19Å
114	S	98.3	Very high	95	Very high	21 Å²	21	31.4 Å²	31.4	15%	0.147	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	40	-173.7	-63.1	0	0	0	0	114.6	H90 S136 N137	H90-S114 WeakPolarHBondContact CA-O 3.5Å; H90-S114 WeakPolarHBondContact CD2-CB 3.3Å; H90-S114 PolarHBondContact CE1-OG 3.08Å; H90-S114 VanDerWaalsContact NE2-CB 3.31Å; H90-S114 WeakPolarHBondContact NE2-CB 3.33Å; H90-S114 PolarHBondContact NE2-OG 3.5Å; S114-S136 PolarHBondContact N-O 2.94Å; S114-N137 WeakPolarHBondContact CA-O 3.09Å; S114-N137 PolarHBondContact OG-ND2 2.96Å
115	N	97.8	Very high	95	Very high	8 Å²	8	31.3 Å²	31.3	4%	0.043	19%	0.187	C	C	.	.	S	Bend	trans	-103.3	-166.9	171.2	-84.8	-87.5	0	0	0	110.8	L88 N91 I93 L112 S113 I117 N138	L88-N115 PolarHBondContact O-ND2 2.94Å; N91-N115 WeakPolarHBondContact CA-OD1 3.38Å; N91-N115 WeakPolarHBondContact CB-OD1 3.28Å; N91-N115 PolarHBondContact O-OD1 3.17Å; I93-N115 HydrophobicContact CB-CB 4.28Å; I93-N115 VanDerWaalsContact CB-OD1 3.28Å; I93-N115 WeakPolarHBondContact CB-OD1 3.22Å; I93-N115 WeakPolarHBondContact CG1-OD1 3.37Å; I93-N115 PolarHBondContact N-OD1 2.81Å; L112-N115 WeakPolarHBondContact O-CB 3.08Å; L112-N115 PolarHBondContact O-ND2 3.07Å; S113-N115 VanDerWaalsContact C-N 3.33Å; S113-N115 PolarHBondContact O-N 2.92Å; S113-N115 PolarHBondContact O-ND2 2.82Å; N115-I117 HydrophobicContact CB-CD1 4.46Å; N115-I117 HydrophobicContact CB-CG1 4.28Å; N115-N138 VanDerWaalsContact CA-OD1 3.22Å; N115-N138 WeakPolarHBondContact CA-OD1 3.47Å; N115-N138 WeakPolarHBondContact CB-OD1 3.25Å; N115-N138 PolarHBondContact N-OD1 3Å; N115-N138 PolarHBondContact O-OD1 3.18Å
116	S	97.3	Very high	95	Very high	29 Å²	29	25.8 Å²	25.8	20%	0.203	16%	0.159	C	C	.	.			trans	-106.5	15	-179.6	-77.6	0	0	0	0	114.4	I93 S118 N138 K139	I93-S116 CarbonylContact O-C 3.49Å; I93-S116 VanDerWaalsContact O-CA 3.31Å; I93-S116 WeakPolarHBondContact O-CA 3.45Å; I93-S116 PolarHBondContact O-N 3.03Å; S116-S118 PolarHBondContact O-N 3.35Å; S116-N138 PolarHBondContact N-OD1 2.91Å; S116-K139 PolarHBondContact OG-NZ 3.26Å
117	I	97.5	Very high	94.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.171	C	C	.	.			trans	-62.9	125.5	-173.7	-53.5	168.6	0	0	0	110.5	I93 S94 L96 L112 N115 E119 I120 L135 N138 K139 I140	I93-I117 HydrophobicContact CG2-CG1 4.45Å; I93-I117 WeakPolarHBondContact O-CG1 3.21Å; I93-I117 PolarHBondContact O-N 3.14Å; S94-I117 WeakPolarHBondContact O-CA 3.42Å; L96-I117 HydrophobicContact CD1-CD1 4.23Å; L96-I117 HydrophobicContact CD2-CD1 3.97Å; L96-I117 HydrophobicContact CG-CD1 4.1Å; L112-I117 HydrophobicContact CB-CD1 4.24Å; L112-I117 HydrophobicContact CD1-CD1 4.46Å; N115-I117 HydrophobicContact CB-CD1 4.46Å; N115-I117 HydrophobicContact CB-CG1 4.28Å; I117-E119 WeakPolarHBondContact CG2-O 3.45Å; I117-I120 HydrophobicContact CG2-CD1 3.8Å; I117-L135 HydrophobicContact CD1-CD2 3.92Å; I117-N138 HydrophobicContact CB-CB 4.32Å; I117-N138 WeakPolarHBondContact CB-OD1 3.34Å; I117-N138 WeakPolarHBondContact CG1-OD1 3.29Å; I117-N138 PolarHBondContact N-OD1 3.32Å; I117-K139 CarbonylContact O-C 3.55Å; I117-K139 VanDerWaalsContact O-CA 3.26Å; I117-K139 WeakPolarHBondContact O-CA 3.38Å; I117-K139 WeakPolarHBondContact O-CB 3.46Å; I117-K139 PolarHBondContact O-N 3.03Å; I117-I140 HydrophobicContact CB-CG1 4.35Å; I117-I140 HydrophobicContact CG2-CG1 4.15Å; I117-I140 WeakPolarHBondContact O-CG1 3.47Å; I117-I140 PolarHBondContact O-N 2.85Å
118	S	95.9	Very high	94.8	Very high	50 Å²	50	28.7 Å²	28.7	35%	0.35	18%	0.175	S	C	.	.			trans	-103.7	-20.9	-176	48.6	0	0	0	0	115	S116 I140 S141	S116-S118 PolarHBondContact O-N 3.35Å; S118-I140 WeakPolarHBondContact O-CA 3.39Å; S118-S141 PolarHBondContact O-N 2.89Å
119	E	94.7	Very high	94.6	Very high	68 Å²	68	30.8 Å²	30.8	32%	0.318	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	151.6	-176.5	61	-167	-173.6	0	0	110.7	I117 K121 V142	I117-E119 WeakPolarHBondContact CG2-O 3.45Å; E119-K121 WeakPolarHBondContact OE1-CE 3.38Å; E119-K121 IonicContact OE1-NZ 2.74Å; E119-K121 PolarHBondContact OE1-NZ 3.34Å; E119-V142 WeakPolarHBondContact CA-O 3.37Å; E119-V142 HydrophobicContact CB-CB 4.26Å
120	I	95.1	Very high	94.5	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	111.2	170.6	-47.8	-66.5	0	0	0	108.2	L96 I117 A124 F125 L135 I140 V142 L143 E144 C147 F148	L96-I120 HydrophobicContact CD1-CD1 4.06Å; I117-I120 HydrophobicContact CG2-CD1 3.8Å; I120-A124 HydrophobicContact CG2-CB 4.22Å; I120-F125 HydrophobicContact CG2-CE2 3.88Å; I120-L135 HydrophobicContact CD1-CD1 3.93Å; I120-L135 HydrophobicContact CD1-CD2 4.23Å; I120-L135 HydrophobicContact CG1-CD1 4.36Å; I120-I140 HydrophobicContact CD1-CD1 3.86Å; I120-I140 HydrophobicContact CD1-CG1 4.39Å; I120-I140 HydrophobicContact CG1-CD1 4.05Å; I120-I140 HydrophobicContact CG1-CG2 4.22Å; I120-V142 PolarHBondContact N-O 2.97Å; I120-V142 VanDerWaalsContact N-O 3.1Å; I120-L143 HydrophobicContact CB-CD2 3.91Å; I120-L143 HydrophobicContact CG1-CD2 3.67Å; I120-E144 PolarHBondContact O-N 3.1Å; I120-C147 HydrophobicContact CB-CB 4.4Å; I120-C147 HydrophobicContact CG2-CB 3.87Å; I120-F148 HydrophobicContact CG2-CE1 4.31Å
121	K	92.1	Very high	94.5	Very high	72 Å²	72	32.6 Å²	32.6	31%	0.313	19%	0.19	S	C	.	.			trans	-78.3	155	-176.2	-69.4	166.2	-179.6	159.1	0	112.3	E95 E119 G123 A124 E144 C147	E95-K121 IonicContact OE2-NZ 3.62Å; E95-K121 PolarHBondContact OE2-NZ 3.32Å; E119-K121 WeakPolarHBondContact OE1-CE 3.38Å; E119-K121 IonicContact OE1-NZ 2.74Å; E119-K121 PolarHBondContact OE1-NZ 3.34Å; K121-G123 PolarHBondContact O-N 2.74Å; K121-A124 HydrophobicContact CB-CB 4.4Å; K121-A124 WeakPolarHBondContact O-CB 3.38Å; K121-A124 PolarHBondContact O-N 2.69Å; K121-A124 VanDerWaalsContact O-N 3.07Å; K121-E144 VanDerWaalsContact CA-OE2 3.27Å; K121-E144 WeakPolarHBondContact CA-OE2 3.26Å; K121-C147 WeakPolarHBondContact O-CB 3.45Å
122	A	89.3	Confident	94.5	Very high	59 Å²	59	34.7 Å²	34.7	49%	0.488	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	127.2	169.2	0	0	0	0	0	109.7	A124 E144	A122-A124 VanDerWaalsContact C-N 3.26Å; A122-A124 PolarHBondContact O-N 2.66Å; A122-E144 HydrophobicContact CB-CB 4.39Å; A122-E144 PolarHBondContact N-OE2 2.89Å
123	G	83.9	Confident	94.5	Very high	21 Å²	21	34.7 Å²	34.7	22%	0.216	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	10.9	-176.4	0	0	0	0	0	115.9	M98 K121 F125	M98-G123 WeakPolarHBondContact CB-O 3.38Å; M98-G123 WeakPolarHBondContact CG-O 3.27Å; K121-G123 PolarHBondContact O-N 2.74Å; G123-F125 CarbonylContact O-C 3.56Å; G123-F125 PolarHBondContact O-N 3.34Å
124	A	90.8	Very high	94.5	Very high	5 Å²	5	34.7 Å²	34.7	4%	0.041	20%	0.196	C	C	.	.	S	Bend	trans	-53.9	-35.7	174.4	0	0	0	0	0	112.3	L96 L101 I120 K121 A122	L96-A124 HydrophobicContact CB-CB 4.41Å; L101-A124 WeakPolarHBondContact CD1-O 3.34Å; I120-A124 HydrophobicContact CG2-CB 4.22Å; K121-A124 HydrophobicContact CB-CB 4.4Å; K121-A124 WeakPolarHBondContact O-CB 3.38Å; K121-A124 PolarHBondContact O-N 2.69Å; K121-A124 VanDerWaalsContact O-N 3.07Å; A122-A124 VanDerWaalsContact C-N 3.26Å; A122-A124 PolarHBondContact O-N 2.66Å
125	F	93.8	Very high	94.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-94.7	122.8	165.6	-55.6	-80.3	0	0	0	109.6	L96 L101 L110 I120 G123 L133 L135 F148 N150 I151	L96-F125 HydrophobicContact CD1-CE1 4.21Å; L96-F125 HydrophobicContact CD1-CE2 4.49Å; L96-F125 HydrophobicContact CD1-CZ 3.75Å; L101-F125 HydrophobicContact CD1-CD1 4.01Å; L101-F125 HydrophobicContact CD1-CE1 4.2Å; L110-F125 HydrophobicContact CD2-CE1 4.09Å; I120-F125 HydrophobicContact CG2-CE2 3.88Å; G123-F125 CarbonylContact O-C 3.56Å; G123-F125 PolarHBondContact O-N 3.34Å; F125-L133 HydrophobicContact CE1-CD1 4.11Å; F125-L133 HydrophobicContact CE1-CD2 4.01Å; F125-L133 HydrophobicContact CE2-CD2 3.92Å; F125-L133 HydrophobicContact CZ-CD1 4.08Å; F125-L133 HydrophobicContact CZ-CD2 3.55Å; F125-L133 HydrophobicContact CZ-CG 4.48Å; F125-L135 HydrophobicContact CZ-CD1 4.46Å; F125-F148 HydrophobicContact CD2-CD1 4.2Å; F125-F148 HydrophobicContact CE2-CD1 4.02Å; F125-F148 AromaticContact CE2-CE1 3.94Å; F125-F148 HydrophobicContact CE2-CE1 3.94Å; F125-N150 VanDerWaalsContact O-CB 3.23Å; F125-N150 WeakPolarHBondContact O-CB 3.24Å; F125-N150 PolarHBondContact O-ND2 3.02Å; F125-I151 HydrophobicContact CB-CD1 4.46Å; F125-I151 HydrophobicContact CB-CG2 4.02Å; F125-I151 HydrophobicContact CD2-CD1 4.24Å; F125-I151 HydrophobicContact CG-CD1 4.16Å
126	P	92.3	Very high	94.5	Very high	5 Å²	5	34 Å²	34	3%	0.032	19%	0.192	C	C	.	.			trans	-72.9	169.4	166.6	27.1	-27.3	0	0	0	111.1	M98 L101 Q102 M128	M98-P126 HydrophobicContact CE-CB 3.96Å; M98-P126 HydrophobicContact CG-CB 3.86Å; M98-P126 HydrophobicContact CG-CG 4.19Å; L101-P126 HydrophobicContact CB-CG 4.08Å; Q102-P126 HydrophobicContact CB-CB 4.15Å; Q102-P126 HydrophobicContact CB-CG 3.82Å; P126-M128 HydrophobicContact CG-CE 3.96Å; P126-M128 WeakPolarHBondContact O-CG 3.31Å; P126-M128 PolarHBondContact O-N 2.79Å; P126-M128 VanDerWaalsContact O-N 3.16Å
127	P	92.4	Very high	94.6	Very high	103 Å²	103	35.7 Å²	35.7	67%	0.669	20%	0.198	S	C	*	.	S	Bend	trans	-59.3	115.7	179.2	-25.2	35.7	0	0	0	112.7	N150	P127-N150 WeakPolarHBondContact CA-O 3.38Å; P127-N150 HydrophobicContact CG-CB 4.4Å
128	M	91.9	Very high	94.6	Very high	16 Å²	16	36.1 Å²	36.1	8%	0.079	20%	0.2	C	C	.	.			trans	-153.3	163.7	-176.8	62.3	173.9	54.5	0	0	113	L101 P126 L130 I151 S154	L101-M128 HydrophobicContact CB-CE 4.21Å; L101-M128 WeakPolarHBondContact O-CE 3.43Å; P126-M128 HydrophobicContact CG-CE 3.96Å; P126-M128 WeakPolarHBondContact O-CG 3.31Å; P126-M128 PolarHBondContact O-N 2.79Å; P126-M128 VanDerWaalsContact O-N 3.16Å; M128-L130 HydrophobicContact CG-CB 3.92Å; M128-L130 PolarHBondContact O-N 2.99Å; M128-L130 HydrophobicContact SD-CB 3.89Å; M128-L130 HydrophobicContact SD-CD1 4.45Å; M128-L130 HydrophobicContact SD-CD2 4.34Å; M128-L130 HydrophobicContact SD-CG 4.47Å; M128-I151 HydrophobicContact CG-CG2 3.48Å; M128-I151 VanDerWaalsContact CG-CG2 3.48Å; M128-I151 HydrophobicContact SD-CG2 4.39Å; M128-S154 PolarHBondContact O-OG 3.24Å; M128-S154 VanDerWaalsContact O-OG 3.04Å
129	Q	92.7	Very high	94.7	Very high	118 Å²	118	37.8 Å²	37.8	55%	0.551	20%	0.201	S	C	*	.			trans	-89.5	40	-177.4	-62.5	-65.1	-14.8	0	0	112.9	L107 K131	L107-Q129 CarbonylContact O-C 3.51Å; Q129-K131 PolarHBondContact O-N 2.75Å
130	L	96.1	Very high	94.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.186	C	C	.	.			trans	-74.1	109.2	-173.9	-170	75.3	0	0	0	111.8	L107 L110 M128 L133 I151 S154 L155	L107-L130 HydrophobicContact CD2-CD1 4.14Å; L107-L130 HydrophobicContact CG-CD1 3.95Å; L110-L130 HydrophobicContact CB-CD1 3.69Å; L110-L130 HydrophobicContact CB-CD2 4.29Å; L110-L130 HydrophobicContact CD2-CD2 4.48Å; M128-L130 HydrophobicContact CG-CB 3.92Å; M128-L130 PolarHBondContact O-N 2.99Å; M128-L130 HydrophobicContact SD-CB 3.89Å; M128-L130 HydrophobicContact SD-CD1 4.45Å; M128-L130 HydrophobicContact SD-CD2 4.34Å; M128-L130 HydrophobicContact SD-CG 4.47Å; L130-L133 HydrophobicContact CD2-CB 3.97Å; L130-L133 HydrophobicContact CD2-CD1 4.23Å; L130-L133 HydrophobicContact CD2-CD2 4.31Å; L130-L133 HydrophobicContact CD2-CG 4.39Å; L130-I151 HydrophobicContact CB-CG2 4.25Å; L130-I151 HydrophobicContact CD2-CD1 4.06Å; L130-S154 PolarHBondContact N-OG 2.98Å; L130-S154 CarbonylContact O-C 3.55Å; L130-S154 PolarHBondContact O-OG 2.79Å; L130-L155 WeakPolarHBondContact O-CA 3.48Å; L130-L155 WeakPolarHBondContact O-CD1 3.48Å; L130-L155 PolarHBondContact O-N 3.45Å
131	K	97.6	Very high	94.9	Very high	78 Å²	78	37 Å²	37	34%	0.339	20%	0.204	S	C	.	.			trans	-87.1	-30.4	-178.1	-60.5	173.6	-167.5	164.6	0	113.4	E108 Q129 S154 L156 V157	E108-K131 HydrophobicContact CB-CD 4.37Å; E108-K131 VanDerWaalsContact CD-CE 3.45Å; E108-K131 PolarHBondContact O-N 3.04Å; E108-K131 VanDerWaalsContact OE1-CE 3.31Å; E108-K131 WeakPolarHBondContact OE1-CE 3.35Å; E108-K131 IonicContact OE1-NZ 2.81Å; E108-K131 PolarHBondContact OE1-NZ 3.27Å; E108-K131 WeakPolarHBondContact OE2-CE 3.46Å; E108-K131 IonicContact OE2-NZ 2.77Å; E108-K131 PolarHBondContact OE2-NZ 3.03Å; Q129-K131 PolarHBondContact O-N 2.75Å; K131-S154 WeakPolarHBondContact CA-O 3.15Å; K131-L156 HydrophobicContact CB-CD1 4.34Å; K131-L156 HydrophobicContact CB-CG 4.31Å; K131-L156 PolarHBondContact O-N 3.25Å; K131-V157 PolarHBondContact O-N 3.23Å; K131-V157 VanDerWaalsContact O-N 3.11Å
132	Y	98.4	Very high	95	Very high	61 Å²	61	37 Å²	37	24%	0.239	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	125.4	-178.2	-179.7	-81.6	0	0	0	111.3	E108 T109 L110 N134 V157 K159	E108-Y132 PolarHBondContact O-N 3.16Å; T109-Y132 HydrophobicContact CG2-CD1 3.85Å; T109-Y132 HydrophobicContact CG2-CG 4.32Å; L110-Y132 PolarHBondContact N-O 3.4Å; Y132-N134 HydrophobicContact CE1-CB 3.63Å; Y132-V157 HydrophobicContact CD2-CB 3.73Å; Y132-V157 HydrophobicContact CD2-CG1 3.72Å; Y132-V157 HydrophobicContact CD2-CG2 4.26Å; Y132-V157 HydrophobicContact CE2-CB 4.31Å; Y132-V157 HydrophobicContact CE2-CG1 3.77Å; Y132-V157 HydrophobicContact CG-CB 4.5Å; Y132-K159 WeakPolarHBondContact OH-CE 3.36Å
133	L	98.3	Very high	95.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	117.2	175	179.6	55.4	0	0	0	111.1	L110 F125 L130 L135 F148 I151 L155 V157 L158 K159	L110-L133 HydrophobicContact CB-CD1 4.24Å; L110-L133 HydrophobicContact CD2-CD1 4.07Å; L110-L133 HydrophobicContact CG-CD1 4.13Å; L110-L133 WeakPolarHBondContact O-CA 3.34Å; F125-L133 HydrophobicContact CE1-CD1 4.11Å; F125-L133 HydrophobicContact CE1-CD2 4.01Å; F125-L133 HydrophobicContact CE2-CD2 3.92Å; F125-L133 HydrophobicContact CZ-CD1 4.08Å; F125-L133 HydrophobicContact CZ-CD2 3.55Å; F125-L133 HydrophobicContact CZ-CG 4.48Å; L130-L133 HydrophobicContact CD2-CB 3.97Å; L130-L133 HydrophobicContact CD2-CD1 4.23Å; L130-L133 HydrophobicContact CD2-CD2 4.31Å; L130-L133 HydrophobicContact CD2-CG 4.39Å; L133-L135 HydrophobicContact CD1-CD1 4.31Å; L133-L135 HydrophobicContact CD1-CD2 4.49Å; L133-L135 HydrophobicContact CD1-CG 4.02Å; L133-L135 HydrophobicContact CD2-CD1 3.98Å; L133-L135 HydrophobicContact CG-CD1 4.08Å; L133-L135 HydrophobicContact CG-CG 4.14Å; L133-F148 HydrophobicContact CD2-CD1 4.33Å; L133-F148 HydrophobicContact CD2-CE1 4.06Å; L133-I151 HydrophobicContact CD2-CD1 3.99Å; L133-L155 HydrophobicContact CB-CD1 3.77Å; L133-V157 PolarHBondContact N-O 3.29Å; L133-L158 HydrophobicContact CB-CD1 4.2Å; L133-L158 HydrophobicContact CD2-CD1 4Å; L133-L158 HydrophobicContact CG-CD1 4.06Å; L133-L158 WeakPolarHBondContact O-CA 3.36Å; L133-K159 PolarHBondContact O-N 3.24Å
134	N	98.6	Very high	95.5	Very high	14 Å²	14	37 Å²	37	8%	0.075	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	114	172.9	-177.8	17.7	0	0	0	111.4	L110 D111 L112 S113 Y132 S136 K159	L110-N134 PolarHBondContact O-N 2.92Å; D111-N134 HydrophobicContact CB-CB 4.39Å; D111-N134 VanDerWaalsContact CG-ND2 3.26Å; D111-N134 PolarHBondContact OD1-ND2 3.02Å; D111-N134 WeakPolarHBondContact OD2-CB 3.28Å; D111-N134 PolarHBondContact OD2-ND2 3.36Å; L112-N134 CarbonylContact C-O 3.53Å; L112-N134 WeakPolarHBondContact CA-O 3.5Å; L112-N134 PolarHBondContact N-O 3.01Å; S113-N134 WeakPolarHBondContact CB-ND2 3.31Å; S113-N134 PolarHBondContact N-O 2.97Å; S113-N134 PolarHBondContact OG-ND2 3.43Å; Y132-N134 HydrophobicContact CE1-CB 3.63Å; N134-S136 WeakPolarHBondContact OD1-CB 3.12Å; N134-S136 PolarHBondContact OD1-N 2.7Å; N134-S136 PolarHBondContact OD1-OG 2.99Å; N134-K159 HydrophobicContact CB-CB 4.33Å; N134-K159 WeakPolarHBondContact OD1-CB 3.46Å
135	L	98.3	Very high	95.5	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.22	C	C	.	.			trans	-114.5	16.1	176.6	-72	166	0	0	0	111.4	L96 L112 I117 I120 F125 L133 N138 I140 F148 K159 L160 N163	L96-L135 HydrophobicContact CD1-CD2 4.32Å; L112-L135 HydrophobicContact CB-CD2 3.94Å; L112-L135 HydrophobicContact CD1-CD2 3.99Å; I117-L135 HydrophobicContact CD1-CD2 3.92Å; I120-L135 HydrophobicContact CD1-CD1 3.93Å; I120-L135 HydrophobicContact CD1-CD2 4.23Å; I120-L135 HydrophobicContact CG1-CD1 4.36Å; F125-L135 HydrophobicContact CZ-CD1 4.46Å; L133-L135 HydrophobicContact CD1-CD1 4.31Å; L133-L135 HydrophobicContact CD1-CD2 4.49Å; L133-L135 HydrophobicContact CD1-CG 4.02Å; L133-L135 HydrophobicContact CD2-CD1 3.98Å; L133-L135 HydrophobicContact CG-CD1 4.08Å; L133-L135 HydrophobicContact CG-CG 4.14Å; L135-N138 PolarHBondContact O-ND2 3.22Å; L135-I140 HydrophobicContact CB-CD1 3.9Å; L135-I140 HydrophobicContact CD1-CD1 4.38Å; L135-I140 HydrophobicContact CD2-CD1 4.46Å; L135-I140 HydrophobicContact CG-CD1 4.49Å; L135-F148 HydrophobicContact CD1-CE1 4.35Å; L135-K159 CarbonylContact C-O 3.47Å; L135-K159 WeakPolarHBondContact CA-O 3.48Å; L135-K159 PolarHBondContact N-O 3.22Å; L135-L160 HydrophobicContact CB-CD2 3.92Å; L135-L160 HydrophobicContact CD1-CD2 3.97Å; L135-N163 PolarHBondContact O-ND2 3.06Å
136	S	98.6	Very high	95.1	Very high	15 Å²	15	41.8 Å²	41.8	11%	0.105	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	153.6	-175.9	-59	0	0	0	0	113	S113 S114 N134 N138 K159 N161	S113-S136 CarbonylContact C-O 3.57Å; S113-S136 WeakPolarHBondContact CA-O 3.49Å; S113-S136 WeakPolarHBondContact CB-O 3.19Å; S114-S136 PolarHBondContact N-O 2.94Å; N134-S136 WeakPolarHBondContact OD1-CB 3.12Å; N134-S136 PolarHBondContact OD1-N 2.7Å; N134-S136 PolarHBondContact OD1-OG 2.99Å; S136-N138 PolarHBondContact O-N 2.66Å; S136-N138 PolarHBondContact O-ND2 3.26Å; S136-K159 PolarHBondContact N-O 2.6Å; S136-K159 WeakPolarHBondContact OG-CB 3.22Å; S136-N161 CarbonylContact C-O 3.53Å; S136-N161 WeakPolarHBondContact CA-O 3.46Å; S136-N161 PolarHBondContact OG-ND2 3.38Å
137	N	98.4	Very high	95.1	Very high	63 Å²	63	41.7 Å²	41.7	34%	0.337	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	29.4	172.8	-155.6	68.8	0	0	0	113.9	S114 N161 R162	S114-N137 WeakPolarHBondContact CA-O 3.09Å; S114-N137 PolarHBondContact OG-ND2 2.96Å; N137-N161 PolarHBondContact N-O 2.8Å; N137-R162 WeakPolarHBondContact CA-O 3.14Å; N137-R162 HydrophobicContact CB-CB 4.26Å; N137-R162 VanDerWaalsContact OD1-CD 3.3Å; N137-R162 WeakPolarHBondContact OD1-CD 3.24Å
138	N	98.3	Very high	95.2	Very high	9 Å²	9	36.8 Å²	36.8	5%	0.048	20%	0.195	C	C	.	.	S	Bend	trans	-95.3	-164.3	172.4	-86.9	-85.8	0	0	0	110.4	L112 N115 S116 I117 L135 S136 I140 N163	L112-N138 PolarHBondContact O-ND2 3.39Å; N115-N138 VanDerWaalsContact CA-OD1 3.22Å; N115-N138 WeakPolarHBondContact CA-OD1 3.47Å; N115-N138 WeakPolarHBondContact CB-OD1 3.25Å; N115-N138 PolarHBondContact N-OD1 3Å; N115-N138 PolarHBondContact O-OD1 3.18Å; S116-N138 PolarHBondContact N-OD1 2.91Å; I117-N138 HydrophobicContact CB-CB 4.32Å; I117-N138 WeakPolarHBondContact CB-OD1 3.34Å; I117-N138 WeakPolarHBondContact CG1-OD1 3.29Å; I117-N138 PolarHBondContact N-OD1 3.32Å; L135-N138 PolarHBondContact O-ND2 3.22Å; S136-N138 PolarHBondContact O-N 2.66Å; S136-N138 PolarHBondContact O-ND2 3.26Å; N138-I140 HydrophobicContact CB-CD1 4.15Å; N138-I140 HydrophobicContact CB-CG1 3.99Å; N138-N163 VanDerWaalsContact CA-OD1 3.24Å; N138-N163 WeakPolarHBondContact CA-OD1 3.3Å; N138-N163 WeakPolarHBondContact CB-OD1 3.2Å; N138-N163 PolarHBondContact N-OD1 3.29Å; N138-N163 PolarHBondContact O-OD1 3.31Å
139	K	97.5	Very high	95.1	Very high	85 Å²	85	38.8 Å²	38.8	37%	0.37	21%	0.206	S	C	.	.			trans	-106.5	12.5	178.7	-63.8	168.4	-175.9	160.9	0	112.3	S116 I117 S141 N163 R164	S116-K139 PolarHBondContact OG-NZ 3.26Å; I117-K139 CarbonylContact O-C 3.55Å; I117-K139 VanDerWaalsContact O-CA 3.26Å; I117-K139 WeakPolarHBondContact O-CA 3.38Å; I117-K139 WeakPolarHBondContact O-CB 3.46Å; I117-K139 PolarHBondContact O-N 3.03Å; K139-S141 PolarHBondContact O-N 3.05Å; K139-S141 VanDerWaalsContact O-N 3.13Å; K139-N163 PolarHBondContact N-OD1 3.42Å; K139-R164 WeakPolarHBondContact O-CD 3.05Å
140	I	97.8	Very high	95.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.196	C	C	.	.			trans	-60.8	113.9	-165.2	-57.6	166.3	0	0	0	110.6	I117 S118 I120 L135 N138 L143 L160 N163 R164 I165	I117-I140 HydrophobicContact CB-CG1 4.35Å; I117-I140 HydrophobicContact CG2-CG1 4.15Å; I117-I140 WeakPolarHBondContact O-CG1 3.47Å; I117-I140 PolarHBondContact O-N 2.85Å; S118-I140 WeakPolarHBondContact O-CA 3.39Å; I120-I140 HydrophobicContact CD1-CD1 3.86Å; I120-I140 HydrophobicContact CD1-CG1 4.39Å; I120-I140 HydrophobicContact CG1-CD1 4.05Å; I120-I140 HydrophobicContact CG1-CG2 4.22Å; L135-I140 HydrophobicContact CB-CD1 3.9Å; L135-I140 HydrophobicContact CD1-CD1 4.38Å; L135-I140 HydrophobicContact CD2-CD1 4.46Å; L135-I140 HydrophobicContact CG-CD1 4.49Å; N138-I140 HydrophobicContact CB-CD1 4.15Å; N138-I140 HydrophobicContact CB-CG1 3.99Å; I140-L143 HydrophobicContact CG2-CD2 3.85Å; I140-L143 HydrophobicContact CG2-CG 4.49Å; I140-L160 HydrophobicContact CD1-CD2 4.11Å; I140-N163 HydrophobicContact CB-CB 4.11Å; I140-N163 WeakPolarHBondContact CB-OD1 3.25Å; I140-N163 WeakPolarHBondContact CG1-OD1 3.47Å; I140-N163 PolarHBondContact N-OD1 3.4Å; I140-R164 CarbonylContact O-C 3.42Å; I140-R164 VanDerWaalsContact O-C 3.23Å; I140-R164 VanDerWaalsContact O-CA 3.27Å; I140-R164 WeakPolarHBondContact O-CA 3.46Å; I140-R164 PolarHBondContact O-N 3.32Å; I140-I165 HydrophobicContact CG2-CG1 4.27Å; I140-I165 WeakPolarHBondContact O-CG1 3.25Å; I140-I165 PolarHBondContact O-N 2.78Å; I140-I165 VanDerWaalsContact O-N 3.08Å
141	S	95.9	Very high	94.9	Very high	54 Å²	54	36.2 Å²	36.2	38%	0.378	20%	0.196	S	C	.	.			trans	-107.2	-23.7	172.9	42.3	0	0	0	0	113.4	S118 K139	S118-S141 PolarHBondContact O-N 2.89Å; K139-S141 PolarHBondContact O-N 3.05Å; K139-S141 VanDerWaalsContact O-N 3.13Å
142	V	93.4	Very high	94.7	Very high	70 Å²	70	34 Å²	34	42%	0.424	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	133	-177.7	-177.9	0	0	0	0	110.3	E119 I120	E119-V142 WeakPolarHBondContact CA-O 3.37Å; E119-V142 HydrophobicContact CB-CB 4.26Å; I120-V142 PolarHBondContact N-O 2.97Å; I120-V142 VanDerWaalsContact N-O 3.1Å
143	L	94.1	Very high	94.4	Very high	7 Å²	7	34.9 Å²	34.9	4%	0.037	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	119.2	164.5	-62.3	176.5	0	0	0	106.6	I120 I140 F148 L160 I165 V172 F173	I120-L143 HydrophobicContact CB-CD2 3.91Å; I120-L143 HydrophobicContact CG1-CD2 3.67Å; I140-L143 HydrophobicContact CG2-CD2 3.85Å; I140-L143 HydrophobicContact CG2-CG 4.49Å; L143-F148 HydrophobicContact CD1-CE2 4.46Å; L143-F148 HydrophobicContact CD2-CE2 4.39Å; L143-F148 HydrophobicContact CD2-CZ 4.16Å; L143-L160 HydrophobicContact CD1-CD1 4.21Å; L143-L160 HydrophobicContact CD2-CD2 4.5Å; L143-I165 HydrophobicContact CD1-CD1 4.12Å; L143-V172 HydrophobicContact CB-CG1 4.33Å; L143-V172 HydrophobicContact CB-CG2 4.47Å; L143-V172 HydrophobicContact CD1-CG1 4.08Å; L143-F173 HydrophobicContact CD1-CZ 4.41Å
144	E	91.1	Very high	94.3	Very high	74 Å²	74	35.4 Å²	35.4	35%	0.346	21%	0.209	S	C	.	.			trans	-74.2	145.6	176.7	-69.7	-170.8	162.8	0	0	111.2	I120 K121 A122 G146 C147	I120-E144 PolarHBondContact O-N 3.1Å; K121-E144 VanDerWaalsContact CA-OE2 3.27Å; K121-E144 WeakPolarHBondContact CA-OE2 3.26Å; A122-E144 HydrophobicContact CB-CB 4.39Å; A122-E144 PolarHBondContact N-OE2 2.89Å; E144-G146 PolarHBondContact O-N 3.28Å; E144-C147 VanDerWaalsContact O-CB 3.24Å; E144-C147 WeakPolarHBondContact O-CB 3.45Å; E144-C147 PolarHBondContact O-N 2.94Å; E144-C147 PolarHBondContact O-SG 3.03Å
145	P	89.4	Confident	94.2	Very high	90 Å²	90	34.7 Å²	34.7	58%	0.584	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.9	126.6	174.5	-26.6	35.7	0	0	0	112	P169	P145-P169 HydrophobicContact CG-CB 4.44Å
146	G	86.9	Confident	94.2	Very high	16 Å²	16	37.4 Å²	37.4	17%	0.165	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	10	-178.5	0	0	0	0	0	115.7	E144 F148 D149	E144-G146 PolarHBondContact O-N 3.28Å; G146-F148 PolarHBondContact O-N 3.03Å; G146-D149 WeakPolarHBondContact CA-OD1 3.08Å; G146-D149 WeakPolarHBondContact O-CB 3.48Å; G146-D149 PolarHBondContact O-N 3.43Å
147	C	91.9	Very high	94.2	Very high	2 Å²	2	38 Å²	38	1%	0.014	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-19.4	178.9	60.2	0	0	0	0	115.4	I120 K121 E144	I120-C147 HydrophobicContact CB-CB 4.4Å; I120-C147 HydrophobicContact CG2-CB 3.87Å; K121-C147 WeakPolarHBondContact O-CB 3.45Å; E144-C147 VanDerWaalsContact O-CB 3.24Å; E144-C147 WeakPolarHBondContact O-CB 3.45Å; E144-C147 PolarHBondContact O-N 2.94Å; E144-C147 PolarHBondContact O-SG 3.03Å
148	F	93.4	Very high	94.2	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	2	175.6	-53	-62.9	0	0	0	114.3	I120 F125 L133 L135 L143 G146 N150 I151 S152 L158 L160 V172 F173 L175	I120-F148 HydrophobicContact CG2-CE1 4.31Å; F125-F148 HydrophobicContact CD2-CD1 4.2Å; F125-F148 HydrophobicContact CE2-CD1 4.02Å; F125-F148 AromaticContact CE2-CE1 3.94Å; F125-F148 HydrophobicContact CE2-CE1 3.94Å; L133-F148 HydrophobicContact CD2-CD1 4.33Å; L133-F148 HydrophobicContact CD2-CE1 4.06Å; L135-F148 HydrophobicContact CD1-CE1 4.35Å; L143-F148 HydrophobicContact CD1-CE2 4.46Å; L143-F148 HydrophobicContact CD2-CE2 4.39Å; L143-F148 HydrophobicContact CD2-CZ 4.16Å; G146-F148 PolarHBondContact O-N 3.03Å; F148-N150 VanDerWaalsContact C-N 3.26Å; F148-N150 PolarHBondContact O-N 3.24Å; F148-I151 HydrophobicContact CB-CG1 4.25Å; F148-I151 HydrophobicContact CD1-CD1 4.25Å; F148-I151 VanDerWaalsContact O-CG1 3.25Å; F148-I151 WeakPolarHBondContact O-CG1 3.33Å; F148-I151 PolarHBondContact O-N 2.96Å; F148-S152 PolarHBondContact O-N 3.05Å; F148-L158 HydrophobicContact CD2-CD2 4.31Å; F148-L158 HydrophobicContact CE1-CD1 4.37Å; F148-L158 HydrophobicContact CE2-CD2 4.03Å; F148-L158 HydrophobicContact CZ-CD1 4.38Å; F148-L158 HydrophobicContact CZ-CD2 4.17Å; F148-L160 HydrophobicContact CZ-CD1 4.35Å; F148-V172 HydrophobicContact CD2-CG1 4.4Å; F148-V172 HydrophobicContact CE2-CG1 4.33Å; F148-F173 HydrophobicContact CE2-CE1 4.37Å; F148-L175 HydrophobicContact CB-CD2 3.82Å
149	D	90.5	Very high	94.2	Very high	58 Å²	58	36.8 Å²	36.8	31%	0.31	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-59.8	-35	-171.6	-80.4	11.4	0	0	0	112.3	G146 I151 S152	G146-D149 WeakPolarHBondContact CA-OD1 3.08Å; G146-D149 WeakPolarHBondContact O-CB 3.48Å; G146-D149 PolarHBondContact O-N 3.43Å; D149-I151 PolarHBondContact O-N 3.09Å; D149-S152 VanDerWaalsContact O-CB 3.29Å; D149-S152 WeakPolarHBondContact O-CB 3.49Å; D149-S152 PolarHBondContact O-N 3.25Å; D149-S152 PolarHBondContact O-OG 3.13Å
150	N	91.9	Very high	94.2	Very high	65 Å²	65	32.8 Å²	32.8	35%	0.348	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-67.3	-15.7	177.6	-77	-18.4	0	0	0	115.1	F125 P127 F148	F125-N150 VanDerWaalsContact O-CB 3.23Å; F125-N150 WeakPolarHBondContact O-CB 3.24Å; F125-N150 PolarHBondContact O-ND2 3.02Å; P127-N150 WeakPolarHBondContact CA-O 3.38Å; P127-N150 HydrophobicContact CG-CB 4.4Å; F148-N150 VanDerWaalsContact C-N 3.26Å; F148-N150 PolarHBondContact O-N 3.24Å
151	I	93.8	Very high	94.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-117.5	8.5	177.7	60.6	173.9	0	0	0	112.5	F125 M128 L130 L133 F148 D149 S153 S154 L155	F125-I151 HydrophobicContact CB-CD1 4.46Å; F125-I151 HydrophobicContact CB-CG2 4.02Å; F125-I151 HydrophobicContact CD2-CD1 4.24Å; F125-I151 HydrophobicContact CG-CD1 4.16Å; M128-I151 HydrophobicContact CG-CG2 3.48Å; M128-I151 VanDerWaalsContact CG-CG2 3.48Å; M128-I151 HydrophobicContact SD-CG2 4.39Å; L130-I151 HydrophobicContact CB-CG2 4.25Å; L130-I151 HydrophobicContact CD2-CD1 4.06Å; L133-I151 HydrophobicContact CD2-CD1 3.99Å; F148-I151 HydrophobicContact CB-CG1 4.25Å; F148-I151 HydrophobicContact CD1-CD1 4.25Å; F148-I151 VanDerWaalsContact O-CG1 3.25Å; F148-I151 WeakPolarHBondContact O-CG1 3.33Å; F148-I151 PolarHBondContact O-N 2.96Å; D149-I151 PolarHBondContact O-N 3.09Å; I151-S153 VanDerWaalsContact C-N 3.26Å; I151-S153 PolarHBondContact O-N 2.94Å; I151-S154 PolarHBondContact O-N 3.08Å; I151-S154 PolarHBondContact O-OG 2.9Å; I151-L155 HydrophobicContact CD1-CD1 4.47Å; I151-L155 HydrophobicContact CD1-CD2 3.95Å; I151-L155 HydrophobicContact CG1-CD2 4.38Å; I151-L155 WeakPolarHBondContact O-CB 3.34Å; I151-L155 PolarHBondContact O-N 2.68Å; I151-L155 VanDerWaalsContact O-N 3.09Å
152	S	92.5	Very high	94.3	Very high	30 Å²	30	37 Å²	37	21%	0.21	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-29.2	-176.5	57.7	0	0	0	0	115.1	F148 D149 R174 P176	F148-S152 PolarHBondContact O-N 3.05Å; D149-S152 VanDerWaalsContact O-CB 3.29Å; D149-S152 WeakPolarHBondContact O-CB 3.49Å; D149-S152 PolarHBondContact O-N 3.25Å; D149-S152 PolarHBondContact O-OG 3.13Å; S152-R174 WeakPolarHBondContact CB-O 3.4Å; S152-P176 WeakPolarHBondContact O-CD 3.42Å
153	S	92.9	Very high	94.6	Very high	81 Å²	81	34.2 Å²	34.2	57%	0.566	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-7.9	-176.6	53.9	0	0	0	0	114.4	I151 Q177	I151-S153 VanDerWaalsContact C-N 3.26Å; I151-S153 PolarHBondContact O-N 2.94Å; S153-Q177 WeakPolarHBondContact O-CG 3.16Å
154	S	95	Very high	94.7	Very high	10 Å²	10	40.4 Å²	40.4	7%	0.07	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.7	-26.6	-170.8	54.4	0	0	0	0	114.1	M128 L130 K131 I151 L156	M128-S154 PolarHBondContact O-OG 3.24Å; M128-S154 VanDerWaalsContact O-OG 3.04Å; L130-S154 PolarHBondContact N-OG 2.98Å; L130-S154 CarbonylContact O-C 3.55Å; L130-S154 PolarHBondContact O-OG 2.79Å; K131-S154 WeakPolarHBondContact CA-O 3.15Å; I151-S154 PolarHBondContact O-N 3.08Å; I151-S154 PolarHBondContact O-OG 2.9Å; S154-L156 PolarHBondContact O-N 2.86Å
155	L	96.9	Very high	95	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.194	C	C	.	.			trans	-71.1	118.8	-173.9	-168	68.4	0	0	0	113.1	L130 L133 I151 L158 L175 Q177 L178	L130-L155 WeakPolarHBondContact O-CA 3.48Å; L130-L155 WeakPolarHBondContact O-CD1 3.48Å; L130-L155 PolarHBondContact O-N 3.45Å; L133-L155 HydrophobicContact CB-CD1 3.77Å; I151-L155 HydrophobicContact CD1-CD1 4.47Å; I151-L155 HydrophobicContact CD1-CD2 3.95Å; I151-L155 HydrophobicContact CG1-CD2 4.38Å; I151-L155 WeakPolarHBondContact O-CB 3.34Å; I151-L155 PolarHBondContact O-N 2.68Å; I151-L155 VanDerWaalsContact O-N 3.09Å; L155-L158 HydrophobicContact CD2-CB 4.11Å; L155-L158 HydrophobicContact CD2-CD2 4.39Å; L155-L175 HydrophobicContact CD2-CD1 4.3Å; L155-Q177 CarbonylContact O-C 3.25Å; L155-Q177 VanDerWaalsContact O-C 3.3Å; L155-L178 HydrophobicContact CB-CD1 4.46Å; L155-L178 HydrophobicContact CD2-CD1 4.08Å; L155-L178 HydrophobicContact CG-CD1 3.84Å; L155-L178 VanDerWaalsContact O-CA 3.31Å; L155-L178 WeakPolarHBondContact O-CA 3.24Å; L155-L178 PolarHBondContact O-N 3.11Å
156	L	97.9	Very high	95.2	Very high	57 Å²	57	36 Å²	36	30%	0.298	19%	0.186	S	C	.	.			trans	-101.2	-32.3	179.9	-53.3	-178.2	0	0	0	112.6	K131 S154 Q177 Q179 F180	K131-L156 HydrophobicContact CB-CD1 4.34Å; K131-L156 HydrophobicContact CB-CG 4.31Å; K131-L156 PolarHBondContact O-N 3.25Å; S154-L156 PolarHBondContact O-N 2.86Å; L156-Q177 HydrophobicContact CD2-CB 4.06Å; L156-Q177 WeakPolarHBondContact CD2-O 3.44Å; L156-Q179 PolarHBondContact O-N 3.35Å; L156-F180 PolarHBondContact O-N 3.13Å
157	V	98.4	Very high	95.4	Very high	27 Å²	27	40.6 Å²	40.6	16%	0.164	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	124.2	-175.5	-177.7	0	0	0	0	110.9	K131 Y132 L133 K159 F180	K131-V157 PolarHBondContact O-N 3.23Å; K131-V157 VanDerWaalsContact O-N 3.11Å; Y132-V157 HydrophobicContact CD2-CB 3.73Å; Y132-V157 HydrophobicContact CD2-CG1 3.72Å; Y132-V157 HydrophobicContact CD2-CG2 4.26Å; Y132-V157 HydrophobicContact CE2-CB 4.31Å; Y132-V157 HydrophobicContact CE2-CG1 3.77Å; Y132-V157 HydrophobicContact CG-CB 4.5Å; L133-V157 PolarHBondContact N-O 3.29Å; V157-K159 HydrophobicContact CG1-CG 4.11Å; V157-F180 HydrophobicContact CG1-CB 4.33Å; V157-F180 HydrophobicContact CG2-CB 4.32Å; V157-F180 HydrophobicContact CG2-CD2 4.04Å
158	L	98.2	Very high	95.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	122.3	176.2	177.3	56.2	0	0	0	110.6	L133 F148 L155 L160 F173 L175 L178 F180 L181 E182	L133-L158 HydrophobicContact CB-CD1 4.2Å; L133-L158 HydrophobicContact CD2-CD1 4Å; L133-L158 HydrophobicContact CG-CD1 4.06Å; L133-L158 WeakPolarHBondContact O-CA 3.36Å; F148-L158 HydrophobicContact CD2-CD2 4.31Å; F148-L158 HydrophobicContact CE1-CD1 4.37Å; F148-L158 HydrophobicContact CE2-CD2 4.03Å; F148-L158 HydrophobicContact CZ-CD1 4.38Å; F148-L158 HydrophobicContact CZ-CD2 4.17Å; L155-L158 HydrophobicContact CD2-CB 4.11Å; L155-L158 HydrophobicContact CD2-CD2 4.39Å; L158-L160 HydrophobicContact CD1-CD1 4.32Å; L158-L160 HydrophobicContact CD1-CG 4.15Å; L158-L160 HydrophobicContact CD2-CD1 4.02Å; L158-L160 HydrophobicContact CG-CD1 4.08Å; L158-L160 HydrophobicContact CG-CG 4.25Å; L158-F173 HydrophobicContact CD2-CD1 4.49Å; L158-F173 HydrophobicContact CD2-CE1 4.21Å; L158-L175 HydrophobicContact CD2-CD1 3.91Å; L158-L178 HydrophobicContact CB-CD1 3.82Å; L158-L178 HydrophobicContact CB-CD2 4.22Å; L158-F180 PolarHBondContact N-O 3.09Å; L158-L181 HydrophobicContact CB-CD1 4.07Å; L158-L181 HydrophobicContact CD2-CD1 3.97Å; L158-L181 HydrophobicContact CG-CD1 3.95Å; L158-E182 PolarHBondContact O-N 3.25Å
159	K	98.7	Very high	94.8	Very high	47 Å²	47	42.8 Å²	42.8	20%	0.204	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	113.6	179.5	-51	-169.9	-172.8	-134.6	0	111.2	Y132 L133 N134 L135 S136 V157 E182	Y132-K159 WeakPolarHBondContact OH-CE 3.36Å; L133-K159 PolarHBondContact O-N 3.24Å; N134-K159 HydrophobicContact CB-CB 4.33Å; N134-K159 WeakPolarHBondContact OD1-CB 3.46Å; L135-K159 CarbonylContact C-O 3.47Å; L135-K159 WeakPolarHBondContact CA-O 3.48Å; L135-K159 PolarHBondContact N-O 3.22Å; S136-K159 PolarHBondContact N-O 2.6Å; S136-K159 WeakPolarHBondContact OG-CB 3.22Å; V157-K159 HydrophobicContact CG1-CG 4.11Å; K159-E182 HydrophobicContact CB-CB 4.44Å; K159-E182 WeakPolarHBondContact CD-OE1 3.27Å; K159-E182 VanDerWaalsContact CE-OE1 3.27Å; K159-E182 WeakPolarHBondContact CE-OE1 3.46Å; K159-E182 HydrophobicContact CG-CB 4.41Å; K159-E182 HydrophobicContact CG-CG 4.27Å; K159-E182 IonicContact NZ-OE1 2.69Å; K159-E182 PolarHBondContact NZ-OE1 3Å
160	L	98.1	Very high	94.1	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.233	C	C	.	.			trans	-118.3	18.3	-178.5	-74.8	164.5	0	0	0	112	L135 I140 L143 F148 L158 N163 I165 F173 E182 L183 N186	L135-L160 HydrophobicContact CB-CD2 3.92Å; L135-L160 HydrophobicContact CD1-CD2 3.97Å; I140-L160 HydrophobicContact CD1-CD2 4.11Å; L143-L160 HydrophobicContact CD1-CD1 4.21Å; L143-L160 HydrophobicContact CD2-CD2 4.5Å; F148-L160 HydrophobicContact CZ-CD1 4.35Å; L158-L160 HydrophobicContact CD1-CD1 4.32Å; L158-L160 HydrophobicContact CD1-CG 4.15Å; L158-L160 HydrophobicContact CD2-CD1 4.02Å; L158-L160 HydrophobicContact CG-CD1 4.08Å; L158-L160 HydrophobicContact CG-CG 4.25Å; L160-N163 PolarHBondContact O-ND2 2.78Å; L160-I165 HydrophobicContact CB-CD1 4.12Å; L160-I165 HydrophobicContact CD1-CD1 4.43Å; L160-I165 HydrophobicContact CD2-CD1 4.39Å; L160-F173 HydrophobicContact CD1-CE1 4.31Å; L160-E182 CarbonylContact C-O 3.58Å; L160-E182 WeakPolarHBondContact CA-O 3.27Å; L160-E182 PolarHBondContact N-O 3.03Å; L160-L183 HydrophobicContact CB-CD2 3.86Å; L160-L183 HydrophobicContact CD1-CD2 3.99Å; L160-N186 PolarHBondContact O-ND2 3.23Å
161	N	98.1	Very high	93	Very high	11 Å²	11	47.2 Å²	47.2	6%	0.059	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	155.1	-176.3	-58.6	-59.7	0	0	0	114	S136 N137 N163 E182 K184	S136-N161 CarbonylContact C-O 3.53Å; S136-N161 WeakPolarHBondContact CA-O 3.46Å; S136-N161 PolarHBondContact OG-ND2 3.38Å; N137-N161 PolarHBondContact N-O 2.8Å; N161-N163 PolarHBondContact O-N 2.89Å; N161-N163 PolarHBondContact O-ND2 3.47Å; N161-E182 PolarHBondContact N-O 3.06Å; N161-E182 WeakPolarHBondContact ND2-CB 3.49Å; N161-E182 PolarHBondContact ND2-OE2 3Å; N161-E182 VanDerWaalsContact OD1-CB 3.24Å; N161-E182 WeakPolarHBondContact OD1-CB 3.42Å; N161-K184 CarbonylContact C-O 3.57Å; N161-K184 VanDerWaalsContact CA-O 3.25Å; N161-K184 WeakPolarHBondContact CA-O 3.31Å; N161-K184 HydrophobicContact CB-CG 4.39Å; N161-K184 WeakPolarHBondContact OD1-CD 3.3Å; N161-K184 WeakPolarHBondContact OD1-CE 3.37Å; N161-K184 WeakPolarHBondContact OD1-CG 3.24Å; N161-K184 PolarHBondContact OD1-N 3.2Å
162	R	98.2	Very high	92.4	Very high	133 Å²	133	47.2 Å²	47.2	50%	0.502	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	37.4	171.6	-58.1	-177.1	-172.5	-172.7	4.7	113.5	N137 K184 R185	N137-R162 WeakPolarHBondContact CA-O 3.14Å; N137-R162 HydrophobicContact CB-CB 4.26Å; N137-R162 VanDerWaalsContact OD1-CD 3.3Å; N137-R162 WeakPolarHBondContact OD1-CD 3.24Å; R162-K184 PolarHBondContact N-O 3.2Å; R162-R185 VanDerWaalsContact CA-O 3.23Å; R162-R185 WeakPolarHBondContact CA-O 3.37Å; R162-R185 HydrophobicContact CG-CB 4.04Å; R162-R185 PolarHBondContact N-O 2.95Å
163	N	98.3	Very high	91.9	Very high	10 Å²	10	45.9 Å²	45.9	5%	0.053	23%	0.234	C	C	.	.	S	Bend	trans	-103.9	-161	174.5	-85.7	-69.5	0	0	0	109.6	L135 N138 K139 I140 L160 N161 I165 N186	L135-N163 PolarHBondContact O-ND2 3.06Å; N138-N163 VanDerWaalsContact CA-OD1 3.24Å; N138-N163 WeakPolarHBondContact CA-OD1 3.3Å; N138-N163 WeakPolarHBondContact CB-OD1 3.2Å; N138-N163 PolarHBondContact N-OD1 3.29Å; N138-N163 PolarHBondContact O-OD1 3.31Å; K139-N163 PolarHBondContact N-OD1 3.42Å; I140-N163 HydrophobicContact CB-CB 4.11Å; I140-N163 WeakPolarHBondContact CB-OD1 3.25Å; I140-N163 WeakPolarHBondContact CG1-OD1 3.47Å; I140-N163 PolarHBondContact N-OD1 3.4Å; L160-N163 PolarHBondContact O-ND2 2.78Å; N161-N163 PolarHBondContact O-N 2.89Å; N161-N163 PolarHBondContact O-ND2 3.47Å; N163-I165 HydrophobicContact CB-CD1 4.37Å; N163-I165 HydrophobicContact CB-CG1 4.24Å; N163-N186 VanDerWaalsContact CA-OD1 3.25Å; N163-N186 WeakPolarHBondContact CA-OD1 3.37Å; N163-N186 WeakPolarHBondContact CB-OD1 3.09Å; N163-N186 PolarHBondContact N-OD1 3.43Å; N163-N186 PolarHBondContact O-OD1 2.88Å
164	R	97.6	Very high	91.6	Very high	137 Å²	137	47.9 Å²	47.9	52%	0.517	23%	0.229	S	C	.	.			trans	-119.7	16.6	-176.4	-59	-177.5	175.9	-167.1	-4.9	112.4	K139 I140 T166 N186	K139-R164 WeakPolarHBondContact O-CD 3.05Å; I140-R164 CarbonylContact O-C 3.42Å; I140-R164 VanDerWaalsContact O-C 3.23Å; I140-R164 VanDerWaalsContact O-CA 3.27Å; I140-R164 WeakPolarHBondContact O-CA 3.46Å; I140-R164 PolarHBondContact O-N 3.32Å; R164-T166 PolarHBondContact O-N 3.08Å; R164-N186 PolarHBondContact N-OD1 3.08Å
165	I	97	Very high	91.5	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	23%	0.226	C	C	.	.			trans	-62.9	124	-173.3	-56.9	167.1	0	0	0	109.4	I140 L143 L160 N163 L167 L168 L183 N186 K187 I188	I140-I165 HydrophobicContact CG2-CG1 4.27Å; I140-I165 WeakPolarHBondContact O-CG1 3.25Å; I140-I165 PolarHBondContact O-N 2.78Å; I140-I165 VanDerWaalsContact O-N 3.08Å; L143-I165 HydrophobicContact CD1-CD1 4.12Å; L160-I165 HydrophobicContact CB-CD1 4.12Å; L160-I165 HydrophobicContact CD1-CD1 4.43Å; L160-I165 HydrophobicContact CD2-CD1 4.39Å; N163-I165 HydrophobicContact CB-CD1 4.37Å; N163-I165 HydrophobicContact CB-CG1 4.24Å; I165-L167 VanDerWaalsContact CG2-O 3.3Å; I165-L167 WeakPolarHBondContact CG2-O 3.23Å; I165-L168 HydrophobicContact CG2-CD2 3.92Å; I165-L183 HydrophobicContact CD1-CD2 4.22Å; I165-N186 HydrophobicContact CB-CB 4.23Å; I165-N186 WeakPolarHBondContact CB-OD1 3.26Å; I165-N186 WeakPolarHBondContact CG1-OD1 3.47Å; I165-N186 PolarHBondContact N-OD1 3.3Å; I165-N186 VanDerWaalsContact N-OD1 3.08Å; I165-K187 CarbonylContact O-C 3.6Å; I165-K187 VanDerWaalsContact O-C 3.27Å; I165-K187 WeakPolarHBondContact O-CA 3.27Å; I165-K187 PolarHBondContact O-N 3.04Å; I165-I188 HydrophobicContact CG2-CG1 4.29Å; I165-I188 PolarHBondContact O-N 3.34Å
166	T	93.3	Very high	91.4	Very high	70 Å²	70	49.9 Å²	49.9	43%	0.429	24%	0.242	S	C	.	.			trans	-103.6	-27.5	-179	48.6	0	0	0	0	113.8	R164 K187	R164-T166 PolarHBondContact O-N 3.08Å; T166-K187 HydrophobicContact CG2-CB 4Å
167	L	90	Very high	91.3	Very high	113 Å²	113	50.9 Å²	50.9	59%	0.592	25%	0.245	S	C	*	.			trans	-137.9	149.5	-174.7	-70.9	167.8	0	0	0	109.7	I165	I165-L167 VanDerWaalsContact CG2-O 3.3Å; I165-L167 WeakPolarHBondContact CG2-O 3.23Å
168	L	91.7	Very high	91.2	Very high	10 Å²	10	49.6 Å²	49.6	5%	0.052	24%	0.237	C	C	.	.			trans	-113.3	99.1	174.1	-61.2	-176.8	0	0	0	108.6	I165 F173 L183 I188 T195 F196 M207	I165-L168 HydrophobicContact CG2-CD2 3.92Å; L168-F173 HydrophobicContact CB-CE2 4.37Å; L168-F173 HydrophobicContact CD1-CE2 4.21Å; L168-F173 HydrophobicContact CD2-CE2 3.93Å; L168-F173 HydrophobicContact CD2-CZ 4.14Å; L168-F173 HydrophobicContact CG-CE2 4.39Å; L168-L183 HydrophobicContact CD1-CD1 4.18Å; L168-L183 HydrophobicContact CD2-CD1 4.46Å; L168-L183 HydrophobicContact CD2-CD2 4.43Å; L168-I188 HydrophobicContact CD1-CD1 4.08Å; L168-I188 HydrophobicContact CD1-CG2 4.49Å; L168-I188 HydrophobicContact CD2-CD1 3.8Å; L168-I188 HydrophobicContact CD2-CG1 4.38Å; L168-I188 HydrophobicContact CG-CD1 4.01Å; L168-I188 HydrophobicContact CG-CG1 4.42Å; L168-I188 HydrophobicContact CG-CG2 4.38Å; L168-T195 HydrophobicContact CB-CG2 3.63Å; L168-T195 HydrophobicContact CD1-CG2 3.85Å; L168-T195 HydrophobicContact CG-CG2 4.41Å; L168-F196 HydrophobicContact CD1-CE1 3.8Å; L168-F196 HydrophobicContact CD1-CZ 3.66Å; L168-M207 HydrophobicContact CD1-CE 4.15Å
169	P	82.9	Confident	91.2	Very high	39 Å²	39	52.6 Å²	52.6	25%	0.253	25%	0.251	S	S	.	.			trans	-65.3	141.7	-173.7	-18.4	29.2	0	0	0	112.6	P145 K171 V172	P145-P169 HydrophobicContact CG-CB 4.44Å; P169-K171 PolarHBondContact O-N 3.31Å; P169-V172 HydrophobicContact CB-CG2 3.8Å; P169-V172 HydrophobicContact CG-CG2 3.86Å; P169-V172 WeakPolarHBondContact O-CB 3.4Å; P169-V172 PolarHBondContact O-N 2.92Å
170	C	74	Confident	91.1	Very high	84 Å²	84	54.4 Å²	54.4	57%	0.568	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	130.7	173.7	-63.4	0	0	0	0	111
171	K	70.6	Confident	91.1	Very high	132 Å²	132	54.4 Å²	54.4	57%	0.574	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	3.8	-178.1	-45.7	165.1	-175.1	169.5	0	116.6	P169 F173 R174	P169-K171 PolarHBondContact O-N 3.31Å; K171-F173 PolarHBondContact O-N 3.29Å; K171-R174 HydrophobicContact CB-CG 4.45Å
172	V	81.1	Confident	91.1	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-29.7	174.5	152.1	0	0	0	0	113.1	L143 F148 P169	L143-V172 HydrophobicContact CB-CG1 4.33Å; L143-V172 HydrophobicContact CB-CG2 4.47Å; L143-V172 HydrophobicContact CD1-CG1 4.08Å; F148-V172 HydrophobicContact CD2-CG1 4.4Å; F148-V172 HydrophobicContact CE2-CG1 4.33Å; P169-V172 HydrophobicContact CB-CG2 3.8Å; P169-V172 HydrophobicContact CG-CG2 3.86Å; P169-V172 WeakPolarHBondContact O-CB 3.4Å; P169-V172 PolarHBondContact O-N 2.92Å
173	F	82	Confident	91.1	Very high	1 Å²	1	48.8 Å²	48.8	0%	0.004	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	55.7	-177.3	-58.5	-61.4	0	0	0	113.4	L143 F148 L158 L160 L168 K171 L175 L181 L183 F196 M199	L143-F173 HydrophobicContact CD1-CZ 4.41Å; F148-F173 HydrophobicContact CE2-CE1 4.37Å; L158-F173 HydrophobicContact CD2-CD1 4.49Å; L158-F173 HydrophobicContact CD2-CE1 4.21Å; L160-F173 HydrophobicContact CD1-CE1 4.31Å; L168-F173 HydrophobicContact CB-CE2 4.37Å; L168-F173 HydrophobicContact CD1-CE2 4.21Å; L168-F173 HydrophobicContact CD2-CE2 3.93Å; L168-F173 HydrophobicContact CD2-CZ 4.14Å; L168-F173 HydrophobicContact CG-CE2 4.39Å; K171-F173 PolarHBondContact O-N 3.29Å; F173-L175 HydrophobicContact CD1-CD1 4.11Å; F173-L175 PolarHBondContact O-N 3.06Å; F173-L181 HydrophobicContact CD1-CD2 4.32Å; F173-L181 HydrophobicContact CE1-CD1 4.33Å; F173-L181 HydrophobicContact CE1-CD2 4.27Å; F173-L181 HydrophobicContact CZ-CD2 4.41Å; F173-L183 HydrophobicContact CZ-CD1 4.35Å; F173-L183 HydrophobicContact CZ-CD2 4.49Å; F173-F196 AromaticContact CD2-CD1 3.9Å; F173-F196 HydrophobicContact CD2-CD1 3.9Å; F173-F196 HydrophobicContact CD2-CE1 4.07Å; F173-F196 HydrophobicContact CE2-CD1 4.35Å; F173-F196 HydrophobicContact CE2-CE1 4.05Å; F173-M199 HydrophobicContact CB-CE 3.69Å; F173-M199 HydrophobicContact CB-CG 4.23Å; F173-M199 HydrophobicContact CB-SD 3.71Å; F173-M199 HydrophobicContact CG-CE 4.19Å; F173-M199 HydrophobicContact CG-SD 4.36Å; F173-M199 VanDerWaalsContact O-CG 3.24Å; F173-M199 WeakPolarHBondContact O-CG 3.4Å
174	R	86.7	Confident	91.1	Very high	123 Å²	123	51 Å²	51	46%	0.464	25%	0.247	S	C	.	.			trans	-81.5	63.7	168.5	-75.1	171	154.7	-171.4	-10	110.8	S152 K171 P176	S152-R174 WeakPolarHBondContact CB-O 3.4Å; K171-R174 HydrophobicContact CB-CG 4.45Å; R174-P176 VanDerWaalsContact O-CD 3.24Å; R174-P176 WeakPolarHBondContact O-CD 3.3Å
175	L	92.6	Very high	91.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.243	C	C	.	.			trans	-119.2	74.4	-169.3	-55.7	173.8	0	0	0	110.7	F148 L155 L158 F173 Q177 L178 G198 M199	F148-L175 HydrophobicContact CB-CD2 3.82Å; L155-L175 HydrophobicContact CD2-CD1 4.3Å; L158-L175 HydrophobicContact CD2-CD1 3.91Å; F173-L175 HydrophobicContact CD1-CD1 4.11Å; F173-L175 PolarHBondContact O-N 3.06Å; L175-Q177 PolarHBondContact O-N 2.87Å; L175-Q177 VanDerWaalsContact O-N 3.13Å; L175-L178 HydrophobicContact CB-CB 3.78Å; L175-L178 HydrophobicContact CB-CD2 4.39Å; L175-L178 HydrophobicContact CD1-CD2 3.99Å; L175-L178 VanDerWaalsContact O-CB 3.3Å; L175-L178 WeakPolarHBondContact O-CB 3.49Å; L175-L178 PolarHBondContact O-N 3.19Å; L175-G198 CarbonylContact C-O 3.59Å; L175-G198 VanDerWaalsContact C-O 3.32Å; L175-G198 PolarHBondContact N-O 3.34Å; L175-M199 HydrophobicContact CB-CG 4.05Å; L175-M199 HydrophobicContact CB-SD 4.28Å
176	P	93.7	Very high	91.2	Very high	53 Å²	53	50.2 Å²	50.2	34%	0.344	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-17.5	-169.2	26.1	-37	0	0	0	114.8	S152 R174 G198 L201	S152-P176 WeakPolarHBondContact O-CD 3.42Å; R174-P176 VanDerWaalsContact O-CD 3.24Å; R174-P176 WeakPolarHBondContact O-CD 3.3Å; P176-G198 WeakPolarHBondContact CA-O 3.32Å; P176-L201 WeakPolarHBondContact O-CD1 3.43Å; P176-L201 WeakPolarHBondContact O-CG 3.42Å
177	Q	95.3	Very high	91.3	Very high	78 Å²	78	52.8 Å²	52.8	36%	0.364	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-4.4	174.6	-62.2	-55.5	-72.6	0	0	113.9	S153 L155 L156 L175 Q179	S153-Q177 WeakPolarHBondContact O-CG 3.16Å; L155-Q177 CarbonylContact O-C 3.25Å; L155-Q177 VanDerWaalsContact O-C 3.3Å; L156-Q177 HydrophobicContact CD2-CB 4.06Å; L156-Q177 WeakPolarHBondContact CD2-O 3.44Å; L175-Q177 PolarHBondContact O-N 2.87Å; L175-Q177 VanDerWaalsContact O-N 3.13Å; Q177-Q179 PolarHBondContact O-N 3.37Å
178	L	96.9	Very high	91.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.222	C	C	.	.			trans	-70.6	126.2	-174.4	-160.4	77.9	0	0	0	110.8	L155 L158 L175 L181 M199 L201 L202	L155-L178 HydrophobicContact CB-CD1 4.46Å; L155-L178 HydrophobicContact CD2-CD1 4.08Å; L155-L178 HydrophobicContact CG-CD1 3.84Å; L155-L178 VanDerWaalsContact O-CA 3.31Å; L155-L178 WeakPolarHBondContact O-CA 3.24Å; L155-L178 PolarHBondContact O-N 3.11Å; L158-L178 HydrophobicContact CB-CD1 3.82Å; L158-L178 HydrophobicContact CB-CD2 4.22Å; L175-L178 HydrophobicContact CB-CB 3.78Å; L175-L178 HydrophobicContact CB-CD2 4.39Å; L175-L178 HydrophobicContact CD1-CD2 3.99Å; L175-L178 VanDerWaalsContact O-CB 3.3Å; L175-L178 WeakPolarHBondContact O-CB 3.49Å; L175-L178 PolarHBondContact O-N 3.19Å; L178-L181 HydrophobicContact CD2-CB 3.89Å; L178-L181 HydrophobicContact CD2-CD1 4.31Å; L178-L181 HydrophobicContact CD2-CD2 4.47Å; L178-L181 HydrophobicContact CD2-CG 4.45Å; L178-M199 HydrophobicContact CB-SD 4.36Å; L178-M199 HydrophobicContact CD2-SD 3.55Å; L178-M199 VanDerWaalsContact CD2-SD 3.55Å; L178-L201 CarbonylContact O-C 3.33Å; L178-L201 VanDerWaalsContact O-C 3.28Å; L178-L202 HydrophobicContact CB-CD1 4.45Å; L178-L202 HydrophobicContact CD2-CD1 4.03Å; L178-L202 HydrophobicContact CG-CD1 4.15Å; L178-L202 WeakPolarHBondContact O-CA 3.47Å; L178-L202 PolarHBondContact O-N 2.87Å; L178-L202 VanDerWaalsContact O-N 3.12Å
179	Q	97.8	Very high	91.8	Very high	62 Å²	62	53.6 Å²	53.6	29%	0.29	25%	0.249	S	C	.	.			trans	-106.5	-26.7	179	-66.1	177.4	37.2	0	0	112.3	L156 Q177 K203 S204	L156-Q179 PolarHBondContact O-N 3.35Å; Q177-Q179 PolarHBondContact O-N 3.37Å; Q179-K203 PolarHBondContact O-N 3.12Å; Q179-S204 PolarHBondContact O-N 3Å
180	F	98.4	Very high	92.4	Very high	85 Å²	85	54.8 Å²	54.8	37%	0.373	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	122.1	-177.3	-58.3	-90.1	0	0	0	111.7	L156 V157 L158	L156-F180 PolarHBondContact O-N 3.13Å; V157-F180 HydrophobicContact CG1-CB 4.33Å; V157-F180 HydrophobicContact CG2-CB 4.32Å; V157-F180 HydrophobicContact CG2-CD2 4.04Å; L158-F180 PolarHBondContact N-O 3.09Å
181	L	97.9	Very high	93.4	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	116.5	175.8	-179.7	54.7	0	0	0	110.8	L158 F173 L178 L183 F196 M199 L202 S204 L205 K206	L158-L181 HydrophobicContact CB-CD1 4.07Å; L158-L181 HydrophobicContact CD2-CD1 3.97Å; L158-L181 HydrophobicContact CG-CD1 3.95Å; F173-L181 HydrophobicContact CD1-CD2 4.32Å; F173-L181 HydrophobicContact CE1-CD1 4.33Å; F173-L181 HydrophobicContact CE1-CD2 4.27Å; F173-L181 HydrophobicContact CZ-CD2 4.41Å; L178-L181 HydrophobicContact CD2-CB 3.89Å; L178-L181 HydrophobicContact CD2-CD1 4.31Å; L178-L181 HydrophobicContact CD2-CD2 4.47Å; L178-L181 HydrophobicContact CD2-CG 4.45Å; L181-L183 HydrophobicContact CD1-CD1 4.45Å; L181-L183 HydrophobicContact CD1-CG 4.23Å; L181-L183 HydrophobicContact CD2-CD1 3.99Å; L181-L183 HydrophobicContact CG-CD1 4.08Å; L181-L183 HydrophobicContact CG-CG 4.21Å; L181-F196 HydrophobicContact CD2-CD1 4.41Å; L181-F196 HydrophobicContact CD2-CE1 4.25Å; L181-M199 HydrophobicContact CD2-CE 3.82Å; L181-M199 HydrophobicContact CD2-SD 4.15Å; L181-L202 HydrophobicContact CB-CD1 3.9Å; L181-L202 HydrophobicContact CB-CD2 4.4Å; L181-S204 PolarHBondContact N-O 2.66Å; L181-S204 VanDerWaalsContact N-O 3.07Å; L181-L205 HydrophobicContact CB-CD1 4.08Å; L181-L205 HydrophobicContact CD2-CD1 3.96Å; L181-L205 HydrophobicContact CG-CD1 3.96Å; L181-K206 PolarHBondContact O-N 2.81Å
182	E	98.3	Very high	94.5	Very high	26 Å²	26	47.6 Å²	47.6	12%	0.121	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	114.6	176.9	-53.6	-172.5	-144.2	0	0	112.1	L158 K159 L160 N161 K184 K206	L158-E182 PolarHBondContact O-N 3.25Å; K159-E182 HydrophobicContact CB-CB 4.44Å; K159-E182 WeakPolarHBondContact CD-OE1 3.27Å; K159-E182 VanDerWaalsContact CE-OE1 3.27Å; K159-E182 WeakPolarHBondContact CE-OE1 3.46Å; K159-E182 HydrophobicContact CG-CB 4.41Å; K159-E182 HydrophobicContact CG-CG 4.27Å; K159-E182 IonicContact NZ-OE1 2.69Å; K159-E182 PolarHBondContact NZ-OE1 3Å; L160-E182 CarbonylContact C-O 3.58Å; L160-E182 WeakPolarHBondContact CA-O 3.27Å; L160-E182 PolarHBondContact N-O 3.03Å; N161-E182 PolarHBondContact N-O 3.06Å; N161-E182 WeakPolarHBondContact ND2-CB 3.49Å; N161-E182 PolarHBondContact ND2-OE2 3Å; N161-E182 VanDerWaalsContact OD1-CB 3.24Å; N161-E182 WeakPolarHBondContact OD1-CB 3.42Å; E182-K184 WeakPolarHBondContact OE2-CE 3.05Å; E182-K184 IonicContact OE2-NZ 2.66Å; E182-K184 PolarHBondContact OE2-NZ 2.79Å; E182-K206 HydrophobicContact CB-CB 4.5Å; E182-K206 HydrophobicContact CG-CB 4.41Å; E182-K206 HydrophobicContact CG-CD 4.43Å
183	L	97.7	Very high	95	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.235	C	C	.	.			trans	-119.3	10.5	-178.8	-76.3	165.5	0	0	0	112.8	L160 I165 L168 F173 L181 N186 I188 F196 L205 K206 M207 N210	L160-L183 HydrophobicContact CB-CD2 3.86Å; L160-L183 HydrophobicContact CD1-CD2 3.99Å; I165-L183 HydrophobicContact CD1-CD2 4.22Å; L168-L183 HydrophobicContact CD1-CD1 4.18Å; L168-L183 HydrophobicContact CD2-CD1 4.46Å; L168-L183 HydrophobicContact CD2-CD2 4.43Å; F173-L183 HydrophobicContact CZ-CD1 4.35Å; F173-L183 HydrophobicContact CZ-CD2 4.49Å; L181-L183 HydrophobicContact CD1-CD1 4.45Å; L181-L183 HydrophobicContact CD1-CG 4.23Å; L181-L183 HydrophobicContact CD2-CD1 3.99Å; L181-L183 HydrophobicContact CG-CD1 4.08Å; L181-L183 HydrophobicContact CG-CG 4.21Å; L183-N186 PolarHBondContact O-ND2 2.84Å; L183-I188 HydrophobicContact CB-CD1 4.43Å; L183-I188 HydrophobicContact CD2-CD1 4.45Å; L183-F196 HydrophobicContact CD1-CE1 4.23Å; L183-L205 HydrophobicContact CD1-CD1 4.38Å; L183-K206 CarbonylContact C-O 3.48Å; L183-K206 WeakPolarHBondContact CA-O 3.34Å; L183-K206 PolarHBondContact N-O 3.07Å; L183-M207 HydrophobicContact CB-CG 4.27Å; L183-M207 HydrophobicContact CD1-CE 4.43Å; L183-N210 PolarHBondContact O-ND2 3.19Å
184	K	97.4	Very high	95.4	Very high	55 Å²	55	54.4 Å²	54.4	24%	0.239	26%	0.255	C	S	.	.			trans	-67	148.1	-170.8	78.5	-125.7	-178.5	179.5	0	113.4	N161 R162 E182 K206 Q208	N161-K184 CarbonylContact C-O 3.57Å; N161-K184 VanDerWaalsContact CA-O 3.25Å; N161-K184 WeakPolarHBondContact CA-O 3.31Å; N161-K184 HydrophobicContact CB-CG 4.39Å; N161-K184 WeakPolarHBondContact OD1-CD 3.3Å; N161-K184 WeakPolarHBondContact OD1-CE 3.37Å; N161-K184 WeakPolarHBondContact OD1-CG 3.24Å; N161-K184 PolarHBondContact OD1-N 3.2Å; R162-K184 PolarHBondContact N-O 3.2Å; E182-K184 WeakPolarHBondContact OE2-CE 3.05Å; E182-K184 IonicContact OE2-NZ 2.66Å; E182-K184 PolarHBondContact OE2-NZ 2.79Å; K184-K206 HydrophobicContact CD-CB 4.39Å; K184-K206 PolarHBondContact N-O 3.11Å; K184-K206 VanDerWaalsContact N-O 3.11Å; K184-Q208 CarbonylContact C-O 3.52Å; K184-Q208 VanDerWaalsContact CA-O 3.26Å; K184-Q208 WeakPolarHBondContact CA-O 3.42Å; K184-Q208 HydrophobicContact CB-CB 4.24Å; K184-Q208 WeakPolarHBondContact CB-O 3.24Å; K184-Q208 VanDerWaalsContact CB-OE1 3.29Å
185	R	97.9	Very high	95.6	Very high	112 Å²	112	48.7 Å²	48.7	42%	0.423	23%	0.234	S	C	.	.	S	Bend	trans	59.6	44.1	-175.9	-55.3	178.2	-174.1	-160	1.4	113.3	R162 Q208 R209	R162-R185 VanDerWaalsContact CA-O 3.23Å; R162-R185 WeakPolarHBondContact CA-O 3.37Å; R162-R185 HydrophobicContact CG-CB 4.04Å; R162-R185 PolarHBondContact N-O 2.95Å; R185-Q208 PolarHBondContact N-O 3.33Å; R185-R209 WeakPolarHBondContact CA-O 3.15Å; R185-R209 HydrophobicContact CG-CB 3.79Å; R185-R209 HydrophobicContact CG-CG 4.45Å
186	N	98.2	Very high	95.6	Very high	10 Å²	10	48.7 Å²	48.7	5%	0.053	23%	0.234	C	C	.	.	S	Bend	trans	-101.2	-153.7	165.6	-86	-76.6	0	0	0	109.5	L160 N163 R164 I165 L183 I188 N210	L160-N186 PolarHBondContact O-ND2 3.23Å; N163-N186 VanDerWaalsContact CA-OD1 3.25Å; N163-N186 WeakPolarHBondContact CA-OD1 3.37Å; N163-N186 WeakPolarHBondContact CB-OD1 3.09Å; N163-N186 PolarHBondContact N-OD1 3.43Å; N163-N186 PolarHBondContact O-OD1 2.88Å; R164-N186 PolarHBondContact N-OD1 3.08Å; I165-N186 HydrophobicContact CB-CB 4.23Å; I165-N186 WeakPolarHBondContact CB-OD1 3.26Å; I165-N186 WeakPolarHBondContact CG1-OD1 3.47Å; I165-N186 PolarHBondContact N-OD1 3.3Å; I165-N186 VanDerWaalsContact N-OD1 3.08Å; L183-N186 PolarHBondContact O-ND2 2.84Å; N186-I188 HydrophobicContact CB-CD1 4.28Å; N186-I188 HydrophobicContact CB-CG1 4.28Å; N186-N210 VanDerWaalsContact CA-OD1 3.27Å; N186-N210 WeakPolarHBondContact CA-OD1 3.43Å; N186-N210 WeakPolarHBondContact CB-OD1 3.33Å; N186-N210 PolarHBondContact N-OD1 3.4Å
187	K	97.2	Very high	95.5	Very high	125 Å²	125	51.8 Å²	51.8	54%	0.543	24%	0.242	S	C	.	.			trans	-129	27.5	-178.8	-61.5	-172.1	174.6	-169.5	0	112.4	I165 T166 K189 N210	I165-K187 CarbonylContact O-C 3.6Å; I165-K187 VanDerWaalsContact O-C 3.27Å; I165-K187 WeakPolarHBondContact O-CA 3.27Å; I165-K187 PolarHBondContact O-N 3.04Å; T166-K187 HydrophobicContact CG2-CB 4Å; K187-K189 PolarHBondContact O-N 2.86Å; K187-N210 CarbonylContact C-O 3.57Å; K187-N210 WeakPolarHBondContact CA-O 3.33Å; K187-N210 PolarHBondContact N-OD1 3.32Å
188	I	96.5	Very high	95.1	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.234	C	C	.	.			trans	-73	113.3	-174.3	-57.5	162.7	0	0	0	108.9	I165 L168 L183 N186 I190 V191 M207 N210 I212	I165-I188 HydrophobicContact CG2-CG1 4.29Å; I165-I188 PolarHBondContact O-N 3.34Å; L168-I188 HydrophobicContact CD1-CD1 4.08Å; L168-I188 HydrophobicContact CD1-CG2 4.49Å; L168-I188 HydrophobicContact CD2-CD1 3.8Å; L168-I188 HydrophobicContact CD2-CG1 4.38Å; L168-I188 HydrophobicContact CG-CD1 4.01Å; L168-I188 HydrophobicContact CG-CG1 4.42Å; L168-I188 HydrophobicContact CG-CG2 4.38Å; L183-I188 HydrophobicContact CB-CD1 4.43Å; L183-I188 HydrophobicContact CD2-CD1 4.45Å; N186-I188 HydrophobicContact CB-CD1 4.28Å; N186-I188 HydrophobicContact CB-CG1 4.28Å; I188-I190 WeakPolarHBondContact CG2-O 3.49Å; I188-V191 HydrophobicContact CG2-CG2 4.31Å; I188-M207 HydrophobicContact CD1-CE 4.18Å; I188-N210 HydrophobicContact CB-CB 4.23Å; I188-N210 WeakPolarHBondContact CB-OD1 3.24Å; I188-N210 WeakPolarHBondContact CD1-OD1 3.38Å; I188-N210 WeakPolarHBondContact CG1-OD1 3.1Å; I188-N210 PolarHBondContact N-O 3.48Å; I188-N210 PolarHBondContact N-OD1 3.2Å; I188-N210 VanDerWaalsContact N-OD1 3.08Å; I188-I212 WeakPolarHBondContact O-CA 3.49Å; I188-I212 WeakPolarHBondContact O-CG1 3.4Å; I188-I212 PolarHBondContact O-N 2.95Å
189	K	95.7	Very high	94.9	Very high	140 Å²	140	49 Å²	49	61%	0.609	23%	0.234	S	C	*	.			trans	-91.9	-30.5	-179.8	-69.8	-168.6	173.7	-169.9	0	114.2	K187 I212 T213 K214	K187-K189 PolarHBondContact O-N 2.86Å; K189-I212 CarbonylContact O-C 3.36Å; K189-I212 WeakPolarHBondContact O-CA 3.47Å; K189-T213 PolarHBondContact O-N 3.28Å; K189-T213 PolarHBondContact O-OG1 2.6Å; K189-K214 PolarHBondContact O-N 3.21Å
190	I	95.1	Very high	94.5	Very high	63 Å²	63	49.1 Å²	49.1	32%	0.323	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	140.9	-174.9	-59.2	178.8	0	0	0	108.1	I188 K214 M216	I188-I190 WeakPolarHBondContact CG2-O 3.49Å; I190-K214 WeakPolarHBondContact CA-O 3.02Å; I190-M216 HydrophobicContact CG2-CE 3.92Å; I190-M216 HydrophobicContact CG2-CG 4.44Å
191	V	95	Very high	94.4	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	119.3	164.7	-172.7	0	0	0	0	107.7	I188 T195 F196 M207 I212 K214 L215 M216 A219	I188-V191 HydrophobicContact CG2-CG2 4.31Å; V191-T195 HydrophobicContact CG1-CG2 4.18Å; V191-F196 HydrophobicContact CG1-CD2 4.39Å; V191-F196 HydrophobicContact CG1-CE2 3.66Å; V191-F196 HydrophobicContact CG1-CZ 4.26Å; V191-M207 HydrophobicContact CG2-CE 3.86Å; V191-I212 HydrophobicContact CG2-CD1 4.49Å; V191-K214 PolarHBondContact N-O 2.88Å; V191-L215 HydrophobicContact CB-CD2 3.75Å; V191-L215 HydrophobicContact CG2-CD2 3.65Å; V191-M216 WeakPolarHBondContact O-CG 3.37Å; V191-M216 PolarHBondContact O-N 3.33Å; V191-A219 HydrophobicContact CB-CB 4.25Å; V191-A219 HydrophobicContact CG1-CB 3.86Å
192	D	92.5	Very high	94.4	Very high	64 Å²	64	48.3 Å²	48.3	34%	0.342	24%	0.236	S	C	.	.			trans	-83.9	162.8	-177.1	-69.1	-52.5	0	0	0	112.2	L194 T195 A219	D192-L194 PolarHBondContact O-N 3.08Å; D192-T195 PolarHBondContact N-OG1 2.86Å; D192-T195 WeakPolarHBondContact O-CB 3.39Å; D192-T195 PolarHBondContact O-N 3.44Å; D192-T195 PolarHBondContact O-OG1 2.76Å; D192-A219 WeakPolarHBondContact O-CA 3.42Å
193	S	91.7	Very high	94.4	Very high	60 Å²	60	50.6 Å²	50.6	42%	0.42	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	135.1	176.6	-54.5	0	0	0	0	111.1	T195 D217	S193-T195 PolarHBondContact O-N 2.77Å; S193-D217 WeakPolarHBondContact CB-O 3.43Å; S193-D217 PolarHBondContact OG-O 3.21Å
194	L	90.6	Very high	94.4	Very high	84 Å²	84	50.9 Å²	50.9	44%	0.44	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	11.6	178.3	-40.5	176	0	0	0	115.7	D192 F196 K197 G218 F221	D192-L194 PolarHBondContact O-N 3.08Å; L194-F196 PolarHBondContact O-N 3.03Å; L194-K197 HydrophobicContact CB-CB 4.18Å; L194-K197 HydrophobicContact CB-CD 4.43Å; L194-K197 HydrophobicContact CD2-CD 4.43Å; L194-K197 WeakPolarHBondContact O-CB 3.49Å; L194-K197 PolarHBondContact O-N 3.14Å; L194-G218 PolarHBondContact N-O 2.79Å; L194-F221 HydrophobicContact CD2-CB 4.1Å; L194-F221 HydrophobicContact CD2-CD1 3.53Å; L194-F221 HydrophobicContact CD2-CE1 4.36Å; L194-F221 HydrophobicContact CD2-CG 4.14Å
195	T	91.8	Very high	94.4	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.018	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49	-37.7	-178.5	-75.2	0	0	0	0	113.3	L168 V191 D192 S193	L168-T195 HydrophobicContact CB-CG2 3.63Å; L168-T195 HydrophobicContact CD1-CG2 3.85Å; L168-T195 HydrophobicContact CG-CG2 4.41Å; V191-T195 HydrophobicContact CG1-CG2 4.18Å; D192-T195 PolarHBondContact N-OG1 2.86Å; D192-T195 WeakPolarHBondContact O-CB 3.39Å; D192-T195 PolarHBondContact O-N 3.44Å; D192-T195 PolarHBondContact O-OG1 2.76Å; S193-T195 PolarHBondContact O-N 2.77Å
196	F	92.3	Very high	94.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	11.2	-175.1	-57.5	-64.8	0	0	0	114.8	L168 F173 L181 L183 V191 L194 G198 M199 L205 M207 A219 F220 L223	L168-F196 HydrophobicContact CD1-CE1 3.8Å; L168-F196 HydrophobicContact CD1-CZ 3.66Å; F173-F196 AromaticContact CD2-CD1 3.9Å; F173-F196 HydrophobicContact CD2-CD1 3.9Å; F173-F196 HydrophobicContact CD2-CE1 4.07Å; F173-F196 HydrophobicContact CE2-CD1 4.35Å; F173-F196 HydrophobicContact CE2-CE1 4.05Å; L181-F196 HydrophobicContact CD2-CD1 4.41Å; L181-F196 HydrophobicContact CD2-CE1 4.25Å; L183-F196 HydrophobicContact CD1-CE1 4.23Å; V191-F196 HydrophobicContact CG1-CD2 4.39Å; V191-F196 HydrophobicContact CG1-CE2 3.66Å; V191-F196 HydrophobicContact CG1-CZ 4.26Å; L194-F196 PolarHBondContact O-N 3.03Å; F196-G198 PolarHBondContact O-N 3Å; F196-M199 HydrophobicContact CB-CE 3.67Å; F196-M199 HydrophobicContact CD1-CE 3.55Å; F196-M199 HydrophobicContact CG-CE 4.03Å; F196-L205 HydrophobicContact CD2-CD2 4.16Å; F196-L205 HydrophobicContact CE1-CD1 4.5Å; F196-L205 HydrophobicContact CE1-CD2 4.43Å; F196-L205 HydrophobicContact CE2-CD2 3.87Å; F196-L205 HydrophobicContact CZ-CD2 4.01Å; F196-M207 HydrophobicContact CE2-SD 4.14Å; F196-M207 HydrophobicContact CZ-CE 3.96Å; F196-M207 HydrophobicContact CZ-SD 3.71Å; F196-A219 WeakPolarHBondContact CD2-O 3.43Å; F196-F220 AromaticContact CD2-CD1 3.75Å; F196-F220 HydrophobicContact CD2-CD1 3.75Å; F196-F220 HydrophobicContact CD2-CE1 4.18Å; F196-F220 AromaticContact CE2-CD1 3.76Å; F196-F220 HydrophobicContact CE2-CD1 3.76Å; F196-F220 AromaticContact CE2-CE1 3.69Å; F196-F220 HydrophobicContact CE2-CE1 3.69Å; F196-L223 HydrophobicContact CB-CD1 3.74Å; F196-L223 HydrophobicContact CB-CD2 3.82Å; F196-L223 HydrophobicContact CB-CG 3.98Å; F196-L223 HydrophobicContact CD2-CD1 4.12Å; F196-L223 HydrophobicContact CG-CD1 4.14Å
197	K	90.5	Very high	94.4	Very high	118 Å²	118	44 Å²	44	51%	0.513	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	123.1	-176.9	-178.7	173.5	-179.3	171.3	0	112	L194	L194-K197 HydrophobicContact CB-CB 4.18Å; L194-K197 HydrophobicContact CB-CD 4.43Å; L194-K197 HydrophobicContact CD2-CD 4.43Å; L194-K197 WeakPolarHBondContact O-CB 3.49Å; L194-K197 PolarHBondContact O-N 3.14Å
198	G	88.8	Confident	94.4	Very high	19 Å²	19	39.1 Å²	39.1	20%	0.196	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.3	14.7	-177	0	0	0	0	0	114.5	L175 P176 F196	L175-G198 CarbonylContact C-O 3.59Å; L175-G198 VanDerWaalsContact C-O 3.32Å; L175-G198 PolarHBondContact N-O 3.34Å; P176-G198 WeakPolarHBondContact CA-O 3.32Å; F196-G198 PolarHBondContact O-N 3Å
199	M	92.3	Very high	94.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.22	C	C	.	.			trans	-116.3	56.1	167.4	-57.4	-170.5	-75.3	0	0	110.4	F173 L175 L178 L181 F196 L201 L202 L223	F173-M199 HydrophobicContact CB-CE 3.69Å; F173-M199 HydrophobicContact CB-CG 4.23Å; F173-M199 HydrophobicContact CB-SD 3.71Å; F173-M199 HydrophobicContact CG-CE 4.19Å; F173-M199 HydrophobicContact CG-SD 4.36Å; F173-M199 VanDerWaalsContact O-CG 3.24Å; F173-M199 WeakPolarHBondContact O-CG 3.4Å; L175-M199 HydrophobicContact CB-CG 4.05Å; L175-M199 HydrophobicContact CB-SD 4.28Å; L178-M199 HydrophobicContact CB-SD 4.36Å; L178-M199 HydrophobicContact CD2-SD 3.55Å; L178-M199 VanDerWaalsContact CD2-SD 3.55Å; L181-M199 HydrophobicContact CD2-CE 3.82Å; L181-M199 HydrophobicContact CD2-SD 4.15Å; F196-M199 HydrophobicContact CB-CE 3.67Å; F196-M199 HydrophobicContact CD1-CE 3.55Å; F196-M199 HydrophobicContact CG-CE 4.03Å; M199-L201 PolarHBondContact O-N 2.86Å; M199-L201 VanDerWaalsContact O-N 3.08Å; M199-L202 HydrophobicContact CB-CB 4.01Å; M199-L202 HydrophobicContact CE-CD2 3.83Å; M199-L202 VanDerWaalsContact O-CB 3.25Å; M199-L202 WeakPolarHBondContact O-CB 3.49Å; M199-L202 PolarHBondContact O-N 3.16Å; M199-L202 HydrophobicContact SD-CD2 4.32Å; M199-L223 HydrophobicContact CB-CD2 4.06Å; M199-L223 HydrophobicContact CE-CD2 4.32Å
200	D	89.8	Confident	94.6	Very high	65 Å²	65	38.5 Å²	38.5	35%	0.348	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.8	-170.9	-61.9	-94.1	0	0	0	114.3	N224 N225	D200-N224 PolarHBondContact OD1-ND2 2.83Å; D200-N225 WeakPolarHBondContact O-CB 3.37Å; D200-N225 PolarHBondContact O-N 3.01Å; D200-N225 PolarHBondContact O-ND2 3.28Å
201	L	95.9	Very high	94.6	Very high	69 Å²	69	37 Å²	37	36%	0.361	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	6.3	177.4	-61.8	-177.5	0	0	0	114.5	P176 L178 M199 K203	P176-L201 WeakPolarHBondContact O-CD1 3.43Å; P176-L201 WeakPolarHBondContact O-CG 3.42Å; L178-L201 CarbonylContact O-C 3.33Å; L178-L201 VanDerWaalsContact O-C 3.28Å; M199-L201 PolarHBondContact O-N 2.86Å; M199-L201 VanDerWaalsContact O-N 3.08Å; L201-K203 PolarHBondContact O-N 3.37Å
202	L	97.2	Very high	94.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.			trans	-68.4	122.4	-178.3	-168	71.4	0	0	0	111.1	L178 L181 M199 L205 L223 N225 M226	L178-L202 HydrophobicContact CB-CD1 4.45Å; L178-L202 HydrophobicContact CD2-CD1 4.03Å; L178-L202 HydrophobicContact CG-CD1 4.15Å; L178-L202 WeakPolarHBondContact O-CA 3.47Å; L178-L202 PolarHBondContact O-N 2.87Å; L178-L202 VanDerWaalsContact O-N 3.12Å; L181-L202 HydrophobicContact CB-CD1 3.9Å; L181-L202 HydrophobicContact CB-CD2 4.4Å; M199-L202 HydrophobicContact CB-CB 4.01Å; M199-L202 HydrophobicContact CE-CD2 3.83Å; M199-L202 VanDerWaalsContact O-CB 3.25Å; M199-L202 WeakPolarHBondContact O-CB 3.49Å; M199-L202 PolarHBondContact O-N 3.16Å; M199-L202 HydrophobicContact SD-CD2 4.32Å; L202-L205 HydrophobicContact CD2-CB 4.28Å; L202-L223 HydrophobicContact CB-CD2 4.1Å; L202-L223 HydrophobicContact CD2-CD1 4.28Å; L202-L223 HydrophobicContact CD2-CD2 3.8Å; L202-N225 CarbonylContact O-C 3.58Å; L202-M226 HydrophobicContact CD2-CE 3.91Å; L202-M226 HydrophobicContact CG-CE 4.35Å; L202-M226 WeakPolarHBondContact O-CA 3.15Å; L202-M226 PolarHBondContact O-N 3.44Å; L202-M226 VanDerWaalsContact O-N 3.14Å
203	K	97.9	Very high	95	Very high	75 Å²	75	37.2 Å²	37.2	33%	0.326	20%	0.198	S	C	.	.			trans	-100.4	-34.4	-177.8	-72.6	170.3	166	-78.3	0	113.4	Q179 L201 E227 E228	Q179-K203 PolarHBondContact O-N 3.12Å; L201-K203 PolarHBondContact O-N 3.37Å; K203-E227 IonicContact NZ-OE1 2.68Å; K203-E227 PolarHBondContact NZ-OE1 3.08Å; K203-E227 PolarHBondContact O-N 3.1Å; K203-E228 PolarHBondContact O-N 2.8Å
204	S	98.4	Very high	95.1	Very high	6 Å²	6	39.7 Å²	39.7	4%	0.042	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	127	-175.2	176.2	0	0	0	0	111.5	Q179 L181 K206 E228	Q179-S204 PolarHBondContact O-N 3Å; L181-S204 PolarHBondContact N-O 2.66Å; L181-S204 VanDerWaalsContact N-O 3.07Å; S204-K206 WeakPolarHBondContact OG-CE 3.38Å; S204-E228 WeakPolarHBondContact CA-O 3.2Å; S204-E228 WeakPolarHBondContact CB-OE2 3.43Å; S204-E228 PolarHBondContact OG-OE2 3.46Å
205	L	98.1	Very high	95.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	113.4	178	175.2	56.2	0	0	0	110.6	L181 L183 F196 L202 M207 F220 L223 M226 E228 L229 E230	L181-L205 HydrophobicContact CB-CD1 4.08Å; L181-L205 HydrophobicContact CD2-CD1 3.96Å; L181-L205 HydrophobicContact CG-CD1 3.96Å; L183-L205 HydrophobicContact CD1-CD1 4.38Å; F196-L205 HydrophobicContact CD2-CD2 4.16Å; F196-L205 HydrophobicContact CE1-CD1 4.5Å; F196-L205 HydrophobicContact CE1-CD2 4.43Å; F196-L205 HydrophobicContact CE2-CD2 3.87Å; F196-L205 HydrophobicContact CZ-CD2 4.01Å; L202-L205 HydrophobicContact CD2-CB 4.28Å; L205-M207 HydrophobicContact CD1-CG 3.77Å; L205-M207 HydrophobicContact CD1-SD 4Å; L205-M207 HydrophobicContact CD2-SD 3.97Å; L205-M207 HydrophobicContact CG-CG 3.92Å; L205-M207 HydrophobicContact CG-SD 3.97Å; L205-F220 HydrophobicContact CD2-CD1 3.9Å; L205-F220 HydrophobicContact CD2-CE1 3.79Å; L205-L223 HydrophobicContact CD2-CD1 4.09Å; L205-M226 HydrophobicContact CB-CE 3.42Å; L205-M226 VanDerWaalsContact CB-CE 3.42Å; L205-M226 HydrophobicContact CB-SD 4.03Å; L205-M226 HydrophobicContact CD2-CE 3.93Å; L205-M226 HydrophobicContact CG-CE 4.34Å; L205-E228 PolarHBondContact N-O 3.05Å; L205-L229 HydrophobicContact CB-CD1 4.15Å; L205-L229 HydrophobicContact CD2-CD1 4.07Å; L205-L229 HydrophobicContact CG-CD1 4.07Å; L205-E230 PolarHBondContact O-N 3.2Å; L205-E230 VanDerWaalsContact O-N 3.08Å
206	K	98.3	Very high	95.6	Very high	31 Å²	31	38.2 Å²	38.2	14%	0.135	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	102.4	-172.1	-60.6	-165.4	176.9	-65	0	111.3	L181 E182 L183 K184 S204 E228 E230	L181-K206 PolarHBondContact O-N 2.81Å; E182-K206 HydrophobicContact CB-CB 4.5Å; E182-K206 HydrophobicContact CG-CB 4.41Å; E182-K206 HydrophobicContact CG-CD 4.43Å; L183-K206 CarbonylContact C-O 3.48Å; L183-K206 WeakPolarHBondContact CA-O 3.34Å; L183-K206 PolarHBondContact N-O 3.07Å; K184-K206 HydrophobicContact CD-CB 4.39Å; K184-K206 PolarHBondContact N-O 3.11Å; K184-K206 VanDerWaalsContact N-O 3.11Å; S204-K206 WeakPolarHBondContact OG-CE 3.38Å; K206-E228 WeakPolarHBondContact CE-OE2 3.35Å; K206-E228 IonicContact NZ-OE1 3.81Å; K206-E228 PolarHBondContact NZ-OE1 3.01Å; K206-E228 IonicContact NZ-OE2 2.61Å; K206-E228 PolarHBondContact NZ-OE2 3.06Å; K206-E230 WeakPolarHBondContact CD-OE2 3.16Å; K206-E230 HydrophobicContact CG-CB 4.5Å; K206-E230 WeakPolarHBondContact CG-OE2 3.07Å; K206-E230 IonicContact NZ-OE1 2.66Å; K206-E230 PolarHBondContact NZ-OE1 3.34Å; K206-E230 IonicContact NZ-OE2 3.59Å; K206-E230 PolarHBondContact NZ-OE2 3.4Å
207	M	97.3	Very high	95.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.22	C	C	.	.			trans	-120.8	16.9	-170.8	-66.2	-170.8	76.1	0	0	114.5	L168 L183 I188 V191 F196 L205 N210 I212 F220 E230 L231 N234	L168-M207 HydrophobicContact CD1-CE 4.15Å; L183-M207 HydrophobicContact CB-CG 4.27Å; L183-M207 HydrophobicContact CD1-CE 4.43Å; I188-M207 HydrophobicContact CD1-CE 4.18Å; V191-M207 HydrophobicContact CG2-CE 3.86Å; F196-M207 HydrophobicContact CE2-SD 4.14Å; F196-M207 HydrophobicContact CZ-CE 3.96Å; F196-M207 HydrophobicContact CZ-SD 3.71Å; L205-M207 HydrophobicContact CD1-CG 3.77Å; L205-M207 HydrophobicContact CD1-SD 4Å; L205-M207 HydrophobicContact CD2-SD 3.97Å; L205-M207 HydrophobicContact CG-CG 3.92Å; L205-M207 HydrophobicContact CG-SD 3.97Å; M207-N210 PolarHBondContact O-ND2 3.02Å; M207-I212 HydrophobicContact CB-CD1 4.36Å; M207-I212 HydrophobicContact CE-CD1 4.07Å; M207-F220 HydrophobicContact SD-CE1 4.27Å; M207-E230 CarbonylContact C-O 3.54Å; M207-E230 WeakPolarHBondContact CA-O 3.22Å; M207-E230 PolarHBondContact N-O 2.98Å; M207-L231 HydrophobicContact CB-CD2 3.95Å; M207-N234 PolarHBondContact O-ND2 3.37Å
208	Q	96.9	Very high	95.8	Very high	23 Å²	23	38 Å²	38	11%	0.107	20%	0.199	C	C	.	.			trans	-56.8	155.9	-177.9	-42.7	89.7	51.7	0	0	113.8	K184 R185 N210 E230 E232	K184-Q208 CarbonylContact C-O 3.52Å; K184-Q208 VanDerWaalsContact CA-O 3.26Å; K184-Q208 WeakPolarHBondContact CA-O 3.42Å; K184-Q208 HydrophobicContact CB-CB 4.24Å; K184-Q208 WeakPolarHBondContact CB-O 3.24Å; K184-Q208 VanDerWaalsContact CB-OE1 3.29Å; R185-Q208 PolarHBondContact N-O 3.33Å; Q208-N210 VanDerWaalsContact C-N 3.33Å; Q208-N210 PolarHBondContact O-N 3.42Å; Q208-E230 HydrophobicContact CG-CB 4.29Å; Q208-E230 PolarHBondContact N-O 2.92Å; Q208-E230 PolarHBondContact NE2-O 2.89Å; Q208-E230 PolarHBondContact NE2-OE2 3.31Å; Q208-E232 CarbonylContact C-O 3.58Å; Q208-E232 WeakPolarHBondContact CA-O 3.25Å; Q208-E232 HydrophobicContact CB-CB 4.4Å; Q208-E232 VanDerWaalsContact CB-O 3.27Å; Q208-E232 WeakPolarHBondContact CB-O 3.26Å; Q208-E232 HydrophobicContact CG-CB 4.08Å; Q208-E232 HydrophobicContact CG-CG 4.47Å; Q208-E232 VanDerWaalsContact CG-OE2 3.26Å; Q208-E232 WeakPolarHBondContact CG-OE2 3.27Å
209	R	97.8	Very high	96	Very high	117 Å²	117	37.1 Å²	37.1	44%	0.442	19%	0.19	S	C	.	.	S	Bend	trans	56.8	41	169.9	-63.5	-179.9	-176.7	-143	2.8	113.4	R185 E232 H233	R185-R209 WeakPolarHBondContact CA-O 3.15Å; R185-R209 HydrophobicContact CG-CB 3.79Å; R185-R209 HydrophobicContact CG-CG 4.45Å; R209-E232 PolarHBondContact N-O 3.33Å; R209-H233 VanDerWaalsContact CA-O 3.24Å; R209-H233 WeakPolarHBondContact CA-O 3.43Å; R209-H233 HydrophobicContact CB-CB 4.27Å; R209-H233 HydrophobicContact CG-CB 3.36Å; R209-H233 PolarHBondContact N-O 3.05Å; R209-H233 PolarHBondContact NE-CD2 3.25Å; R209-H233 PolarHBondContact NE-NE2 2.83Å; R209-H233 PolarHBondContact NH2-CE1 3.28Å; R209-H233 PolarHBondContact NH2-NE2 2.95Å
210	N	97.8	Very high	96.1	Very high	10 Å²	10	37.1 Å²	37.1	5%	0.053	19%	0.19	C	C	.	.	S	Bend	trans	-99.5	-25.3	177.9	-97.7	-74.4	0	0	0	113.5	L183 N186 K187 I188 M207 Q208 I212 N234	L183-N210 PolarHBondContact O-ND2 3.19Å; N186-N210 VanDerWaalsContact CA-OD1 3.27Å; N186-N210 WeakPolarHBondContact CA-OD1 3.43Å; N186-N210 WeakPolarHBondContact CB-OD1 3.33Å; N186-N210 PolarHBondContact N-OD1 3.4Å; K187-N210 CarbonylContact C-O 3.57Å; K187-N210 WeakPolarHBondContact CA-O 3.33Å; K187-N210 PolarHBondContact N-OD1 3.32Å; I188-N210 HydrophobicContact CB-CB 4.23Å; I188-N210 WeakPolarHBondContact CB-OD1 3.24Å; I188-N210 WeakPolarHBondContact CD1-OD1 3.38Å; I188-N210 WeakPolarHBondContact CG1-OD1 3.1Å; I188-N210 PolarHBondContact N-O 3.48Å; I188-N210 PolarHBondContact N-OD1 3.2Å; I188-N210 VanDerWaalsContact N-OD1 3.08Å; M207-N210 PolarHBondContact O-ND2 3.02Å; Q208-N210 VanDerWaalsContact C-N 3.33Å; Q208-N210 PolarHBondContact O-N 3.42Å; N210-I212 HydrophobicContact CB-CD1 4.21Å; N210-I212 HydrophobicContact CB-CG1 3.77Å; N210-N234 WeakPolarHBondContact CA-OD1 3.15Å; N210-N234 WeakPolarHBondContact CB-OD1 3.3Å; N210-N234 PolarHBondContact N-OD1 2.85Å
211	G	96.6	Very high	96.3	Very high	33 Å²	33	37 Å²	37	34%	0.34	19%	0.186	S	C	.	.			trans	78.6	32.4	-169.2	0	0	0	0	0	112.6	T213 N234	G211-T213 PolarHBondContact O-N 3.2Å; G211-N234 PolarHBondContact N-OD1 3.29Å
212	I	97.9	Very high	96	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.171	C	C	.	.			trans	-63.6	116.7	176.5	-55.3	167.3	0	0	0	108.5	I188 K189 V191 M207 N210 L215 L231 N234 N235 L236	I188-I212 WeakPolarHBondContact O-CA 3.49Å; I188-I212 WeakPolarHBondContact O-CG1 3.4Å; I188-I212 PolarHBondContact O-N 2.95Å; K189-I212 CarbonylContact O-C 3.36Å; K189-I212 WeakPolarHBondContact O-CA 3.47Å; V191-I212 HydrophobicContact CG2-CD1 4.49Å; M207-I212 HydrophobicContact CB-CD1 4.36Å; M207-I212 HydrophobicContact CE-CD1 4.07Å; N210-I212 HydrophobicContact CB-CD1 4.21Å; N210-I212 HydrophobicContact CB-CG1 3.77Å; I212-L215 HydrophobicContact CG2-CD2 3.87Å; I212-L215 HydrophobicContact CG2-CG 4.25Å; I212-L231 HydrophobicContact CD1-CD2 3.78Å; I212-N234 HydrophobicContact CB-CB 4.12Å; I212-N234 PolarHBondContact N-OD1 2.99Å; I212-N235 CarbonylContact O-C 3.39Å; I212-N235 VanDerWaalsContact O-C 3.22Å; I212-N235 WeakPolarHBondContact O-CA 3.29Å; I212-N235 PolarHBondContact O-N 3.39Å; I212-L236 HydrophobicContact CB-CD2 4.44Å; I212-L236 HydrophobicContact CG2-CD2 3.88Å; I212-L236 PolarHBondContact O-N 3.33Å
213	T	96.5	Very high	95.8	Very high	69 Å²	69	33.9 Å²	33.9	42%	0.423	17%	0.171	S	C	.	.			trans	-97.4	-21.5	175.7	51.9	0	0	0	0	112.6	K189 G211 N235	K189-T213 PolarHBondContact O-N 3.28Å; K189-T213 PolarHBondContact O-OG1 2.6Å; G211-T213 PolarHBondContact O-N 3.2Å; T213-N235 HydrophobicContact CG2-CB 4.02Å
214	K	95.4	Very high	95.4	Very high	111 Å²	111	33.8 Å²	33.8	48%	0.483	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	137	179	-165.9	177.2	-175.8	-165.2	0	112.5	K189 I190 V191 M216	K189-K214 PolarHBondContact O-N 3.21Å; I190-K214 WeakPolarHBondContact CA-O 3.02Å; V191-K214 PolarHBondContact N-O 2.88Å; K214-M216 HydrophobicContact CD-CE 4.05Å; K214-M216 HydrophobicContact CD-SD 3.72Å; K214-M216 WeakPolarHBondContact CE-SD 3.2Å; K214-M216 HydrophobicContact CG-SD 4.34Å; K214-M216 PolarHBondContact NZ-SD 2.95Å
215	L	96.6	Very high	95.3	Very high	9 Å²	9	36.6 Å²	36.6	5%	0.047	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	132	161.7	-58.8	168.4	0	0	0	106.8	V191 I212 A219 F220 L231 L236 W243	V191-L215 HydrophobicContact CB-CD2 3.75Å; V191-L215 HydrophobicContact CG2-CD2 3.65Å; I212-L215 HydrophobicContact CG2-CD2 3.87Å; I212-L215 HydrophobicContact CG2-CG 4.25Å; L215-A219 HydrophobicContact CB-CB 4.48Å; L215-F220 HydrophobicContact CD1-CE2 3.97Å; L215-F220 HydrophobicContact CD1-CZ 4.3Å; L215-F220 HydrophobicContact CD2-CE2 4.28Å; L215-F220 HydrophobicContact CD2-CZ 3.98Å; L215-L231 HydrophobicContact CD1-CD1 4.19Å; L215-L236 HydrophobicContact CD1-CD1 3.92Å; L215-L236 HydrophobicContact CD1-CD2 4.02Å; L215-L236 HydrophobicContact CG-CD2 3.9Å; L215-W243 HydrophobicContact CB-CB 3.59Å; L215-W243 HydrophobicContact CB-CD2 4.27Å; L215-W243 HydrophobicContact CB-CG 3.79Å; L215-W243 HydrophobicContact CD1-CB 4.45Å; L215-W243 HydrophobicContact CD1-CD2 3.56Å; L215-W243 HydrophobicContact CD1-CE3 3.51Å; L215-W243 HydrophobicContact CD1-CG 4.02Å; L215-W243 HydrophobicContact CD1-CH2 4.23Å; L215-W243 HydrophobicContact CD1-CZ2 4.28Å; L215-W243 HydrophobicContact CD1-CZ3 3.86Å
216	M	94.6	Very high	95.2	Very high	48 Å²	48	36.6 Å²	36.6	24%	0.236	19%	0.189	C	C	.	.			trans	-84.5	162.5	175	-59.9	-64.3	-168.9	0	0	111.1	I190 V191 K214 G218 A219	I190-M216 HydrophobicContact CG2-CE 3.92Å; I190-M216 HydrophobicContact CG2-CG 4.44Å; V191-M216 WeakPolarHBondContact O-CG 3.37Å; V191-M216 PolarHBondContact O-N 3.33Å; K214-M216 HydrophobicContact CD-CE 4.05Å; K214-M216 HydrophobicContact CD-SD 3.72Å; K214-M216 WeakPolarHBondContact CE-SD 3.2Å; K214-M216 HydrophobicContact CG-SD 4.34Å; K214-M216 PolarHBondContact NZ-SD 2.95Å; M216-G218 PolarHBondContact O-N 2.84Å; M216-A219 WeakPolarHBondContact O-CB 3.38Å; M216-A219 PolarHBondContact O-N 3.3Å
217	D	94.9	Very high	95.2	Very high	107 Å²	107	37.9 Å²	37.9	57%	0.572	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	132.1	177.4	-64.5	-5	0	0	0	110.7	S193 A219 G242	S193-D217 WeakPolarHBondContact CB-O 3.43Å; S193-D217 PolarHBondContact OG-O 3.21Å; D217-A219 VanDerWaalsContact C-N 3.28Å; D217-A219 PolarHBondContact O-N 2.67Å; D217-G242 CarbonylContact C-O 3.48Å; D217-G242 WeakPolarHBondContact CA-O 3.42Å; D217-G242 WeakPolarHBondContact OD1-CA 3.39Å
218	G	92.8	Very high	95.3	Very high	7 Å²	7	39.8 Å²	39.8	7%	0.072	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	23.3	-172.8	0	0	0	0	0	114.8	L194 M216 F220 F221 G242	L194-G218 PolarHBondContact N-O 2.79Å; M216-G218 PolarHBondContact O-N 2.84Å; G218-F220 PolarHBondContact O-N 2.6Å; G218-F221 VanDerWaalsContact O-CB 3.29Å; G218-F221 WeakPolarHBondContact O-CB 3.19Å; G218-F221 PolarHBondContact O-N 2.86Å; G218-G242 PolarHBondContact N-O 3.35Å
219	A	94.1	Very high	95.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-42	174.7	0	0	0	0	0	112.9	V191 D192 F196 L215 M216 D217	V191-A219 HydrophobicContact CB-CB 4.25Å; V191-A219 HydrophobicContact CG1-CB 3.86Å; D192-A219 WeakPolarHBondContact O-CA 3.42Å; F196-A219 WeakPolarHBondContact CD2-O 3.43Å; L215-A219 HydrophobicContact CB-CB 4.48Å; M216-A219 WeakPolarHBondContact O-CB 3.38Å; M216-A219 PolarHBondContact O-N 3.3Å; D217-A219 VanDerWaalsContact C-N 3.28Å; D217-A219 PolarHBondContact O-N 2.67Å
220	F	94.3	Very high	95.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	10.3	178.1	-55.6	-63.6	0	0	0	113.9	F196 L205 M207 L215 G218 G222 L223 L229 L231 W243 L247	F196-F220 AromaticContact CD2-CD1 3.75Å; F196-F220 HydrophobicContact CD2-CD1 3.75Å; F196-F220 HydrophobicContact CD2-CE1 4.18Å; F196-F220 AromaticContact CE2-CD1 3.76Å; F196-F220 HydrophobicContact CE2-CD1 3.76Å; F196-F220 AromaticContact CE2-CE1 3.69Å; F196-F220 HydrophobicContact CE2-CE1 3.69Å; L205-F220 HydrophobicContact CD2-CD1 3.9Å; L205-F220 HydrophobicContact CD2-CE1 3.79Å; M207-F220 HydrophobicContact SD-CE1 4.27Å; L215-F220 HydrophobicContact CD1-CE2 3.97Å; L215-F220 HydrophobicContact CD1-CZ 4.3Å; L215-F220 HydrophobicContact CD2-CE2 4.28Å; L215-F220 HydrophobicContact CD2-CZ 3.98Å; G218-F220 PolarHBondContact O-N 2.6Å; F220-G222 PolarHBondContact O-N 3.02Å; F220-L223 HydrophobicContact CB-CD1 4.06Å; F220-L223 HydrophobicContact CD1-CD1 4.11Å; F220-L223 WeakPolarHBondContact O-CB 3.49Å; F220-L223 VanDerWaalsContact O-CG 3.3Å; F220-L223 WeakPolarHBondContact O-CG 3.32Å; F220-L223 PolarHBondContact O-N 2.88Å; F220-L229 HydrophobicContact CD2-CD2 4.02Å; F220-L229 HydrophobicContact CE1-CD1 4Å; F220-L229 HydrophobicContact CE1-CD2 4.42Å; F220-L229 HydrophobicContact CE2-CD2 3.76Å; F220-L229 HydrophobicContact CG-CD2 4.47Å; F220-L229 HydrophobicContact CZ-CD1 4.07Å; F220-L229 HydrophobicContact CZ-CD2 3.99Å; F220-L231 HydrophobicContact CE2-CD1 4.29Å; F220-L231 HydrophobicContact CZ-CD1 4.11Å; F220-L231 HydrophobicContact CZ-CD2 4.3Å; F220-W243 HydrophobicContact CD2-CE3 4.19Å; F220-W243 WeakPolarHBondContact CD2-O 3.39Å; F220-W243 AromaticContact CE2-CE3 3.81Å; F220-W243 HydrophobicContact CE2-CE3 3.81Å; F220-W243 HydrophobicContact CE2-CZ3 4.16Å; F220-L247 HydrophobicContact CB-CD1 4.04Å; F220-L247 HydrophobicContact CB-CD2 3.94Å; F220-L247 HydrophobicContact CB-CG 4.15Å; F220-L247 HydrophobicContact CD2-CD1 4.06Å; F220-L247 HydrophobicContact CG-CD1 4.32Å
221	F	92.7	Very high	95.4	Very high	61 Å²	61	33.7 Å²	33.7	27%	0.268	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	133.9	-176.3	177.8	-90.6	0	0	0	112.3	L194 G218 Y245	L194-F221 HydrophobicContact CD2-CB 4.1Å; L194-F221 HydrophobicContact CD2-CD1 3.53Å; L194-F221 HydrophobicContact CD2-CE1 4.36Å; L194-F221 HydrophobicContact CD2-CG 4.14Å; G218-F221 VanDerWaalsContact O-CB 3.29Å; G218-F221 WeakPolarHBondContact O-CB 3.19Å; G218-F221 PolarHBondContact O-N 2.86Å; F221-Y245 HydrophobicContact CB-CD1 4.45Å; F221-Y245 AromaticContact CD2-CD1 3.47Å; F221-Y245 HydrophobicContact CD2-CD1 3.47Å; F221-Y245 VanDerWaalsContact CD2-CD1 3.47Å; F221-Y245 AromaticContact CD2-CE1 3.34Å; F221-Y245 HydrophobicContact CD2-CE1 3.34Å; F221-Y245 HydrophobicContact CE2-CD1 4.11Å; F221-Y245 AromaticContact CE2-CE1 3.48Å; F221-Y245 HydrophobicContact CE2-CE1 3.48Å; F221-Y245 VanDerWaalsContact CE2-CE1 3.48Å; F221-Y245 HydrophobicContact CG-CD1 4.28Å; F221-Y245 HydrophobicContact CG-CE1 4.35Å
222	G	89.1	Confident	95.4	Very high	4 Å²	4	33.5 Å²	33.5	4%	0.041	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.5	-2.2	-174	0	0	0	0	0	114.1	F220 N224	F220-G222 PolarHBondContact O-N 3.02Å; G222-N224 PolarHBondContact O-N 3.32Å; G222-N224 PolarHBondContact O-ND2 2.93Å
223	L	93.7	Very high	95.4	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.182	C	C	.	.			trans	-84.6	59.3	173.4	-59.4	-178.7	0	0	0	110.9	F196 M199 L202 L205 F220 N225 M226 L247	F196-L223 HydrophobicContact CB-CD1 3.74Å; F196-L223 HydrophobicContact CB-CD2 3.82Å; F196-L223 HydrophobicContact CB-CG 3.98Å; F196-L223 HydrophobicContact CD2-CD1 4.12Å; F196-L223 HydrophobicContact CG-CD1 4.14Å; M199-L223 HydrophobicContact CB-CD2 4.06Å; M199-L223 HydrophobicContact CE-CD2 4.32Å; L202-L223 HydrophobicContact CB-CD2 4.1Å; L202-L223 HydrophobicContact CD2-CD1 4.28Å; L202-L223 HydrophobicContact CD2-CD2 3.8Å; L205-L223 HydrophobicContact CD2-CD1 4.09Å; F220-L223 HydrophobicContact CB-CD1 4.06Å; F220-L223 HydrophobicContact CD1-CD1 4.11Å; F220-L223 WeakPolarHBondContact O-CB 3.49Å; F220-L223 VanDerWaalsContact O-CG 3.3Å; F220-L223 WeakPolarHBondContact O-CG 3.32Å; F220-L223 PolarHBondContact O-N 2.88Å; L223-N225 PolarHBondContact O-N 2.93Å; L223-N225 VanDerWaalsContact O-N 3.11Å; L223-M226 HydrophobicContact CB-CB 4.22Å; L223-M226 HydrophobicContact CB-CE 4.06Å; L223-M226 HydrophobicContact CD1-CE 3.41Å; L223-M226 VanDerWaalsContact CD1-CE 3.41Å; L223-M226 HydrophobicContact CG-CE 4.23Å; L223-M226 WeakPolarHBondContact O-CB 3.13Å; L223-M226 PolarHBondContact O-N 2.94Å; L223-M226 VanDerWaalsContact O-N 3.1Å; L223-L247 HydrophobicContact CB-CD2 4.32Å
224	N	90.1	Very high	95.5	Very high	73 Å²	73	33.4 Å²	33.4	39%	0.39	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.8	-165.6	-66.9	-52.8	0	0	0	114.8	D200 G222 M249	D200-N224 PolarHBondContact OD1-ND2 2.83Å; G222-N224 PolarHBondContact O-N 3.32Å; G222-N224 PolarHBondContact O-ND2 2.93Å; N224-M249 WeakPolarHBondContact O-CG 3.4Å
225	N	95.1	Very high	95.6	Very high	65 Å²	65	32.2 Å²	32.2	35%	0.348	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.2	21	178.3	-67.2	-82.5	0	0	0	113.5	D200 L202 L223 E227	D200-N225 WeakPolarHBondContact O-CB 3.37Å; D200-N225 PolarHBondContact O-N 3.01Å; D200-N225 PolarHBondContact O-ND2 3.28Å; L202-N225 CarbonylContact O-C 3.58Å; L223-N225 PolarHBondContact O-N 2.93Å; L223-N225 VanDerWaalsContact O-N 3.11Å; N225-E227 PolarHBondContact O-N 3.11Å
226	M	97	Very high	95.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.164	C	C	.	.			trans	-62.8	125	177.7	-172.8	68.8	80.7	0	0	111.1	L202 L205 L223 L247 M249 L250	L202-M226 HydrophobicContact CD2-CE 3.91Å; L202-M226 HydrophobicContact CG-CE 4.35Å; L202-M226 WeakPolarHBondContact O-CA 3.15Å; L202-M226 PolarHBondContact O-N 3.44Å; L202-M226 VanDerWaalsContact O-N 3.14Å; L205-M226 HydrophobicContact CB-CE 3.42Å; L205-M226 VanDerWaalsContact CB-CE 3.42Å; L205-M226 HydrophobicContact CB-SD 4.03Å; L205-M226 HydrophobicContact CD2-CE 3.93Å; L205-M226 HydrophobicContact CG-CE 4.34Å; L223-M226 HydrophobicContact CB-CB 4.22Å; L223-M226 HydrophobicContact CB-CE 4.06Å; L223-M226 HydrophobicContact CD1-CE 3.41Å; L223-M226 VanDerWaalsContact CD1-CE 3.41Å; L223-M226 HydrophobicContact CG-CE 4.23Å; L223-M226 WeakPolarHBondContact O-CB 3.13Å; L223-M226 PolarHBondContact O-N 2.94Å; L223-M226 VanDerWaalsContact O-N 3.1Å; M226-L247 HydrophobicContact CB-CD2 3.91Å; M226-L247 HydrophobicContact CG-CD2 4.14Å; M226-M249 CarbonylContact O-C 3.55Å; M226-M249 VanDerWaalsContact O-CB 3.32Å; M226-M249 WeakPolarHBondContact O-CB 3.47Å; M226-M249 VanDerWaalsContact O-O 3.06Å; M226-L250 HydrophobicContact CG-CD1 3.76Å; M226-L250 VanDerWaalsContact O-CA 3.32Å; M226-L250 WeakPolarHBondContact O-CA 3.16Å; M226-L250 PolarHBondContact O-N 3.11Å; M226-L250 VanDerWaalsContact O-N 3.11Å
227	E	97.9	Very high	95.8	Very high	57 Å²	57	33.7 Å²	33.7	27%	0.266	18%	0.176	S	C	.	.			trans	-106.5	-32.4	174.5	-67	-178.3	-116.8	0	0	111.9	K203 N225 R251 V252	K203-E227 IonicContact NZ-OE1 2.68Å; K203-E227 PolarHBondContact NZ-OE1 3.08Å; K203-E227 PolarHBondContact O-N 3.1Å; N225-E227 PolarHBondContact O-N 3.11Å; E227-R251 PolarHBondContact O-N 2.94Å; E227-R251 IonicContact OE2-NH1 2.68Å; E227-R251 PolarHBondContact OE2-NH1 2.78Å; E227-V252 PolarHBondContact O-N 3.09Å
228	E	98.5	Very high	95.8	Very high	41 Å²	41	30.9 Å²	30.9	19%	0.192	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	122.9	-173.8	-177.2	-171	-138.6	0	0	112.9	K203 S204 L205 K206 E230 V252 R254	K203-E228 PolarHBondContact O-N 2.8Å; S204-E228 WeakPolarHBondContact CA-O 3.2Å; S204-E228 WeakPolarHBondContact CB-OE2 3.43Å; S204-E228 PolarHBondContact OG-OE2 3.46Å; L205-E228 PolarHBondContact N-O 3.05Å; K206-E228 WeakPolarHBondContact CE-OE2 3.35Å; K206-E228 IonicContact NZ-OE1 3.81Å; K206-E228 PolarHBondContact NZ-OE1 3.01Å; K206-E228 IonicContact NZ-OE2 2.61Å; K206-E228 PolarHBondContact NZ-OE2 3.06Å; E228-E230 HydrophobicContact CG-CG 4.33Å; E228-V252 WeakPolarHBondContact CA-O 3.41Å; E228-V252 HydrophobicContact CB-CB 4.28Å; E228-V252 HydrophobicContact CG-CB 4.07Å; E228-V252 HydrophobicContact CG-CG1 4Å; E228-R254 IonicContact OE1-CZ 2.74Å; E228-R254 IonicContact OE1-NH1 3.99Å; E228-R254 PolarHBondContact OE1-NH1 3.25Å
229	L	98.3	Very high	95.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122.6	174.6	-179.5	58	0	0	0	110.6	L205 F220 L231 L247 L250 V252 L253 R254	L205-L229 HydrophobicContact CB-CD1 4.15Å; L205-L229 HydrophobicContact CD2-CD1 4.07Å; L205-L229 HydrophobicContact CG-CD1 4.07Å; F220-L229 HydrophobicContact CD2-CD2 4.02Å; F220-L229 HydrophobicContact CE1-CD1 4Å; F220-L229 HydrophobicContact CE1-CD2 4.42Å; F220-L229 HydrophobicContact CE2-CD2 3.76Å; F220-L229 HydrophobicContact CG-CD2 4.47Å; F220-L229 HydrophobicContact CZ-CD1 4.07Å; F220-L229 HydrophobicContact CZ-CD2 3.99Å; L229-L231 HydrophobicContact CD1-CD1 4.26Å; L229-L231 HydrophobicContact CD1-CG 4.16Å; L229-L231 HydrophobicContact CD2-CD1 3.91Å; L229-L231 HydrophobicContact CG-CD1 3.92Å; L229-L231 HydrophobicContact CG-CG 4.16Å; L229-L247 HydrophobicContact CD2-CD1 4.03Å; L229-L250 HydrophobicContact CB-CD1 3.75Å; L229-V252 PolarHBondContact N-O 2.9Å; L229-L253 HydrophobicContact CB-CD1 4.08Å; L229-L253 HydrophobicContact CD2-CD1 4.02Å; L229-L253 HydrophobicContact CG-CD1 4.04Å; L229-L253 WeakPolarHBondContact O-CA 3.38Å; L229-R254 PolarHBondContact O-N 2.97Å
230	E	98.3	Very high	95.9	Very high	21 Å²	21	32 Å²	32	10%	0.098	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	107.5	-176.6	-76.4	-174.1	172.3	0	0	111.6	L205 K206 M207 Q208 E228 E232 R254	L205-E230 PolarHBondContact O-N 3.2Å; L205-E230 VanDerWaalsContact O-N 3.08Å; K206-E230 WeakPolarHBondContact CD-OE2 3.16Å; K206-E230 HydrophobicContact CG-CB 4.5Å; K206-E230 WeakPolarHBondContact CG-OE2 3.07Å; K206-E230 IonicContact NZ-OE1 2.66Å; K206-E230 PolarHBondContact NZ-OE1 3.34Å; K206-E230 IonicContact NZ-OE2 3.59Å; K206-E230 PolarHBondContact NZ-OE2 3.4Å; M207-E230 CarbonylContact C-O 3.54Å; M207-E230 WeakPolarHBondContact CA-O 3.22Å; M207-E230 PolarHBondContact N-O 2.98Å; Q208-E230 HydrophobicContact CG-CB 4.29Å; Q208-E230 PolarHBondContact N-O 2.92Å; Q208-E230 PolarHBondContact NE2-O 2.89Å; Q208-E230 PolarHBondContact NE2-OE2 3.31Å; E228-E230 HydrophobicContact CG-CG 4.33Å; E230-E232 WeakPolarHBondContact CA-OE2 3.42Å; E230-E232 WeakPolarHBondContact CB-OE2 3.29Å; E230-R254 HydrophobicContact CG-CB 4.33Å; E230-R254 IonicContact OE1-NH1 2.86Å; E230-R254 PolarHBondContact OE1-NH1 3.21Å
231	L	97.9	Very high	96	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.			trans	-120.5	19.4	-174.5	-70.8	164.3	0	0	0	113	M207 I212 L215 F220 L229 N234 L236 W243 R254 F255 N258	M207-L231 HydrophobicContact CB-CD2 3.95Å; I212-L231 HydrophobicContact CD1-CD2 3.78Å; L215-L231 HydrophobicContact CD1-CD1 4.19Å; F220-L231 HydrophobicContact CE2-CD1 4.29Å; F220-L231 HydrophobicContact CZ-CD1 4.11Å; F220-L231 HydrophobicContact CZ-CD2 4.3Å; L229-L231 HydrophobicContact CD1-CD1 4.26Å; L229-L231 HydrophobicContact CD1-CG 4.16Å; L229-L231 HydrophobicContact CD2-CD1 3.91Å; L229-L231 HydrophobicContact CG-CD1 3.92Å; L229-L231 HydrophobicContact CG-CG 4.16Å; L231-N234 PolarHBondContact O-ND2 2.93Å; L231-L236 HydrophobicContact CD1-CD1 4.45Å; L231-W243 HydrophobicContact CD1-CZ3 4.19Å; L231-R254 PolarHBondContact N-O 2.6Å; L231-F255 HydrophobicContact CB-CB 3.93Å; L231-N258 PolarHBondContact O-ND2 3.27Å
232	E	97.9	Very high	96	Very high	29 Å²	29	33.1 Å²	33.1	14%	0.136	17%	0.173	C	C	.	.			trans	-60.9	154.4	-177.8	-49.1	92.6	98.2	0	0	113.3	Q208 R209 E230 N234 R254 S256	Q208-E232 CarbonylContact C-O 3.58Å; Q208-E232 WeakPolarHBondContact CA-O 3.25Å; Q208-E232 HydrophobicContact CB-CB 4.4Å; Q208-E232 VanDerWaalsContact CB-O 3.27Å; Q208-E232 WeakPolarHBondContact CB-O 3.26Å; Q208-E232 HydrophobicContact CG-CB 4.08Å; Q208-E232 HydrophobicContact CG-CG 4.47Å; Q208-E232 VanDerWaalsContact CG-OE2 3.26Å; Q208-E232 WeakPolarHBondContact CG-OE2 3.27Å; R209-E232 PolarHBondContact N-O 3.33Å; E230-E232 WeakPolarHBondContact CA-OE2 3.42Å; E230-E232 WeakPolarHBondContact CB-OE2 3.29Å; E232-N234 PolarHBondContact O-N 3.5Å; E232-N234 PolarHBondContact O-ND2 3.05Å; E232-R254 HydrophobicContact CG-CB 3.88Å; E232-S256 CarbonylContact C-O 3.51Å; E232-S256 WeakPolarHBondContact CA-O 3.41Å; E232-S256 WeakPolarHBondContact CB-O 3.17Å
233	H	98	Very high	96.3	Very high	55 Å²	55	33.2 Å²	33.2	26%	0.255	17%	0.172	S	C	.	.	S	Bend	trans	54.8	49	-179	-52.2	-89.7	0	0	0	113.3	R209 S256 Q257	R209-H233 VanDerWaalsContact CA-O 3.24Å; R209-H233 WeakPolarHBondContact CA-O 3.43Å; R209-H233 HydrophobicContact CB-CB 4.27Å; R209-H233 HydrophobicContact CG-CB 3.36Å; R209-H233 PolarHBondContact N-O 3.05Å; R209-H233 PolarHBondContact NE-CD2 3.25Å; R209-H233 PolarHBondContact NE-NE2 2.83Å; R209-H233 PolarHBondContact NH2-CE1 3.28Å; R209-H233 PolarHBondContact NH2-NE2 2.95Å; H233-S256 PolarHBondContact N-O 3.43Å; H233-Q257 CarbonylContact C-O 3.51Å; H233-Q257 WeakPolarHBondContact CA-O 3.13Å; H233-Q257 PolarHBondContact CE1-NE2 3.35Å; H233-Q257 PolarHBondContact CE1-OE1 3.21Å; H233-Q257 PolarHBondContact N-O 3.22Å; H233-Q257 PolarHBondContact ND1-OE1 3.05Å
234	N	98.3	Very high	96.4	Very high	13 Å²	13	33.2 Å²	33.2	7%	0.07	17%	0.172	C	C	.	.	S	Bend	trans	-118	-161.5	172.2	-76.9	-60.7	0	0	0	109.4	M207 N210 G211 I212 L231 E232 Q257 N258	M207-N234 PolarHBondContact O-ND2 3.37Å; N210-N234 WeakPolarHBondContact CA-OD1 3.15Å; N210-N234 WeakPolarHBondContact CB-OD1 3.3Å; N210-N234 PolarHBondContact N-OD1 2.85Å; G211-N234 PolarHBondContact N-OD1 3.29Å; I212-N234 HydrophobicContact CB-CB 4.12Å; I212-N234 PolarHBondContact N-OD1 2.99Å; L231-N234 PolarHBondContact O-ND2 2.93Å; E232-N234 PolarHBondContact O-N 3.5Å; E232-N234 PolarHBondContact O-ND2 3.05Å; N234-Q257 PolarHBondContact N-O 3.07Å; N234-N258 VanDerWaalsContact CA-OD1 3.29Å; N234-N258 WeakPolarHBondContact CA-OD1 3.29Å; N234-N258 WeakPolarHBondContact CB-OD1 3.34Å; N234-N258 PolarHBondContact O-OD1 2.94Å
235	N	97.6	Very high	96.6	Very high	86 Å²	86	34.9 Å²	34.9	46%	0.46	17%	0.174	S	C	.	.			trans	-131.1	39.3	-176.3	-158.6	111.9	0	0	0	110.4	I212 T213 N258	I212-N235 CarbonylContact O-C 3.39Å; I212-N235 VanDerWaalsContact O-C 3.22Å; I212-N235 WeakPolarHBondContact O-CA 3.29Å; I212-N235 PolarHBondContact O-N 3.39Å; T213-N235 HydrophobicContact CG2-CB 4.02Å; N235-N258 PolarHBondContact N-OD1 3.41Å
236	L	97.6	Very high	96.3	Very high	6 Å²	6	32 Å²	32	3%	0.031	16%	0.158	C	C	.	.			trans	-73.7	139.1	173.8	-56.9	176.4	0	0	0	109.8	I212 L215 L231 N258 A259 I260	I212-L236 HydrophobicContact CB-CD2 4.44Å; I212-L236 HydrophobicContact CG2-CD2 3.88Å; I212-L236 PolarHBondContact O-N 3.33Å; L215-L236 HydrophobicContact CD1-CD1 3.92Å; L215-L236 HydrophobicContact CD1-CD2 4.02Å; L215-L236 HydrophobicContact CG-CD2 3.9Å; L231-L236 HydrophobicContact CD1-CD1 4.45Å; L236-N258 HydrophobicContact CB-CB 4.41Å; L236-N258 WeakPolarHBondContact CB-OD1 3.39Å; L236-N258 WeakPolarHBondContact CG-OD1 3.27Å; L236-N258 PolarHBondContact N-OD1 3.3Å; L236-A259 CarbonylContact O-C 3.43Å; L236-A259 WeakPolarHBondContact O-CA 3.34Å; L236-A259 PolarHBondContact O-N 2.84Å; L236-I260 HydrophobicContact CB-CG1 4.33Å; L236-I260 WeakPolarHBondContact O-CG1 3.41Å; L236-I260 PolarHBondContact O-N 2.82Å
237	T	96.8	Very high	96.2	Very high	82 Å²	82	32 Å²	32	50%	0.503	16%	0.158	S	C	.	.			trans	-111.1	-16.6	-175.5	54.1	0	0	0	0	114.6	A259 I260 G261	T237-A259 WeakPolarHBondContact CA-O 3.42Å; T237-A259 HydrophobicContact CG2-CB 4.26Å; T237-I260 WeakPolarHBondContact O-CA 3.43Å; T237-G261 PolarHBondContact O-N 3.44Å
238	E	95.8	Very high	95.9	Very high	48 Å²	48	34.2 Å²	34.2	22%	0.224	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	157.9	177.3	60.9	159.9	-141	0	0	113.3	N240 I262 R264	E238-N240 PolarHBondContact OE1-ND2 3.38Å; E238-I262 CarbonylContact C-O 3.58Å; E238-I262 VanDerWaalsContact CA-O 3.25Å; E238-I262 WeakPolarHBondContact CA-O 3.46Å; E238-I262 HydrophobicContact CB-CB 4.26Å; E238-R264 IonicContact OE1-NE 3.45Å; E238-R264 IonicContact OE1-NH2 2.98Å; E238-R264 IonicContact OE2-CZ 3.41Å; E238-R264 VanDerWaalsContact OE2-CZ 3.23Å; E238-R264 IonicContact OE2-NE 2.66Å; E238-R264 PolarHBondContact OE2-NE 3.37Å; E238-R264 IonicContact OE2-NH2 3.41Å; E238-R264 PolarHBondContact OE2-NH2 2.92Å
239	V	95.6	Very high	95.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.8	171.2	-158.8	0	0	0	0	108.9	W243 L244 F255 I260 I262 I263 R264 A267 W268	V239-W243 HydrophobicContact CB-CZ2 4.47Å; V239-W243 HydrophobicContact CG1-CH2 4.32Å; V239-W243 HydrophobicContact CG1-CZ2 3.83Å; V239-L244 HydrophobicContact CG1-CD1 3.93Å; V239-F255 HydrophobicContact CB-CE2 4.5Å; V239-F255 HydrophobicContact CG1-CE2 4.08Å; V239-F255 HydrophobicContact CG1-CZ 4.27Å; V239-F255 HydrophobicContact CG2-CE2 3.64Å; V239-F255 HydrophobicContact CG2-CZ 3.89Å; V239-I260 HydrophobicContact CG2-CD1 4.24Å; V239-I260 HydrophobicContact CG2-CG2 3.72Å; V239-I262 PolarHBondContact N-O 3.09Å; V239-I263 HydrophobicContact CB-CG1 4.47Å; V239-I263 HydrophobicContact CB-CG2 4.36Å; V239-I263 HydrophobicContact CG2-CG1 4.02Å; V239-R264 WeakPolarHBondContact O-CG 3.36Å; V239-R264 PolarHBondContact O-N 3.18Å; V239-A267 HydrophobicContact CB-CB 4.43Å; V239-A267 HydrophobicContact CG1-CB 4.1Å; V239-W268 HydrophobicContact CG1-CH2 3.79Å; V239-W268 HydrophobicContact CG1-CZ2 4.33Å; V239-W268 HydrophobicContact CG1-CZ3 4.07Å
240	N	94.3	Very high	95.8	Very high	30 Å²	30	35.7 Å²	35.7	16%	0.16	18%	0.177	C	C	.	.			trans	-139.3	160.9	179.6	75.6	47.7	0	0	0	110.8	E238 G242 W243 R264	E238-N240 PolarHBondContact OE1-ND2 3.38Å; N240-G242 VanDerWaalsContact C-N 3.26Å; N240-G242 PolarHBondContact O-N 2.86Å; N240-G242 WeakPolarHBondContact OD1-CA 3.49Å; N240-G242 PolarHBondContact OD1-N 3.44Å; N240-W243 VanDerWaalsContact OD1-CD1 3.27Å; N240-W243 PolarHBondContact OD1-N 2.65Å; N240-R264 HydrophobicContact CB-CB 4.42Å; N240-R264 HydrophobicContact CB-CG 3.72Å
241	K	94.4	Very high	95.8	Very high	70 Å²	70	39.4 Å²	39.4	30%	0.304	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-18	-176.3	75.9	174.6	172.2	-154.4	0	114.6	L244 Y245 D266 E269 F270	K241-L244 PolarHBondContact O-N 3.28Å; K241-Y245 PolarHBondContact O-N 3.02Å; K241-Y245 VanDerWaalsContact O-N 3.09Å; K241-D266 WeakPolarHBondContact CB-O 3.19Å; K241-D266 HydrophobicContact CD-CB 4.04Å; K241-D266 VanDerWaalsContact CD-OD2 3.24Å; K241-D266 WeakPolarHBondContact CD-OD2 3.47Å; K241-D266 WeakPolarHBondContact CE-OD2 3.48Å; K241-D266 IonicContact NZ-OD2 3.78Å; K241-D266 PolarHBondContact NZ-OD2 2.98Å; K241-E269 HydrophobicContact CD-CB 4.49Å; K241-E269 WeakPolarHBondContact CD-OE2 3.49Å; K241-E269 WeakPolarHBondContact CE-OE2 3.32Å; K241-E269 IonicContact NZ-OE2 3.39Å; K241-E269 PolarHBondContact NZ-OE2 2.79Å; K241-F270 HydrophobicContact CB-CD2 4.18Å; K241-F270 HydrophobicContact CB-CE2 3.91Å; K241-F270 HydrophobicContact CD-CE2 3.95Å; K241-F270 HydrophobicContact CD-CZ 4.5Å; K241-F270 HydrophobicContact CG-CE2 4.15Å
242	G	94.8	Very high	95.8	Very high	14 Å²	14	40.5 Å²	40.5	14%	0.144	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-53.4	-176.3	0	0	0	0	0	111.2	D217 G218 N240 Y245	D217-G242 CarbonylContact C-O 3.48Å; D217-G242 WeakPolarHBondContact CA-O 3.42Å; D217-G242 WeakPolarHBondContact OD1-CA 3.39Å; G218-G242 PolarHBondContact N-O 3.35Å; N240-G242 VanDerWaalsContact C-N 3.26Å; N240-G242 PolarHBondContact O-N 2.86Å; N240-G242 WeakPolarHBondContact OD1-CA 3.49Å; N240-G242 PolarHBondContact OD1-N 3.44Å; G242-Y245 VanDerWaalsContact O-CB 3.27Å; G242-Y245 WeakPolarHBondContact O-CB 3.3Å; G242-Y245 PolarHBondContact O-N 2.73Å
243	W	94.9	Very high	95.9	Very high	7 Å²	7	39.1 Å²	39.1	3%	0.027	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-24.3	178.7	63	-101.6	0	0	0	113.9	L215 F220 L231 V239 N240 Y245 F255	L215-W243 HydrophobicContact CB-CB 3.59Å; L215-W243 HydrophobicContact CB-CD2 4.27Å; L215-W243 HydrophobicContact CB-CG 3.79Å; L215-W243 HydrophobicContact CD1-CB 4.45Å; L215-W243 HydrophobicContact CD1-CD2 3.56Å; L215-W243 HydrophobicContact CD1-CE3 3.51Å; L215-W243 HydrophobicContact CD1-CG 4.02Å; L215-W243 HydrophobicContact CD1-CH2 4.23Å; L215-W243 HydrophobicContact CD1-CZ2 4.28Å; L215-W243 HydrophobicContact CD1-CZ3 3.86Å; F220-W243 HydrophobicContact CD2-CE3 4.19Å; F220-W243 WeakPolarHBondContact CD2-O 3.39Å; F220-W243 AromaticContact CE2-CE3 3.81Å; F220-W243 HydrophobicContact CE2-CE3 3.81Å; F220-W243 HydrophobicContact CE2-CZ3 4.16Å; L231-W243 HydrophobicContact CD1-CZ3 4.19Å; V239-W243 HydrophobicContact CB-CZ2 4.47Å; V239-W243 HydrophobicContact CG1-CH2 4.32Å; V239-W243 HydrophobicContact CG1-CZ2 3.83Å; N240-W243 VanDerWaalsContact OD1-CD1 3.27Å; N240-W243 PolarHBondContact OD1-N 2.65Å; W243-Y245 VanDerWaalsContact C-N 3.26Å; W243-Y245 PolarHBondContact O-N 2.75Å; W243-F255 HydrophobicContact CH2-CD2 4.28Å; W243-F255 HydrophobicContact CH2-CE2 4.08Å; W243-F255 HydrophobicContact CZ2-CE2 4.34Å
244	L	95.6	Very high	95.9	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-3.2	173.6	-71.1	171.3	0	0	0	114	V239 K241 G246 L247 L253 A267 W268	V239-L244 HydrophobicContact CG1-CD1 3.93Å; K241-L244 PolarHBondContact O-N 3.28Å; L244-G246 PolarHBondContact O-N 3.45Å; L244-L247 HydrophobicContact CD2-CD1 3.96Å; L244-L247 PolarHBondContact O-N 3.41Å; L244-L253 HydrophobicContact CD2-CD2 4.38Å; L244-A267 WeakPolarHBondContact CD1-O 3.29Å; L244-W268 HydrophobicContact CD1-CE3 4.13Å; L244-W268 HydrophobicContact CD1-CZ3 4.09Å
245	Y	93.9	Very high	95.8	Very high	109 Å²	109	38.4 Å²	38.4	43%	0.427	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	119.3	-173.8	-178.9	-117.5	0	0	0	113.8	F221 K241 G242 W243 F270	F221-Y245 HydrophobicContact CB-CD1 4.45Å; F221-Y245 AromaticContact CD2-CD1 3.47Å; F221-Y245 HydrophobicContact CD2-CD1 3.47Å; F221-Y245 VanDerWaalsContact CD2-CD1 3.47Å; F221-Y245 AromaticContact CD2-CE1 3.34Å; F221-Y245 HydrophobicContact CD2-CE1 3.34Å; F221-Y245 HydrophobicContact CE2-CD1 4.11Å; F221-Y245 AromaticContact CE2-CE1 3.48Å; F221-Y245 HydrophobicContact CE2-CE1 3.48Å; F221-Y245 VanDerWaalsContact CE2-CE1 3.48Å; F221-Y245 HydrophobicContact CG-CD1 4.28Å; F221-Y245 HydrophobicContact CG-CE1 4.35Å; K241-Y245 PolarHBondContact O-N 3.02Å; K241-Y245 VanDerWaalsContact O-N 3.09Å; G242-Y245 VanDerWaalsContact O-CB 3.27Å; G242-Y245 WeakPolarHBondContact O-CB 3.3Å; G242-Y245 PolarHBondContact O-N 2.73Å; W243-Y245 VanDerWaalsContact C-N 3.26Å; W243-Y245 PolarHBondContact O-N 2.75Å; Y245-F270 HydrophobicContact CD2-CD1 4.18Å; Y245-F270 HydrophobicContact CD2-CD2 4Å; Y245-F270 AromaticContact CD2-CE1 3.88Å; Y245-F270 HydrophobicContact CD2-CE1 3.88Å; Y245-F270 AromaticContact CD2-CE2 3.66Å; Y245-F270 HydrophobicContact CD2-CE2 3.66Å; Y245-F270 HydrophobicContact CD2-CG 4.26Å; Y245-F270 AromaticContact CD2-CZ 3.62Å; Y245-F270 HydrophobicContact CD2-CZ 3.62Å; Y245-F270 HydrophobicContact CE2-CE1 4.01Å; Y245-F270 HydrophobicContact CE2-CE2 4.49Å; Y245-F270 AromaticContact CE2-CZ 4Å; Y245-F270 HydrophobicContact CE2-CZ 4Å
246	G	88.1	Confident	95.8	Very high	3 Å²	3	34.7 Å²	34.7	3%	0.031	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.6	-1.7	176.3	0	0	0	0	0	116.1	L244 H248	L244-G246 PolarHBondContact O-N 3.45Å; G246-H248 PolarHBondContact O-CD2 3Å; G246-H248 VanDerWaalsContact O-CD2 3.26Å; G246-H248 PolarHBondContact O-N 2.98Å
247	L	94.7	Very high	95.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.183	C	C	.	.			trans	-79.1	43	-176.3	-69.3	176.6	0	0	0	114.7	F220 L223 M226 L229 L244 M249 L250 F270	F220-L247 HydrophobicContact CB-CD1 4.04Å; F220-L247 HydrophobicContact CB-CD2 3.94Å; F220-L247 HydrophobicContact CB-CG 4.15Å; F220-L247 HydrophobicContact CD2-CD1 4.06Å; F220-L247 HydrophobicContact CG-CD1 4.32Å; L223-L247 HydrophobicContact CB-CD2 4.32Å; M226-L247 HydrophobicContact CB-CD2 3.91Å; M226-L247 HydrophobicContact CG-CD2 4.14Å; L229-L247 HydrophobicContact CD2-CD1 4.03Å; L244-L247 HydrophobicContact CD2-CD1 3.96Å; L244-L247 PolarHBondContact O-N 3.41Å; L247-M249 PolarHBondContact O-N 2.78Å; L247-L250 HydrophobicContact CB-CB 4.22Å; L247-L250 HydrophobicContact CB-CD2 4.48Å; L247-L250 HydrophobicContact CD1-CD2 4.27Å; L247-L250 VanDerWaalsContact O-CB 3.3Å; L247-L250 WeakPolarHBondContact O-CB 3.33Å; L247-L250 PolarHBondContact O-N 2.86Å; L247-F270 CarbonylContact C-O 3.56Å; L247-F270 VanDerWaalsContact C-O 3.27Å
248	H	93.6	Very high	95.9	Very high	104 Å²	104	35.2 Å²	35.2	48%	0.481	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-10.4	-171.9	-58.9	-74.6	0	0	0	116.6	G246 F270 K273	G246-H248 PolarHBondContact O-CD2 3Å; G246-H248 VanDerWaalsContact O-CD2 3.26Å; G246-H248 PolarHBondContact O-N 2.98Å; H248-F270 VanDerWaalsContact CA-O 3.29Å; H248-F270 WeakPolarHBondContact CA-O 3.44Å; H248-F270 AromaticContact CE1-CD1 3.78Å; H248-F270 PolarHBondContact N-O 2.87Å; H248-K273 WeakPolarHBondContact O-CD 3.3Å
249	M	96.1	Very high	96	Very high	73 Å²	73	34 Å²	34	36%	0.36	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-0.9	178.6	-65	-61.5	-168	0	0	113.4	N224 M226 L247 R251 K273	N224-M249 WeakPolarHBondContact O-CG 3.4Å; M226-M249 CarbonylContact O-C 3.55Å; M226-M249 VanDerWaalsContact O-CB 3.32Å; M226-M249 WeakPolarHBondContact O-CB 3.47Å; M226-M249 VanDerWaalsContact O-O 3.06Å; L247-M249 PolarHBondContact O-N 2.78Å; M249-R251 WeakPolarHBondContact O-CG 3.24Å; M249-R251 PolarHBondContact O-N 3.13Å; M249-K273 HydrophobicContact SD-CD 4.31Å; M249-K273 PolarHBondContact SD-NZ 2.62Å
250	L	97.8	Very high	96.1	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.16	C	C	.	.			trans	-66.7	126.1	-171.4	-168.8	71.2	0	0	0	111.4	M226 L229 L247 L253 K273 L274	M226-L250 HydrophobicContact CG-CD1 3.76Å; M226-L250 VanDerWaalsContact O-CA 3.32Å; M226-L250 WeakPolarHBondContact O-CA 3.16Å; M226-L250 PolarHBondContact O-N 3.11Å; M226-L250 VanDerWaalsContact O-N 3.11Å; L229-L250 HydrophobicContact CB-CD1 3.75Å; L247-L250 HydrophobicContact CB-CB 4.22Å; L247-L250 HydrophobicContact CB-CD2 4.48Å; L247-L250 HydrophobicContact CD1-CD2 4.27Å; L247-L250 VanDerWaalsContact O-CB 3.3Å; L247-L250 WeakPolarHBondContact O-CB 3.33Å; L247-L250 PolarHBondContact O-N 2.86Å; L250-L253 HydrophobicContact CD2-CB 4.11Å; L250-L253 HydrophobicContact CD2-CD1 4.45Å; L250-L253 HydrophobicContact CD2-CD2 4.47Å; L250-K273 CarbonylContact O-C 3.59Å; L250-L274 HydrophobicContact CD2-CD1 4.04Å; L250-L274 HydrophobicContact CG-CD1 3.9Å; L250-L274 WeakPolarHBondContact O-CA 2.98Å; L250-L274 PolarHBondContact O-N 3.37Å
251	R	98.3	Very high	96.2	Very high	98 Å²	98	33.7 Å²	33.7	37%	0.37	16%	0.164	S	C	.	.			trans	-112.4	-30.6	-178.6	-63.1	171.6	71.4	-148.1	-7.1	112	E227 M249 E275 E276	E227-R251 PolarHBondContact O-N 2.94Å; E227-R251 IonicContact OE2-NH1 2.68Å; E227-R251 PolarHBondContact OE2-NH1 2.78Å; M249-R251 WeakPolarHBondContact O-CG 3.24Å; M249-R251 PolarHBondContact O-N 3.13Å; R251-E275 IonicContact CZ-OE1 2.76Å; R251-E275 VanDerWaalsContact CZ-OE1 3.32Å; R251-E275 IonicContact CZ-OE2 3.3Å; R251-E275 IonicContact NE-OE1 3.98Å; R251-E275 PolarHBondContact NE-OE1 3.2Å; R251-E275 IonicContact NE-OE2 2.88Å; R251-E275 PolarHBondContact NE-OE2 3.03Å; R251-E275 VanDerWaalsContact NH2-CD 3.3Å; R251-E275 IonicContact NH2-OE1 2.67Å; R251-E275 PolarHBondContact NH2-OE1 2.98Å; R251-E275 IonicContact NH2-OE2 3.02Å; R251-E275 PolarHBondContact NH2-OE2 3.33Å; R251-E275 WeakPolarHBondContact O-CA 3.14Å; R251-E275 PolarHBondContact O-N 2.73Å; R251-E276 PolarHBondContact O-N 2.98Å
252	V	98.6	Very high	96.2	Very high	24 Å²	24	34.9 Å²	34.9	15%	0.145	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	123.1	-178.7	176.6	0	0	0	0	110	E227 E228 L229 R254 E276	E227-V252 PolarHBondContact O-N 3.09Å; E228-V252 WeakPolarHBondContact CA-O 3.41Å; E228-V252 HydrophobicContact CB-CB 4.28Å; E228-V252 HydrophobicContact CG-CB 4.07Å; E228-V252 HydrophobicContact CG-CG1 4Å; L229-V252 PolarHBondContact N-O 2.9Å; V252-R254 HydrophobicContact CG1-CG 4.09Å; V252-R254 VanDerWaalsContact CG1-CZ 3.45Å; V252-E276 HydrophobicContact CG1-CB 4.43Å; V252-E276 HydrophobicContact CG2-CB 4.21Å
253	L	98.4	Very high	96.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	108.5	172.9	179.5	58.8	0	0	0	110	L229 L244 L250 F255 W268 L274 E276 L277 D278	L229-L253 HydrophobicContact CB-CD1 4.08Å; L229-L253 HydrophobicContact CD2-CD1 4.02Å; L229-L253 HydrophobicContact CG-CD1 4.04Å; L229-L253 WeakPolarHBondContact O-CA 3.38Å; L244-L253 HydrophobicContact CD2-CD2 4.38Å; L250-L253 HydrophobicContact CD2-CB 4.11Å; L250-L253 HydrophobicContact CD2-CD1 4.45Å; L250-L253 HydrophobicContact CD2-CD2 4.47Å; L253-F255 HydrophobicContact CD2-CE1 4.06Å; L253-F255 HydrophobicContact CD2-CZ 4.06Å; L253-F255 HydrophobicContact CG-CD1 4.05Å; L253-F255 HydrophobicContact CG-CE1 4.03Å; L253-F255 HydrophobicContact CG-CZ 4.46Å; L253-W268 HydrophobicContact CD2-CZ3 3.9Å; L253-L274 HydrophobicContact CB-CD1 3.78Å; L253-L274 HydrophobicContact CB-CD2 4.19Å; L253-E276 PolarHBondContact N-O 2.92Å; L253-L277 HydrophobicContact CB-CD1 4.16Å; L253-L277 HydrophobicContact CD2-CD1 3.95Å; L253-L277 HydrophobicContact CG-CD1 4.18Å; L253-D278 PolarHBondContact O-N 3.26Å
254	R	98.4	Very high	96.2	Very high	52 Å²	52	40 Å²	40	20%	0.196	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	127.7	175.1	-57.8	-176.9	-173.6	105	14.3	109.7	E228 L229 E230 L231 E232 V252 E276 D278	E228-R254 IonicContact OE1-CZ 2.74Å; E228-R254 IonicContact OE1-NH1 3.99Å; E228-R254 PolarHBondContact OE1-NH1 3.25Å; L229-R254 PolarHBondContact O-N 2.97Å; E230-R254 HydrophobicContact CG-CB 4.33Å; E230-R254 IonicContact OE1-NH1 2.86Å; E230-R254 PolarHBondContact OE1-NH1 3.21Å; L231-R254 PolarHBondContact N-O 2.6Å; E232-R254 HydrophobicContact CG-CB 3.88Å; V252-R254 HydrophobicContact CG1-CG 4.09Å; V252-R254 VanDerWaalsContact CG1-CZ 3.45Å; R254-E276 IonicContact CZ-OE1 2.6Å; R254-E276 VanDerWaalsContact CZ-OE1 3.23Å; R254-E276 IonicContact NE-OE1 2.96Å; R254-E276 PolarHBondContact NE-OE1 2.69Å; R254-E276 VanDerWaalsContact NH2-CD 3.29Å; R254-E276 IonicContact NH2-OE1 3.23Å; R254-E276 PolarHBondContact NH2-OE1 3.09Å; R254-E276 IonicContact NH2-OE2 3.69Å; R254-E276 PolarHBondContact NH2-OE2 2.81Å; R254-D278 HydrophobicContact CB-CB 4.41Å; R254-D278 HydrophobicContact CG-CB 4.26Å
255	F	95.8	Very high	96	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.215	C	C	.	.			trans	-157	31.8	-179.2	61.6	-30.9	0	0	0	112	L231 V239 W243 L253 N258 I260 W268 L277 D278 L279 N282	L231-F255 HydrophobicContact CB-CB 3.93Å; V239-F255 HydrophobicContact CB-CE2 4.5Å; V239-F255 HydrophobicContact CG1-CE2 4.08Å; V239-F255 HydrophobicContact CG1-CZ 4.27Å; V239-F255 HydrophobicContact CG2-CE2 3.64Å; V239-F255 HydrophobicContact CG2-CZ 3.89Å; W243-F255 HydrophobicContact CH2-CD2 4.28Å; W243-F255 HydrophobicContact CH2-CE2 4.08Å; W243-F255 HydrophobicContact CZ2-CE2 4.34Å; L253-F255 HydrophobicContact CD2-CE1 4.06Å; L253-F255 HydrophobicContact CD2-CZ 4.06Å; L253-F255 HydrophobicContact CG-CD1 4.05Å; L253-F255 HydrophobicContact CG-CE1 4.03Å; L253-F255 HydrophobicContact CG-CZ 4.46Å; F255-N258 PolarHBondContact O-ND2 3.39Å; F255-I260 HydrophobicContact CD2-CD1 3.42Å; F255-I260 VanDerWaalsContact CD2-CD1 3.42Å; F255-I260 HydrophobicContact CE2-CD1 3.54Å; F255-I260 HydrophobicContact CG-CD1 4.12Å; F255-I260 HydrophobicContact CZ-CD1 4.3Å; F255-W268 HydrophobicContact CZ-CH2 4.09Å; F255-L277 HydrophobicContact CE1-CD1 3.56Å; F255-L277 HydrophobicContact CZ-CD1 4.16Å; F255-D278 CarbonylContact C-O 3.19Å; F255-D278 VanDerWaalsContact CD1-O 3.24Å; F255-D278 WeakPolarHBondContact CD1-O 3.46Å; F255-D278 PolarHBondContact N-O 3.09Å; F255-D278 VanDerWaalsContact N-O 3.09Å; F255-L279 HydrophobicContact CD1-CD2 4.2Å; F255-L279 HydrophobicContact CD1-CG 4.45Å; F255-L279 HydrophobicContact CE1-CD2 3.44Å; F255-L279 VanDerWaalsContact CE1-CD2 3.44Å; F255-L279 HydrophobicContact CE1-CG 3.6Å; F255-L279 HydrophobicContact CE2-CD2 4.11Å; F255-L279 HydrophobicContact CZ-CD2 3.38Å; F255-L279 HydrophobicContact CZ-CG 3.95Å; F255-N282 PolarHBondContact O-ND2 3.03Å
256	S	97.8	Very high	95.8	Very high	9 Å²	9	41.7 Å²	41.7	6%	0.063	21%	0.21	C	C	.	.			trans	-63.6	159.2	170.4	49.1	0	0	0	0	112.8	E232 H233 D278 S280	E232-S256 CarbonylContact C-O 3.51Å; E232-S256 WeakPolarHBondContact CA-O 3.41Å; E232-S256 WeakPolarHBondContact CB-O 3.17Å; H233-S256 PolarHBondContact N-O 3.43Å; S256-D278 WeakPolarHBondContact CB-OD2 3.1Å; S256-D278 PolarHBondContact N-O 2.99Å; S256-D278 PolarHBondContact OG-OD2 3.29Å; S256-S280 CarbonylContact C-O 3.48Å; S256-S280 WeakPolarHBondContact CA-O 3.42Å; S256-S280 WeakPolarHBondContact CB-O 2.99Å; S256-S280 WeakPolarHBondContact CB-OG 3.28Å
257	Q	97.9	Very high	96.1	Very high	86 Å²	86	41.6 Å²	41.6	40%	0.402	21%	0.209	S	C	.	.	S	Bend	trans	57.9	50	-173.7	-63.3	174.2	64.8	0	0	111.5	H233 N234 S280 F281	H233-Q257 CarbonylContact C-O 3.51Å; H233-Q257 WeakPolarHBondContact CA-O 3.13Å; H233-Q257 PolarHBondContact CE1-NE2 3.35Å; H233-Q257 PolarHBondContact CE1-OE1 3.21Å; H233-Q257 PolarHBondContact N-O 3.22Å; H233-Q257 PolarHBondContact ND1-OE1 3.05Å; N234-Q257 PolarHBondContact N-O 3.07Å; Q257-S280 PolarHBondContact N-O 2.66Å; Q257-F281 WeakPolarHBondContact CA-O 3.07Å; Q257-F281 HydrophobicContact CB-CB 4.27Å; Q257-F281 HydrophobicContact CG-CB 3.39Å; Q257-F281 HydrophobicContact CG-CD2 4.15Å; Q257-F281 HydrophobicContact CG-CG 3.8Å; Q257-F281 PolarHBondContact N-O 3.16Å
258	N	98.4	Very high	96.1	Very high	12 Å²	12	41.7 Å²	41.7	6%	0.064	21%	0.209	C	C	.	.	S	Bend	trans	-114.7	-164.1	166.9	-86.5	-89.8	0	0	0	108.8	L231 N234 N235 L236 F255 I260 F281 N282	L231-N258 PolarHBondContact O-ND2 3.27Å; N234-N258 VanDerWaalsContact CA-OD1 3.29Å; N234-N258 WeakPolarHBondContact CA-OD1 3.29Å; N234-N258 WeakPolarHBondContact CB-OD1 3.34Å; N234-N258 PolarHBondContact O-OD1 2.94Å; N235-N258 PolarHBondContact N-OD1 3.41Å; L236-N258 HydrophobicContact CB-CB 4.41Å; L236-N258 WeakPolarHBondContact CB-OD1 3.39Å; L236-N258 WeakPolarHBondContact CG-OD1 3.27Å; L236-N258 PolarHBondContact N-OD1 3.3Å; F255-N258 PolarHBondContact O-ND2 3.39Å; N258-I260 HydrophobicContact CB-CD1 4.06Å; N258-I260 HydrophobicContact CB-CG1 3.95Å; N258-F281 PolarHBondContact N-O 2.9Å; N258-N282 VanDerWaalsContact CA-OD1 3.29Å; N258-N282 WeakPolarHBondContact CA-OD1 3.17Å; N258-N282 WeakPolarHBondContact CB-OD1 3.11Å; N258-N282 PolarHBondContact N-OD1 3.12Å; N258-N282 PolarHBondContact O-OD1 2.96Å
259	A	97.6	Very high	96.2	Very high	22 Å²	22	41 Å²	41	18%	0.182	21%	0.206	C	C	.	.			trans	-116	29.5	177.9	0	0	0	0	0	111.5	L236 T237 G261 N282	L236-A259 CarbonylContact O-C 3.43Å; L236-A259 WeakPolarHBondContact O-CA 3.34Å; L236-A259 PolarHBondContact O-N 2.84Å; T237-A259 WeakPolarHBondContact CA-O 3.42Å; T237-A259 HydrophobicContact CG2-CB 4.26Å; A259-G261 PolarHBondContact O-N 3.42Å; A259-N282 PolarHBondContact N-OD1 2.82Å
260	I	97.9	Very high	96.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.195	C	C	.	.			trans	-70.9	114.3	-169	-60	167.5	0	0	0	109.6	L236 T237 V239 F255 N258 L279 N282 H283 L284	L236-I260 HydrophobicContact CB-CG1 4.33Å; L236-I260 WeakPolarHBondContact O-CG1 3.41Å; L236-I260 PolarHBondContact O-N 2.82Å; T237-I260 WeakPolarHBondContact O-CA 3.43Å; V239-I260 HydrophobicContact CG2-CD1 4.24Å; V239-I260 HydrophobicContact CG2-CG2 3.72Å; F255-I260 HydrophobicContact CD2-CD1 3.42Å; F255-I260 VanDerWaalsContact CD2-CD1 3.42Å; F255-I260 HydrophobicContact CE2-CD1 3.54Å; F255-I260 HydrophobicContact CG-CD1 4.12Å; F255-I260 HydrophobicContact CZ-CD1 4.3Å; N258-I260 HydrophobicContact CB-CD1 4.06Å; N258-I260 HydrophobicContact CB-CG1 3.95Å; I260-L279 HydrophobicContact CD1-CD2 4.11Å; I260-N282 HydrophobicContact CB-CB 4.19Å; I260-N282 VanDerWaalsContact CB-OD1 3.28Å; I260-N282 WeakPolarHBondContact CB-OD1 3.47Å; I260-N282 WeakPolarHBondContact CG1-OD1 3.26Å; I260-N282 PolarHBondContact N-OD1 3.42Å; I260-H283 CarbonylContact O-C 3.52Å; I260-H283 WeakPolarHBondContact O-CA 3.19Å; I260-H283 PolarHBondContact O-N 3.46Å; I260-L284 HydrophobicContact CG2-CD2 4.09Å; I260-L284 PolarHBondContact O-N 3.41Å; I260-L284 VanDerWaalsContact O-N 3.16Å
261	G	96.8	Very high	95.9	Very high	24 Å²	24	38.9 Å²	38.9	25%	0.247	20%	0.195	C	C	.	.			trans	-104.5	-16.6	174.3	0	0	0	0	0	114.4	T237 A259 H283	T237-G261 PolarHBondContact O-N 3.44Å; A259-G261 PolarHBondContact O-N 3.42Å; G261-H283 WeakPolarHBondContact CA-O 3.48Å
262	I	95	Very high	95.7	Very high	95 Å²	95	39.7 Å²	39.7	49%	0.487	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	133.7	-172.2	-60.2	175.1	0	0	0	110.9	E238 V239	E238-I262 CarbonylContact C-O 3.58Å; E238-I262 VanDerWaalsContact CA-O 3.25Å; E238-I262 WeakPolarHBondContact CA-O 3.46Å; E238-I262 HydrophobicContact CB-CB 4.26Å; V239-I262 PolarHBondContact N-O 3.09Å
263	I	96.4	Very high	95.6	Very high	21 Å²	21	43.1 Å²	43.1	11%	0.108	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125	163.7	-56.3	170.3	0	0	0	106.5	V239 A267 W268 L279 L284 L287 F292	V239-I263 HydrophobicContact CB-CG1 4.47Å; V239-I263 HydrophobicContact CB-CG2 4.36Å; V239-I263 HydrophobicContact CG2-CG1 4.02Å; I263-A267 HydrophobicContact CG2-CB 4.22Å; I263-W268 HydrophobicContact CG2-CZ2 3.87Å; I263-L279 HydrophobicContact CD1-CD1 3.79Å; I263-L284 HydrophobicContact CD1-CD1 4.43Å; I263-L284 HydrophobicContact CD1-CD2 4.25Å; I263-L284 HydrophobicContact CG1-CD2 4.08Å; I263-L287 HydrophobicContact CD1-CD2 3.96Å; I263-F292 HydrophobicContact CD1-CE1 4.02Å; I263-F292 HydrophobicContact CD1-CZ 4.25Å
264	R	93.9	Very high	95.6	Very high	108 Å²	108	43.1 Å²	43.1	41%	0.408	22%	0.216	S	C	.	.			trans	-75.5	143.9	175.7	-57.2	-53.6	-171.9	100.7	4.7	110.3	E238 V239 N240 D266 A267	E238-R264 IonicContact OE1-NE 3.45Å; E238-R264 IonicContact OE1-NH2 2.98Å; E238-R264 IonicContact OE2-CZ 3.41Å; E238-R264 VanDerWaalsContact OE2-CZ 3.23Å; E238-R264 IonicContact OE2-NE 2.66Å; E238-R264 PolarHBondContact OE2-NE 3.37Å; E238-R264 IonicContact OE2-NH2 3.41Å; E238-R264 PolarHBondContact OE2-NH2 2.92Å; V239-R264 WeakPolarHBondContact O-CG 3.36Å; V239-R264 PolarHBondContact O-N 3.18Å; N240-R264 HydrophobicContact CB-CB 4.42Å; N240-R264 HydrophobicContact CB-CG 3.72Å; R264-D266 PolarHBondContact O-N 3.47Å; R264-A267 VanDerWaalsContact O-CB 3.26Å; R264-A267 WeakPolarHBondContact O-CB 3.42Å; R264-A267 PolarHBondContact O-N 3.31Å
265	P	90	Very high	95.6	Very high	83 Å²	83	43.9 Å²	43.9	54%	0.539	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-23.7	-177.8	-30	37.2	0	0	0	115.9
266	D	91.1	Very high	95.7	Very high	62 Å²	62	46.4 Å²	46.4	33%	0.332	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	2.3	-178.2	64.2	-6.5	0	0	0	113.9	K241 R264 W268 E269	K241-D266 WeakPolarHBondContact CB-O 3.19Å; K241-D266 HydrophobicContact CD-CB 4.04Å; K241-D266 VanDerWaalsContact CD-OD2 3.24Å; K241-D266 WeakPolarHBondContact CD-OD2 3.47Å; K241-D266 WeakPolarHBondContact CE-OD2 3.48Å; K241-D266 IonicContact NZ-OD2 3.78Å; K241-D266 PolarHBondContact NZ-OD2 2.98Å; R264-D266 PolarHBondContact O-N 3.47Å; D266-W268 PolarHBondContact O-N 3.2Å; D266-E269 VanDerWaalsContact O-CB 3.3Å; D266-E269 WeakPolarHBondContact O-CB 3.43Å; D266-E269 PolarHBondContact O-N 3Å; D266-E269 VanDerWaalsContact O-N 3.07Å
267	A	94.1	Very high	95.7	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-37	-171.7	0	0	0	0	0	113.8	V239 L244 I263 R264	V239-A267 HydrophobicContact CB-CB 4.43Å; V239-A267 HydrophobicContact CG1-CB 4.1Å; L244-A267 WeakPolarHBondContact CD1-O 3.29Å; I263-A267 HydrophobicContact CG2-CB 4.22Å; R264-A267 VanDerWaalsContact O-CB 3.26Å; R264-A267 WeakPolarHBondContact O-CB 3.42Å; R264-A267 PolarHBondContact O-N 3.31Å
268	W	95.1	Very high	95.8	Very high	3 Å²	3	43 Å²	43	1%	0.011	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	2	-173.5	-46.3	119.3	0	0	0	114.9	V239 L244 L253 F255 I263 D266 F270 C271 L277 A291 L295	V239-W268 HydrophobicContact CG1-CH2 3.79Å; V239-W268 HydrophobicContact CG1-CZ2 4.33Å; V239-W268 HydrophobicContact CG1-CZ3 4.07Å; L244-W268 HydrophobicContact CD1-CE3 4.13Å; L244-W268 HydrophobicContact CD1-CZ3 4.09Å; L253-W268 HydrophobicContact CD2-CZ3 3.9Å; F255-W268 HydrophobicContact CZ-CH2 4.09Å; I263-W268 HydrophobicContact CG2-CZ2 3.87Å; D266-W268 PolarHBondContact O-N 3.2Å; W268-F270 PolarHBondContact O-N 2.9Å; W268-C271 PolarHBondContact O-N 2.96Å; W268-L277 HydrophobicContact CH2-CD1 3.81Å; W268-L277 HydrophobicContact CH2-CD2 3.92Å; W268-L277 HydrophobicContact CZ2-CD2 3.98Å; W268-L277 HydrophobicContact CZ3-CD1 4.15Å; W268-A291 PolarHBondContact NE1-O 3.35Å; W268-L295 HydrophobicContact CB-CD2 3.77Å; W268-L295 HydrophobicContact CB-CG 3.95Å; W268-L295 HydrophobicContact CD2-CD1 3.82Å; W268-L295 HydrophobicContact CD2-CD2 4.2Å; W268-L295 HydrophobicContact CD2-CG 4.2Å; W268-L295 HydrophobicContact CE3-CD1 4.41Å; W268-L295 HydrophobicContact CE3-CD2 4.42Å; W268-L295 HydrophobicContact CG-CD1 3.84Å; W268-L295 HydrophobicContact CG-CD2 3.92Å; W268-L295 HydrophobicContact CG-CG 3.76Å
269	E	93.9	Very high	95.7	Very high	89 Å²	89	42.4 Å²	42.4	42%	0.416	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.2	-39.4	-176.6	-172.4	-178.8	152.3	0	0	112.5	K241 D266 Q272	K241-E269 HydrophobicContact CD-CB 4.49Å; K241-E269 WeakPolarHBondContact CD-OE2 3.49Å; K241-E269 WeakPolarHBondContact CE-OE2 3.32Å; K241-E269 IonicContact NZ-OE2 3.39Å; K241-E269 PolarHBondContact NZ-OE2 2.79Å; D266-E269 VanDerWaalsContact O-CB 3.3Å; D266-E269 WeakPolarHBondContact O-CB 3.43Å; D266-E269 PolarHBondContact O-N 3Å; D266-E269 VanDerWaalsContact O-N 3.07Å; E269-Q272 PolarHBondContact O-NE2 3.43Å
270	F	93.9	Very high	95.8	Very high	29 Å²	29	41.6 Å²	41.6	13%	0.127	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-4.3	-177.5	-52.5	-62.4	0	0	0	115.3	K241 Y245 L247 H248 W268	K241-F270 HydrophobicContact CB-CD2 4.18Å; K241-F270 HydrophobicContact CB-CE2 3.91Å; K241-F270 HydrophobicContact CD-CE2 3.95Å; K241-F270 HydrophobicContact CD-CZ 4.5Å; K241-F270 HydrophobicContact CG-CE2 4.15Å; Y245-F270 HydrophobicContact CD2-CD1 4.18Å; Y245-F270 HydrophobicContact CD2-CD2 4Å; Y245-F270 AromaticContact CD2-CE1 3.88Å; Y245-F270 HydrophobicContact CD2-CE1 3.88Å; Y245-F270 AromaticContact CD2-CE2 3.66Å; Y245-F270 HydrophobicContact CD2-CE2 3.66Å; Y245-F270 HydrophobicContact CD2-CG 4.26Å; Y245-F270 AromaticContact CD2-CZ 3.62Å; Y245-F270 HydrophobicContact CD2-CZ 3.62Å; Y245-F270 HydrophobicContact CE2-CE1 4.01Å; Y245-F270 HydrophobicContact CE2-CE2 4.49Å; Y245-F270 AromaticContact CE2-CZ 4Å; Y245-F270 HydrophobicContact CE2-CZ 4Å; L247-F270 CarbonylContact C-O 3.56Å; L247-F270 VanDerWaalsContact C-O 3.27Å; H248-F270 VanDerWaalsContact CA-O 3.29Å; H248-F270 WeakPolarHBondContact CA-O 3.44Å; H248-F270 AromaticContact CE1-CD1 3.78Å; H248-F270 PolarHBondContact N-O 2.87Å; W268-F270 PolarHBondContact O-N 2.9Å
271	C	94	Very high	95.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.225	C	C	.	.			trans	-117.5	28.5	-170.3	-65.5	0	0	0	0	113.8	W268 K273 L274	W268-C271 PolarHBondContact O-N 2.96Å; C271-K273 PolarHBondContact O-N 3.13Å; C271-L274 WeakPolarHBondContact O-CB 3.44Å; C271-L274 PolarHBondContact O-N 2.98Å; C271-L274 VanDerWaalsContact O-N 3.12Å
272	Q	94.1	Very high	95.9	Very high	115 Å²	115	44.9 Å²	44.9	54%	0.537	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-4.5	-172.1	-58.2	175.5	22.5	0	0	115.6	E269	E269-Q272 PolarHBondContact O-NE2 3.43Å
273	K	96.7	Very high	96	Very high	95 Å²	95	45.8 Å²	45.8	41%	0.413	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	7.6	175.8	-67.5	-165.8	-174.6	175.9	0	114.4	H248 M249 L250 C271 E275	H248-K273 WeakPolarHBondContact O-CD 3.3Å; M249-K273 HydrophobicContact SD-CD 4.31Å; M249-K273 PolarHBondContact SD-NZ 2.62Å; L250-K273 CarbonylContact O-C 3.59Å; C271-K273 PolarHBondContact O-N 3.13Å; K273-E275 PolarHBondContact O-N 3.12Å
274	L	97.9	Very high	96.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.212	C	C	.	.			trans	-65	131.6	-177	-154.1	73.8	0	0	0	111.5	L250 L253 C271 L277 L295 L297 L298	L250-L274 HydrophobicContact CD2-CD1 4.04Å; L250-L274 HydrophobicContact CG-CD1 3.9Å; L250-L274 WeakPolarHBondContact O-CA 2.98Å; L250-L274 PolarHBondContact O-N 3.37Å; L253-L274 HydrophobicContact CB-CD1 3.78Å; L253-L274 HydrophobicContact CB-CD2 4.19Å; C271-L274 WeakPolarHBondContact O-CB 3.44Å; C271-L274 PolarHBondContact O-N 2.98Å; C271-L274 VanDerWaalsContact O-N 3.12Å; L274-L277 HydrophobicContact CD2-CB 3.74Å; L274-L277 HydrophobicContact CD2-CD1 3.7Å; L274-L277 HydrophobicContact CD2-CD2 4.36Å; L274-L277 HydrophobicContact CD2-CG 4.14Å; L274-L295 HydrophobicContact CB-CD2 4.04Å; L274-L295 HydrophobicContact CD2-CD2 4.42Å; L274-L297 CarbonylContact O-C 3.49Å; L274-L297 VanDerWaalsContact O-C 3.25Å; L274-L298 HydrophobicContact CB-CD1 4.21Å; L274-L298 HydrophobicContact CD2-CD1 4.02Å; L274-L298 HydrophobicContact CG-CD1 4.06Å; L274-L298 WeakPolarHBondContact O-CA 3.2Å; L274-L298 PolarHBondContact O-N 3Å; L274-L298 VanDerWaalsContact O-N 3.13Å
275	E	98.3	Very high	96.1	Very high	69 Å²	69	43 Å²	43	32%	0.322	21%	0.213	S	C	.	.	S	Bend	trans	-110.2	-31.4	178.7	-69	168.8	-156.2	0	0	111.2	R251 K273 E299 N300	R251-E275 IonicContact CZ-OE1 2.76Å; R251-E275 VanDerWaalsContact CZ-OE1 3.32Å; R251-E275 IonicContact CZ-OE2 3.3Å; R251-E275 IonicContact NE-OE1 3.98Å; R251-E275 PolarHBondContact NE-OE1 3.2Å; R251-E275 IonicContact NE-OE2 2.88Å; R251-E275 PolarHBondContact NE-OE2 3.03Å; R251-E275 VanDerWaalsContact NH2-CD 3.3Å; R251-E275 IonicContact NH2-OE1 2.67Å; R251-E275 PolarHBondContact NH2-OE1 2.98Å; R251-E275 IonicContact NH2-OE2 3.02Å; R251-E275 PolarHBondContact NH2-OE2 3.33Å; R251-E275 WeakPolarHBondContact O-CA 3.14Å; R251-E275 PolarHBondContact O-N 2.73Å; K273-E275 PolarHBondContact O-N 3.12Å; E275-E299 PolarHBondContact O-N 2.93Å; E275-N300 PolarHBondContact O-N 3.22Å
276	E	98.6	Very high	96.2	Very high	53 Å²	53	44.2 Å²	44.2	25%	0.248	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	125.2	178.8	-171.5	-170	136.2	0	0	111.7	R251 V252 L253 R254 N300	R251-E276 PolarHBondContact O-N 2.98Å; V252-E276 HydrophobicContact CG1-CB 4.43Å; V252-E276 HydrophobicContact CG2-CB 4.21Å; L253-E276 PolarHBondContact N-O 2.92Å; R254-E276 IonicContact CZ-OE1 2.6Å; R254-E276 VanDerWaalsContact CZ-OE1 3.23Å; R254-E276 IonicContact NE-OE1 2.96Å; R254-E276 PolarHBondContact NE-OE1 2.69Å; R254-E276 VanDerWaalsContact NH2-CD 3.29Å; R254-E276 IonicContact NH2-OE1 3.23Å; R254-E276 PolarHBondContact NH2-OE1 3.09Å; R254-E276 IonicContact NH2-OE2 3.69Å; R254-E276 PolarHBondContact NH2-OE2 2.81Å; E276-N300 HydrophobicContact CG-CB 4.25Å
277	L	98.6	Very high	96.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	114.5	176.5	-175.3	62	0	0	0	110.7	L253 F255 W268 L274 L279 F292 L295 L298 N300 L301 N302	L253-L277 HydrophobicContact CB-CD1 4.16Å; L253-L277 HydrophobicContact CD2-CD1 3.95Å; L253-L277 HydrophobicContact CG-CD1 4.18Å; F255-L277 HydrophobicContact CE1-CD1 3.56Å; F255-L277 HydrophobicContact CZ-CD1 4.16Å; W268-L277 HydrophobicContact CH2-CD1 3.81Å; W268-L277 HydrophobicContact CH2-CD2 3.92Å; W268-L277 HydrophobicContact CZ2-CD2 3.98Å; W268-L277 HydrophobicContact CZ3-CD1 4.15Å; L274-L277 HydrophobicContact CD2-CB 3.74Å; L274-L277 HydrophobicContact CD2-CD1 3.7Å; L274-L277 HydrophobicContact CD2-CD2 4.36Å; L274-L277 HydrophobicContact CD2-CG 4.14Å; L277-L279 HydrophobicContact CD2-CD1 4.05Å; L277-L279 HydrophobicContact CG-CD1 4.24Å; L277-L279 HydrophobicContact CG-CG 4.41Å; L277-F292 HydrophobicContact CD2-CD1 4.24Å; L277-F292 HydrophobicContact CD2-CE1 4.24Å; L277-L295 HydrophobicContact CD2-CD1 3.94Å; L277-L298 HydrophobicContact CB-CD1 3.82Å; L277-L298 HydrophobicContact CB-CD2 4.26Å; L277-N300 PolarHBondContact N-O 2.93Å; L277-L301 HydrophobicContact CB-CD1 4.09Å; L277-L301 HydrophobicContact CD2-CD1 3.89Å; L277-L301 HydrophobicContact CG-CD1 4.1Å; L277-N302 PolarHBondContact O-N 3.34Å
278	D	98.6	Very high	96	Very high	21 Å²	21	45.2 Å²	45.2	11%	0.112	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	99.5	177.2	177.7	31.8	0	0	0	112.4	L253 R254 F255 S256 S280 N302	L253-D278 PolarHBondContact O-N 3.26Å; R254-D278 HydrophobicContact CB-CB 4.41Å; R254-D278 HydrophobicContact CG-CB 4.26Å; F255-D278 CarbonylContact C-O 3.19Å; F255-D278 VanDerWaalsContact CD1-O 3.24Å; F255-D278 WeakPolarHBondContact CD1-O 3.46Å; F255-D278 PolarHBondContact N-O 3.09Å; F255-D278 VanDerWaalsContact N-O 3.09Å; S256-D278 WeakPolarHBondContact CB-OD2 3.1Å; S256-D278 PolarHBondContact N-O 2.99Å; S256-D278 PolarHBondContact OG-OD2 3.29Å; D278-S280 WeakPolarHBondContact OD1-CB 3.25Å; D278-S280 PolarHBondContact OD1-N 2.78Å; D278-S280 VanDerWaalsContact OD1-N 3.16Å; D278-S280 PolarHBondContact OD1-OG 2.85Å; D278-N302 PolarHBondContact OD1-ND2 2.7Å
279	L	97.9	Very high	95.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.236	C	C	.	.			trans	-101.6	8.8	177	-86.3	165.6	0	0	0	112.9	F255 I260 I263 L277 N282 L284 F292 N302 L303 N306	F255-L279 HydrophobicContact CD1-CD2 4.2Å; F255-L279 HydrophobicContact CD1-CG 4.45Å; F255-L279 HydrophobicContact CE1-CD2 3.44Å; F255-L279 VanDerWaalsContact CE1-CD2 3.44Å; F255-L279 HydrophobicContact CE1-CG 3.6Å; F255-L279 HydrophobicContact CE2-CD2 4.11Å; F255-L279 HydrophobicContact CZ-CD2 3.38Å; F255-L279 HydrophobicContact CZ-CG 3.95Å; I260-L279 HydrophobicContact CD1-CD2 4.11Å; I263-L279 HydrophobicContact CD1-CD1 3.79Å; L277-L279 HydrophobicContact CD2-CD1 4.05Å; L277-L279 HydrophobicContact CG-CD1 4.24Å; L277-L279 HydrophobicContact CG-CG 4.41Å; L279-N282 WeakPolarHBondContact O-CB 3.38Å; L279-N282 PolarHBondContact O-ND2 2.98Å; L279-L284 HydrophobicContact CB-CD1 4.31Å; L279-L284 HydrophobicContact CD1-CD1 4.31Å; L279-L284 HydrophobicContact CD2-CD1 4.36Å; L279-F292 HydrophobicContact CD1-CE1 4.08Å; L279-N302 CarbonylContact C-O 3.23Å; L279-N302 WeakPolarHBondContact CA-O 3.25Å; L279-N302 WeakPolarHBondContact CB-O 3.36Å; L279-N302 PolarHBondContact N-O 3.2Å; L279-L303 HydrophobicContact CB-CD2 3.85Å; L279-L303 HydrophobicContact CD1-CD2 3.75Å; L279-L303 HydrophobicContact CG-CD2 4.46Å; L279-N306 PolarHBondContact O-ND2 3.11Å; L279-N306 VanDerWaalsContact O-ND2 3.08Å
280	S	98.6	Very high	95.5	Very high	5 Å²	5	49.6 Å²	49.6	4%	0.035	23%	0.234	C	C	.	.			trans	-64.6	159.4	-174.5	59.3	0	0	0	0	114.3	S256 Q257 D278 N282 N302 G304	S256-S280 CarbonylContact C-O 3.48Å; S256-S280 WeakPolarHBondContact CA-O 3.42Å; S256-S280 WeakPolarHBondContact CB-O 2.99Å; S256-S280 WeakPolarHBondContact CB-OG 3.28Å; Q257-S280 PolarHBondContact N-O 2.66Å; D278-S280 WeakPolarHBondContact OD1-CB 3.25Å; D278-S280 PolarHBondContact OD1-N 2.78Å; D278-S280 VanDerWaalsContact OD1-N 3.16Å; D278-S280 PolarHBondContact OD1-OG 2.85Å; S280-N282 PolarHBondContact O-ND2 3.36Å; S280-N302 VanDerWaalsContact CB-ND2 3.25Å; S280-N302 WeakPolarHBondContact CB-ND2 3.48Å; S280-N302 PolarHBondContact N-O 2.97Å; S280-N302 PolarHBondContact OG-ND2 3.41Å; S280-G304 CarbonylContact C-O 3.3Å; S280-G304 WeakPolarHBondContact CA-O 3.49Å; S280-G304 WeakPolarHBondContact CB-O 3.15Å
281	F	98.4	Very high	95.5	Very high	88 Å²	88	48.5 Å²	48.5	39%	0.386	23%	0.231	S	C	.	.	S	Bend	trans	53.7	57.7	-177.8	-58.9	-86.5	0	0	0	112.2	Q257 N258 G304 D305	Q257-F281 WeakPolarHBondContact CA-O 3.07Å; Q257-F281 HydrophobicContact CB-CB 4.27Å; Q257-F281 HydrophobicContact CG-CB 3.39Å; Q257-F281 HydrophobicContact CG-CD2 4.15Å; Q257-F281 HydrophobicContact CG-CG 3.8Å; Q257-F281 PolarHBondContact N-O 3.16Å; N258-F281 PolarHBondContact N-O 2.9Å; F281-G304 PolarHBondContact N-O 2.95Å; F281-D305 WeakPolarHBondContact CA-O 3.27Å; F281-D305 HydrophobicContact CD1-CB 3.47Å; F281-D305 VanDerWaalsContact CD1-CB 3.47Å; F281-D305 HydrophobicContact CD2-CB 4.05Å; F281-D305 HydrophobicContact CE1-CB 3.47Å; F281-D305 VanDerWaalsContact CE1-CB 3.47Å; F281-D305 VanDerWaalsContact CE1-CG 3.42Å; F281-D305 WeakPolarHBondContact CE1-OD1 3.47Å; F281-D305 HydrophobicContact CE2-CB 4.05Å; F281-D305 WeakPolarHBondContact CE2-OD2 3.42Å; F281-D305 HydrophobicContact CG-CB 3.77Å; F281-D305 HydrophobicContact CZ-CB 3.76Å; F281-D305 VanDerWaalsContact CZ-OD1 3.3Å; F281-D305 WeakPolarHBondContact CZ-OD1 3.34Å; F281-D305 WeakPolarHBondContact CZ-OD2 3.33Å; F281-D305 PolarHBondContact N-O 3.11Å
282	N	98.6	Very high	95.5	Very high	5 Å²	5	48.5 Å²	48.5	3%	0.027	23%	0.231	C	C	.	.	S	Bend	trans	-129.9	-160.4	176.9	-87.9	-72.2	0	0	0	109.8	F255 N258 A259 I260 L279 S280 N306	F255-N282 PolarHBondContact O-ND2 3.03Å; N258-N282 VanDerWaalsContact CA-OD1 3.29Å; N258-N282 WeakPolarHBondContact CA-OD1 3.17Å; N258-N282 WeakPolarHBondContact CB-OD1 3.11Å; N258-N282 PolarHBondContact N-OD1 3.12Å; N258-N282 PolarHBondContact O-OD1 2.96Å; A259-N282 PolarHBondContact N-OD1 2.82Å; I260-N282 HydrophobicContact CB-CB 4.19Å; I260-N282 VanDerWaalsContact CB-OD1 3.28Å; I260-N282 WeakPolarHBondContact CB-OD1 3.47Å; I260-N282 WeakPolarHBondContact CG1-OD1 3.26Å; I260-N282 PolarHBondContact N-OD1 3.42Å; L279-N282 WeakPolarHBondContact O-CB 3.38Å; L279-N282 PolarHBondContact O-ND2 2.98Å; S280-N282 PolarHBondContact O-ND2 3.36Å; N282-N306 WeakPolarHBondContact CA-OD1 3.31Å; N282-N306 WeakPolarHBondContact CB-OD1 3.41Å; N282-N306 PolarHBondContact N-OD1 2.75Å; N282-N306 PolarHBondContact O-OD1 3.43Å
283	H	97.6	Very high	95.4	Very high	114 Å²	114	46.1 Å²	46.1	53%	0.528	23%	0.227	S	C	.	.			trans	-123.5	27.4	-175.8	-59.6	-17.8	0	0	0	111.8	I260 G261 T285 N306	I260-H283 CarbonylContact O-C 3.52Å; I260-H283 WeakPolarHBondContact O-CA 3.19Å; I260-H283 PolarHBondContact O-N 3.46Å; G261-H283 WeakPolarHBondContact CA-O 3.48Å; H283-T285 PolarHBondContact O-N 3.07Å; H283-N306 PolarHBondContact N-OD1 2.97Å
284	L	97.6	Very high	95.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	23%	0.226	C	C	.	.			trans	-67.2	125.4	177.7	-61.7	170.7	0	0	0	109.5	I260 I263 L279 L287 L303 N306 S307 V308	I260-L284 HydrophobicContact CG2-CD2 4.09Å; I260-L284 PolarHBondContact O-N 3.41Å; I260-L284 VanDerWaalsContact O-N 3.16Å; I263-L284 HydrophobicContact CD1-CD1 4.43Å; I263-L284 HydrophobicContact CD1-CD2 4.25Å; I263-L284 HydrophobicContact CG1-CD2 4.08Å; L279-L284 HydrophobicContact CB-CD1 4.31Å; L279-L284 HydrophobicContact CD1-CD1 4.31Å; L279-L284 HydrophobicContact CD2-CD1 4.36Å; L284-L287 HydrophobicContact CD1-CD2 4.44Å; L284-L303 HydrophobicContact CD1-CD2 3.94Å; L284-N306 HydrophobicContact CB-CB 4.41Å; L284-N306 WeakPolarHBondContact CB-OD1 3.48Å; L284-N306 PolarHBondContact N-OD1 2.99Å; L284-N306 VanDerWaalsContact N-OD1 3.07Å; L284-S307 CarbonylContact O-C 3.55Å; L284-S307 WeakPolarHBondContact O-CA 3.31Å; L284-S307 PolarHBondContact O-N 2.96Å; L284-V308 HydrophobicContact CB-CG2 3.84Å; L284-V308 VanDerWaalsContact O-CG2 3.32Å; L284-V308 WeakPolarHBondContact O-CG2 3.25Å; L284-V308 PolarHBondContact O-N 3.45Å
285	T	94.4	Very high	94.9	Very high	70 Å²	70	43.4 Å²	43.4	43%	0.429	23%	0.226	S	C	.	.			trans	-111.4	-25.8	178.4	53.2	0	0	0	0	113.6	H283 S307 V308 S309 H310	H283-T285 PolarHBondContact O-N 3.07Å; T285-S307 WeakPolarHBondContact CA-O 3.4Å; T285-V308 WeakPolarHBondContact O-CA 3.49Å; T285-S309 PolarHBondContact O-N 2.94Å; T285-S309 PolarHBondContact O-OG 3.27Å; T285-H310 PolarHBondContact O-N 3.35Å
286	R	91.4	Very high	94.7	Very high	109 Å²	109	41.4 Å²	41.4	41%	0.411	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	144.5	-176.8	63.3	-167.6	-63.8	119	14.3	110.6	E288 H310 E499	R286-E288 IonicContact CZ-OE1 3.15Å; R286-E288 IonicContact NE-OE1 3.93Å; R286-E288 PolarHBondContact NE-OE1 3.07Å; R286-E288 IonicContact NH2-OE1 3.71Å; R286-E288 PolarHBondContact NH2-OE1 3.44Å; R286-E288 IonicContact NH2-OE2 3.93Å; R286-H310 HydrophobicContact CB-CB 3.89Å; R286-E499 IonicContact CZ-OE1 2.75Å; R286-E499 IonicContact NH1-OE1 2.71Å; R286-E499 PolarHBondContact NH1-OE1 3Å; R286-E499 IonicContact NH2-OE1 3.8Å; R286-E499 PolarHBondContact NH2-OE1 3.08Å
287	L	92.9	Very high	94.6	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.016	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	107.6	174.1	-62.9	170.2	0	0	0	108.9	I263 L284 A291 F292 L303 V308 H310 L311 G312 V315	I263-L287 HydrophobicContact CD1-CD2 3.96Å; L284-L287 HydrophobicContact CD1-CD2 4.44Å; L287-A291 HydrophobicContact CB-CB 4.36Å; L287-A291 HydrophobicContact CD2-CB 4.29Å; L287-F292 HydrophobicContact CD1-CE2 4.03Å; L287-F292 HydrophobicContact CD1-CZ 4.06Å; L287-F292 HydrophobicContact CD2-CE2 4.28Å; L287-F292 HydrophobicContact CD2-CZ 3.99Å; L287-L303 HydrophobicContact CD1-CD1 3.82Å; L287-L303 HydrophobicContact CD1-CD2 4.32Å; L287-V308 HydrophobicContact CD1-CG1 4.15Å; L287-V308 HydrophobicContact CD1-CG2 4.21Å; L287-V308 HydrophobicContact CG-CG1 4.33Å; L287-V308 HydrophobicContact CG-CG2 4.46Å; L287-H310 PolarHBondContact N-O 2.9Å; L287-L311 HydrophobicContact CB-CD2 4.15Å; L287-L311 HydrophobicContact CD1-CD2 3.85Å; L287-L311 HydrophobicContact CG-CD2 4.45Å; L287-G312 PolarHBondContact O-N 3.35Å; L287-V315 HydrophobicContact CB-CG2 3.95Å
288	E	89.1	Confident	94.6	Very high	80 Å²	80	43.2 Å²	43.2	37%	0.374	24%	0.235	S	C	.	.			trans	-71.5	161	177.3	-53.1	-56.1	148.8	0	0	111.6	R286 T290 A291 V315	R286-E288 IonicContact CZ-OE1 3.15Å; R286-E288 IonicContact NE-OE1 3.93Å; R286-E288 PolarHBondContact NE-OE1 3.07Å; R286-E288 IonicContact NH2-OE1 3.71Å; R286-E288 PolarHBondContact NH2-OE1 3.44Å; R286-E288 IonicContact NH2-OE2 3.93Å; E288-T290 PolarHBondContact O-N 3.19Å; E288-A291 WeakPolarHBondContact O-CB 3.41Å; E288-A291 PolarHBondContact O-N 3.05Å; E288-V315 VanDerWaalsContact O-CG2 3.26Å; E288-V315 WeakPolarHBondContact O-CG2 3.38Å
289	E	87.7	Confident	94.5	Very high	122 Å²	122	45.1 Å²	45.1	57%	0.57	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-47.4	-40.3	179	-178	-179.2	-175.1	0	0	113.3	A291 E313	E289-A291 VanDerWaalsContact C-N 3.34Å; E289-A291 PolarHBondContact O-N 2.89Å; E289-E313 WeakPolarHBondContact CG-O 3.4Å
290	T	90.7	Very high	94.6	Very high	61 Å²	61	48.4 Å²	48.4	37%	0.374	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-81.1	-5.4	-177.1	52.4	0	0	0	0	114.8	E288 F292 S293	E288-T290 PolarHBondContact O-N 3.19Å; T290-F292 PolarHBondContact O-N 3.36Å; T290-S293 WeakPolarHBondContact O-CB 2.94Å; T290-S293 PolarHBondContact O-N 2.93Å
291	A	93.8	Very high	94.6	Very high	7 Å²	7	48.3 Å²	48.3	6%	0.058	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-60	-22	-169.2	0	0	0	0	0	114.9	W268 L287 E288 E289 V315	W268-A291 PolarHBondContact NE1-O 3.35Å; L287-A291 HydrophobicContact CB-CB 4.36Å; L287-A291 HydrophobicContact CD2-CB 4.29Å; E288-A291 WeakPolarHBondContact O-CB 3.41Å; E288-A291 PolarHBondContact O-N 3.05Å; E289-A291 VanDerWaalsContact C-N 3.34Å; E289-A291 PolarHBondContact O-N 2.89Å; A291-V315 HydrophobicContact CB-CG2 4.37Å
292	F	94.4	Very high	94.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-127	28.3	174	-50.4	-72.7	0	0	0	112.8	I263 L277 L279 L287 T290 L295 L301 L303 V315 F316 S318 L319	I263-F292 HydrophobicContact CD1-CE1 4.02Å; I263-F292 HydrophobicContact CD1-CZ 4.25Å; L277-F292 HydrophobicContact CD2-CD1 4.24Å; L277-F292 HydrophobicContact CD2-CE1 4.24Å; L279-F292 HydrophobicContact CD1-CE1 4.08Å; L287-F292 HydrophobicContact CD1-CE2 4.03Å; L287-F292 HydrophobicContact CD1-CZ 4.06Å; L287-F292 HydrophobicContact CD2-CE2 4.28Å; L287-F292 HydrophobicContact CD2-CZ 3.99Å; T290-F292 PolarHBondContact O-N 3.36Å; F292-L295 HydrophobicContact CB-CD1 4.28Å; F292-L295 HydrophobicContact CD1-CD1 4.23Å; F292-L295 PolarHBondContact O-N 2.89Å; F292-L301 HydrophobicContact CD1-CD2 4.48Å; F292-L301 HydrophobicContact CE1-CD1 4.26Å; F292-L301 HydrophobicContact CE1-CD2 4.33Å; F292-L301 HydrophobicContact CE2-CD2 4.38Å; F292-L301 HydrophobicContact CZ-CD2 4.29Å; F292-L303 HydrophobicContact CE1-CD2 4.44Å; F292-L303 HydrophobicContact CE2-CD1 4.3Å; F292-L303 HydrophobicContact CZ-CD1 3.94Å; F292-L303 HydrophobicContact CZ-CD2 3.91Å; F292-L303 HydrophobicContact CZ-CG 4.49Å; F292-V315 HydrophobicContact CD2-CG2 4.02Å; F292-V315 HydrophobicContact CE2-CG2 4.09Å; F292-F316 HydrophobicContact CD2-CD1 4.13Å; F292-F316 HydrophobicContact CD2-CE1 4.11Å; F292-F316 HydrophobicContact CE2-CD1 4.28Å; F292-F316 AromaticContact CE2-CE1 3.79Å; F292-F316 HydrophobicContact CE2-CE1 3.79Å; F292-S318 PolarHBondContact O-OG 3.01Å; F292-L319 HydrophobicContact CB-CD1 4.31Å; F292-L319 HydrophobicContact CB-CD2 3.98Å; F292-L319 HydrophobicContact CB-CG 4.38Å
293	S	91.1	Very high	94.5	Very high	64 Å²	64	45.4 Å²	45.4	45%	0.448	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	142.6	176.3	-168.4	0	0	0	0	111.5	T290 L295	T290-S293 WeakPolarHBondContact O-CB 2.94Å; T290-S293 PolarHBondContact O-N 2.93Å; S293-L295 VanDerWaalsContact C-N 3.27Å; S293-L295 PolarHBondContact O-N 3.21Å
294	G	89.9	Confident	94.6	Very high	39 Å²	39	40 Å²	40	40%	0.402	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	-13.3	-178.4	0	0	0	0	0	116.5	G296	G294-G296 PolarHBondContact O-N 3.01Å
295	L	94.8	Very high	94.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.231	C	C	.	.			trans	-80.3	41.3	-178.9	-64.5	-175.6	0	0	0	114	W268 L274 L277 F292 S293 L297 L298 L319	W268-L295 HydrophobicContact CB-CD2 3.77Å; W268-L295 HydrophobicContact CB-CG 3.95Å; W268-L295 HydrophobicContact CD2-CD1 3.82Å; W268-L295 HydrophobicContact CD2-CD2 4.2Å; W268-L295 HydrophobicContact CD2-CG 4.2Å; W268-L295 HydrophobicContact CE3-CD1 4.41Å; W268-L295 HydrophobicContact CE3-CD2 4.42Å; W268-L295 HydrophobicContact CG-CD1 3.84Å; W268-L295 HydrophobicContact CG-CD2 3.92Å; W268-L295 HydrophobicContact CG-CG 3.76Å; L274-L295 HydrophobicContact CB-CD2 4.04Å; L274-L295 HydrophobicContact CD2-CD2 4.42Å; L277-L295 HydrophobicContact CD2-CD1 3.94Å; F292-L295 HydrophobicContact CB-CD1 4.28Å; F292-L295 HydrophobicContact CD1-CD1 4.23Å; F292-L295 PolarHBondContact O-N 2.89Å; S293-L295 VanDerWaalsContact C-N 3.27Å; S293-L295 PolarHBondContact O-N 3.21Å; L295-L297 PolarHBondContact O-N 3.16Å; L295-L297 VanDerWaalsContact O-N 3.08Å; L295-L298 HydrophobicContact CB-CB 4.34Å; L295-L298 HydrophobicContact CD1-CD2 4.39Å; L295-L298 VanDerWaalsContact O-CB 3.31Å; L295-L298 WeakPolarHBondContact O-CB 3.1Å; L295-L298 PolarHBondContact O-N 2.94Å; L295-L298 VanDerWaalsContact O-N 3.11Å; L295-L319 HydrophobicContact CB-CD2 3.74Å; L295-L319 WeakPolarHBondContact O-CD2 3.09Å
296	G	93.9	Very high	94.8	Very high	27 Å²	27	38.7 Å²	38.7	28%	0.278	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-12.5	-173.1	0	0	0	0	0	115.8	G294 S318 N321	G294-G296 PolarHBondContact O-N 3.01Å; G296-S318 WeakPolarHBondContact CA-O 3.24Å; G296-N321 PolarHBondContact O-ND2 2.8Å
297	L	96.4	Very high	95.1	Very high	91 Å²	91	35.9 Å²	35.9	48%	0.476	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-2	176.9	-68.8	176.2	0	0	0	114	L274 L295 E299	L274-L297 CarbonylContact O-C 3.49Å; L274-L297 VanDerWaalsContact O-C 3.25Å; L295-L297 PolarHBondContact O-N 3.16Å; L295-L297 VanDerWaalsContact O-N 3.08Å; L297-E299 PolarHBondContact O-N 2.78Å
298	L	97.8	Very high	95.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.21	C	C	.	.			trans	-65.5	126.9	-176	-163.4	72.4	0	0	0	111.3	L274 L277 L295 L301 L319 N321 L322	L274-L298 HydrophobicContact CB-CD1 4.21Å; L274-L298 HydrophobicContact CD2-CD1 4.02Å; L274-L298 HydrophobicContact CG-CD1 4.06Å; L274-L298 WeakPolarHBondContact O-CA 3.2Å; L274-L298 PolarHBondContact O-N 3Å; L274-L298 VanDerWaalsContact O-N 3.13Å; L277-L298 HydrophobicContact CB-CD1 3.82Å; L277-L298 HydrophobicContact CB-CD2 4.26Å; L295-L298 HydrophobicContact CB-CB 4.34Å; L295-L298 HydrophobicContact CD1-CD2 4.39Å; L295-L298 VanDerWaalsContact O-CB 3.31Å; L295-L298 WeakPolarHBondContact O-CB 3.1Å; L295-L298 PolarHBondContact O-N 2.94Å; L295-L298 VanDerWaalsContact O-N 3.11Å; L298-L301 HydrophobicContact CD2-CB 3.93Å; L298-L301 HydrophobicContact CD2-CD1 4.33Å; L298-L301 HydrophobicContact CD2-CD2 4.34Å; L298-L301 HydrophobicContact CD2-CG 4.44Å; L298-L319 HydrophobicContact CB-CD2 4.26Å; L298-L319 HydrophobicContact CD2-CD1 4.42Å; L298-L319 HydrophobicContact CD2-CD2 4.1Å; L298-N321 CarbonylContact O-C 3.28Å; L298-L322 HydrophobicContact CB-CD1 4.33Å; L298-L322 HydrophobicContact CD2-CD1 4.02Å; L298-L322 HydrophobicContact CG-CD1 4Å; L298-L322 VanDerWaalsContact O-CA 3.27Å; L298-L322 WeakPolarHBondContact O-CA 3.38Å; L298-L322 PolarHBondContact O-N 2.9Å; L298-L322 VanDerWaalsContact O-N 3.11Å
299	E	97.9	Very high	95.3	Very high	61 Å²	61	34.2 Å²	34.2	29%	0.285	21%	0.208	S	C	.	.			trans	-103.6	-32.7	175.8	-60.6	-150	146.4	0	0	112	E275 L297 R323 S324	E275-E299 PolarHBondContact O-N 2.93Å; L297-E299 PolarHBondContact O-N 2.78Å; E299-R323 HydrophobicContact CB-CG 4.19Å; E299-R323 WeakPolarHBondContact O-CA 3.13Å; E299-R323 PolarHBondContact O-N 2.76Å; E299-R323 IonicContact OE1-CZ 2.73Å; E299-R323 VanDerWaalsContact OE1-CZ 3.23Å; E299-R323 IonicContact OE1-NE 2.87Å; E299-R323 PolarHBondContact OE1-NE 2.82Å; E299-R323 IonicContact OE1-NH2 3.73Å; E299-R323 PolarHBondContact OE1-NH2 3.27Å; E299-R323 WeakPolarHBondContact OE2-CD 3.47Å; E299-R323 IonicContact OE2-CZ 3.61Å; E299-R323 IonicContact OE2-NE 2.71Å; E299-R323 PolarHBondContact OE2-NE 2.69Å; E299-R323 IonicContact OE2-NH2 3.95Å; E299-S324 PolarHBondContact O-N 3.47Å; E299-S324 VanDerWaalsContact O-N 3.08Å
300	N	98.6	Very high	95.3	Very high	69 Å²	69	29 Å²	29	37%	0.369	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	123.2	-178	-62.2	-43.6	0	0	0	111.7	E275 E276 L277 S324	E275-N300 PolarHBondContact O-N 3.22Å; E276-N300 HydrophobicContact CG-CB 4.25Å; L277-N300 PolarHBondContact N-O 2.93Å; N300-S324 WeakPolarHBondContact OD1-CB 3.43Å
301	L	98.5	Very high	95.2	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.016	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	121.3	174.8	178.4	52.9	0	0	0	110.3	L277 F292 L298 L303 F316 L319 L322 S324 L325 D326	L277-L301 HydrophobicContact CB-CD1 4.09Å; L277-L301 HydrophobicContact CD2-CD1 3.89Å; L277-L301 HydrophobicContact CG-CD1 4.1Å; F292-L301 HydrophobicContact CD1-CD2 4.48Å; F292-L301 HydrophobicContact CE1-CD1 4.26Å; F292-L301 HydrophobicContact CE1-CD2 4.33Å; F292-L301 HydrophobicContact CE2-CD2 4.38Å; F292-L301 HydrophobicContact CZ-CD2 4.29Å; L298-L301 HydrophobicContact CD2-CB 3.93Å; L298-L301 HydrophobicContact CD2-CD1 4.33Å; L298-L301 HydrophobicContact CD2-CD2 4.34Å; L298-L301 HydrophobicContact CD2-CG 4.44Å; L301-L303 HydrophobicContact CD1-CD1 4.36Å; L301-L303 HydrophobicContact CD1-CD2 4.3Å; L301-L303 HydrophobicContact CD1-CG 3.99Å; L301-L303 HydrophobicContact CD2-CD1 3.98Å; L301-L303 HydrophobicContact CD2-CG 4.49Å; L301-L303 HydrophobicContact CG-CD1 4.05Å; L301-L303 HydrophobicContact CG-CG 4.05Å; L301-F316 HydrophobicContact CD2-CD1 4.33Å; L301-F316 HydrophobicContact CD2-CE1 4.11Å; L301-L319 HydrophobicContact CD2-CD1 3.7Å; L301-L322 HydrophobicContact CB-CD1 3.79Å; L301-L322 HydrophobicContact CB-CD2 4.26Å; L301-S324 PolarHBondContact N-O 3.02Å; L301-L325 HydrophobicContact CB-CD1 4.05Å; L301-L325 HydrophobicContact CD2-CD1 3.9Å; L301-L325 HydrophobicContact CG-CD1 3.89Å; L301-L325 WeakPolarHBondContact O-CA 3.4Å; L301-D326 PolarHBondContact O-N 2.75Å
302	N	98.7	Very high	94.8	Very high	33 Å²	33	26.1 Å²	26.1	18%	0.176	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	114	174.5	-178.6	19.7	0	0	0	110.7	L277 D278 L279 S280 G304	L277-N302 PolarHBondContact O-N 3.34Å; D278-N302 PolarHBondContact OD1-ND2 2.7Å; L279-N302 CarbonylContact C-O 3.23Å; L279-N302 WeakPolarHBondContact CA-O 3.25Å; L279-N302 WeakPolarHBondContact CB-O 3.36Å; L279-N302 PolarHBondContact N-O 3.2Å; S280-N302 VanDerWaalsContact CB-ND2 3.25Å; S280-N302 WeakPolarHBondContact CB-ND2 3.48Å; S280-N302 PolarHBondContact N-O 2.97Å; S280-N302 PolarHBondContact OG-ND2 3.41Å; N302-G304 PolarHBondContact OD1-N 2.94Å; N302-G304 VanDerWaalsContact OD1-N 3.09Å
303	L	98.3	Very high	94.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.185	C	C	.	.			trans	-117.3	9.3	176.8	-66.4	165.6	0	0	0	111.3	L279 L284 L287 F292 L301 N306 F316 L325 D326 I327 N330	L279-L303 HydrophobicContact CB-CD2 3.85Å; L279-L303 HydrophobicContact CD1-CD2 3.75Å; L279-L303 HydrophobicContact CG-CD2 4.46Å; L284-L303 HydrophobicContact CD1-CD2 3.94Å; L287-L303 HydrophobicContact CD1-CD1 3.82Å; L287-L303 HydrophobicContact CD1-CD2 4.32Å; F292-L303 HydrophobicContact CE1-CD2 4.44Å; F292-L303 HydrophobicContact CE2-CD1 4.3Å; F292-L303 HydrophobicContact CZ-CD1 3.94Å; F292-L303 HydrophobicContact CZ-CD2 3.91Å; F292-L303 HydrophobicContact CZ-CG 4.49Å; L301-L303 HydrophobicContact CD1-CD1 4.36Å; L301-L303 HydrophobicContact CD1-CD2 4.3Å; L301-L303 HydrophobicContact CD1-CG 3.99Å; L301-L303 HydrophobicContact CD2-CD1 3.98Å; L301-L303 HydrophobicContact CD2-CG 4.49Å; L301-L303 HydrophobicContact CG-CD1 4.05Å; L301-L303 HydrophobicContact CG-CG 4.05Å; L303-N306 PolarHBondContact O-ND2 2.97Å; L303-N306 VanDerWaalsContact O-ND2 3.15Å; L303-F316 HydrophobicContact CD1-CE1 4.08Å; L303-F316 HydrophobicContact CD1-CZ 4.3Å; L303-L325 HydrophobicContact CD1-CD1 4.44Å; L303-D326 CarbonylContact C-O 3.48Å; L303-D326 WeakPolarHBondContact CA-O 3.4Å; L303-D326 PolarHBondContact N-O 2.06Å; L303-I327 HydrophobicContact CB-CB 4.49Å; L303-I327 HydrophobicContact CB-CG1 4.33Å; L303-I327 HydrophobicContact CB-CG2 3.93Å; L303-I327 HydrophobicContact CD1-CD1 4.41Å; L303-I327 HydrophobicContact CD1-CG1 4.39Å; L303-N330 PolarHBondContact O-ND2 3.08Å
304	G	98.2	Very high	93.8	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.172	C	C	.	.			trans	-58.8	158.5	-177.3	0	0	0	0	0	113.7	S280 F281 N302 N306 D326 R328	S280-G304 CarbonylContact C-O 3.3Å; S280-G304 WeakPolarHBondContact CA-O 3.49Å; S280-G304 WeakPolarHBondContact CB-O 3.15Å; F281-G304 PolarHBondContact N-O 2.95Å; N302-G304 PolarHBondContact OD1-N 2.94Å; N302-G304 VanDerWaalsContact OD1-N 3.09Å; G304-N306 PolarHBondContact O-N 2.78Å; G304-N306 PolarHBondContact O-ND2 3.08Å; G304-N306 VanDerWaalsContact O-ND2 3.07Å; G304-D326 PolarHBondContact N-O 2.98Å; G304-R328 CarbonylContact C-O 3.59Å; G304-R328 VanDerWaalsContact CA-O 3.25Å; G304-R328 WeakPolarHBondContact CA-O 3.43Å
305	D	98.4	Very high	93.8	Very high	32 Å²	32	26.1 Å²	26.1	17%	0.171	15%	0.153	C	C	.	.	S	Bend	trans	58.5	49.4	173.6	-44.9	-99.6	0	0	0	111.8	F281 R328 D329	F281-D305 WeakPolarHBondContact CA-O 3.27Å; F281-D305 HydrophobicContact CD1-CB 3.47Å; F281-D305 VanDerWaalsContact CD1-CB 3.47Å; F281-D305 HydrophobicContact CD2-CB 4.05Å; F281-D305 HydrophobicContact CE1-CB 3.47Å; F281-D305 VanDerWaalsContact CE1-CB 3.47Å; F281-D305 VanDerWaalsContact CE1-CG 3.42Å; F281-D305 WeakPolarHBondContact CE1-OD1 3.47Å; F281-D305 HydrophobicContact CE2-CB 4.05Å; F281-D305 WeakPolarHBondContact CE2-OD2 3.42Å; F281-D305 HydrophobicContact CG-CB 3.77Å; F281-D305 HydrophobicContact CZ-CB 3.76Å; F281-D305 VanDerWaalsContact CZ-OD1 3.3Å; F281-D305 WeakPolarHBondContact CZ-OD1 3.34Å; F281-D305 WeakPolarHBondContact CZ-OD2 3.33Å; F281-D305 PolarHBondContact N-O 3.11Å; D305-R328 PolarHBondContact N-O 3.39Å; D305-R328 IonicContact OD1-NE 2.75Å; D305-R328 IonicContact OD2-CZ 3.45Å; D305-R328 IonicContact OD2-NE 2.73Å; D305-R328 PolarHBondContact OD2-NE 2.66Å; D305-R328 IonicContact OD2-NH2 3.02Å; D305-R328 PolarHBondContact OD2-NH2 2.96Å; D305-D329 WeakPolarHBondContact CA-O 3.5Å; D305-D329 PolarHBondContact N-O 3.38Å
306	N	98.4	Very high	93.7	Very high	12 Å²	12	26.1 Å²	26.1	6%	0.064	15%	0.153	C	C	.	.	S	Bend	trans	-124.1	-153.7	178.9	-91	-91.1	0	0	0	109.2	L279 N282 H283 L284 L303 G304 V308 D329 N330	L279-N306 PolarHBondContact O-ND2 3.11Å; L279-N306 VanDerWaalsContact O-ND2 3.08Å; N282-N306 WeakPolarHBondContact CA-OD1 3.31Å; N282-N306 WeakPolarHBondContact CB-OD1 3.41Å; N282-N306 PolarHBondContact N-OD1 2.75Å; N282-N306 PolarHBondContact O-OD1 3.43Å; H283-N306 PolarHBondContact N-OD1 2.97Å; L284-N306 HydrophobicContact CB-CB 4.41Å; L284-N306 WeakPolarHBondContact CB-OD1 3.48Å; L284-N306 PolarHBondContact N-OD1 2.99Å; L284-N306 VanDerWaalsContact N-OD1 3.07Å; L303-N306 PolarHBondContact O-ND2 2.97Å; L303-N306 VanDerWaalsContact O-ND2 3.15Å; G304-N306 PolarHBondContact O-N 2.78Å; G304-N306 PolarHBondContact O-ND2 3.08Å; G304-N306 VanDerWaalsContact O-ND2 3.07Å; N306-V308 HydrophobicContact CB-CG2 4.23Å; N306-D329 PolarHBondContact N-O 3.21Å; N306-N330 VanDerWaalsContact C-OD1 3.25Å; N306-N330 WeakPolarHBondContact CB-OD1 3.36Å; N306-N330 PolarHBondContact N-ND2 3.18Å
307	S	97	Very high	93.4	Very high	50 Å²	50	27.7 Å²	27.7	35%	0.35	16%	0.16	S	C	.	.			trans	-135.2	31.2	176.1	-53.6	0	0	0	0	111.7	L284 T285 S309 N330	L284-S307 CarbonylContact O-C 3.55Å; L284-S307 WeakPolarHBondContact O-CA 3.31Å; L284-S307 PolarHBondContact O-N 2.96Å; T285-S307 WeakPolarHBondContact CA-O 3.4Å; S307-S309 PolarHBondContact O-N 3.4Å; S307-S309 VanDerWaalsContact O-N 3.11Å; S307-N330 PolarHBondContact N-OD1 2.94Å
308	V	95.5	Very high	93	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.148	C	C	.	.			trans	-68.7	109.5	-173.7	-178.2	0	0	0	0	109.7	L284 T285 L287 N306 H310 L311 N330 E331 I332	L284-V308 HydrophobicContact CB-CG2 3.84Å; L284-V308 VanDerWaalsContact O-CG2 3.32Å; L284-V308 WeakPolarHBondContact O-CG2 3.25Å; L284-V308 PolarHBondContact O-N 3.45Å; T285-V308 WeakPolarHBondContact O-CA 3.49Å; L287-V308 HydrophobicContact CD1-CG1 4.15Å; L287-V308 HydrophobicContact CD1-CG2 4.21Å; L287-V308 HydrophobicContact CG-CG1 4.33Å; L287-V308 HydrophobicContact CG-CG2 4.46Å; N306-V308 HydrophobicContact CB-CG2 4.23Å; V308-H310 WeakPolarHBondContact CG1-O 3.18Å; V308-L311 HydrophobicContact CG1-CD2 3.67Å; V308-L311 HydrophobicContact CG1-CG 4.19Å; V308-N330 VanDerWaalsContact CB-OD1 3.27Å; V308-N330 WeakPolarHBondContact CB-OD1 3.36Å; V308-N330 WeakPolarHBondContact CG2-OD1 3.33Å; V308-N330 PolarHBondContact N-OD1 2.91Å; V308-E331 CarbonylContact O-C 3.57Å; V308-E331 VanDerWaalsContact O-C 3.3Å; V308-E331 WeakPolarHBondContact O-CA 3.26Å; V308-E331 PolarHBondContact O-N 2.77Å; V308-I332 PolarHBondContact O-N 2.87Å
309	S	90.5	Very high	92.8	Very high	48 Å²	48	24.9 Å²	24.9	34%	0.336	15%	0.148	S	C	.	.			trans	-106	-19.6	173.4	56.7	0	0	0	0	112.3	T285 S307 W334	T285-S309 PolarHBondContact O-N 2.94Å; T285-S309 PolarHBondContact O-OG 3.27Å; S307-S309 PolarHBondContact O-N 3.4Å; S307-S309 VanDerWaalsContact O-N 3.11Å; S309-W334 PolarHBondContact O-NE1 3.23Å
310	H	88.1	Confident	92.5	Very high	13 Å²	13	24.5 Å²	24.5	6%	0.06	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.2	176.4	-171.1	122.2	0	0	0	112.7	T285 R286 L287 V308 W334 E499	T285-H310 PolarHBondContact O-N 3.35Å; R286-H310 HydrophobicContact CB-CB 3.89Å; L287-H310 PolarHBondContact N-O 2.9Å; V308-H310 WeakPolarHBondContact CG1-O 3.18Å; H310-W334 HydrophobicContact CB-CZ2 4.04Å; H310-W334 AromaticContact CD2-CZ2 3.98Å; H310-W334 AromaticContact CE1-CZ2 3.98Å; H310-W334 AromaticContact CG-CZ2 3.63Å; H310-W334 AromaticContact ND1-CZ2 3.68Å; H310-W334 AromaticContact NE2-CH2 3.89Å; H310-E499 IonicContact CE1-OE1 3.58Å; H310-E499 PolarHBondContact CE1-OE1 3.18Å; H310-E499 IonicContact CG-OE1 2.81Å; H310-E499 IonicContact ND1-OE1 2.69Å; H310-E499 PolarHBondContact ND1-OE1 2.8Å; H310-E499 IonicContact ND1-OE2 3.15Å
311	L	89.8	Confident	92.3	Very high	2 Å²	2	23 Å²	23	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	113.8	169.4	-65.7	176.9	0	0	0	109.8	L287 V308 V315 F316 I332 W334 A335 V342	L287-L311 HydrophobicContact CB-CD2 4.15Å; L287-L311 HydrophobicContact CD1-CD2 3.85Å; L287-L311 HydrophobicContact CG-CD2 4.45Å; V308-L311 HydrophobicContact CG1-CD2 3.67Å; V308-L311 HydrophobicContact CG1-CG 4.19Å; L311-V315 HydrophobicContact CB-CG1 4.24Å; L311-F316 HydrophobicContact CD1-CE2 4.29Å; L311-F316 HydrophobicContact CD2-CE2 4.36Å; L311-F316 HydrophobicContact CD2-CZ 4.07Å; L311-I332 HydrophobicContact CD1-CD1 3.87Å; L311-I332 HydrophobicContact CD1-CG1 4.2Å; L311-I332 HydrophobicContact CD1-CG2 4.48Å; L311-W334 WeakPolarHBondContact O-CH2 3.46Å; L311-A335 HydrophobicContact CB-CB 4.33Å; L311-A335 HydrophobicContact CD1-CB 3.98Å; L311-V342 HydrophobicContact CB-CG1 3.84Å; L311-V342 HydrophobicContact CD1-CG1 4.07Å
312	G	84.9	Confident	92.2	Very high	5 Å²	5	22.8 Å²	22.8	5%	0.052	15%	0.146	C	C	.	.			trans	-62.2	152.4	-177	0	0	0	0	0	113.5	L287 G314 V315	L287-G312 PolarHBondContact O-N 3.35Å; G312-G314 PolarHBondContact O-N 2.82Å; G312-V315 WeakPolarHBondContact O-CB 3.3Å; G312-V315 VanDerWaalsContact O-CG1 3.29Å; G312-V315 WeakPolarHBondContact O-CG1 3.44Å; G312-V315 PolarHBondContact O-N 3.24Å; G312-V315 VanDerWaalsContact O-N 3.13Å
313	E	81.1	Confident	92.1	Very high	86 Å²	86	26.4 Å²	26.4	40%	0.402	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	122	171.5	-164.4	164.9	132.2	0	0	108.4	E289 V315 I340 R535 R551	E289-E313 WeakPolarHBondContact CG-O 3.4Å; E313-V315 PolarHBondContact O-N 3.44Å; E313-I340 HydrophobicContact CB-CG2 4.2Å; E313-I340 HydrophobicContact CG-CG2 3.9Å; E313-R535 VanDerWaalsContact CD-NH1 3.28Å; E313-R535 IonicContact OE1-CZ 2.87Å; E313-R535 IonicContact OE1-NH1 2.67Å; E313-R535 PolarHBondContact OE1-NH1 3.39Å; E313-R535 IonicContact OE1-NH2 2.78Å; E313-R535 IonicContact OE2-NH1 2.97Å; E313-R535 PolarHBondContact OE2-NH1 3.34Å; E313-R551 IonicContact OE2-CZ 2.93Å; E313-R551 IonicContact OE2-NH1 3.99Å; E313-R551 PolarHBondContact OE2-NH1 2.83Å
314	G	84.1	Confident	92.2	Very high	16 Å²	16	28 Å²	28	17%	0.165	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	8	-178.8	0	0	0	0	0	117.6	G312 F316 S317	G312-G314 PolarHBondContact O-N 2.82Å; G314-F316 PolarHBondContact O-N 2.9Å; G314-S317 WeakPolarHBondContact O-CB 3.15Å; G314-S317 PolarHBondContact O-N 3.31Å; G314-S317 PolarHBondContact O-OG 2.77Å
315	V	90.1	Very high	92.1	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-27.1	-176.9	63.4	0	0	0	0	116.1	L287 E288 A291 F292 L311 G312 E313 V342	L287-V315 HydrophobicContact CB-CG2 3.95Å; E288-V315 VanDerWaalsContact O-CG2 3.26Å; E288-V315 WeakPolarHBondContact O-CG2 3.38Å; A291-V315 HydrophobicContact CB-CG2 4.37Å; F292-V315 HydrophobicContact CD2-CG2 4.02Å; F292-V315 HydrophobicContact CE2-CG2 4.09Å; L311-V315 HydrophobicContact CB-CG1 4.24Å; G312-V315 WeakPolarHBondContact O-CB 3.3Å; G312-V315 VanDerWaalsContact O-CG1 3.29Å; G312-V315 WeakPolarHBondContact O-CG1 3.44Å; G312-V315 PolarHBondContact O-N 3.24Å; G312-V315 VanDerWaalsContact O-N 3.13Å; E313-V315 PolarHBondContact O-N 3.44Å; V315-V342 HydrophobicContact CG1-CG1 3.94Å
316	F	91.5	Very high	92.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	5.5	176	-53.7	-59.1	0	0	0	113.9	F292 L301 L303 L311 G314 S318 L319 L325 I327 V342 F343 M346	F292-F316 HydrophobicContact CD2-CD1 4.13Å; F292-F316 HydrophobicContact CD2-CE1 4.11Å; F292-F316 HydrophobicContact CE2-CD1 4.28Å; F292-F316 AromaticContact CE2-CE1 3.79Å; F292-F316 HydrophobicContact CE2-CE1 3.79Å; L301-F316 HydrophobicContact CD2-CD1 4.33Å; L301-F316 HydrophobicContact CD2-CE1 4.11Å; L303-F316 HydrophobicContact CD1-CE1 4.08Å; L303-F316 HydrophobicContact CD1-CZ 4.3Å; L311-F316 HydrophobicContact CD1-CE2 4.29Å; L311-F316 HydrophobicContact CD2-CE2 4.36Å; L311-F316 HydrophobicContact CD2-CZ 4.07Å; G314-F316 PolarHBondContact O-N 2.9Å; F316-S318 VanDerWaalsContact C-N 3.27Å; F316-S318 PolarHBondContact O-N 2.82Å; F316-L319 HydrophobicContact CB-CD1 4.3Å; F316-L319 HydrophobicContact CD1-CD1 3.85Å; F316-L319 WeakPolarHBondContact O-CB 3.27Å; F316-L319 PolarHBondContact O-N 3.15Å; F316-L325 HydrophobicContact CD2-CD2 4.27Å; F316-L325 HydrophobicContact CE1-CD1 4.38Å; F316-L325 HydrophobicContact CE2-CD2 4.18Å; F316-L325 HydrophobicContact CG-CD2 4.48Å; F316-L325 HydrophobicContact CZ-CD2 4.31Å; F316-I327 HydrophobicContact CE2-CD1 4.11Å; F316-I327 HydrophobicContact CZ-CD1 3.71Å; F316-V342 HydrophobicContact CD2-CG1 4.1Å; F316-V342 HydrophobicContact CE2-CG1 4.06Å; F316-F343 AromaticContact CD2-CD1 3.95Å; F316-F343 HydrophobicContact CD2-CD1 3.95Å; F316-F343 HydrophobicContact CD2-CE1 4.18Å; F316-F343 HydrophobicContact CE2-CD1 4.25Å; F316-F343 HydrophobicContact CE2-CE1 4Å; F316-M346 HydrophobicContact CB-CE 3.85Å; F316-M346 HydrophobicContact CB-CG 4.14Å; F316-M346 HydrophobicContact CB-SD 3.67Å; F316-M346 HydrophobicContact CD2-CE 4.08Å; F316-M346 HydrophobicContact CG-CE 4.18Å; F316-M346 HydrophobicContact CG-SD 4.29Å
317	S	88.3	Confident	92.1	Very high	60 Å²	60	26.7 Å²	26.7	42%	0.42	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-28.7	-174.5	66.1	0	0	0	0	113.8	G314 L319	G314-S317 WeakPolarHBondContact O-CB 3.15Å; G314-S317 PolarHBondContact O-N 3.31Å; G314-S317 PolarHBondContact O-OG 2.77Å; S317-L319 VanDerWaalsContact C-N 3.27Å; S317-L319 PolarHBondContact O-N 2.78Å
318	S	88.1	Confident	92.2	Very high	33 Å²	33	27.5 Å²	27.5	23%	0.231	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-23.2	174.2	60.1	0	0	0	0	113.3	F292 G296 F316 A320	F292-S318 PolarHBondContact O-OG 3.01Å; G296-S318 WeakPolarHBondContact CA-O 3.24Å; F316-S318 VanDerWaalsContact C-N 3.27Å; F316-S318 PolarHBondContact O-N 2.82Å; S318-A320 PolarHBondContact O-N 3.07Å
319	L	93.2	Very high	92.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.171	C	C	.	.			trans	-86.5	52	-167	-53.3	-177	0	0	0	112.3	F292 L295 L298 L301 F316 S317 N321 L322	F292-L319 HydrophobicContact CB-CD1 4.31Å; F292-L319 HydrophobicContact CB-CD2 3.98Å; F292-L319 HydrophobicContact CB-CG 4.38Å; L295-L319 HydrophobicContact CB-CD2 3.74Å; L295-L319 WeakPolarHBondContact O-CD2 3.09Å; L298-L319 HydrophobicContact CB-CD2 4.26Å; L298-L319 HydrophobicContact CD2-CD1 4.42Å; L298-L319 HydrophobicContact CD2-CD2 4.1Å; L301-L319 HydrophobicContact CD2-CD1 3.7Å; F316-L319 HydrophobicContact CB-CD1 4.3Å; F316-L319 HydrophobicContact CD1-CD1 3.85Å; F316-L319 WeakPolarHBondContact O-CB 3.27Å; F316-L319 PolarHBondContact O-N 3.15Å; S317-L319 VanDerWaalsContact C-N 3.27Å; S317-L319 PolarHBondContact O-N 2.78Å; L319-N321 PolarHBondContact O-N 3.04Å; L319-L322 HydrophobicContact CB-CB 4.03Å; L319-L322 HydrophobicContact CB-CD2 4.4Å; L319-L322 HydrophobicContact CD1-CD1 4.48Å; L319-L322 HydrophobicContact CD1-CD2 4.01Å; L319-L322 WeakPolarHBondContact O-CB 3.32Å; L319-L322 PolarHBondContact O-N 2.98Å
320	A	90.6	Very high	92.6	Very high	52 Å²	52	28 Å²	28	43%	0.43	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-10.5	-173.3	0	0	0	0	0	115.5	S318	S318-A320 PolarHBondContact O-N 3.07Å
321	N	95.1	Very high	93	Very high	37 Å²	37	32 Å²	32	20%	0.198	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-2.4	174.4	-77.1	-59.2	0	0	0	114.8	G296 L298 L319 R323 K348	G296-N321 PolarHBondContact O-ND2 2.8Å; L298-N321 CarbonylContact O-C 3.28Å; L319-N321 PolarHBondContact O-N 3.04Å; N321-R323 PolarHBondContact O-N 3.35Å; N321-K348 PolarHBondContact OD1-NZ 3.41Å
322	L	96.9	Very high	93.2	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.			trans	-62.2	133	-171.3	-154.5	71.1	0	0	0	112.1	L298 L301 L319 L325 M346 K348 L349	L298-L322 HydrophobicContact CB-CD1 4.33Å; L298-L322 HydrophobicContact CD2-CD1 4.02Å; L298-L322 HydrophobicContact CG-CD1 4Å; L298-L322 VanDerWaalsContact O-CA 3.27Å; L298-L322 WeakPolarHBondContact O-CA 3.38Å; L298-L322 PolarHBondContact O-N 2.9Å; L298-L322 VanDerWaalsContact O-N 3.11Å; L301-L322 HydrophobicContact CB-CD1 3.79Å; L301-L322 HydrophobicContact CB-CD2 4.26Å; L319-L322 HydrophobicContact CB-CB 4.03Å; L319-L322 HydrophobicContact CB-CD2 4.4Å; L319-L322 HydrophobicContact CD1-CD1 4.48Å; L319-L322 HydrophobicContact CD1-CD2 4.01Å; L319-L322 WeakPolarHBondContact O-CB 3.32Å; L319-L322 PolarHBondContact O-N 2.98Å; L322-L325 HydrophobicContact CD2-CB 3.91Å; L322-L325 HydrophobicContact CD2-CD1 4.25Å; L322-L325 HydrophobicContact CD2-CD2 4.3Å; L322-L325 HydrophobicContact CD2-CG 4.38Å; L322-M346 HydrophobicContact CB-SD 4.4Å; L322-M346 HydrophobicContact CD2-SD 3.63Å; L322-K348 CarbonylContact O-C 3.53Å; L322-L349 HydrophobicContact CB-CD1 4.37Å; L322-L349 HydrophobicContact CD2-CD1 4.04Å; L322-L349 HydrophobicContact CG-CD1 4.09Å; L322-L349 VanDerWaalsContact O-CA 3.27Å; L322-L349 WeakPolarHBondContact O-CA 3.37Å; L322-L349 PolarHBondContact O-N 2.84Å
323	R	97.3	Very high	93.4	Very high	108 Å²	108	32.9 Å²	32.9	41%	0.408	18%	0.18	S	C	.	.			trans	-113.9	-37	180	-57.4	-172.9	-173.2	-74.7	-7.8	112.4	E299 N321 N350 T351	E299-R323 HydrophobicContact CB-CG 4.19Å; E299-R323 WeakPolarHBondContact O-CA 3.13Å; E299-R323 PolarHBondContact O-N 2.76Å; E299-R323 IonicContact OE1-CZ 2.73Å; E299-R323 VanDerWaalsContact OE1-CZ 3.23Å; E299-R323 IonicContact OE1-NE 2.87Å; E299-R323 PolarHBondContact OE1-NE 2.82Å; E299-R323 IonicContact OE1-NH2 3.73Å; E299-R323 PolarHBondContact OE1-NH2 3.27Å; E299-R323 WeakPolarHBondContact OE2-CD 3.47Å; E299-R323 IonicContact OE2-CZ 3.61Å; E299-R323 IonicContact OE2-NE 2.71Å; E299-R323 PolarHBondContact OE2-NE 2.69Å; E299-R323 IonicContact OE2-NH2 3.95Å; N321-R323 PolarHBondContact O-N 3.35Å; R323-N350 PolarHBondContact O-N 2.92Å; R323-T351 PolarHBondContact O-N 3.17Å
324	S	98.4	Very high	93.6	Very high	34 Å²	34	29.9 Å²	29.9	24%	0.238	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	124.6	-179.9	-167.9	0	0	0	0	110.7	E299 N300 L301 T351	E299-S324 PolarHBondContact O-N 3.47Å; E299-S324 VanDerWaalsContact O-N 3.08Å; N300-S324 WeakPolarHBondContact OD1-CB 3.43Å; L301-S324 PolarHBondContact N-O 3.02Å; S324-T351 WeakPolarHBondContact CA-O 3.12Å
325	L	98	Very high	93.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	112.4	174.8	-179.8	54	0	0	0	109.2	L301 L303 F316 L322 I327 F343 M346 L349 T351 L352 I353	L301-L325 HydrophobicContact CB-CD1 4.05Å; L301-L325 HydrophobicContact CD2-CD1 3.9Å; L301-L325 HydrophobicContact CG-CD1 3.89Å; L301-L325 WeakPolarHBondContact O-CA 3.4Å; L303-L325 HydrophobicContact CD1-CD1 4.44Å; F316-L325 HydrophobicContact CD2-CD2 4.27Å; F316-L325 HydrophobicContact CE1-CD1 4.38Å; F316-L325 HydrophobicContact CE2-CD2 4.18Å; F316-L325 HydrophobicContact CG-CD2 4.48Å; F316-L325 HydrophobicContact CZ-CD2 4.31Å; L322-L325 HydrophobicContact CD2-CB 3.91Å; L322-L325 HydrophobicContact CD2-CD1 4.25Å; L322-L325 HydrophobicContact CD2-CD2 4.3Å; L322-L325 HydrophobicContact CD2-CG 4.38Å; L325-I327 HydrophobicContact CD1-CD1 3.98Å; L325-I327 HydrophobicContact CD1-CG1 3.79Å; L325-I327 HydrophobicContact CD2-CD1 4.14Å; L325-I327 HydrophobicContact CG-CD1 4.03Å; L325-I327 HydrophobicContact CG-CG1 3.92Å; L325-F343 HydrophobicContact CD2-CE1 4.32Å; L325-M346 HydrophobicContact CD2-CE 3.73Å; L325-M346 HydrophobicContact CD2-SD 4.09Å; L325-L349 HydrophobicContact CB-CD1 3.74Å; L325-L349 HydrophobicContact CB-CD2 4.35Å; L325-T351 PolarHBondContact N-O 3.02Å; L325-L352 HydrophobicContact CB-CD1 4.17Å; L325-L352 HydrophobicContact CD2-CD1 4.08Å; L325-L352 HydrophobicContact CG-CD1 4.08Å; L325-L352 WeakPolarHBondContact O-CA 3.21Å; L325-I353 PolarHBondContact O-N 2.77Å
326	D	98.6	Very high	93.7	Very high	16 Å²	16	29.4 Å²	29.4	9%	0.086	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	117.7	174.7	-169.3	-18.1	0	0	0	109.7	L301 L303 G304 R328 I353	L301-D326 PolarHBondContact O-N 2.75Å; L303-D326 CarbonylContact C-O 3.48Å; L303-D326 WeakPolarHBondContact CA-O 3.4Å; L303-D326 PolarHBondContact N-O 2.06Å; G304-D326 PolarHBondContact N-O 2.98Å; D326-R328 WeakPolarHBondContact OD1-CB 3.15Å; D326-R328 VanDerWaalsContact OD1-CG 3.31Å; D326-R328 WeakPolarHBondContact OD1-CG 3.38Å; D326-R328 PolarHBondContact OD1-N 3.06Å; D326-R328 IonicContact OD1-NH1 3.32Å; D326-R328 IonicContact OD2-CZ 3.05Å; D326-R328 IonicContact OD2-NH1 2.93Å; D326-R328 PolarHBondContact OD2-NH1 2.84Å; D326-I353 HydrophobicContact CB-CB 4.38Å; D326-I353 HydrophobicContact CB-CD1 4.37Å
327	I	97.1	Very high	93.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.161	C	C	.	.			trans	-132.7	39.9	171.9	-28.8	175.7	0	0	0	109.6	L303 F316 L325 N330 I332 I353 N357	L303-I327 HydrophobicContact CB-CB 4.49Å; L303-I327 HydrophobicContact CB-CG1 4.33Å; L303-I327 HydrophobicContact CB-CG2 3.93Å; L303-I327 HydrophobicContact CD1-CD1 4.41Å; L303-I327 HydrophobicContact CD1-CG1 4.39Å; F316-I327 HydrophobicContact CE2-CD1 4.11Å; F316-I327 HydrophobicContact CZ-CD1 3.71Å; L325-I327 HydrophobicContact CD1-CD1 3.98Å; L325-I327 HydrophobicContact CD1-CG1 3.79Å; L325-I327 HydrophobicContact CD2-CD1 4.14Å; L325-I327 HydrophobicContact CG-CD1 4.03Å; L325-I327 HydrophobicContact CG-CG1 3.92Å; I327-N330 HydrophobicContact CG2-CB 4.3Å; I327-I332 HydrophobicContact CB-CD1 3.98Å; I327-I332 HydrophobicContact CD1-CD1 4.22Å; I327-I332 HydrophobicContact CG2-CD1 3.65Å; I327-I353 CarbonylContact C-O 3.44Å; I327-I353 PolarHBondContact N-O 2.84Å; I327-N357 PolarHBondContact O-ND2 3.31Å
328	R	98.2	Very high	93.2	Very high	67 Å²	67	27.7 Å²	27.7	25%	0.253	15%	0.145	S	C	.	.			trans	-60.4	161	172.4	72.8	-179.3	177.2	-104	-16	112.2	G304 D305 D326 N330 I353 Q355	G304-R328 CarbonylContact C-O 3.59Å; G304-R328 VanDerWaalsContact CA-O 3.25Å; G304-R328 WeakPolarHBondContact CA-O 3.43Å; D305-R328 PolarHBondContact N-O 3.39Å; D305-R328 IonicContact OD1-NE 2.75Å; D305-R328 IonicContact OD2-CZ 3.45Å; D305-R328 IonicContact OD2-NE 2.73Å; D305-R328 PolarHBondContact OD2-NE 2.66Å; D305-R328 IonicContact OD2-NH2 3.02Å; D305-R328 PolarHBondContact OD2-NH2 2.96Å; D326-R328 WeakPolarHBondContact OD1-CB 3.15Å; D326-R328 VanDerWaalsContact OD1-CG 3.31Å; D326-R328 WeakPolarHBondContact OD1-CG 3.38Å; D326-R328 PolarHBondContact OD1-N 3.06Å; D326-R328 IonicContact OD1-NH1 3.32Å; D326-R328 IonicContact OD2-CZ 3.05Å; D326-R328 IonicContact OD2-NH1 2.93Å; D326-R328 PolarHBondContact OD2-NH1 2.84Å; R328-N330 PolarHBondContact O-N 3.15Å; R328-N330 PolarHBondContact O-ND2 2.69Å; R328-I353 HydrophobicContact CB-CG2 3.99Å; R328-I353 PolarHBondContact N-O 3.34Å; R328-Q355 CarbonylContact C-O 3.32Å; R328-Q355 WeakPolarHBondContact CA-O 3.45Å; R328-Q355 HydrophobicContact CB-CB 4.08Å
329	D	98.1	Very high	92.2	Very high	56 Å²	56	28.1 Å²	28.1	30%	0.299	15%	0.148	S	C	.	.	S	Bend	trans	45	65.7	171.5	-149.9	8.8	0	0	0	112.7	D305 N306 Q355 Q356	D305-D329 WeakPolarHBondContact CA-O 3.5Å; D305-D329 PolarHBondContact N-O 3.38Å; N306-D329 PolarHBondContact N-O 3.21Å; D329-Q355 PolarHBondContact N-O 3.45Å; D329-Q356 HydrophobicContact CB-CB 4.27Å; D329-Q356 PolarHBondContact OD1-NE2 2.8Å; D329-Q356 PolarHBondContact OD2-NE2 2.67Å
330	N	98.1	Very high	91	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.011	16%	0.155	C	C	.	.	S	Bend	trans	-140.9	-169.4	-177.2	-92.8	-83.4	0	0	0	108.4	L303 N306 S307 V308 I327 R328 I332 N357 K358	L303-N330 PolarHBondContact O-ND2 3.08Å; N306-N330 VanDerWaalsContact C-OD1 3.25Å; N306-N330 WeakPolarHBondContact CB-OD1 3.36Å; N306-N330 PolarHBondContact N-ND2 3.18Å; S307-N330 PolarHBondContact N-OD1 2.94Å; V308-N330 VanDerWaalsContact CB-OD1 3.27Å; V308-N330 WeakPolarHBondContact CB-OD1 3.36Å; V308-N330 WeakPolarHBondContact CG2-OD1 3.33Å; V308-N330 PolarHBondContact N-OD1 2.91Å; I327-N330 HydrophobicContact CG2-CB 4.3Å; R328-N330 PolarHBondContact O-N 3.15Å; R328-N330 PolarHBondContact O-ND2 2.69Å; N330-I332 HydrophobicContact CB-CG1 4.47Å; N330-N357 WeakPolarHBondContact CA-OD1 3.43Å; N330-N357 WeakPolarHBondContact CB-OD1 3.44Å; N330-N357 PolarHBondContact O-OD1 2.85Å; N330-K358 PolarHBondContact O-NZ 3.02Å
331	E	95.7	Very high	90.1	Very high	97 Å²	97	27.6 Å²	27.6	45%	0.453	14%	0.14	S	C	.	.			trans	-109.9	19.4	-176	-61	-155.4	153	0	0	114	V308 S333 K358	V308-E331 CarbonylContact O-C 3.57Å; V308-E331 VanDerWaalsContact O-C 3.3Å; V308-E331 WeakPolarHBondContact O-CA 3.26Å; V308-E331 PolarHBondContact O-N 2.77Å; E331-S333 PolarHBondContact O-N 2.84Å; E331-K358 HydrophobicContact CB-CG 4.48Å
332	I	93.1	Very high	89.5	Confident	2 Å²	2	26 Å²	26	1%	0.01	13%	0.132	C	C	.	.			trans	-66.2	132.2	-175.4	-57.5	168.4	0	0	0	110.8	V308 L311 I327 N330 A335 I336 L354 N357 K358 I359	V308-I332 PolarHBondContact O-N 2.87Å; L311-I332 HydrophobicContact CD1-CD1 3.87Å; L311-I332 HydrophobicContact CD1-CG1 4.2Å; L311-I332 HydrophobicContact CD1-CG2 4.48Å; I327-I332 HydrophobicContact CB-CD1 3.98Å; I327-I332 HydrophobicContact CD1-CD1 4.22Å; I327-I332 HydrophobicContact CG2-CD1 3.65Å; N330-I332 HydrophobicContact CB-CG1 4.47Å; I332-A335 HydrophobicContact CG2-CB 3.95Å; I332-I336 HydrophobicContact CG2-CG1 4.09Å; I332-L354 HydrophobicContact CD1-CD2 4.07Å; I332-N357 HydrophobicContact CB-CB 4.19Å; I332-N357 VanDerWaalsContact CB-OD1 3.27Å; I332-N357 WeakPolarHBondContact CB-OD1 3.41Å; I332-N357 WeakPolarHBondContact CG1-OD1 3.31Å; I332-N357 PolarHBondContact N-OD1 3.09Å; I332-K358 CarbonylContact O-C 3.57Å; I332-K358 WeakPolarHBondContact O-CA 3.26Å; I332-K358 PolarHBondContact O-N 2.94Å; I332-I359 PolarHBondContact O-N 2.98Å
333	S	89.9	Confident	88.9	Confident	25 Å²	25	26.1 Å²	26.1	18%	0.175	13%	0.133	C	C	.	.			trans	-142.5	-72.7	168.7	149.7	0	0	0	0	108.9	E331 A335 I336 E337	E331-S333 PolarHBondContact O-N 2.84Å; S333-A335 VanDerWaalsContact C-N 3.26Å; S333-A335 PolarHBondContact O-N 3.44Å; S333-I336 PolarHBondContact O-N 3.25Å; S333-E337 WeakPolarHBondContact CB-OE1 3.3Å; S333-E337 PolarHBondContact O-N 3.06Å; S333-E337 PolarHBondContact OG-OE1 2.75Å
334	W	85.1	Confident	88.2	Confident	23 Å²	23	24.5 Å²	24.5	9%	0.087	14%	0.135	C	C	.	.	H	α-helix	trans	-59.1	-27.1	-170.6	62.6	-93.8	0	0	0	115.5	S309 H310 L311 I336 E337 D338 I340 R495 Y548	S309-W334 PolarHBondContact O-NE1 3.23Å; H310-W334 HydrophobicContact CB-CZ2 4.04Å; H310-W334 AromaticContact CD2-CZ2 3.98Å; H310-W334 AromaticContact CE1-CZ2 3.98Å; H310-W334 AromaticContact CG-CZ2 3.63Å; H310-W334 AromaticContact ND1-CZ2 3.68Å; H310-W334 AromaticContact NE2-CH2 3.89Å; L311-W334 WeakPolarHBondContact O-CH2 3.46Å; W334-I336 PolarHBondContact O-N 3.07Å; W334-I336 VanDerWaalsContact O-N 3.13Å; W334-E337 PolarHBondContact O-N 2.69Å; W334-D338 VanDerWaalsContact O-CB 3.23Å; W334-D338 WeakPolarHBondContact O-CB 3.45Å; W334-D338 PolarHBondContact O-N 2.85Å; W334-I340 HydrophobicContact CE3-CD1 3.37Å; W334-I340 HydrophobicContact CZ3-CD1 3.27Å; W334-R495 VanDerWaalsContact CD1-NH1 3.35Å; W334-R495 VanDerWaalsContact CD1-NH2 3.28Å; W334-R495 VanDerWaalsContact CG-NH1 3.28Å; W334-Y548 HydrophobicContact CB-CE1 3.86Å; W334-Y548 WeakPolarHBondContact CB-OH 3.32Å
335	A	86.1	Confident	87.2	Confident	5 Å²	5	24.2 Å²	24.2	4%	0.041	14%	0.137	C	C	.	.	H	α-helix	trans	-58.5	-27	174.6	0	0	0	0	0	113	L311 I332 S333 V342	L311-A335 HydrophobicContact CB-CB 4.33Å; L311-A335 HydrophobicContact CD1-CB 3.98Å; I332-A335 HydrophobicContact CG2-CB 3.95Å; S333-A335 VanDerWaalsContact C-N 3.26Å; S333-A335 PolarHBondContact O-N 3.44Å; A335-V342 HydrophobicContact CB-CG2 3.99Å
336	I	89.6	Confident	86.7	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-99.2	-29.2	178.1	-49.2	-56.6	0	0	0	111.1	I332 S333 W334 F343 L354 I359 I362 A366 F367	I332-I336 HydrophobicContact CG2-CG1 4.09Å; S333-I336 PolarHBondContact O-N 3.25Å; W334-I336 PolarHBondContact O-N 3.07Å; W334-I336 VanDerWaalsContact O-N 3.13Å; I336-F343 HydrophobicContact CD1-CE2 3.5Å; I336-F343 VanDerWaalsContact CD1-CE2 3.5Å; I336-F343 HydrophobicContact CD1-CZ 3.8Å; I336-L354 HydrophobicContact CD1-CD1 3.97Å; I336-I359 HydrophobicContact CB-CD1 4.39Å; I336-I359 HydrophobicContact CB-CG1 4.29Å; I336-I359 HydrophobicContact CB-CG2 4.08Å; I336-I359 HydrophobicContact CG1-CD1 3.77Å; I336-I359 HydrophobicContact CG1-CG1 3.97Å; I336-I359 HydrophobicContact CG2-CD1 4.44Å; I336-I359 HydrophobicContact CG2-CG2 3.8Å; I336-I362 HydrophobicContact CG2-CG1 4.25Å; I336-A366 HydrophobicContact CG2-CB 3.9Å; I336-F367 HydrophobicContact CD1-CE1 4.38Å; I336-F367 HydrophobicContact CG2-CZ 4.43Å
337	E	89.3	Confident	86.1	Confident	7 Å²	7	31.2 Å²	31.2	3%	0.033	17%	0.167	C	C	.	.	H	α-helix	trans	-89.8	-22.8	-176.1	-54.7	-172.4	-134.2	0	0	114.5	S333 W334 K360 S361 T363 Y548	S333-E337 WeakPolarHBondContact CB-OE1 3.3Å; S333-E337 PolarHBondContact O-N 3.06Å; S333-E337 PolarHBondContact OG-OE1 2.75Å; W334-E337 PolarHBondContact O-N 2.69Å; E337-K360 PolarHBondContact OE1-N 2.98Å; E337-S361 WeakPolarHBondContact CG-O 3.27Å; E337-T363 WeakPolarHBondContact O-CG2 3.36Å; E337-Y548 HydrophobicContact CB-CD2 4.43Å; E337-Y548 HydrophobicContact CB-CE2 3.56Å
338	D	81.3	Confident	86	Confident	17 Å²	17	35.8 Å²	35.8	9%	0.091	19%	0.187	C	C	.	.	S	Bend	trans	-101.8	6.5	-176.1	-170.1	41.3	0	0	0	114.1	W334 I340 Q537 Y548 R551	W334-D338 VanDerWaalsContact O-CB 3.23Å; W334-D338 WeakPolarHBondContact O-CB 3.45Å; W334-D338 PolarHBondContact O-N 2.85Å; D338-I340 HydrophobicContact CB-CD1 3.84Å; D338-I340 HydrophobicContact CB-CG1 3.86Å; D338-I340 PolarHBondContact O-N 2.84Å; D338-I340 VanDerWaalsContact O-N 3.1Å; D338-I340 VanDerWaalsContact OD2-CD1 3.27Å; D338-I340 WeakPolarHBondContact OD2-CD1 3.48Å; D338-I340 VanDerWaalsContact OD2-CG1 3.25Å; D338-I340 WeakPolarHBondContact OD2-CG1 3.45Å; D338-Q537 VanDerWaalsContact CG-NE2 3.31Å; D338-Q537 PolarHBondContact OD1-NE2 2.99Å; D338-Q537 PolarHBondContact OD2-NE2 3.16Å; D338-Q537 PolarHBondContact OD2-OE1 3.47Å; D338-Y548 HydrophobicContact CB-CD1 3.8Å; D338-Y548 HydrophobicContact CB-CD2 4.49Å; D338-Y548 HydrophobicContact CB-CE1 4.11Å; D338-Y548 HydrophobicContact CB-CG 4.04Å; D338-Y548 WeakPolarHBondContact OD1-CB 3.42Å; D338-R551 IonicContact OD2-CZ 3.27Å; D338-R551 IonicContact OD2-NE 3.69Å; D338-R551 IonicContact OD2-NH2 3.37Å; D338-R551 PolarHBondContact OD2-NH2 2.93Å
339	S	66.5	Low	85.8	Confident	43 Å²	43	32.6 Å²	32.6	30%	0.301	18%	0.175	S	C	.	.			trans	62.3	21.8	169.6	-50.6	0	0	0	0	116.5	G341 T363	S339-G341 VanDerWaalsContact C-N 3.27Å; S339-G341 PolarHBondContact O-N 3.11Å; S339-T363 VanDerWaalsContact OG-CB 3.27Å; S339-T363 WeakPolarHBondContact OG-CB 3.41Å; S339-T363 WeakPolarHBondContact OG-CG2 3.37Å; S339-T363 PolarHBondContact OG-OG1 3.18Å
340	I	67.6	Low	85.8	Confident	28 Å²	28	32.6 Å²	32.6	14%	0.144	18%	0.175	C	C	.	.			trans	-70.7	-18.2	-167.2	-58.9	166.1	0	0	0	113.7	E313 W334 D338 V342 R551	E313-I340 HydrophobicContact CB-CG2 4.2Å; E313-I340 HydrophobicContact CG-CG2 3.9Å; W334-I340 HydrophobicContact CE3-CD1 3.37Å; W334-I340 HydrophobicContact CZ3-CD1 3.27Å; D338-I340 HydrophobicContact CB-CD1 3.84Å; D338-I340 HydrophobicContact CB-CG1 3.86Å; D338-I340 PolarHBondContact O-N 2.84Å; D338-I340 VanDerWaalsContact O-N 3.1Å; D338-I340 VanDerWaalsContact OD2-CD1 3.27Å; D338-I340 WeakPolarHBondContact OD2-CD1 3.48Å; D338-I340 VanDerWaalsContact OD2-CG1 3.25Å; D338-I340 WeakPolarHBondContact OD2-CG1 3.45Å; I340-V342 HydrophobicContact CB-CG2 4.08Å; I340-V342 HydrophobicContact CG2-CG2 4.16Å; I340-R551 VanDerWaalsContact CG1-NH2 3.28Å
341	G	71.4	Confident	85.8	Confident	12 Å²	12	33.8 Å²	33.8	12%	0.124	18%	0.182	C	C	.	.			trans	76.5	33.4	-174.4	0	0	0	0	0	113.2	S339 F343 V344	S339-G341 VanDerWaalsContact C-N 3.27Å; S339-G341 PolarHBondContact O-N 3.11Å; G341-F343 PolarHBondContact O-N 2.93Å; G341-V344 VanDerWaalsContact O-CB 3.26Å; G341-V344 WeakPolarHBondContact O-CB 3.42Å; G341-V344 VanDerWaalsContact O-CG2 3.27Å; G341-V344 WeakPolarHBondContact O-CG2 3.27Å; G341-V344 PolarHBondContact O-N 2.98Å
342	V	82.4	Confident	85.9	Confident	3 Å²	3	29.2 Å²	29.2	2%	0.018	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-26.3	176.9	179.3	0	0	0	0	112.8	L311 V315 F316 A335 I340	L311-V342 HydrophobicContact CB-CG1 3.84Å; L311-V342 HydrophobicContact CD1-CG1 4.07Å; V315-V342 HydrophobicContact CG1-CG1 3.94Å; F316-V342 HydrophobicContact CD2-CG1 4.1Å; F316-V342 HydrophobicContact CE2-CG1 4.06Å; A335-V342 HydrophobicContact CB-CG2 3.99Å; I340-V342 HydrophobicContact CB-CG2 4.08Å; I340-V342 HydrophobicContact CG2-CG2 4.16Å
343	F	86	Confident	86.1	Confident	3 Å²	3	30.6 Å²	30.6	1%	0.013	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	4.7	178.8	-54.5	-43.1	0	0	0	115.2	F316 L325 I336 G341 G345 M346 L352 L354 A366 F367 L370	F316-F343 AromaticContact CD2-CD1 3.95Å; F316-F343 HydrophobicContact CD2-CD1 3.95Å; F316-F343 HydrophobicContact CD2-CE1 4.18Å; F316-F343 HydrophobicContact CE2-CD1 4.25Å; F316-F343 HydrophobicContact CE2-CE1 4Å; L325-F343 HydrophobicContact CD2-CE1 4.32Å; I336-F343 HydrophobicContact CD1-CE2 3.5Å; I336-F343 VanDerWaalsContact CD1-CE2 3.5Å; I336-F343 HydrophobicContact CD1-CZ 3.8Å; G341-F343 PolarHBondContact O-N 2.93Å; F343-G345 PolarHBondContact O-N 2.98Å; F343-M346 HydrophobicContact CB-CE 3.71Å; F343-M346 HydrophobicContact CD1-CE 3.43Å; F343-M346 VanDerWaalsContact CD1-CE 3.43Å; F343-M346 HydrophobicContact CE1-CE 4.39Å; F343-M346 HydrophobicContact CG-CE 3.93Å; F343-M346 PolarHBondContact O-N 2.95Å; F343-L352 HydrophobicContact CD2-CD2 4.32Å; F343-L352 HydrophobicContact CE2-CD2 3.9Å; F343-L352 HydrophobicContact CZ-CD1 4.36Å; F343-L352 HydrophobicContact CZ-CD2 4.15Å; F343-L354 HydrophobicContact CE2-CD1 4.41Å; F343-L354 HydrophobicContact CZ-CD1 4.3Å; F343-L354 HydrophobicContact CZ-CD2 4.49Å; F343-A366 WeakPolarHBondContact CD2-O 3.42Å; F343-F367 HydrophobicContact CD2-CD1 4.08Å; F343-F367 HydrophobicContact CE2-CD1 4.02Å; F343-F367 HydrophobicContact CE2-CE1 4.1Å; F343-L370 HydrophobicContact CB-CD1 3.98Å; F343-L370 HydrophobicContact CB-CD2 4.01Å; F343-L370 HydrophobicContact CB-CG 4.03Å; F343-L370 HydrophobicContact CD2-CD1 3.91Å; F343-L370 HydrophobicContact CG-CD1 4.15Å
344	V	81.1	Confident	86.5	Confident	74 Å²	74	29.4 Å²	29.4	45%	0.448	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	134.6	178.7	170.2	0	0	0	0	110.5	G341	G341-V344 VanDerWaalsContact O-CB 3.26Å; G341-V344 WeakPolarHBondContact O-CB 3.42Å; G341-V344 VanDerWaalsContact O-CG2 3.27Å; G341-V344 WeakPolarHBondContact O-CG2 3.27Å; G341-V344 PolarHBondContact O-N 2.98Å
345	G	78.3	Confident	87.1	Confident	29 Å²	29	30.5 Å²	30.5	30%	0.299	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.1	-23.8	-178.9	0	0	0	0	0	114.4	F343 K347	F343-G345 PolarHBondContact O-N 2.98Å; G345-K347 PolarHBondContact O-N 3Å
346	M	87.1	Confident	87.6	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	18%	0.178	C	C	.	.			trans	-77.3	53.4	-176.8	-68.3	-160.2	-73.8	0	0	114.4	F316 L322 L325 F343 K348 L349 L370	F316-M346 HydrophobicContact CB-CE 3.85Å; F316-M346 HydrophobicContact CB-CG 4.14Å; F316-M346 HydrophobicContact CB-SD 3.67Å; F316-M346 HydrophobicContact CD2-CE 4.08Å; F316-M346 HydrophobicContact CG-CE 4.18Å; F316-M346 HydrophobicContact CG-SD 4.29Å; L322-M346 HydrophobicContact CB-SD 4.4Å; L322-M346 HydrophobicContact CD2-SD 3.63Å; L325-M346 HydrophobicContact CD2-CE 3.73Å; L325-M346 HydrophobicContact CD2-SD 4.09Å; F343-M346 HydrophobicContact CB-CE 3.71Å; F343-M346 HydrophobicContact CD1-CE 3.43Å; F343-M346 VanDerWaalsContact CD1-CE 3.43Å; F343-M346 HydrophobicContact CE1-CE 4.39Å; F343-M346 HydrophobicContact CG-CE 3.93Å; F343-M346 PolarHBondContact O-N 2.95Å; M346-K348 PolarHBondContact O-N 3.34Å; M346-L349 HydrophobicContact CB-CB 4.17Å; M346-L349 HydrophobicContact CE-CD2 4Å; M346-L349 WeakPolarHBondContact O-CB 3.44Å; M346-L349 PolarHBondContact O-N 2.63Å; M346-L349 VanDerWaalsContact O-N 3.07Å; M346-L349 HydrophobicContact SD-CD1 4.47Å; M346-L349 HydrophobicContact SD-CD2 4.32Å; M346-L370 HydrophobicContact CB-CD2 3.99Å; M346-L370 HydrophobicContact CE-CD2 4.47Å
347	K	86.6	Confident	88	Confident	162 Å²	162	33.6 Å²	33.6	70%	0.704	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-5.3	-174	-63.5	-178.4	-179.9	-176.6	0	115.9	G345 A372	G345-K347 PolarHBondContact O-N 3Å; K347-A372 WeakPolarHBondContact O-CB 3.45Å
348	K	93.8	Very high	88.2	Confident	96 Å²	96	38 Å²	38	42%	0.417	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-0.3	177.9	-61.6	-167.6	-166.9	173	0	113.8	N321 L322 M346 N350	N321-K348 PolarHBondContact OD1-NZ 3.41Å; L322-K348 CarbonylContact O-C 3.53Å; M346-K348 PolarHBondContact O-N 3.34Å; K348-N350 PolarHBondContact O-N 3.48Å
349	L	95.7	Very high	88.8	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.194	C	C	.	.			trans	-66.8	120.3	-176.4	-165.8	73	0	0	0	109.7	L322 L325 M346 L352 L370 A372 L373	L322-L349 HydrophobicContact CB-CD1 4.37Å; L322-L349 HydrophobicContact CD2-CD1 4.04Å; L322-L349 HydrophobicContact CG-CD1 4.09Å; L322-L349 VanDerWaalsContact O-CA 3.27Å; L322-L349 WeakPolarHBondContact O-CA 3.37Å; L322-L349 PolarHBondContact O-N 2.84Å; L325-L349 HydrophobicContact CB-CD1 3.74Å; L325-L349 HydrophobicContact CB-CD2 4.35Å; M346-L349 HydrophobicContact CB-CB 4.17Å; M346-L349 HydrophobicContact CE-CD2 4Å; M346-L349 WeakPolarHBondContact O-CB 3.44Å; M346-L349 PolarHBondContact O-N 2.63Å; M346-L349 VanDerWaalsContact O-N 3.07Å; M346-L349 HydrophobicContact SD-CD1 4.47Å; M346-L349 HydrophobicContact SD-CD2 4.32Å; L349-L352 HydrophobicContact CD2-CB 4.13Å; L349-L352 HydrophobicContact CD2-CD1 4.48Å; L349-L370 HydrophobicContact CB-CD2 4.08Å; L349-L370 HydrophobicContact CD2-CD1 4.26Å; L349-L370 HydrophobicContact CD2-CD2 3.76Å; L349-A372 CarbonylContact O-C 3.52Å; L349-L373 HydrophobicContact CB-CD1 4.42Å; L349-L373 HydrophobicContact CD2-CD1 4.02Å; L349-L373 HydrophobicContact CG-CD1 3.96Å; L349-L373 WeakPolarHBondContact O-CA 3.3Å; L349-L373 PolarHBondContact O-N 2.82Å
350	N	96.6	Very high	90	Very high	56 Å²	56	38.8 Å²	38.8	30%	0.299	20%	0.196	S	C	.	.			trans	-101.2	-40.2	179.1	-178.4	-68.1	0	0	0	110.4	R323 K348 L373 E374 H375	R323-N350 PolarHBondContact O-N 2.92Å; K348-N350 PolarHBondContact O-N 3.48Å; N350-L373 WeakPolarHBondContact O-CD1 3.29Å; N350-E374 WeakPolarHBondContact ND2-CG 3.45Å; N350-E374 PolarHBondContact ND2-OE2 3.04Å; N350-E374 PolarHBondContact O-N 3.41Å; N350-H375 PolarHBondContact O-N 3.33Å
351	T	98.2	Very high	91.2	Very high	27 Å²	27	37.8 Å²	37.8	17%	0.166	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.9	-176.4	-60.9	0	0	0	0	111.4	R323 S324 L325 I353 H375	R323-T351 PolarHBondContact O-N 3.17Å; S324-T351 WeakPolarHBondContact CA-O 3.12Å; L325-T351 PolarHBondContact N-O 3.02Å; T351-I353 HydrophobicContact CG2-CD1 4.29Å; T351-I353 HydrophobicContact CG2-CG1 4.02Å; T351-H375 WeakPolarHBondContact CA-O 3.42Å; T351-H375 HydrophobicContact CG2-CB 4.16Å
352	L	97.6	Very high	92.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	119.2	172.9	177.7	57.5	0	0	0	109.8	L325 F343 L349 L354 F367 L370 L373 H375 L376 D377	L325-L352 HydrophobicContact CB-CD1 4.17Å; L325-L352 HydrophobicContact CD2-CD1 4.08Å; L325-L352 HydrophobicContact CG-CD1 4.08Å; L325-L352 WeakPolarHBondContact O-CA 3.21Å; F343-L352 HydrophobicContact CD2-CD2 4.32Å; F343-L352 HydrophobicContact CE2-CD2 3.9Å; F343-L352 HydrophobicContact CZ-CD1 4.36Å; F343-L352 HydrophobicContact CZ-CD2 4.15Å; L349-L352 HydrophobicContact CD2-CB 4.13Å; L349-L352 HydrophobicContact CD2-CD1 4.48Å; L352-L354 HydrophobicContact CD1-CD1 4.38Å; L352-L354 HydrophobicContact CD1-CD2 4.4Å; L352-L354 HydrophobicContact CD1-CG 4.07Å; L352-L354 HydrophobicContact CD2-CD1 3.98Å; L352-L354 HydrophobicContact CG-CD1 4.09Å; L352-L354 HydrophobicContact CG-CG 4.08Å; L352-F367 HydrophobicContact CD2-CD1 4.12Å; L352-F367 HydrophobicContact CD2-CE1 4.07Å; L352-L370 HydrophobicContact CD2-CD1 3.77Å; L352-L373 HydrophobicContact CB-CD1 3.76Å; L352-L373 HydrophobicContact CB-CD2 4.16Å; L352-H375 PolarHBondContact N-O 3.2Å; L352-L376 HydrophobicContact CB-CD1 4.26Å; L352-L376 HydrophobicContact CD2-CD1 4.12Å; L352-L376 HydrophobicContact CG-CD1 4.16Å; L352-L376 WeakPolarHBondContact O-CA 3.33Å; L352-D377 PolarHBondContact O-N 3.43Å; L352-D377 VanDerWaalsContact O-N 3.11Å
353	I	98.4	Very high	92.6	Very high	32 Å²	32	38.4 Å²	38.4	16%	0.164	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	113.9	178.4	-53.2	176	0	0	0	108.7	L325 D326 I327 R328 T351 Q355 D377	L325-I353 PolarHBondContact O-N 2.77Å; D326-I353 HydrophobicContact CB-CB 4.38Å; D326-I353 HydrophobicContact CB-CD1 4.37Å; I327-I353 CarbonylContact C-O 3.44Å; I327-I353 PolarHBondContact N-O 2.84Å; R328-I353 HydrophobicContact CB-CG2 3.99Å; R328-I353 PolarHBondContact N-O 3.34Å; T351-I353 HydrophobicContact CG2-CD1 4.29Å; T351-I353 HydrophobicContact CG2-CG1 4.02Å; I353-Q355 HydrophobicContact CG2-CB 4.1Å; I353-D377 HydrophobicContact CG2-CB 4.27Å
354	L	97.3	Very high	92.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.214	C	C	.	.			trans	-119.7	17.9	177.7	-69.9	170.4	0	0	0	111.7	I332 I336 F343 L352 N357 I359 F367 D377 L378 N381	I332-L354 HydrophobicContact CD1-CD2 4.07Å; I336-L354 HydrophobicContact CD1-CD1 3.97Å; F343-L354 HydrophobicContact CE2-CD1 4.41Å; F343-L354 HydrophobicContact CZ-CD1 4.3Å; F343-L354 HydrophobicContact CZ-CD2 4.49Å; L352-L354 HydrophobicContact CD1-CD1 4.38Å; L352-L354 HydrophobicContact CD1-CD2 4.4Å; L352-L354 HydrophobicContact CD1-CG 4.07Å; L352-L354 HydrophobicContact CD2-CD1 3.98Å; L352-L354 HydrophobicContact CG-CD1 4.09Å; L352-L354 HydrophobicContact CG-CG 4.08Å; L354-N357 PolarHBondContact O-ND2 3.45Å; L354-I359 HydrophobicContact CB-CD1 4.15Å; L354-I359 HydrophobicContact CD1-CD1 4.3Å; L354-F367 HydrophobicContact CD1-CE1 4.01Å; L354-D377 CarbonylContact C-O 3.27Å; L354-D377 WeakPolarHBondContact CA-O 3.26Å; L354-D377 PolarHBondContact N-O 2.95Å; L354-L378 HydrophobicContact CB-CD2 4.03Å; L354-L378 HydrophobicContact CD1-CD2 4.09Å; L354-N381 PolarHBondContact O-ND2 2.99Å
355	Q	97.6	Very high	93	Very high	46 Å²	46	44 Å²	44	22%	0.215	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	141.1	179.3	-176.6	-178.8	123.6	0	0	112.4	R328 D329 I353 N357 D377 S379 K380	R328-Q355 CarbonylContact C-O 3.32Å; R328-Q355 WeakPolarHBondContact CA-O 3.45Å; R328-Q355 HydrophobicContact CB-CB 4.08Å; D329-Q355 PolarHBondContact N-O 3.45Å; I353-Q355 HydrophobicContact CG2-CB 4.1Å; Q355-N357 VanDerWaalsContact C-N 3.27Å; Q355-N357 PolarHBondContact O-N 2.91Å; Q355-N357 PolarHBondContact O-ND2 3.43Å; Q355-D377 PolarHBondContact N-O 3.43Å; Q355-D377 PolarHBondContact NE2-OD2 3.03Å; Q355-S379 CarbonylContact C-O 3.49Å; Q355-S379 VanDerWaalsContact CA-O 3.31Å; Q355-S379 WeakPolarHBondContact CA-O 3.48Å; Q355-S379 WeakPolarHBondContact CG-O 3.43Å; Q355-S379 WeakPolarHBondContact CG-OG 3.41Å; Q355-S379 PolarHBondContact NE2-OG 3.04Å; Q355-K380 HydrophobicContact CG-CD 3.95Å; Q355-K380 HydrophobicContact CG-CG 4.35Å
356	Q	97.1	Very high	93.5	Very high	64 Å²	64	43 Å²	43	30%	0.299	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	25	171.5	-152.2	168.4	-60.4	0	0	115.6	D329 S379 K380	D329-Q356 HydrophobicContact CB-CB 4.27Å; D329-Q356 PolarHBondContact OD1-NE2 2.8Å; D329-Q356 PolarHBondContact OD2-NE2 2.67Å; Q356-S379 PolarHBondContact N-O 2.81Å; Q356-K380 HydrophobicContact CB-CB 4.18Å; Q356-K380 HydrophobicContact CB-CD 3.94Å; Q356-K380 HydrophobicContact CG-CB 4.34Å; Q356-K380 HydrophobicContact CG-CD 4Å
357	N	97.2	Very high	93.7	Very high	6 Å²	6	43.3 Å²	43.3	3%	0.032	20%	0.201	C	C	.	.	S	Bend	trans	-85	-168.9	169.3	-81.3	-81.8	0	0	0	111.5	I327 N330 I332 L354 Q355 I359 N381	I327-N357 PolarHBondContact O-ND2 3.31Å; N330-N357 WeakPolarHBondContact CA-OD1 3.43Å; N330-N357 WeakPolarHBondContact CB-OD1 3.44Å; N330-N357 PolarHBondContact O-OD1 2.85Å; I332-N357 HydrophobicContact CB-CB 4.19Å; I332-N357 VanDerWaalsContact CB-OD1 3.27Å; I332-N357 WeakPolarHBondContact CB-OD1 3.41Å; I332-N357 WeakPolarHBondContact CG1-OD1 3.31Å; I332-N357 PolarHBondContact N-OD1 3.09Å; L354-N357 PolarHBondContact O-ND2 3.45Å; Q355-N357 VanDerWaalsContact C-N 3.27Å; Q355-N357 PolarHBondContact O-N 2.91Å; Q355-N357 PolarHBondContact O-ND2 3.43Å; N357-I359 HydrophobicContact CB-CD1 4.27Å; N357-I359 HydrophobicContact CB-CG1 4.2Å; N357-N381 VanDerWaalsContact CA-OD1 3.25Å; N357-N381 WeakPolarHBondContact CA-OD1 3.16Å; N357-N381 WeakPolarHBondContact CB-OD1 3.25Å; N357-N381 PolarHBondContact N-OD1 3.42Å; N357-N381 PolarHBondContact O-OD1 2.86Å
358	K	94.1	Very high	93.7	Very high	99 Å²	99	39.6 Å²	39.6	43%	0.43	19%	0.186	S	C	.	.			trans	-104.8	13.9	-176.6	-46.8	-57.2	-178.9	-114.1	0	113.1	N330 E331 I332 K360	N330-K358 PolarHBondContact O-NZ 3.02Å; E331-K358 HydrophobicContact CB-CG 4.48Å; I332-K358 CarbonylContact O-C 3.57Å; I332-K358 WeakPolarHBondContact O-CA 3.26Å; I332-K358 PolarHBondContact O-N 2.94Å; K358-K360 PolarHBondContact O-N 3.29Å
359	I	93.9	Very high	93.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.179	C	C	.	.			trans	-61.7	122.1	-173.2	-54.9	163.5	0	0	0	110.4	I332 I336 L354 N357 S361 I362 L378 N381 G382 I383	I332-I359 PolarHBondContact O-N 2.98Å; I336-I359 HydrophobicContact CB-CD1 4.39Å; I336-I359 HydrophobicContact CB-CG1 4.29Å; I336-I359 HydrophobicContact CB-CG2 4.08Å; I336-I359 HydrophobicContact CG1-CD1 3.77Å; I336-I359 HydrophobicContact CG1-CG1 3.97Å; I336-I359 HydrophobicContact CG2-CD1 4.44Å; I336-I359 HydrophobicContact CG2-CG2 3.8Å; L354-I359 HydrophobicContact CB-CD1 4.15Å; L354-I359 HydrophobicContact CD1-CD1 4.3Å; N357-I359 HydrophobicContact CB-CD1 4.27Å; N357-I359 HydrophobicContact CB-CG1 4.2Å; I359-S361 WeakPolarHBondContact CG2-O 3.36Å; I359-I362 HydrophobicContact CG2-CG1 4.4Å; I359-L378 HydrophobicContact CD1-CD2 4.01Å; I359-N381 HydrophobicContact CB-CB 4.17Å; I359-N381 WeakPolarHBondContact CB-OD1 3.49Å; I359-N381 WeakPolarHBondContact CD1-OD1 3.32Å; I359-N381 WeakPolarHBondContact CG1-OD1 3.4Å; I359-N381 PolarHBondContact N-OD1 3.28Å; I359-G382 CarbonylContact O-C 3.53Å; I359-G382 PolarHBondContact O-N 2.82Å; I359-I383 HydrophobicContact CB-CG1 4.46Å; I359-I383 HydrophobicContact CG2-CG1 4.17Å; I359-I383 WeakPolarHBondContact O-CG1 3.29Å; I359-I383 PolarHBondContact O-N 2.71Å
360	K	92.3	Very high	92.9	Very high	76 Å²	76	36.4 Å²	36.4	33%	0.33	18%	0.18	S	C	.	.			trans	-104	-19.3	173.2	-62.4	-172.7	-179.5	-173.8	0	114.1	E337 K358 M384 S385	E337-K360 PolarHBondContact OE1-N 2.98Å; K358-K360 PolarHBondContact O-N 3.29Å; K360-M384 HydrophobicContact CB-CG 4.23Å; K360-M384 HydrophobicContact CB-SD 4.46Å; K360-M384 HydrophobicContact CD-SD 4.24Å; K360-M384 PolarHBondContact O-N 2.76Å; K360-S385 PolarHBondContact O-N 3.02Å
361	S	92.1	Very high	92.6	Very high	8 Å²	8	40.8 Å²	40.8	6%	0.056	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	148	-173.5	-166.1	0	0	0	0	110.9	E337 I359 S385 K458	E337-S361 WeakPolarHBondContact CG-O 3.27Å; I359-S361 WeakPolarHBondContact CG2-O 3.36Å; S361-S385 CarbonylContact C-O 3.59Å; S361-S385 WeakPolarHBondContact CA-O 3.14Å; S361-S385 PolarHBondContact OG-OG 3.38Å; S361-K458 PolarHBondContact OG-NZ 3.02Å
362	I	93.4	Very high	92.3	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	110.9	171	-55.6	-178.5	0	0	0	108	I336 I359 A366 F367 L378 I383 S385 I386 H387 S390	I336-I362 HydrophobicContact CG2-CG1 4.25Å; I359-I362 HydrophobicContact CG2-CG1 4.4Å; I362-A366 HydrophobicContact CG2-CB 3.76Å; I362-F367 HydrophobicContact CD1-CE2 4.38Å; I362-F367 HydrophobicContact CG2-CD2 4.21Å; I362-F367 HydrophobicContact CG2-CE2 3.57Å; I362-F367 HydrophobicContact CG2-CZ 4.31Å; I362-L378 HydrophobicContact CD1-CD1 3.62Å; I362-L378 HydrophobicContact CD1-CD2 4.41Å; I362-I383 HydrophobicContact CD1-CD1 4.04Å; I362-S385 PolarHBondContact N-O 3.36Å; I362-I386 HydrophobicContact CB-CG2 4.11Å; I362-I386 HydrophobicContact CD1-CD1 4.34Å; I362-I386 HydrophobicContact CD1-CG1 4.17Å; I362-I386 HydrophobicContact CD1-CG2 4.34Å; I362-I386 HydrophobicContact CG1-CG1 4.45Å; I362-I386 HydrophobicContact CG2-CG2 4.41Å; I362-H387 WeakPolarHBondContact O-CB 3.39Å; I362-H387 PolarHBondContact O-N 3.16Å; I362-S390 WeakPolarHBondContact CG2-OG 3.43Å
363	T	90.9	Very high	92.3	Very high	25 Å²	25	41.4 Å²	41.4	15%	0.153	21%	0.206	C	C	.	.			trans	-85.1	165.6	-179.7	74.4	0	0	0	0	112	E337 S339 K365 A366 S390	E337-T363 WeakPolarHBondContact O-CG2 3.36Å; S339-T363 VanDerWaalsContact OG-CB 3.27Å; S339-T363 WeakPolarHBondContact OG-CB 3.41Å; S339-T363 WeakPolarHBondContact OG-CG2 3.37Å; S339-T363 PolarHBondContact OG-OG1 3.18Å; T363-K365 PolarHBondContact O-N 3.26Å; T363-K365 PolarHBondContact OG1-N 3.02Å; T363-A366 VanDerWaalsContact O-CB 3.29Å; T363-A366 WeakPolarHBondContact O-CB 3.15Å; T363-A366 PolarHBondContact O-N 2.98Å; T363-A366 VanDerWaalsContact O-N 3.09Å; T363-A366 PolarHBondContact OG1-N 3.04Å; T363-S390 WeakPolarHBondContact O-CB 3.35Å
364	K	88.5	Confident	92.2	Very high	109 Å²	109	42.7 Å²	42.7	47%	0.474	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49	-32.8	175.2	176.9	159.1	-176.4	159.2	0	114.4	D389	K364-D389 HydrophobicContact CD-CB 3.84Å; K364-D389 WeakPolarHBondContact CD-OD2 3.43Å; K364-D389 VanDerWaalsContact CE-OD2 3.22Å; K364-D389 WeakPolarHBondContact CE-OD2 3.15Å; K364-D389 HydrophobicContact CG-CB 3.81Å; K364-D389 IonicContact NZ-OD2 3.19Å; K364-D389 PolarHBondContact NZ-OD2 3.44Å
365	K	87.2	Confident	92.2	Very high	86 Å²	86	45.3 Å²	45.3	37%	0.374	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	0.2	-175.8	-68.1	178.6	154.3	-74.4	0	114.3	T363 F367 E368	T363-K365 PolarHBondContact O-N 3.26Å; T363-K365 PolarHBondContact OG1-N 3.02Å; K365-F367 PolarHBondContact O-N 2.92Å; K365-E368 HydrophobicContact CB-CB 4.35Å; K365-E368 WeakPolarHBondContact CD-OE2 3.44Å; K365-E368 VanDerWaalsContact CG-OE2 3.3Å; K365-E368 WeakPolarHBondContact CG-OE2 3.41Å; K365-E368 IonicContact NZ-OE1 2.68Å; K365-E368 PolarHBondContact NZ-OE1 3.32Å; K365-E368 IonicContact NZ-OE2 2.71Å; K365-E368 PolarHBondContact NZ-OE2 2.72Å; K365-E368 WeakPolarHBondContact O-CB 3.42Å; K365-E368 PolarHBondContact O-N 2.94Å; K365-E368 VanDerWaalsContact O-N 3.08Å
366	A	88.8	Confident	92.2	Very high	7 Å²	7	43.1 Å²	43.1	6%	0.058	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-31.9	-175.5	0	0	0	0	0	114.2	I336 F343 I362 T363	I336-A366 HydrophobicContact CG2-CB 3.9Å; F343-A366 WeakPolarHBondContact CD2-O 3.42Å; I362-A366 HydrophobicContact CG2-CB 3.76Å; T363-A366 VanDerWaalsContact O-CB 3.29Å; T363-A366 WeakPolarHBondContact O-CB 3.15Å; T363-A366 PolarHBondContact O-N 2.98Å; T363-A366 VanDerWaalsContact O-N 3.09Å; T363-A366 PolarHBondContact OG1-N 3.04Å
367	F	89.9	Confident	92.2	Very high	9 Å²	9	40.7 Å²	40.7	4%	0.039	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.3	26.4	-179.4	-53.4	-58.4	0	0	0	112.4	I336 F343 L352 L354 I362 K365 G369 L370 L376 L378 L391 M394	I336-F367 HydrophobicContact CD1-CE1 4.38Å; I336-F367 HydrophobicContact CG2-CZ 4.43Å; F343-F367 HydrophobicContact CD2-CD1 4.08Å; F343-F367 HydrophobicContact CE2-CD1 4.02Å; F343-F367 HydrophobicContact CE2-CE1 4.1Å; L352-F367 HydrophobicContact CD2-CD1 4.12Å; L352-F367 HydrophobicContact CD2-CE1 4.07Å; L354-F367 HydrophobicContact CD1-CE1 4.01Å; I362-F367 HydrophobicContact CD1-CE2 4.38Å; I362-F367 HydrophobicContact CG2-CD2 4.21Å; I362-F367 HydrophobicContact CG2-CE2 3.57Å; I362-F367 HydrophobicContact CG2-CZ 4.31Å; K365-F367 PolarHBondContact O-N 2.92Å; F367-G369 PolarHBondContact O-N 3.44Å; F367-L370 HydrophobicContact CB-CB 4.5Å; F367-L370 HydrophobicContact CB-CD1 4.11Å; F367-L370 HydrophobicContact CD1-CD1 4.08Å; F367-L370 WeakPolarHBondContact O-CB 3.49Å; F367-L370 PolarHBondContact O-N 3.11Å; F367-L370 VanDerWaalsContact O-N 3.13Å; F367-L376 HydrophobicContact CD2-CD2 4.48Å; F367-L376 HydrophobicContact CE1-CD1 4.34Å; F367-L376 HydrophobicContact CE2-CD2 4.07Å; F367-L376 HydrophobicContact CZ-CD1 4.33Å; F367-L376 HydrophobicContact CZ-CD2 4.22Å; F367-L378 HydrophobicContact CE2-CD1 4.48Å; F367-L378 HydrophobicContact CZ-CD1 4.23Å; F367-L378 HydrophobicContact CZ-CD2 4.25Å; F367-L391 HydrophobicContact CD2-CD2 4.01Å; F367-L391 HydrophobicContact CE2-CD2 3.99Å; F367-M394 HydrophobicContact CB-CE 3.63Å; F367-M394 HydrophobicContact CB-SD 3.93Å; F367-M394 HydrophobicContact CD2-CE 3.68Å; F367-M394 HydrophobicContact CG-CE 3.86Å; F367-M394 HydrophobicContact CG-SD 4.48Å
368	E	86.3	Confident	92.2	Very high	84 Å²	84	40.4 Å²	40.4	39%	0.393	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	124.9	-179.9	-170.5	169.7	-151.8	0	0	111.4	K365	K365-E368 HydrophobicContact CB-CB 4.35Å; K365-E368 WeakPolarHBondContact CD-OE2 3.44Å; K365-E368 VanDerWaalsContact CG-OE2 3.3Å; K365-E368 WeakPolarHBondContact CG-OE2 3.41Å; K365-E368 IonicContact NZ-OE1 2.68Å; K365-E368 PolarHBondContact NZ-OE1 3.32Å; K365-E368 IonicContact NZ-OE2 2.71Å; K365-E368 PolarHBondContact NZ-OE2 2.72Å; K365-E368 WeakPolarHBondContact O-CB 3.42Å; K365-E368 PolarHBondContact O-N 2.94Å; K365-E368 VanDerWaalsContact O-N 3.08Å
369	G	83.9	Confident	92.3	Very high	26 Å²	26	36.2 Å²	36.2	27%	0.268	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.1	-7	-175.8	0	0	0	0	0	115.8	F367 E371	F367-G369 PolarHBondContact O-N 3.44Å; G369-E371 VanDerWaalsContact C-N 3.27Å; G369-E371 PolarHBondContact O-N 2.97Å
370	L	90.4	Very high	92.4	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	21%	0.207	C	C	.	.			trans	-87.2	38.7	-179.7	-61.7	-172.9	0	0	0	114.1	F343 M346 L349 L352 F367 A372 L373 M394	F343-L370 HydrophobicContact CB-CD1 3.98Å; F343-L370 HydrophobicContact CB-CD2 4.01Å; F343-L370 HydrophobicContact CB-CG 4.03Å; F343-L370 HydrophobicContact CD2-CD1 3.91Å; F343-L370 HydrophobicContact CG-CD1 4.15Å; M346-L370 HydrophobicContact CB-CD2 3.99Å; M346-L370 HydrophobicContact CE-CD2 4.47Å; L349-L370 HydrophobicContact CB-CD2 4.08Å; L349-L370 HydrophobicContact CD2-CD1 4.26Å; L349-L370 HydrophobicContact CD2-CD2 3.76Å; L352-L370 HydrophobicContact CD2-CD1 3.77Å; F367-L370 HydrophobicContact CB-CB 4.5Å; F367-L370 HydrophobicContact CB-CD1 4.11Å; F367-L370 HydrophobicContact CD1-CD1 4.08Å; F367-L370 WeakPolarHBondContact O-CB 3.49Å; F367-L370 PolarHBondContact O-N 3.11Å; F367-L370 VanDerWaalsContact O-N 3.13Å; L370-A372 PolarHBondContact O-N 3.42Å; L370-L373 HydrophobicContact CB-CB 4.28Å; L370-L373 HydrophobicContact CD1-CD2 4.4Å; L370-L373 VanDerWaalsContact O-CB 3.29Å; L370-L373 WeakPolarHBondContact O-CB 3.41Å; L370-L373 PolarHBondContact O-N 3.42Å; L370-M394 HydrophobicContact CB-SD 4.07Å; L370-M394 WeakPolarHBondContact O-CG 3.29Å
371	E	88.9	Confident	92.5	Very high	149 Å²	149	38 Å²	38	70%	0.696	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-24.7	-175.7	-64.6	173.4	-148.7	0	0	114.6	G369	G369-E371 VanDerWaalsContact C-N 3.27Å; G369-E371 PolarHBondContact O-N 2.97Å
372	A	93.4	Very high	92.6	Very high	40 Å²	40	39.1 Å²	39.1	33%	0.331	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	0.9	-179.4	0	0	0	0	0	114.5	K347 L349 L370 E374	K347-A372 WeakPolarHBondContact O-CB 3.45Å; L349-A372 CarbonylContact O-C 3.52Å; L370-A372 PolarHBondContact O-N 3.42Å; A372-E374 PolarHBondContact O-N 2.99Å
373	L	95.8	Very high	92.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.			trans	-71.3	126.5	-173.2	-157.9	76.4	0	0	0	111.7	L349 N350 L352 L370 L376 M394 K395 L396	L349-L373 HydrophobicContact CB-CD1 4.42Å; L349-L373 HydrophobicContact CD2-CD1 4.02Å; L349-L373 HydrophobicContact CG-CD1 3.96Å; L349-L373 WeakPolarHBondContact O-CA 3.3Å; L349-L373 PolarHBondContact O-N 2.82Å; N350-L373 WeakPolarHBondContact O-CD1 3.29Å; L352-L373 HydrophobicContact CB-CD1 3.76Å; L352-L373 HydrophobicContact CB-CD2 4.16Å; L370-L373 HydrophobicContact CB-CB 4.28Å; L370-L373 HydrophobicContact CD1-CD2 4.4Å; L370-L373 VanDerWaalsContact O-CB 3.29Å; L370-L373 WeakPolarHBondContact O-CB 3.41Å; L370-L373 PolarHBondContact O-N 3.42Å; L373-L376 HydrophobicContact CD2-CB 3.97Å; L373-L376 HydrophobicContact CD2-CD1 4.26Å; L373-L376 HydrophobicContact CD2-CD2 4.38Å; L373-L376 HydrophobicContact CD2-CG 4.43Å; L373-M394 HydrophobicContact CB-CG 4.35Å; L373-M394 HydrophobicContact CB-SD 3.82Å; L373-M394 HydrophobicContact CD2-SD 3.57Å; L373-M394 VanDerWaalsContact CD2-SD 3.57Å; L373-M394 HydrophobicContact CG-SD 4.33Å; L373-K395 CarbonylContact O-C 3.59Å; L373-L396 HydrophobicContact CB-CD2 4.45Å; L373-L396 HydrophobicContact CD2-CD2 4.12Å; L373-L396 HydrophobicContact CG-CD2 4.24Å
374	E	96.4	Very high	92.7	Very high	59 Å²	59	38.4 Å²	38.4	28%	0.276	20%	0.2	S	C	.	.			trans	-115.8	-21.9	179.4	-53	-169.9	146.9	0	0	112.4	N350 A372 K397 V398	N350-E374 WeakPolarHBondContact ND2-CG 3.45Å; N350-E374 PolarHBondContact ND2-OE2 3.04Å; N350-E374 PolarHBondContact O-N 3.41Å; A372-E374 PolarHBondContact O-N 2.99Å; E374-K397 HydrophobicContact CB-CD 4.17Å; E374-K397 HydrophobicContact CB-CG 4.23Å; E374-K397 HydrophobicContact CG-CD 4.45Å; E374-K397 PolarHBondContact O-N 2.75Å; E374-K397 WeakPolarHBondContact OE1-CE 3.22Å; E374-K397 IonicContact OE1-NZ 2.62Å; E374-K397 PolarHBondContact OE1-NZ 2.74Å; E374-K397 WeakPolarHBondContact OE2-CE 3.48Å; E374-K397 IonicContact OE2-NZ 2.79Å; E374-K397 PolarHBondContact OE2-NZ 2.75Å; E374-V398 PolarHBondContact O-N 3.1Å
375	H	97.8	Very high	92.9	Very high	55 Å²	55	34.3 Å²	34.3	26%	0.255	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	121.3	178.3	-171.5	139.7	0	0	0	110.5	N350 T351 L352 V398	N350-H375 PolarHBondContact O-N 3.33Å; T351-H375 WeakPolarHBondContact CA-O 3.42Å; T351-H375 HydrophobicContact CG2-CB 4.16Å; L352-H375 PolarHBondContact N-O 3.2Å; H375-V398 WeakPolarHBondContact CA-O 3.41Å; H375-V398 HydrophobicContact CB-CB 4.25Å
376	L	97.6	Very high	93.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	115.8	174.9	178.5	57.1	0	0	0	110.6	L352 F367 L373 L378 L391 M394 L396 V398 F399 V400	L352-L376 HydrophobicContact CB-CD1 4.26Å; L352-L376 HydrophobicContact CD2-CD1 4.12Å; L352-L376 HydrophobicContact CG-CD1 4.16Å; L352-L376 WeakPolarHBondContact O-CA 3.33Å; F367-L376 HydrophobicContact CD2-CD2 4.48Å; F367-L376 HydrophobicContact CE1-CD1 4.34Å; F367-L376 HydrophobicContact CE2-CD2 4.07Å; F367-L376 HydrophobicContact CZ-CD1 4.33Å; F367-L376 HydrophobicContact CZ-CD2 4.22Å; L373-L376 HydrophobicContact CD2-CB 3.97Å; L373-L376 HydrophobicContact CD2-CD1 4.26Å; L373-L376 HydrophobicContact CD2-CD2 4.38Å; L373-L376 HydrophobicContact CD2-CG 4.43Å; L376-L378 HydrophobicContact CD1-CD1 4.19Å; L376-L378 HydrophobicContact CD1-CG 4.01Å; L376-L378 HydrophobicContact CD2-CD1 3.84Å; L376-L378 HydrophobicContact CG-CD1 3.88Å; L376-L378 HydrophobicContact CG-CG 4.08Å; L376-L391 HydrophobicContact CD2-CD2 3.94Å; L376-M394 HydrophobicContact CD2-CE 4.33Å; L376-L396 HydrophobicContact CB-CD1 4.39Å; L376-L396 HydrophobicContact CB-CD2 3.76Å; L376-L396 HydrophobicContact CD2-CD1 4.29Å; L376-V398 PolarHBondContact N-O 2.87Å; L376-F399 HydrophobicContact CB-CD2 4.28Å; L376-F399 HydrophobicContact CD2-CD2 4.19Å; L376-F399 HydrophobicContact CD2-CE2 4.05Å; L376-F399 HydrophobicContact CG-CD2 4.29Å; L376-F399 HydrophobicContact CG-CE2 4.39Å; L376-F399 WeakPolarHBondContact O-CA 3.31Å; L376-V400 PolarHBondContact O-N 3.4Å
377	D	98.1	Very high	93.5	Very high	13 Å²	13	33.3 Å²	33.3	7%	0.07	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.2	171.7	-176.3	2.9	0	0	0	111	L352 I353 L354 Q355 S379 V400	L352-D377 PolarHBondContact O-N 3.43Å; L352-D377 VanDerWaalsContact O-N 3.11Å; I353-D377 HydrophobicContact CG2-CB 4.27Å; L354-D377 CarbonylContact C-O 3.27Å; L354-D377 WeakPolarHBondContact CA-O 3.26Å; L354-D377 PolarHBondContact N-O 2.95Å; Q355-D377 PolarHBondContact N-O 3.43Å; Q355-D377 PolarHBondContact NE2-OD2 3.03Å; D377-S379 WeakPolarHBondContact OD1-CB 3.14Å; D377-S379 PolarHBondContact OD1-N 2.93Å; D377-S379 PolarHBondContact OD1-OG 3.39Å; D377-V400 HydrophobicContact CB-CB 4.12Å; D377-V400 HydrophobicContact CB-CG2 4.36Å
378	L	97.1	Very high	93.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.191	C	C	.	.			trans	-118	10	177.5	-72.9	162.3	0	0	0	112	L354 I359 I362 F367 L376 N381 I383 F399 V400 L401	L354-L378 HydrophobicContact CB-CD2 4.03Å; L354-L378 HydrophobicContact CD1-CD2 4.09Å; I359-L378 HydrophobicContact CD1-CD2 4.01Å; I362-L378 HydrophobicContact CD1-CD1 3.62Å; I362-L378 HydrophobicContact CD1-CD2 4.41Å; F367-L378 HydrophobicContact CE2-CD1 4.48Å; F367-L378 HydrophobicContact CZ-CD1 4.23Å; F367-L378 HydrophobicContact CZ-CD2 4.25Å; L376-L378 HydrophobicContact CD1-CD1 4.19Å; L376-L378 HydrophobicContact CD1-CG 4.01Å; L376-L378 HydrophobicContact CD2-CD1 3.84Å; L376-L378 HydrophobicContact CG-CD1 3.88Å; L376-L378 HydrophobicContact CG-CG 4.08Å; L378-N381 WeakPolarHBondContact O-CB 3.4Å; L378-N381 PolarHBondContact O-N 3.03Å; L378-N381 PolarHBondContact O-ND2 2.96Å; L378-I383 HydrophobicContact CB-CD1 3.92Å; L378-I383 HydrophobicContact CD2-CD1 4.4Å; L378-F399 HydrophobicContact CD1-CE2 3.99Å; L378-V400 PolarHBondContact N-O 2.83Å; L378-L401 HydrophobicContact CB-CD1 4.19Å
379	S	96.1	Very high	93.6	Very high	11 Å²	11	33.3 Å²	33.3	8%	0.077	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	154.3	-176.7	65.3	0	0	0	0	113.5	Q355 Q356 D377 N381 V400	Q355-S379 CarbonylContact C-O 3.49Å; Q355-S379 VanDerWaalsContact CA-O 3.31Å; Q355-S379 WeakPolarHBondContact CA-O 3.48Å; Q355-S379 WeakPolarHBondContact CG-O 3.43Å; Q355-S379 WeakPolarHBondContact CG-OG 3.41Å; Q355-S379 PolarHBondContact NE2-OG 3.04Å; Q356-S379 PolarHBondContact N-O 2.81Å; D377-S379 WeakPolarHBondContact OD1-CB 3.14Å; D377-S379 PolarHBondContact OD1-N 2.93Å; D377-S379 PolarHBondContact OD1-OG 3.39Å; S379-N381 PolarHBondContact O-N 2.98Å; S379-N381 VanDerWaalsContact O-N 3.09Å; S379-N381 PolarHBondContact O-ND2 3.02Å; S379-V400 PolarHBondContact N-O 2.88Å
380	K	94.8	Very high	94	Very high	110 Å²	110	32.3 Å²	32.3	48%	0.478	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	7.4	-176.1	-45.8	170.6	-179.1	165.6	0	115.3	Q355 Q356 N402	Q355-K380 HydrophobicContact CG-CD 3.95Å; Q355-K380 HydrophobicContact CG-CG 4.35Å; Q356-K380 HydrophobicContact CB-CB 4.18Å; Q356-K380 HydrophobicContact CB-CD 3.94Å; Q356-K380 HydrophobicContact CG-CB 4.34Å; Q356-K380 HydrophobicContact CG-CD 4Å; K380-N402 PolarHBondContact N-O 3.31Å
381	N	95.2	Very high	94	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	17%	0.174	C	C	.	.	S	Bend	trans	-82.1	146.6	165.9	-72.8	-86.8	0	0	0	110.1	L354 N357 I359 L378 S379 I383	L354-N381 PolarHBondContact O-ND2 2.99Å; N357-N381 VanDerWaalsContact CA-OD1 3.25Å; N357-N381 WeakPolarHBondContact CA-OD1 3.16Å; N357-N381 WeakPolarHBondContact CB-OD1 3.25Å; N357-N381 PolarHBondContact N-OD1 3.42Å; N357-N381 PolarHBondContact O-OD1 2.86Å; I359-N381 HydrophobicContact CB-CB 4.17Å; I359-N381 WeakPolarHBondContact CB-OD1 3.49Å; I359-N381 WeakPolarHBondContact CD1-OD1 3.32Å; I359-N381 WeakPolarHBondContact CG1-OD1 3.4Å; I359-N381 PolarHBondContact N-OD1 3.28Å; L378-N381 WeakPolarHBondContact O-CB 3.4Å; L378-N381 PolarHBondContact O-N 3.03Å; L378-N381 PolarHBondContact O-ND2 2.96Å; S379-N381 PolarHBondContact O-N 2.98Å; S379-N381 VanDerWaalsContact O-N 3.09Å; S379-N381 PolarHBondContact O-ND2 3.02Å; N381-I383 HydrophobicContact CB-CD1 3.76Å; N381-I383 HydrophobicContact CB-CG1 3.75Å; N381-I383 PolarHBondContact O-N 3.09Å
382	G	93.2	Very high	93.8	Very high	31 Å²	31	28.3 Å²	28.3	32%	0.32	16%	0.163	S	C	.	.			trans	-77.4	44.5	176.9	0	0	0	0	0	113.5	I359 M384	I359-G382 CarbonylContact O-C 3.53Å; I359-G382 PolarHBondContact O-N 2.82Å; G382-M384 WeakPolarHBondContact O-CG 3.46Å; G382-M384 PolarHBondContact O-N 2.91Å
383	I	95.3	Very high	93.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.176	C	C	.	.			trans	-66.6	124.2	-171.1	-68	159.2	0	0	0	110.4	I359 I362 L378 N381 I386 L401 T403 L406	I359-I383 HydrophobicContact CB-CG1 4.46Å; I359-I383 HydrophobicContact CG2-CG1 4.17Å; I359-I383 WeakPolarHBondContact O-CG1 3.29Å; I359-I383 PolarHBondContact O-N 2.71Å; I362-I383 HydrophobicContact CD1-CD1 4.04Å; L378-I383 HydrophobicContact CB-CD1 3.92Å; L378-I383 HydrophobicContact CD2-CD1 4.4Å; N381-I383 HydrophobicContact CB-CD1 3.76Å; N381-I383 HydrophobicContact CB-CG1 3.75Å; N381-I383 PolarHBondContact O-N 3.09Å; I383-I386 HydrophobicContact CG2-CD1 3.9Å; I383-I386 HydrophobicContact CG2-CG1 3.58Å; I383-L401 HydrophobicContact CD1-CD1 3.63Å; I383-T403 HydrophobicContact CB-CG2 4.42Å; I383-T403 PolarHBondContact O-OG1 2.93Å; I383-L406 HydrophobicContact CG2-CD2 4.28Å; I383-L406 WeakPolarHBondContact O-CD2 3.27Å
384	M	93.1	Very high	93.2	Very high	11 Å²	11	33.5 Å²	33.5	5%	0.054	18%	0.181	C	C	.	.			trans	-110.1	-29.7	-175.6	-41.9	-167.9	78.1	0	0	112.3	K360 G382 S405 L407 F544	K360-M384 HydrophobicContact CB-CG 4.23Å; K360-M384 HydrophobicContact CB-SD 4.46Å; K360-M384 HydrophobicContact CD-SD 4.24Å; K360-M384 PolarHBondContact O-N 2.76Å; G382-M384 WeakPolarHBondContact O-CG 3.46Å; G382-M384 PolarHBondContact O-N 2.91Å; M384-S405 VanDerWaalsContact CA-O 3.32Å; M384-S405 WeakPolarHBondContact CA-O 3.03Å; M384-S405 WeakPolarHBondContact CB-O 3.43Å; M384-S405 WeakPolarHBondContact CE-O 3.29Å; M384-L407 HydrophobicContact CB-CG 4.4Å; M384-L407 WeakPolarHBondContact O-CB 3.26Å; M384-L407 PolarHBondContact O-N 2.92Å; M384-F544 HydrophobicContact CE-CD1 4.32Å
385	S	92.5	Very high	92.9	Very high	24 Å²	24	39 Å²	39	17%	0.168	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	140.9	179.7	45.8	0	0	0	0	112	K360 S361 I362 K458	K360-S385 PolarHBondContact O-N 3.02Å; S361-S385 CarbonylContact C-O 3.59Å; S361-S385 WeakPolarHBondContact CA-O 3.14Å; S361-S385 PolarHBondContact OG-OG 3.38Å; I362-S385 PolarHBondContact N-O 3.36Å; S385-K458 PolarHBondContact OG-NZ 3.24Å
386	I	94.3	Very high	92.7	Very high	6 Å²	6	37.2 Å²	37.2	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	122.4	179.2	-51.2	179.6	0	0	0	108.5	I362 I383 L391 L401 W414 L415	I362-I386 HydrophobicContact CB-CG2 4.11Å; I362-I386 HydrophobicContact CD1-CD1 4.34Å; I362-I386 HydrophobicContact CD1-CG1 4.17Å; I362-I386 HydrophobicContact CD1-CG2 4.34Å; I362-I386 HydrophobicContact CG1-CG1 4.45Å; I362-I386 HydrophobicContact CG2-CG2 4.41Å; I383-I386 HydrophobicContact CG2-CD1 3.9Å; I383-I386 HydrophobicContact CG2-CG1 3.58Å; I386-L391 HydrophobicContact CG2-CD1 4.41Å; I386-L401 HydrophobicContact CD1-CD2 3.78Å; I386-W414 HydrophobicContact CB-CZ2 3.98Å; I386-W414 HydrophobicContact CG2-CH2 3.82Å; I386-W414 HydrophobicContact CG2-CZ2 3.65Å; I386-W414 WeakPolarHBondContact O-CZ2 3Å; I386-L415 HydrophobicContact CD1-CD2 4.42Å
387	H	92.9	Very high	92.6	Very high	66 Å²	66	43.7 Å²	43.7	31%	0.306	22%	0.224	S	C	.	.			trans	-76.3	136.1	177.5	-171.1	-73.4	0	0	0	111.1	I362 D389 S390	I362-H387 WeakPolarHBondContact O-CB 3.39Å; I362-H387 PolarHBondContact O-N 3.16Å; H387-D389 IonicContact CE1-OD2 2.96Å; H387-D389 PolarHBondContact CE1-OD2 3.28Å; H387-D389 PolarHBondContact ND1-N 3.2Å; H387-D389 VanDerWaalsContact ND1-N 3.17Å; H387-D389 PolarHBondContact O-N 3.39Å; H387-S390 VanDerWaalsContact O-CB 3.25Å; H387-S390 WeakPolarHBondContact O-CB 3.39Å; H387-S390 PolarHBondContact O-N 3.02Å; H387-S390 PolarHBondContact O-OG 3.13Å
388	P	89.5	Confident	92.5	Very high	40 Å²	40	45.7 Å²	45.7	26%	0.26	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-54	-50.5	-177.7	16.8	-30.1	0	0	0	113.6	S390 L391 W414	P388-S390 PolarHBondContact O-N 3.43Å; P388-L391 PolarHBondContact O-N 3.3Å; P388-W414 VanDerWaalsContact CA-CE2 3.47Å; P388-W414 HydrophobicContact CB-CB 4.49Å; P388-W414 HydrophobicContact CB-CD2 3.84Å; P388-W414 HydrophobicContact CB-CG 3.77Å
389	D	89.9	Confident	92.5	Very high	52 Å²	52	45.7 Å²	45.7	28%	0.278	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-64.7	-10.1	179.7	-60	-25.3	0	0	0	114.7	K364 H387 L391 S392 H393	K364-D389 HydrophobicContact CD-CB 3.84Å; K364-D389 WeakPolarHBondContact CD-OD2 3.43Å; K364-D389 VanDerWaalsContact CE-OD2 3.22Å; K364-D389 WeakPolarHBondContact CE-OD2 3.15Å; K364-D389 HydrophobicContact CG-CB 3.81Å; K364-D389 IonicContact NZ-OD2 3.19Å; K364-D389 PolarHBondContact NZ-OD2 3.44Å; H387-D389 IonicContact CE1-OD2 2.96Å; H387-D389 PolarHBondContact CE1-OD2 3.28Å; H387-D389 PolarHBondContact ND1-N 3.2Å; H387-D389 VanDerWaalsContact ND1-N 3.17Å; H387-D389 PolarHBondContact O-N 3.39Å; D389-L391 VanDerWaalsContact C-N 3.3Å; D389-L391 PolarHBondContact O-N 2.84Å; D389-S392 WeakPolarHBondContact CA-OG 3.38Å; D389-H393 PolarHBondContact O-CD2 2.85Å; D389-H393 VanDerWaalsContact O-CD2 3.25Å
390	S	91.2	Very high	92.6	Very high	5 Å²	5	46.9 Å²	46.9	4%	0.035	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-70.7	-25.5	179.9	70.9	0	0	0	0	113.3	I362 T363 H387 P388 M394	I362-S390 WeakPolarHBondContact CG2-OG 3.43Å; T363-S390 WeakPolarHBondContact O-CB 3.35Å; H387-S390 VanDerWaalsContact O-CB 3.25Å; H387-S390 WeakPolarHBondContact O-CB 3.39Å; H387-S390 PolarHBondContact O-N 3.02Å; H387-S390 PolarHBondContact O-OG 3.13Å; P388-S390 PolarHBondContact O-N 3.43Å; S390-M394 VanDerWaalsContact O-CE 3.31Å; S390-M394 WeakPolarHBondContact O-CE 3.37Å
391	L	90.9	Very high	92.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-20.9	-179.2	-57	-175.4	0	0	0	113.4	F367 L376 I386 P388 D389 H393 M394 F399 W414 W418	F367-L391 HydrophobicContact CD2-CD2 4.01Å; F367-L391 HydrophobicContact CE2-CD2 3.99Å; L376-L391 HydrophobicContact CD2-CD2 3.94Å; I386-L391 HydrophobicContact CG2-CD1 4.41Å; P388-L391 PolarHBondContact O-N 3.3Å; D389-L391 VanDerWaalsContact C-N 3.3Å; D389-L391 PolarHBondContact O-N 2.84Å; L391-H393 PolarHBondContact O-N 3.42Å; L391-H393 VanDerWaalsContact O-N 3.15Å; L391-M394 HydrophobicContact CD2-CE 3.68Å; L391-M394 PolarHBondContact O-N 2.79Å; L391-M394 VanDerWaalsContact O-N 3.13Å; L391-F399 HydrophobicContact CD1-CE2 3.8Å; L391-F399 HydrophobicContact CD1-CZ 3.72Å; L391-F399 HydrophobicContact CD2-CE2 4.43Å; L391-W414 HydrophobicContact CD1-CH2 4.09Å; L391-W414 HydrophobicContact CG-CH2 4.5Å; L391-W418 HydrophobicContact CB-CH2 4.2Å; L391-W418 HydrophobicContact CB-CZ2 3.89Å; L391-W418 HydrophobicContact CD1-CH2 3.57Å; L391-W418 HydrophobicContact CD1-CZ2 4.13Å; L391-W418 HydrophobicContact CD1-CZ3 3.86Å
392	S	85.4	Confident	92.5	Very high	67 Å²	67	45.3 Å²	45.3	47%	0.469	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-21.3	-172	67.5	0	0	0	0	114.9	D389	D389-S392 WeakPolarHBondContact CA-OG 3.38Å
393	H	86.8	Confident	92.6	Very high	130 Å²	130	44.1 Å²	44.1	60%	0.602	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-12.5	178.5	-61.5	-61.7	0	0	0	114.1	D389 L391	D389-H393 PolarHBondContact O-CD2 2.85Å; D389-H393 VanDerWaalsContact O-CD2 3.25Å; L391-H393 PolarHBondContact O-N 3.42Å; L391-H393 VanDerWaalsContact O-N 3.15Å
394	M	90.2	Very high	92.6	Very high	20 Å²	20	48.1 Å²	48.1	10%	0.099	26%	0.255	C	S	.	.			trans	-102.8	147.3	-174.8	-66.7	-177.4	-76.1	0	0	112.3	F367 L370 L373 L376 S390 L391 L396	F367-M394 HydrophobicContact CB-CE 3.63Å; F367-M394 HydrophobicContact CB-SD 3.93Å; F367-M394 HydrophobicContact CD2-CE 3.68Å; F367-M394 HydrophobicContact CG-CE 3.86Å; F367-M394 HydrophobicContact CG-SD 4.48Å; L370-M394 HydrophobicContact CB-SD 4.07Å; L370-M394 WeakPolarHBondContact O-CG 3.29Å; L373-M394 HydrophobicContact CB-CG 4.35Å; L373-M394 HydrophobicContact CB-SD 3.82Å; L373-M394 HydrophobicContact CD2-SD 3.57Å; L373-M394 VanDerWaalsContact CD2-SD 3.57Å; L373-M394 HydrophobicContact CG-SD 4.33Å; L376-M394 HydrophobicContact CD2-CE 4.33Å; S390-M394 VanDerWaalsContact O-CE 3.31Å; S390-M394 WeakPolarHBondContact O-CE 3.37Å; L391-M394 HydrophobicContact CD2-CE 3.68Å; L391-M394 PolarHBondContact O-N 2.79Å; L391-M394 VanDerWaalsContact O-N 3.13Å; M394-L396 HydrophobicContact CB-CD2 4.4Å; M394-L396 HydrophobicContact CB-CG 4.09Å; M394-L396 PolarHBondContact O-N 2.84Å
395	K	89	Confident	92.6	Very high	173 Å²	173	49.2 Å²	49.2	75%	0.752	26%	0.263	S	S	*	.			trans	-102.8	57.1	-179.9	-67.4	179.8	-177.4	171	0	111.2	L373 K397	L373-K395 CarbonylContact O-C 3.59Å; K395-K397 PolarHBondContact O-N 3.44Å
396	L	94.5	Very high	92.8	Very high	18 Å²	18	48 Å²	48	9%	0.094	26%	0.255	C	S	.	.			trans	-58.2	131.3	-178.2	-62.8	174.4	0	0	0	111.3	L373 L376 M394 F399 W418 F424	L373-L396 HydrophobicContact CB-CD2 4.45Å; L373-L396 HydrophobicContact CD2-CD2 4.12Å; L373-L396 HydrophobicContact CG-CD2 4.24Å; L376-L396 HydrophobicContact CB-CD1 4.39Å; L376-L396 HydrophobicContact CB-CD2 3.76Å; L376-L396 HydrophobicContact CD2-CD1 4.29Å; M394-L396 HydrophobicContact CB-CD2 4.4Å; M394-L396 HydrophobicContact CB-CG 4.09Å; M394-L396 PolarHBondContact O-N 2.84Å; L396-F399 HydrophobicContact CD1-CB 4.26Å; L396-F399 HydrophobicContact CD1-CD2 3.78Å; L396-F399 HydrophobicContact CD1-CG 4.3Å; L396-W418 HydrophobicContact CD1-CH2 4.21Å; L396-W418 HydrophobicContact CD1-CZ2 4.44Å; L396-F424 HydrophobicContact CB-CE2 4.44Å; L396-F424 HydrophobicContact CB-CZ 3.81Å; L396-F424 WeakPolarHBondContact O-CZ 3.18Å
397	K	94.8	Very high	92.7	Very high	136 Å²	136	48 Å²	48	59%	0.591	26%	0.255	S	S	*	.	S	Bend	trans	-102.5	-28.8	168.3	-60.8	176.4	-172.1	162.8	0	111.2	E374 K395	E374-K397 HydrophobicContact CB-CD 4.17Å; E374-K397 HydrophobicContact CB-CG 4.23Å; E374-K397 HydrophobicContact CG-CD 4.45Å; E374-K397 PolarHBondContact O-N 2.75Å; E374-K397 WeakPolarHBondContact OE1-CE 3.22Å; E374-K397 IonicContact OE1-NZ 2.62Å; E374-K397 PolarHBondContact OE1-NZ 2.74Å; E374-K397 WeakPolarHBondContact OE2-CE 3.48Å; E374-K397 IonicContact OE2-NZ 2.79Å; E374-K397 PolarHBondContact OE2-NZ 2.75Å; K395-K397 PolarHBondContact O-N 3.44Å
398	V	95.9	Very high	92.8	Very high	56 Å²	56	45 Å²	45	34%	0.339	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	116.6	176.3	-178.5	0	0	0	0	108.2	E374 H375 L376 V400	E374-V398 PolarHBondContact O-N 3.1Å; H375-V398 WeakPolarHBondContact CA-O 3.41Å; H375-V398 HydrophobicContact CB-CB 4.25Å; L376-V398 PolarHBondContact N-O 2.87Å; V398-V400 HydrophobicContact CG1-CG2 3.87Å
399	F	96.8	Very high	93	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	119.6	171.9	-179.7	-112.6	0	0	0	108.4	L376 L378 L391 L396 L401 W418 L419 F424 S427 V428	L376-F399 HydrophobicContact CB-CD2 4.28Å; L376-F399 HydrophobicContact CD2-CD2 4.19Å; L376-F399 HydrophobicContact CD2-CE2 4.05Å; L376-F399 HydrophobicContact CG-CD2 4.29Å; L376-F399 HydrophobicContact CG-CE2 4.39Å; L376-F399 WeakPolarHBondContact O-CA 3.31Å; L378-F399 HydrophobicContact CD1-CE2 3.99Å; L391-F399 HydrophobicContact CD1-CE2 3.8Å; L391-F399 HydrophobicContact CD1-CZ 3.72Å; L391-F399 HydrophobicContact CD2-CE2 4.43Å; L396-F399 HydrophobicContact CD1-CB 4.26Å; L396-F399 HydrophobicContact CD1-CD2 3.78Å; L396-F399 HydrophobicContact CD1-CG 4.3Å; F399-L401 HydrophobicContact CD1-CB 4.48Å; F399-L401 HydrophobicContact CE1-CB 3.77Å; F399-L401 HydrophobicContact CE1-CD2 3.93Å; F399-L401 HydrophobicContact CZ-CB 3.95Å; F399-L401 HydrophobicContact CZ-CD2 3.91Å; F399-W418 HydrophobicContact CD1-CH2 4.08Å; F399-W418 AromaticContact CD1-CZ3 3.83Å; F399-W418 HydrophobicContact CD1-CZ3 3.83Å; F399-W418 HydrophobicContact CD2-CH2 4.45Å; F399-W418 HydrophobicContact CE1-CH2 4.26Å; F399-W418 AromaticContact CE1-CZ3 3.8Å; F399-W418 HydrophobicContact CE1-CZ3 3.8Å; F399-W418 HydrophobicContact CG-CH2 4.18Å; F399-W418 HydrophobicContact CG-CZ3 4.4Å; F399-W418 HydrophobicContact CZ-CZ3 4.31Å; F399-L419 HydrophobicContact CD1-CD2 3.99Å; F399-L419 HydrophobicContact CE1-CD2 3.96Å; F399-F424 HydrophobicContact CB-CD1 3.85Å; F399-F424 HydrophobicContact CB-CD2 3.75Å; F399-F424 HydrophobicContact CB-CE1 3.89Å; F399-F424 HydrophobicContact CB-CE2 3.77Å; F399-F424 HydrophobicContact CB-CG 3.8Å; F399-F424 HydrophobicContact CB-CZ 3.85Å; F399-F424 HydrophobicContact CD1-CB 4.49Å; F399-F424 HydrophobicContact CD1-CD2 4.03Å; F399-F424 HydrophobicContact CD1-CG 4.35Å; F399-F424 HydrophobicContact CG-CD2 4.25Å; F399-F424 HydrophobicContact CG-CE2 4.41Å; F399-S427 VanDerWaalsContact O-CB 3.3Å; F399-S427 WeakPolarHBondContact O-CB 3.47Å; F399-S427 PolarHBondContact O-OG 2.94Å; F399-V428 HydrophobicContact CD1-CG2 3.7Å; F399-V428 HydrophobicContact CE1-CG2 4.11Å
400	V	97.4	Very high	93.2	Very high	35 Å²	35	43.4 Å²	43.4	21%	0.212	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	119.3	-178.4	-164.4	0	0	0	0	108.7	L376 D377 L378 S379 V398	L376-V400 PolarHBondContact O-N 3.4Å; D377-V400 HydrophobicContact CB-CB 4.12Å; D377-V400 HydrophobicContact CB-CG2 4.36Å; L378-V400 PolarHBondContact N-O 2.83Å; S379-V400 PolarHBondContact N-O 2.88Å; V398-V400 HydrophobicContact CG1-CG2 3.87Å
401	L	95.7	Very high	93.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	120.3	-178.4	173.7	63.6	0	0	0	109	L378 I383 I386 F399 T403 S427 V428 S429 V430	L378-L401 HydrophobicContact CB-CD1 4.19Å; I383-L401 HydrophobicContact CD1-CD1 3.63Å; I386-L401 HydrophobicContact CD1-CD2 3.78Å; F399-L401 HydrophobicContact CD1-CB 4.48Å; F399-L401 HydrophobicContact CE1-CB 3.77Å; F399-L401 HydrophobicContact CE1-CD2 3.93Å; F399-L401 HydrophobicContact CZ-CB 3.95Å; F399-L401 HydrophobicContact CZ-CD2 3.91Å; L401-T403 HydrophobicContact CD1-CG2 3.95Å; L401-T403 HydrophobicContact CG-CG2 4.17Å; L401-S427 PolarHBondContact N-O 3.13Å; L401-V428 HydrophobicContact CB-CG1 4.15Å; L401-V428 HydrophobicContact CB-CG2 4.23Å; L401-V428 CarbonylContact O-C 3.53Å; L401-V428 VanDerWaalsContact O-CA 3.26Å; L401-V428 WeakPolarHBondContact O-CA 3.46Å; L401-S429 PolarHBondContact O-N 2.85Å; L401-V430 HydrophobicContact CD2-CG1 3.6Å; L401-V430 HydrophobicContact CG-CG1 3.93Å
402	N	93.7	Very high	93.3	Very high	82 Å²	82	48.7 Å²	48.7	44%	0.439	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	109.2	172.4	-170.6	6	0	0	0	108.9	K380 S429	K380-N402 PolarHBondContact N-O 3.31Å; N402-S429 VanDerWaalsContact CA-O 3.29Å; N402-S429 WeakPolarHBondContact CA-O 3.32Å; N402-S429 VanDerWaalsContact OD1-CB 3.3Å; N402-S429 WeakPolarHBondContact OD1-CB 3.48Å; N402-S429 PolarHBondContact OD1-O 3.41Å; N402-S429 PolarHBondContact OD1-OG 3.06Å
403	T	94.3	Very high	93.7	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	143.4	179.3	172.9	0	0	0	0	110.4	I383 L401 S405 L406 S429 V430 M431	I383-T403 HydrophobicContact CB-CG2 4.42Å; I383-T403 PolarHBondContact O-OG1 2.93Å; L401-T403 HydrophobicContact CD1-CG2 3.95Å; L401-T403 HydrophobicContact CG-CG2 4.17Å; T403-S405 PolarHBondContact OG1-N 3.29Å; T403-S405 VanDerWaalsContact OG1-N 3.09Å; T403-L406 HydrophobicContact CG2-CD1 3.84Å; T403-L406 HydrophobicContact CG2-CD2 4.12Å; T403-L406 HydrophobicContact CG2-CG 3.79Å; T403-S429 PolarHBondContact N-O 2.62Å; T403-V430 HydrophobicContact CG2-CG1 4.1Å; T403-M431 PolarHBondContact O-N 2.8Å
404	S	94.9	Very high	94.1	Very high	84 Å²	84	45.4 Å²	45.4	59%	0.587	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	32.1	170	68.2	0	0	0	0	111.6	M431	S404-M431 CarbonylContact C-O 3.34Å
405	S	94.8	Very high	94.4	Very high	34 Å²	34	44.4 Å²	44.4	24%	0.238	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	8.2	-171.5	-57.6	0	0	0	0	113.5	M384 T403	M384-S405 VanDerWaalsContact CA-O 3.32Å; M384-S405 WeakPolarHBondContact CA-O 3.03Å; M384-S405 WeakPolarHBondContact CB-O 3.43Å; M384-S405 WeakPolarHBondContact CE-O 3.29Å; T403-S405 PolarHBondContact OG1-N 3.29Å; T403-S405 VanDerWaalsContact OG1-N 3.09Å
406	L	95.1	Very high	94.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	138.2	-168.4	-69.9	167.2	0	0	0	113.8	I383 T403 C408 L412 V430 M431 A433 H434 V443	I383-L406 HydrophobicContact CG2-CD2 4.28Å; I383-L406 WeakPolarHBondContact O-CD2 3.27Å; T403-L406 HydrophobicContact CG2-CD1 3.84Å; T403-L406 HydrophobicContact CG2-CD2 4.12Å; T403-L406 HydrophobicContact CG2-CG 3.79Å; L406-C408 PolarHBondContact O-N 3.39Å; L406-L412 HydrophobicContact CB-CD2 4.25Å; L406-L412 HydrophobicContact CD1-CD2 4.32Å; L406-V430 HydrophobicContact CD1-CB 3.63Å; L406-V430 HydrophobicContact CD1-CG1 3.84Å; L406-M431 PolarHBondContact N-O 2.78Å; L406-A433 PolarHBondContact O-N 3.08Å; L406-H434 PolarHBondContact O-N 2.89Å; L406-V443 HydrophobicContact CD1-CG2 3.79Å
407	L	94	Very high	94.6	Very high	6 Å²	6	38.3 Å²	38.3	3%	0.031	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	103.4	160.9	-58.4	179.1	0	0	0	107.5	M384 D409 H434 P457 K458 F544	M384-L407 HydrophobicContact CB-CG 4.4Å; M384-L407 WeakPolarHBondContact O-CB 3.26Å; M384-L407 PolarHBondContact O-N 2.92Å; L407-D409 PolarHBondContact O-N 2.99Å; L407-D409 VanDerWaalsContact O-N 3.14Å; L407-H434 HydrophobicContact CD2-CB 3.76Å; L407-P457 HydrophobicContact CD1-CG 4.42Å; L407-P457 HydrophobicContact CD2-CG 3.85Å; L407-K458 HydrophobicContact CD1-CB 4.1Å; L407-F544 HydrophobicContact CD2-CB 4.35Å; L407-F544 HydrophobicContact CD2-CD1 3.64Å; L407-F544 HydrophobicContact CD2-CE1 4.32Å; L407-F544 HydrophobicContact CD2-CG 4.33Å
408	C	94.9	Very high	94.6	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.007	19%	0.188	C	C	.	.			trans	-88.4	62.8	176.6	-70.2	0	0	0	0	110.1	L406 L412 C432 H434 P435 L438 L451	L406-C408 PolarHBondContact O-N 3.39Å; C408-L412 HydrophobicContact CB-CD2 4.48Å; C408-C432 HydrophobicContact CB-CB 3.77Å; C408-C432 WeakPolarHBondContact CB-SG 3.47Å; C408-C432 WeakPolarHBondContact SG-CA 3.39Å; C408-C432 WeakPolarHBondContact SG-CB 3.32Å; C408-C432 CovalentContact SG-SG 2.03Å; C408-C432 PolarHBondContact SG-SG 2.94Å; C408-H434 WeakPolarHBondContact CB-O 3.38Å; C408-H434 PolarHBondContact N-O 3.4Å; C408-P435 WeakPolarHBondContact O-CD 3.47Å; C408-L438 HydrophobicContact CB-CD1 3.85Å; C408-L451 HydrophobicContact CB-CD2 3.7Å; C408-L451 VanDerWaalsContact O-CD2 3.27Å; C408-L451 WeakPolarHBondContact O-CD2 3.46Å
409	D	93.4	Very high	94.6	Very high	23 Å²	23	31.1 Å²	31.1	12%	0.123	17%	0.172	C	C	.	.	S	Bend	trans	-96.1	-176.3	172.1	65	42.5	0	0	0	111.1	L407 Q411 L412 V452	L407-D409 PolarHBondContact O-N 2.99Å; L407-D409 VanDerWaalsContact O-N 3.14Å; D409-Q411 PolarHBondContact O-N 3.13Å; D409-Q411 WeakPolarHBondContact OD1-CA 3.11Å; D409-Q411 WeakPolarHBondContact OD1-CB 3.47Å; D409-Q411 WeakPolarHBondContact OD1-CG 3.23Å; D409-Q411 PolarHBondContact OD1-N 2.66Å; D409-L412 PolarHBondContact O-N 3.15Å; D409-V452 CarbonylContact C-O 3.52Å; D409-V452 WeakPolarHBondContact CA-O 3.49Å; D409-V452 WeakPolarHBondContact CB-O 3.44Å
410	C	92.6	Very high	94.4	Very high	37 Å²	37	33.8 Å²	33.8	25%	0.25	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-62.8	-21.7	-179.9	82	0	0	0	0	114.6	L412 Q413 L451 V452 C453	C410-L412 PolarHBondContact O-N 3.41Å; C410-Q413 WeakPolarHBondContact O-CB 3.48Å; C410-Q413 WeakPolarHBondContact O-CG 3.32Å; C410-Q413 PolarHBondContact O-N 3.14Å; C410-L451 VanDerWaalsContact CA-O 3.25Å; C410-L451 WeakPolarHBondContact CA-O 3.3Å; C410-L451 VanDerWaalsContact CB-O 3.26Å; C410-L451 WeakPolarHBondContact CB-O 3.29Å; C410-V452 PolarHBondContact N-O 2.82Å; C410-C453 WeakPolarHBondContact CA-SG 3.43Å; C410-C453 HydrophobicContact CB-CB 3.96Å; C410-C453 WeakPolarHBondContact CB-SG 3.4Å; C410-C453 PolarHBondContact N-SG 3.19Å; C410-C453 WeakPolarHBondContact SG-CB 3.49Å; C410-C453 CovalentContact SG-SG 2.03Å; C410-C453 PolarHBondContact SG-SG 3.23Å
411	Q	91.9	Very high	94.3	Very high	112 Å²	112	37.8 Å²	37.8	52%	0.523	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-69.5	-14.8	174.6	-51.6	-60.6	-54.5	0	0	112.2	D409 W414	D409-Q411 PolarHBondContact O-N 3.13Å; D409-Q411 WeakPolarHBondContact OD1-CA 3.11Å; D409-Q411 WeakPolarHBondContact OD1-CB 3.47Å; D409-Q411 WeakPolarHBondContact OD1-CG 3.23Å; D409-Q411 PolarHBondContact OD1-N 2.66Å; Q411-W414 PolarHBondContact O-NE1 3.06Å
412	L	93.8	Very high	94.1	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.016	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-96.6	-3.4	179.1	-145	74	0	0	0	114	L406 C408 D409 C410 W414 L415 V443	L406-L412 HydrophobicContact CB-CD2 4.25Å; L406-L412 HydrophobicContact CD1-CD2 4.32Å; C408-L412 HydrophobicContact CB-CD2 4.48Å; D409-L412 PolarHBondContact O-N 3.15Å; C410-L412 PolarHBondContact O-N 3.41Å; L412-W414 PolarHBondContact O-N 3.18Å; L412-L415 HydrophobicContact CD1-CB 4.43Å; L412-L415 HydrophobicContact CD1-CD2 3.84Å; L412-L415 HydrophobicContact CD2-CD2 4.23Å; L412-L415 HydrophobicContact CG-CB 4.12Å; L412-L415 HydrophobicContact CG-CD2 3.96Å; L412-L415 WeakPolarHBondContact O-CB 3.27Å; L412-L415 PolarHBondContact O-N 2.84Å; L412-V443 HydrophobicContact CD2-CG1 4.04Å; L412-V443 HydrophobicContact CD2-CG2 3.86Å
413	Q	93.9	Very high	94.2	Very high	79 Å²	79	44.8 Å²	44.8	37%	0.369	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-32.3	-177.9	-78.6	178.2	6.3	0	0	114.5	C410 P417 L448 L451	C410-Q413 WeakPolarHBondContact O-CB 3.48Å; C410-Q413 WeakPolarHBondContact O-CG 3.32Å; C410-Q413 PolarHBondContact O-N 3.14Å; Q413-P417 VanDerWaalsContact O-CD 3.28Å; Q413-P417 WeakPolarHBondContact O-CD 3.47Å; Q413-L448 HydrophobicContact CB-CD2 4.14Å; Q413-L448 HydrophobicContact CG-CD2 4.34Å; Q413-L448 PolarHBondContact NE2-O 3.46Å; Q413-L448 VanDerWaalsContact O-CD2 3.3Å; Q413-L448 WeakPolarHBondContact O-CD2 3.14Å; Q413-L451 HydrophobicContact CB-CD1 4.44Å; Q413-L451 HydrophobicContact CG-CB 3.65Å; Q413-L451 HydrophobicContact CG-CD1 3.97Å; Q413-L451 HydrophobicContact CG-CG 4.47Å; Q413-L451 PolarHBondContact NE2-O 3.25Å
414	W	94.8	Very high	94.2	Very high	49 Å²	49	45 Å²	45	19%	0.186	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-25.8	-180	67.2	-84.8	0	0	0	113.8	I386 P388 L391 Q411 L412 W418	I386-W414 HydrophobicContact CB-CZ2 3.98Å; I386-W414 HydrophobicContact CG2-CH2 3.82Å; I386-W414 HydrophobicContact CG2-CZ2 3.65Å; I386-W414 WeakPolarHBondContact O-CZ2 3Å; P388-W414 VanDerWaalsContact CA-CE2 3.47Å; P388-W414 HydrophobicContact CB-CB 4.49Å; P388-W414 HydrophobicContact CB-CD2 3.84Å; P388-W414 HydrophobicContact CB-CG 3.77Å; L391-W414 HydrophobicContact CD1-CH2 4.09Å; L391-W414 HydrophobicContact CG-CH2 4.5Å; Q411-W414 PolarHBondContact O-NE1 3.06Å; L412-W414 PolarHBondContact O-N 3.18Å; W414-W418 HydrophobicContact CE3-CB 3.86Å; W414-W418 HydrophobicContact CE3-CD2 4.45Å; W414-W418 HydrophobicContact CE3-CG 4.03Å; W414-W418 HydrophobicContact CZ3-CB 4.17Å; W414-W418 AromaticContact CZ3-CD2 3.88Å; W414-W418 HydrophobicContact CZ3-CD2 3.88Å; W414-W418 HydrophobicContact CZ3-CE3 4.04Å; W414-W418 AromaticContact CZ3-CG 3.94Å; W414-W418 HydrophobicContact CZ3-CG 3.94Å; W414-W418 WeakPolarHBondContact O-CB 3.45Å; W414-W418 PolarHBondContact O-N 3.44Å
415	L	95.4	Very high	94.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-71.8	-43.6	-164.8	-178.7	63.2	0	0	0	112.4	I386 L412 W418 L419	I386-L415 HydrophobicContact CD1-CD2 4.42Å; L412-L415 HydrophobicContact CD1-CB 4.43Å; L412-L415 HydrophobicContact CD1-CD2 3.84Å; L412-L415 HydrophobicContact CD2-CD2 4.23Å; L412-L415 HydrophobicContact CG-CB 4.12Å; L412-L415 HydrophobicContact CG-CD2 3.96Å; L412-L415 WeakPolarHBondContact O-CB 3.27Å; L412-L415 PolarHBondContact O-N 2.84Å; L415-W418 HydrophobicContact CD1-CE3 4.17Å; L415-W418 PolarHBondContact O-N 3.38Å; L415-L419 HydrophobicContact CD1-CD1 4.03Å; L415-L419 HydrophobicContact CD1-CD2 4.49Å; L415-L419 HydrophobicContact CD1-CG 3.98Å; L415-L419 HydrophobicContact CG-CD1 3.9Å; L415-L419 HydrophobicContact CG-CG 4.3Å; L415-L419 WeakPolarHBondContact O-CB 3.46Å; L415-L419 WeakPolarHBondContact O-CG 3.28Å; L415-L419 PolarHBondContact O-N 3.08Å
416	G	94.4	Very high	93.8	Very high	8 Å²	8	53 Å²	53	8%	0.082	27%	0.268	C	S	.	.	H	α-helix	trans	-59.4	-52	178.2	0	0	0	0	0	113.3	T420	G416-T420 PolarHBondContact O-N 3.31Å; G416-T420 PolarHBondContact O-OG1 3.04Å
417	P	94.7	Very high	93.6	Very high	54 Å²	54	55.2 Å²	55.2	35%	0.351	28%	0.283	S	S	.	.	H	α-helix	trans	-57.1	-51.3	170.7	-26.8	35.7	0	0	0	112.7	Q413 L419 T420 D421 L448	Q413-P417 VanDerWaalsContact O-CD 3.28Å; Q413-P417 WeakPolarHBondContact O-CD 3.47Å; P417-L419 VanDerWaalsContact C-N 3.34Å; P417-L419 PolarHBondContact O-N 3.13Å; P417-T420 WeakPolarHBondContact O-CA 3.25Å; P417-T420 WeakPolarHBondContact O-CB 3.46Å; P417-T420 PolarHBondContact O-N 3.46Å; P417-D421 PolarHBondContact O-N 2.91Å; P417-L448 HydrophobicContact CG-CD2 4.47Å
418	W	94.9	Very high	93.6	Very high	42 Å²	42	55.9 Å²	55.9	16%	0.159	29%	0.287	C	S	.	.	H	α-helix	trans	-59.2	-40.1	-177.3	179.7	89.4	0	0	0	113.3	L391 L396 F399 W414 L415 T420 N422 F424	L391-W418 HydrophobicContact CB-CH2 4.2Å; L391-W418 HydrophobicContact CB-CZ2 3.89Å; L391-W418 HydrophobicContact CD1-CH2 3.57Å; L391-W418 HydrophobicContact CD1-CZ2 4.13Å; L391-W418 HydrophobicContact CD1-CZ3 3.86Å; L396-W418 HydrophobicContact CD1-CH2 4.21Å; L396-W418 HydrophobicContact CD1-CZ2 4.44Å; F399-W418 HydrophobicContact CD1-CH2 4.08Å; F399-W418 AromaticContact CD1-CZ3 3.83Å; F399-W418 HydrophobicContact CD1-CZ3 3.83Å; F399-W418 HydrophobicContact CD2-CH2 4.45Å; F399-W418 HydrophobicContact CE1-CH2 4.26Å; F399-W418 AromaticContact CE1-CZ3 3.8Å; F399-W418 HydrophobicContact CE1-CZ3 3.8Å; F399-W418 HydrophobicContact CG-CH2 4.18Å; F399-W418 HydrophobicContact CG-CZ3 4.4Å; F399-W418 HydrophobicContact CZ-CZ3 4.31Å; W414-W418 HydrophobicContact CE3-CB 3.86Å; W414-W418 HydrophobicContact CE3-CD2 4.45Å; W414-W418 HydrophobicContact CE3-CG 4.03Å; W414-W418 HydrophobicContact CZ3-CB 4.17Å; W414-W418 AromaticContact CZ3-CD2 3.88Å; W414-W418 HydrophobicContact CZ3-CD2 3.88Å; W414-W418 HydrophobicContact CZ3-CE3 4.04Å; W414-W418 AromaticContact CZ3-CG 3.94Å; W414-W418 HydrophobicContact CZ3-CG 3.94Å; W414-W418 WeakPolarHBondContact O-CB 3.45Å; W414-W418 PolarHBondContact O-N 3.44Å; L415-W418 HydrophobicContact CD1-CE3 4.17Å; L415-W418 PolarHBondContact O-N 3.38Å; W418-T420 VanDerWaalsContact C-N 3.27Å; W418-T420 PolarHBondContact O-N 3.43Å; W418-N422 PolarHBondContact NE1-ND2 3.44Å; W418-N422 WeakPolarHBondContact O-CB 3.37Å; W418-N422 PolarHBondContact O-N 3.22Å; W418-N422 VanDerWaalsContact O-N 3.1Å; W418-N422 PolarHBondContact O-ND2 2.83Å; W418-F424 HydrophobicContact CE3-CD2 4.46Å; W418-F424 AromaticContact CH2-CD2 3.89Å; W418-F424 HydrophobicContact CH2-CD2 3.89Å; W418-F424 AromaticContact CH2-CE2 3.57Å; W418-F424 HydrophobicContact CH2-CE2 3.57Å; W418-F424 AromaticContact CZ2-CE2 3.94Å; W418-F424 HydrophobicContact CZ2-CE2 3.94Å; W418-F424 AromaticContact CZ3-CD2 3.84Å; W418-F424 HydrophobicContact CZ3-CD2 3.84Å; W418-F424 HydrophobicContact CZ3-CE2 4.01Å
419	L	94.9	Very high	93.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-31.2	174.2	-74.1	172.5	0	0	0	113.1	F399 L415 P417 H423 F424 L425 V428 V430 V444	F399-L419 HydrophobicContact CD1-CD2 3.99Å; F399-L419 HydrophobicContact CE1-CD2 3.96Å; L415-L419 HydrophobicContact CD1-CD1 4.03Å; L415-L419 HydrophobicContact CD1-CD2 4.49Å; L415-L419 HydrophobicContact CD1-CG 3.98Å; L415-L419 HydrophobicContact CG-CD1 3.9Å; L415-L419 HydrophobicContact CG-CG 4.3Å; L415-L419 WeakPolarHBondContact O-CB 3.46Å; L415-L419 WeakPolarHBondContact O-CG 3.28Å; L415-L419 PolarHBondContact O-N 3.08Å; P417-L419 VanDerWaalsContact C-N 3.34Å; P417-L419 PolarHBondContact O-N 3.13Å; L419-H423 PolarHBondContact O-N 3.33Å; L419-F424 HydrophobicContact CD2-CB 3.96Å; L419-F424 HydrophobicContact CD2-CD2 4.32Å; L419-F424 PolarHBondContact O-N 2.93Å; L419-L425 HydrophobicContact CB-CD2 4.07Å; L419-V428 HydrophobicContact CD1-CG1 3.89Å; L419-V428 HydrophobicContact CD2-CB 4.18Å; L419-V428 HydrophobicContact CD2-CG1 3.88Å; L419-V428 HydrophobicContact CD2-CG2 3.89Å; L419-V430 HydrophobicContact CD1-CG2 3.79Å; L419-V444 HydrophobicContact CD1-CG2 4.34Å
420	T	93.7	Very high	93.6	Very high	56 Å²	56	56.8 Å²	56.8	34%	0.344	30%	0.295	S	S	.	.	H	α-helix	trans	-78.3	-48.8	179.9	-56.1	0	0	0	0	110.8	G416 P417 W418 N422 H423 L425	G416-T420 PolarHBondContact O-N 3.31Å; G416-T420 PolarHBondContact O-OG1 3.04Å; P417-T420 WeakPolarHBondContact O-CA 3.25Å; P417-T420 WeakPolarHBondContact O-CB 3.46Å; P417-T420 PolarHBondContact O-N 3.46Å; W418-T420 VanDerWaalsContact C-N 3.27Å; W418-T420 PolarHBondContact O-N 3.43Å; T420-N422 VanDerWaalsContact C-N 3.32Å; T420-N422 PolarHBondContact O-N 2.95Å; T420-H423 PolarHBondContact O-N 2.91Å; T420-H423 PolarHBondContact O-ND1 2.03Å; T420-L425 HydrophobicContact CG2-CD1 4.27Å
421	D	94	Very high	93.8	Very high	118 Å²	118	58.1 Å²	58.1	63%	0.631	30%	0.299	S	S	*	.	H	α-helix	trans	-64.1	-35.3	-178.7	-66.5	-23.5	0	0	0	112.3	P417	P417-D421 PolarHBondContact O-N 2.91Å
422	N	93.1	Very high	94	Very high	72 Å²	72	52.9 Å²	52.9	39%	0.385	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	7	174.8	-62.1	-87.8	0	0	0	113.5	W418 T420 F424	W418-N422 PolarHBondContact NE1-ND2 3.44Å; W418-N422 WeakPolarHBondContact O-CB 3.37Å; W418-N422 PolarHBondContact O-N 3.22Å; W418-N422 VanDerWaalsContact O-N 3.1Å; W418-N422 PolarHBondContact O-ND2 2.83Å; T420-N422 VanDerWaalsContact C-N 3.32Å; T420-N422 PolarHBondContact O-N 2.95Å; N422-F424 VanDerWaalsContact C-N 3.28Å; N422-F424 HydrophobicContact CB-CD2 3.66Å; N422-F424 HydrophobicContact CB-CE2 3.33Å; N422-F424 HydrophobicContact CB-CG 4.38Å; N422-F424 HydrophobicContact CB-CZ 3.8Å; N422-F424 PolarHBondContact O-N 2.85Å
423	H	94.5	Very high	94	Very high	158 Å²	158	54.3 Å²	54.3	73%	0.731	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	21.8	173.9	-53.8	-20.4	0	0	0	116.5	L419 T420 L425	L419-H423 PolarHBondContact O-N 3.33Å; T420-H423 PolarHBondContact O-N 2.91Å; T420-H423 PolarHBondContact O-ND1 2.03Å; H423-L425 PolarHBondContact O-N 2.79Å; H423-L425 VanDerWaalsContact O-N 3.15Å
424	F	95.4	Very high	93.9	Very high	10 Å²	10	52.1 Å²	52.1	4%	0.044	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-75.9	3.7	-178.3	-59.9	-45	0	0	0	115	L396 F399 W418 L419 N422 Q426 S427 V428	L396-F424 HydrophobicContact CB-CE2 4.44Å; L396-F424 HydrophobicContact CB-CZ 3.81Å; L396-F424 WeakPolarHBondContact O-CZ 3.18Å; F399-F424 HydrophobicContact CB-CD1 3.85Å; F399-F424 HydrophobicContact CB-CD2 3.75Å; F399-F424 HydrophobicContact CB-CE1 3.89Å; F399-F424 HydrophobicContact CB-CE2 3.77Å; F399-F424 HydrophobicContact CB-CG 3.8Å; F399-F424 HydrophobicContact CB-CZ 3.85Å; F399-F424 HydrophobicContact CD1-CB 4.49Å; F399-F424 HydrophobicContact CD1-CD2 4.03Å; F399-F424 HydrophobicContact CD1-CG 4.35Å; F399-F424 HydrophobicContact CG-CD2 4.25Å; F399-F424 HydrophobicContact CG-CE2 4.41Å; W418-F424 HydrophobicContact CE3-CD2 4.46Å; W418-F424 AromaticContact CH2-CD2 3.89Å; W418-F424 HydrophobicContact CH2-CD2 3.89Å; W418-F424 AromaticContact CH2-CE2 3.57Å; W418-F424 HydrophobicContact CH2-CE2 3.57Å; W418-F424 AromaticContact CZ2-CE2 3.94Å; W418-F424 HydrophobicContact CZ2-CE2 3.94Å; W418-F424 AromaticContact CZ3-CD2 3.84Å; W418-F424 HydrophobicContact CZ3-CD2 3.84Å; W418-F424 HydrophobicContact CZ3-CE2 4.01Å; L419-F424 HydrophobicContact CD2-CB 3.96Å; L419-F424 HydrophobicContact CD2-CD2 4.32Å; L419-F424 PolarHBondContact O-N 2.93Å; N422-F424 VanDerWaalsContact C-N 3.28Å; N422-F424 HydrophobicContact CB-CD2 3.66Å; N422-F424 HydrophobicContact CB-CE2 3.33Å; N422-F424 HydrophobicContact CB-CG 4.38Å; N422-F424 HydrophobicContact CB-CZ 3.8Å; N422-F424 PolarHBondContact O-N 2.85Å; F424-Q426 PolarHBondContact O-N 3.21Å; F424-S427 PolarHBondContact O-N 3.18Å; F424-S427 PolarHBondContact O-OG 3.25Å; F424-V428 HydrophobicContact CB-CG2 3.92Å; F424-V428 WeakPolarHBondContact O-CB 3.27Å; F424-V428 WeakPolarHBondContact O-CG2 2.99Å; F424-V428 PolarHBondContact O-N 3.42Å
425	L	91.3	Very high	93.8	Very high	87 Å²	87	51 Å²	51	46%	0.455	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-60.3	-11.6	-176.1	-58.4	-178.9	0	0	0	115.5	L419 T420 H423 V444	L419-L425 HydrophobicContact CB-CD2 4.07Å; T420-L425 HydrophobicContact CG2-CD1 4.27Å; H423-L425 PolarHBondContact O-N 2.79Å; H423-L425 VanDerWaalsContact O-N 3.15Å; L425-V444 HydrophobicContact CD2-CB 4.49Å; L425-V444 HydrophobicContact CD2-CG1 4.03Å; L425-V444 HydrophobicContact CD2-CG2 3.78Å
426	Q	89.8	Confident	93.6	Very high	199 Å²	199	55.1 Å²	55.1	93%	0.93	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-94.1	-24.1	174.8	-63.1	-172.7	8.3	0	0	113.8	F424	F424-Q426 PolarHBondContact O-N 3.21Å
427	S	90	Very high	93.5	Very high	46 Å²	46	59.3 Å²	59.3	32%	0.322	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	0	-178.5	52.7	0	0	0	0	113.2	F399 L401 F424	F399-S427 VanDerWaalsContact O-CB 3.3Å; F399-S427 WeakPolarHBondContact O-CB 3.47Å; F399-S427 PolarHBondContact O-OG 2.94Å; L401-S427 PolarHBondContact N-O 3.13Å; F424-S427 PolarHBondContact O-N 3.18Å; F424-S427 PolarHBondContact O-OG 3.25Å
428	V	93.8	Very high	93.6	Very high	19 Å²	19	56.8 Å²	56.8	12%	0.115	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	135.4	-172.6	177.8	0	0	0	0	112.2	F399 L401 L419 F424 V430	F399-V428 HydrophobicContact CD1-CG2 3.7Å; F399-V428 HydrophobicContact CE1-CG2 4.11Å; L401-V428 HydrophobicContact CB-CG1 4.15Å; L401-V428 HydrophobicContact CB-CG2 4.23Å; L401-V428 CarbonylContact O-C 3.53Å; L401-V428 VanDerWaalsContact O-CA 3.26Å; L401-V428 WeakPolarHBondContact O-CA 3.46Å; L419-V428 HydrophobicContact CD1-CG1 3.89Å; L419-V428 HydrophobicContact CD2-CB 4.18Å; L419-V428 HydrophobicContact CD2-CG1 3.88Å; L419-V428 HydrophobicContact CD2-CG2 3.89Å; F424-V428 HydrophobicContact CB-CG2 3.92Å; F424-V428 WeakPolarHBondContact O-CB 3.27Å; F424-V428 WeakPolarHBondContact O-CG2 2.99Å; F424-V428 PolarHBondContact O-N 3.42Å; V428-V430 HydrophobicContact CG1-CB 4.4Å; V428-V430 HydrophobicContact CG1-CG1 3.63Å; V428-V430 HydrophobicContact CG1-CG2 4.01Å
429	S	94.1	Very high	93.6	Very high	43 Å²	43	60.5 Å²	60.5	30%	0.301	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	102.3	175.5	164.2	0	0	0	0	108.5	L401 N402 T403	L401-S429 PolarHBondContact O-N 2.85Å; N402-S429 VanDerWaalsContact CA-O 3.29Å; N402-S429 WeakPolarHBondContact CA-O 3.32Å; N402-S429 VanDerWaalsContact OD1-CB 3.3Å; N402-S429 WeakPolarHBondContact OD1-CB 3.48Å; N402-S429 PolarHBondContact OD1-O 3.41Å; N402-S429 PolarHBondContact OD1-OG 3.06Å; T403-S429 PolarHBondContact N-O 2.62Å
430	V	95.1	Very high	93.6	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.006	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	108.3	-172.3	-77.9	0	0	0	0	110.5	L401 T403 L406 L419 V428 N442 V443	L401-V430 HydrophobicContact CD2-CG1 3.6Å; L401-V430 HydrophobicContact CG-CG1 3.93Å; T403-V430 HydrophobicContact CG2-CG1 4.1Å; L406-V430 HydrophobicContact CD1-CB 3.63Å; L406-V430 HydrophobicContact CD1-CG1 3.84Å; L419-V430 HydrophobicContact CD1-CG2 3.79Å; V428-V430 HydrophobicContact CG1-CB 4.4Å; V428-V430 HydrophobicContact CG1-CG1 3.63Å; V428-V430 HydrophobicContact CG1-CG2 4.01Å; V430-N442 VanDerWaalsContact O-CA 3.26Å; V430-N442 WeakPolarHBondContact O-CA 3.11Å; V430-V443 HydrophobicContact CB-CG2 3.97Å; V430-V443 HydrophobicContact CG2-CB 3.98Å; V430-V443 HydrophobicContact CG2-CG2 3.99Å; V430-V443 PolarHBondContact O-N 2.99Å
431	M	96.1	Very high	93.7	Very high	65 Å²	65	63.9 Å²	63.9	32%	0.32	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	140.2	178.3	-52.5	-62.7	-153	0	0	111.8	T403 S404 L406 R441 N442	T403-M431 PolarHBondContact O-N 2.8Å; S404-M431 CarbonylContact C-O 3.34Å; L406-M431 PolarHBondContact N-O 2.78Å; M431-R441 WeakPolarHBondContact CA-O 3.3Å; M431-N442 VanDerWaalsContact SD-CA 3.54Å; M431-N442 HydrophobicContact SD-CB 3.65Å
432	C	96	Very high	93.8	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.007	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	135.5	174	-57.5	0	0	0	0	111.4	C408 L438 G440 R441	C408-C432 HydrophobicContact CB-CB 3.77Å; C408-C432 WeakPolarHBondContact CB-SG 3.47Å; C408-C432 WeakPolarHBondContact SG-CA 3.39Å; C408-C432 WeakPolarHBondContact SG-CB 3.32Å; C408-C432 CovalentContact SG-SG 2.03Å; C408-C432 PolarHBondContact SG-SG 2.94Å; C432-L438 HydrophobicContact CB-CB 4.01Å; C432-L438 WeakPolarHBondContact CB-O 3.48Å; C432-G440 PolarHBondContact O-N 2.98Å; C432-R441 PolarHBondContact N-O 2.95Å
433	A	94.2	Very high	93.9	Very high	33 Å²	33	57.2 Å²	57.2	27%	0.273	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-29.7	167.3	0	0	0	0	0	112.2	L406	L406-A433 PolarHBondContact O-N 3.08Å
434	H	92.6	Very high	93.8	Very high	34 Å²	34	52.4 Å²	52.4	16%	0.157	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	151.8	178.7	-171.4	85.1	0	0	0	109.3	L406 L407 C408 D455 F544	L406-H434 PolarHBondContact O-N 2.89Å; L407-H434 HydrophobicContact CD2-CB 3.76Å; C408-H434 WeakPolarHBondContact CB-O 3.38Å; C408-H434 PolarHBondContact N-O 3.4Å; H434-D455 IonicContact CD2-OD2 2.71Å; H434-D455 IonicContact CE1-OD2 3.23Å; H434-D455 PolarHBondContact CE1-OD2 2.86Å; H434-D455 IonicContact NE2-OD1 2.88Å; H434-D455 PolarHBondContact NE2-OD1 3.41Å; H434-D455 IonicContact NE2-OD2 2.74Å; H434-D455 PolarHBondContact NE2-OD2 2.87Å; H434-F544 HydrophobicContact CB-CE1 4.09Å
435	P	92.6	Very high	93.7	Very high	26 Å²	26	55.2 Å²	55.2	17%	0.169	33%	0.331	C	S	.	.	S	Bend	cis	-62.2	161	-9.9	27.2	-36.2	0	0	0	113.2	C408 S437 L438 L439	C408-P435 WeakPolarHBondContact O-CD 3.47Å; P435-S437 PolarHBondContact O-N 3.25Å; P435-S437 VanDerWaalsContact O-N 3.08Å; P435-L438 HydrophobicContact CG-CB 4.41Å; P435-L438 HydrophobicContact CG-CD1 4.06Å; P435-L438 HydrophobicContact CG-CG 4.09Å; P435-L438 PolarHBondContact O-N 2.73Å; P435-L439 PolarHBondContact O-N 3.27Å
436	A	90.8	Very high	93.9	Very high	85 Å²	85	51.8 Å²	51.8	70%	0.702	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-21.8	-179.3	0	0	0	0	0	114.1	L438	A436-L438 VanDerWaalsContact C-N 3.3Å
437	S	93.1	Very high	94.1	Very high	96 Å²	96	44.6 Å²	44.6	67%	0.671	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-23.6	171.3	47.4	0	0	0	0	114.1	P435	P435-S437 PolarHBondContact O-N 3.25Å; P435-S437 VanDerWaalsContact O-N 3.08Å
438	L	95.3	Very high	94.2	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-4.3	-178.8	-62.6	-176.6	0	0	0	113.6	C408 C432 P435 A436 G440 R441 V446 E450 L451	C408-L438 HydrophobicContact CB-CD1 3.85Å; C432-L438 HydrophobicContact CB-CB 4.01Å; C432-L438 WeakPolarHBondContact CB-O 3.48Å; P435-L438 HydrophobicContact CG-CB 4.41Å; P435-L438 HydrophobicContact CG-CD1 4.06Å; P435-L438 HydrophobicContact CG-CG 4.09Å; P435-L438 PolarHBondContact O-N 2.73Å; A436-L438 VanDerWaalsContact C-N 3.3Å; L438-G440 PolarHBondContact O-N 2.86Å; L438-R441 VanDerWaalsContact CD2-NH1 3.32Å; L438-R441 VanDerWaalsContact O-CB 3.32Å; L438-R441 WeakPolarHBondContact O-CB 3.13Å; L438-R441 PolarHBondContact O-N 2.98Å; L438-V446 HydrophobicContact CD1-CG1 3.77Å; L438-V446 HydrophobicContact CD1-CG2 4.46Å; L438-V446 HydrophobicContact CD2-CG1 3.94Å; L438-V446 HydrophobicContact CD2-CG2 4.21Å; L438-E450 HydrophobicContact CD2-CB 4.31Å; L438-L451 HydrophobicContact CD1-CD2 4.07Å
439	L	95.3	Very high	94.2	Very high	119 Å²	119	52.9 Å²	52.9	62%	0.623	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.5	121.5	-176.8	176.1	61.2	0	0	0	112.9	P435 R441	P435-L439 PolarHBondContact O-N 3.27Å; L439-R441 VanDerWaalsContact C-N 3.3Å; L439-R441 PolarHBondContact O-N 3.07Å
440	G	95.3	Very high	94.2	Very high	48 Å²	48	54.2 Å²	54.2	50%	0.495	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	-3.2	178.5	0	0	0	0	0	115.7	C432 L438	C432-G440 PolarHBondContact O-N 2.98Å; L438-G440 PolarHBondContact O-N 2.86Å
441	R	96.4	Very high	94.1	Very high	80 Å²	80	54.4 Å²	54.4	30%	0.302	32%	0.323	S	S	.	.			trans	-75.8	146.9	170.8	-66.9	176	64.7	-176.4	-5.2	110.7	M431 C432 L438 L439 S445 V446 E450	M431-R441 WeakPolarHBondContact CA-O 3.3Å; C432-R441 PolarHBondContact N-O 2.95Å; L438-R441 VanDerWaalsContact CD2-NH1 3.32Å; L438-R441 VanDerWaalsContact O-CB 3.32Å; L438-R441 WeakPolarHBondContact O-CB 3.13Å; L438-R441 PolarHBondContact O-N 2.98Å; L439-R441 VanDerWaalsContact C-N 3.3Å; L439-R441 PolarHBondContact O-N 3.07Å; R441-S445 PolarHBondContact NH2-O 2.97Å; R441-V446 HydrophobicContact CB-CG2 4.08Å; R441-E450 IonicContact CZ-OE1 3.61Å; R441-E450 IonicContact CZ-OE2 3.54Å; R441-E450 VanDerWaalsContact NH1-CD 3.34Å; R441-E450 IonicContact NH1-OE1 3.66Å; R441-E450 PolarHBondContact NH1-OE1 3.08Å; R441-E450 IonicContact NH1-OE2 3.23Å; R441-E450 PolarHBondContact NH1-OE2 3.03Å; R441-E450 IonicContact NH2-OE1 3.9Å; R441-E450 PolarHBondContact NH2-OE1 3.26Å; R441-E450 IonicContact NH2-OE2 2.69Å
442	N	95.3	Very high	94	Very high	45 Å²	45	54.3 Å²	54.3	24%	0.241	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-78	136.5	172.5	-175	-63.9	0	0	0	109.6	V430 M431 V444 S445	V430-N442 VanDerWaalsContact O-CA 3.26Å; V430-N442 WeakPolarHBondContact O-CA 3.11Å; M431-N442 VanDerWaalsContact SD-CA 3.54Å; M431-N442 HydrophobicContact SD-CB 3.65Å; N442-V444 PolarHBondContact O-N 3.17Å; N442-V444 VanDerWaalsContact O-N 3.14Å; N442-V444 WeakPolarHBondContact OD1-CB 3.27Å; N442-V444 WeakPolarHBondContact OD1-CG2 3.47Å; N442-V444 PolarHBondContact OD1-N 2.63Å; N442-S445 PolarHBondContact N-OG 3.09Å; N442-S445 WeakPolarHBondContact O-CA 3.45Å; N442-S445 WeakPolarHBondContact O-CB 3.49Å; N442-S445 PolarHBondContact O-N 2.77Å; N442-S445 PolarHBondContact O-OG 3.05Å
443	V	94.9	Very high	93.6	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.024	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-53.3	-37	-178.4	-177.7	0	0	0	0	112.5	L406 L412 V430 S445 V446	L406-V443 HydrophobicContact CD1-CG2 3.79Å; L412-V443 HydrophobicContact CD2-CG1 4.04Å; L412-V443 HydrophobicContact CD2-CG2 3.86Å; V430-V443 HydrophobicContact CB-CG2 3.97Å; V430-V443 HydrophobicContact CG2-CB 3.98Å; V430-V443 HydrophobicContact CG2-CG2 3.99Å; V430-V443 PolarHBondContact O-N 2.99Å; V443-S445 PolarHBondContact O-N 2.68Å; V443-V446 PolarHBondContact O-N 3.34Å
444	V	93.4	Very high	93.2	Very high	58 Å²	58	62.3 Å²	62.3	35%	0.352	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-71.2	-8.6	179.8	-170	0	0	0	0	112.4	L419 L425 N442	L419-V444 HydrophobicContact CD1-CG2 4.34Å; L425-V444 HydrophobicContact CD2-CB 4.49Å; L425-V444 HydrophobicContact CD2-CG1 4.03Å; L425-V444 HydrophobicContact CD2-CG2 3.78Å; N442-V444 PolarHBondContact O-N 3.17Å; N442-V444 VanDerWaalsContact O-N 3.14Å; N442-V444 WeakPolarHBondContact OD1-CB 3.27Å; N442-V444 WeakPolarHBondContact OD1-CG2 3.47Å; N442-V444 PolarHBondContact OD1-N 2.63Å
445	S	93.5	Very high	92.9	Very high	69 Å²	69	63.1 Å²	63.1	48%	0.483	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-112.5	11.3	177.6	70.5	0	0	0	0	114.1	R441 N442 V443	R441-S445 PolarHBondContact NH2-O 2.97Å; N442-S445 PolarHBondContact N-OG 3.09Å; N442-S445 WeakPolarHBondContact O-CA 3.45Å; N442-S445 WeakPolarHBondContact O-CB 3.49Å; N442-S445 PolarHBondContact O-N 2.77Å; N442-S445 PolarHBondContact O-OG 3.05Å; V443-S445 PolarHBondContact O-N 2.68Å
446	V	95	Very high	92.6	Very high	15 Å²	15	64.8 Å²	64.8	9%	0.091	38%	0.378	C	S	.	.	S	Bend	trans	-101.7	137.7	173.8	-179.2	0	0	0	0	108.5	L438 R441 V443 E450 L451	L438-V446 HydrophobicContact CD1-CG1 3.77Å; L438-V446 HydrophobicContact CD1-CG2 4.46Å; L438-V446 HydrophobicContact CD2-CG1 3.94Å; L438-V446 HydrophobicContact CD2-CG2 4.21Å; R441-V446 HydrophobicContact CB-CG2 4.08Å; V443-V446 PolarHBondContact O-N 3.34Å; V446-E450 HydrophobicContact CG1-CB 3.69Å; V446-L451 HydrophobicContact CG1-CD1 4.5Å; V446-L451 HydrophobicContact CG1-CD2 3.75Å; V446-L451 HydrophobicContact CG1-CG 3.85Å
447	S	94	Very high	92.6	Very high	48 Å²	48	60.8 Å²	60.8	34%	0.336	35%	0.345	S	S	.	.			trans	-78.7	152.1	176.1	101.1	0	0	0	0	110.7	E449 E450	S447-E449 WeakPolarHBondContact CB-OE2 3.25Å; S447-E449 PolarHBondContact O-N 2.61Å; S447-E449 PolarHBondContact OG-OE2 3.29Å; S447-E450 PolarHBondContact N-OE1 2.81Å; S447-E450 WeakPolarHBondContact O-CB 2.91Å; S447-E450 PolarHBondContact O-N 2.87Å
448	L	92.7	Very high	92.5	Very high	85 Å²	85	58.2 Å²	58.2	45%	0.445	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-64.5	-25.2	-175.6	-62.9	176.2	0	0	0	112.2	Q413 P417 E450 L451	Q413-L448 HydrophobicContact CB-CD2 4.14Å; Q413-L448 HydrophobicContact CG-CD2 4.34Å; Q413-L448 PolarHBondContact NE2-O 3.46Å; Q413-L448 VanDerWaalsContact O-CD2 3.3Å; Q413-L448 WeakPolarHBondContact O-CD2 3.14Å; P417-L448 HydrophobicContact CG-CD2 4.47Å; L448-E450 VanDerWaalsContact C-N 3.34Å; L448-L451 HydrophobicContact CD2-CD1 4.41Å; L448-L451 PolarHBondContact O-N 3.48Å
449	E	92.4	Very high	92.4	Very high	153 Å²	153	58.1 Å²	58.1	72%	0.715	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-74.6	-19.7	175.4	-51.8	82.1	177.5	0	0	113.4	S447	S447-E449 WeakPolarHBondContact CB-OE2 3.25Å; S447-E449 PolarHBondContact O-N 2.61Å; S447-E449 PolarHBondContact OG-OE2 3.29Å
450	E	94	Very high	92.2	Very high	72 Å²	72	59.9 Å²	59.9	34%	0.336	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-82.5	-15.7	173.3	-61.2	-177.5	-79.2	0	0	112.5	L438 R441 V446 S447 L448 V452	L438-E450 HydrophobicContact CD2-CB 4.31Å; R441-E450 IonicContact CZ-OE1 3.61Å; R441-E450 IonicContact CZ-OE2 3.54Å; R441-E450 VanDerWaalsContact NH1-CD 3.34Å; R441-E450 IonicContact NH1-OE1 3.66Å; R441-E450 PolarHBondContact NH1-OE1 3.08Å; R441-E450 IonicContact NH1-OE2 3.23Å; R441-E450 PolarHBondContact NH1-OE2 3.03Å; R441-E450 IonicContact NH2-OE1 3.9Å; R441-E450 PolarHBondContact NH2-OE1 3.26Å; R441-E450 IonicContact NH2-OE2 2.69Å; V446-E450 HydrophobicContact CG1-CB 3.69Å; S447-E450 PolarHBondContact N-OE1 2.81Å; S447-E450 WeakPolarHBondContact O-CB 2.91Å; S447-E450 PolarHBondContact O-N 2.87Å; L448-E450 VanDerWaalsContact C-N 3.34Å; E450-V452 PolarHBondContact O-N 3.44Å
451	L	93.8	Very high	92.2	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.021	30%	0.3	C	S	.	.			trans	-92.9	83.2	-178.2	-64	175.8	0	0	0	110.3	C408 C410 Q413 L438 V446 L448	C408-L451 HydrophobicContact CB-CD2 3.7Å; C408-L451 VanDerWaalsContact O-CD2 3.27Å; C408-L451 WeakPolarHBondContact O-CD2 3.46Å; C410-L451 VanDerWaalsContact CA-O 3.25Å; C410-L451 WeakPolarHBondContact CA-O 3.3Å; C410-L451 VanDerWaalsContact CB-O 3.26Å; C410-L451 WeakPolarHBondContact CB-O 3.29Å; Q413-L451 HydrophobicContact CB-CD1 4.44Å; Q413-L451 HydrophobicContact CG-CB 3.65Å; Q413-L451 HydrophobicContact CG-CD1 3.97Å; Q413-L451 HydrophobicContact CG-CG 4.47Å; Q413-L451 PolarHBondContact NE2-O 3.25Å; L438-L451 HydrophobicContact CD1-CD2 4.07Å; V446-L451 HydrophobicContact CG1-CD1 4.5Å; V446-L451 HydrophobicContact CG1-CD2 3.75Å; V446-L451 HydrophobicContact CG1-CG 3.85Å; L448-L451 HydrophobicContact CD2-CD1 4.41Å; L448-L451 PolarHBondContact O-N 3.48Å
452	V	93.1	Very high	92.1	Very high	64 Å²	64	58.1 Å²	58.1	39%	0.388	31%	0.307	S	S	.	.			trans	-103.6	161.8	-179.5	-65.5	0	0	0	0	112.2	D409 C410 E450 D454	D409-V452 CarbonylContact C-O 3.52Å; D409-V452 WeakPolarHBondContact CA-O 3.49Å; D409-V452 WeakPolarHBondContact CB-O 3.44Å; C410-V452 PolarHBondContact N-O 2.82Å; E450-V452 PolarHBondContact O-N 3.44Å; V452-D454 HydrophobicContact CG2-CB 4.43Å
453	C	88.9	Confident	92.1	Very high	55 Å²	55	60 Å²	60	37%	0.372	32%	0.315	S	S	.	.			trans	-116.4	45.4	173.2	-71.4	0	0	0	0	110.7	C410	C410-C453 WeakPolarHBondContact CA-SG 3.43Å; C410-C453 HydrophobicContact CB-CB 3.96Å; C410-C453 WeakPolarHBondContact CB-SG 3.4Å; C410-C453 PolarHBondContact N-SG 3.19Å; C410-C453 WeakPolarHBondContact SG-CB 3.49Å; C410-C453 CovalentContact SG-SG 2.03Å; C410-C453 PolarHBondContact SG-SG 3.23Å
454	D	85.3	Confident	92.2	Very high	146 Å²	146	64 Å²	64	78%	0.781	33%	0.333	S	S	*	.	S	Bend	trans	-74.5	-19.6	178.5	-62.6	-20	0	0	0	111.8	V452	V452-D454 HydrophobicContact CG2-CB 4.43Å
455	D	85	Confident	92.3	Very high	52 Å²	52	61.3 Å²	61.3	28%	0.278	32%	0.316	S	S	.	.			trans	-128.4	161.3	172.6	83.5	-33.9	0	0	0	112.1	H434 S485	H434-D455 IonicContact CD2-OD2 2.71Å; H434-D455 IonicContact CE1-OD2 3.23Å; H434-D455 PolarHBondContact CE1-OD2 2.86Å; H434-D455 IonicContact NE2-OD1 2.88Å; H434-D455 PolarHBondContact NE2-OD1 3.41Å; H434-D455 IonicContact NE2-OD2 2.74Å; H434-D455 PolarHBondContact NE2-OD2 2.87Å; D455-S485 WeakPolarHBondContact CB-OG 3.48Å
456	F	88.3	Confident	92.5	Very high	60 Å²	60	65.6 Å²	65.6	26%	0.263	33%	0.329	S	S	.	.			trans	-135.7	81.8	174.5	61.1	-79.4	0	0	0	109.5	K458 R460 S484 S485 E516	F456-K458 VanDerWaalsContact C-N 3.26Å; F456-K458 PolarHBondContact O-N 2.74Å; F456-R460 HydrophobicContact CD2-CB 4.05Å; F456-R460 HydrophobicContact CE2-CB 4.07Å; F456-S484 PolarHBondContact O-OG 2.73Å; F456-S485 VanDerWaalsContact C-OG 3.29Å; F456-S485 PolarHBondContact N-OG 3.03Å; F456-S485 PolarHBondContact O-N 3.1Å; F456-S485 PolarHBondContact O-OG 2.8Å; F456-E516 HydrophobicContact CZ-CG 4.32Å; F456-E516 WeakPolarHBondContact CZ-OE1 3.44Å
457	P	89.7	Confident	92.6	Very high	2 Å²	2	69.4 Å²	69.4	1%	0.013	35%	0.352	C	S	.	.			trans	-74.2	-17.2	-172.7	32.5	-39.6	0	0	0	113.1	L407 S484 N542 F544	L407-P457 HydrophobicContact CD1-CG 4.42Å; L407-P457 HydrophobicContact CD2-CG 3.85Å; P457-S484 PolarHBondContact O-OG 2.75Å; P457-N542 PolarHBondContact O-ND2 2.75Å; P457-N542 PolarHBondContact O-OD1 2.89Å; P457-F544 HydrophobicContact CB-CB 4.48Å; P457-F544 HydrophobicContact CB-CD1 4.32Å; P457-F544 HydrophobicContact CB-CD2 3.65Å; P457-F544 HydrophobicContact CB-CE1 4.43Å; P457-F544 HydrophobicContact CB-CE2 3.76Å; P457-F544 HydrophobicContact CB-CG 3.91Å; P457-F544 HydrophobicContact CB-CZ 4.16Å; P457-F544 HydrophobicContact CG-CD1 4.48Å; P457-F544 HydrophobicContact CG-CG 4.34Å; P457-F544 VanDerWaalsContact O-CD2 3.29Å; P457-F544 WeakPolarHBondContact O-CD2 3.4Å
458	K	90.6	Very high	92.6	Very high	41 Å²	41	68.4 Å²	68.4	18%	0.178	35%	0.347	C	S	.	.	S	Bend	trans	-83	139	170.4	-174.3	-178.5	-179.1	-171.6	0	109.8	S361 S385 L407 F456 R460 F544 A546	S361-K458 PolarHBondContact OG-NZ 3.02Å; S385-K458 PolarHBondContact OG-NZ 3.24Å; L407-K458 HydrophobicContact CD1-CB 4.1Å; F456-K458 VanDerWaalsContact C-N 3.26Å; F456-K458 PolarHBondContact O-N 2.74Å; K458-R460 PolarHBondContact O-N 3.27Å; K458-F544 HydrophobicContact CB-CB 4.32Å; K458-A546 WeakPolarHBondContact CE-O 3.26Å; K458-A546 PolarHBondContact NZ-O 2.84Å
459	P	92.8	Very high	92.7	Very high	1 Å²	1	69 Å²	69	1%	0.006	35%	0.354	C	S	.	.			trans	-60.6	134.7	-178.1	-24.8	36.1	0	0	0	112.6	M490 V540 N542 N547	P459-M490 HydrophobicContact CB-SD 3.82Å; P459-M490 HydrophobicContact CG-CG 4.02Å; P459-M490 HydrophobicContact CG-SD 3.92Å; P459-V540 HydrophobicContact CB-CB 4.36Å; P459-V540 HydrophobicContact CB-CG1 3.98Å; P459-V540 HydrophobicContact CG-CG1 4.39Å; P459-N542 WeakPolarHBondContact CD-OD1 3.36Å; P459-N542 HydrophobicContact CG-CB 4.17Å; P459-N547 WeakPolarHBondContact O-CB 3.27Å; P459-N547 PolarHBondContact O-ND2 2.03Å
460	R	92.8	Very high	92.9	Very high	155 Å²	155	62.1 Å²	62.1	59%	0.585	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.5	173.4	178.3	178.9	174.4	-175.2	-2.5	109.1	F456 K458 T462 A482 S483	F456-R460 HydrophobicContact CD2-CB 4.05Å; F456-R460 HydrophobicContact CE2-CB 4.07Å; K458-R460 PolarHBondContact O-N 3.27Å; R460-T462 HydrophobicContact CG-CG2 4.41Å; R460-A482 CarbonylContact O-C 3.59Å; R460-A482 WeakPolarHBondContact O-CA 3.3Å; R460-A482 WeakPolarHBondContact O-CB 3.46Å; R460-S483 PolarHBondContact N-O 3.36Å; R460-S483 PolarHBondContact O-N 3.05Å
461	I	94.5	Very high	92.9	Very high	17 Å²	17	61.6 Å²	61.6	9%	0.087	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	133.4	171.1	-64.6	170.3	0	0	0	108.7	E463 H464 L481 A482 V540 N547 Y548	I461-E463 VanDerWaalsContact CG2-O 3.28Å; I461-E463 WeakPolarHBondContact CG2-O 3.43Å; I461-H464 VanDerWaalsContact CG2-CE1 3.44Å; I461-H464 WeakPolarHBondContact CG2-CE1 3.39Å; I461-H464 WeakPolarHBondContact CG2-ND1 3.37Å; I461-L481 CarbonylContact C-O 3.56Å; I461-L481 WeakPolarHBondContact CA-O 3.12Å; I461-L481 WeakPolarHBondContact CG2-O 3.49Å; I461-A482 HydrophobicContact CG1-CB 4.11Å; I461-V540 HydrophobicContact CD1-CG2 4.26Å; I461-V540 HydrophobicContact CG1-CG2 4.12Å; I461-N547 HydrophobicContact CD1-CB 4.42Å; I461-Y548 VanDerWaalsContact CD1-C 3.43Å
462	T	94.2	Very high	93	Very high	74 Å²	74	67.8 Å²	67.8	45%	0.454	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	-26.3	-174.1	49.8	0	0	0	0	112.8	R460 L481	R460-T462 HydrophobicContact CG-CG2 4.41Å; T462-L481 PolarHBondContact N-O 2.88Å; T462-L481 PolarHBondContact OG1-O 2.86Å
463	E	95.3	Very high	93	Very high	86 Å²	86	66.5 Å²	66.5	40%	0.402	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137.7	169.5	-164.1	-170	118	0	0	108.7	I461 S479 L481	I461-E463 VanDerWaalsContact CG2-O 3.28Å; I461-E463 WeakPolarHBondContact CG2-O 3.43Å; E463-S479 PolarHBondContact OE1-OG 2.96Å; E463-L481 HydrophobicContact CB-CB 3.33Å; E463-L481 HydrophobicContact CB-CD2 4.34Å; E463-L481 HydrophobicContact CB-CG 4.47Å; E463-L481 HydrophobicContact CG-CB 4.5Å; E463-L481 PolarHBondContact N-O 3.27Å; E463-L481 PolarHBondContact O-N 3.4Å; E463-L481 VanDerWaalsContact O-N 3.08Å
464	H	95.8	Very high	93.3	Very high	88 Å²	88	66.6 Å²	66.6	41%	0.407	34%	0.344	S	S	.	.			trans	-117.4	138.3	-169.6	-82.4	-47.2	0	0	0	109.8	I461 N550	I461-H464 VanDerWaalsContact CG2-CE1 3.44Å; I461-H464 WeakPolarHBondContact CG2-CE1 3.39Å; I461-H464 WeakPolarHBondContact CG2-ND1 3.37Å; H464-N550 VanDerWaalsContact CB-OD1 3.26Å; H464-N550 WeakPolarHBondContact CB-OD1 3.26Å
465	P	97	Very high	93.9	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-59	140.2	175.9	23.4	-34.3	0	0	0	111.8	L478 S479 W494 N550 A552	P465-L478 HydrophobicContact CB-CB 4.23Å; P465-S479 WeakPolarHBondContact CA-O 3.44Å; P465-S479 WeakPolarHBondContact CB-O 3.31Å; P465-S479 WeakPolarHBondContact CD-O 3.48Å; P465-W494 HydrophobicContact CB-CH2 4.07Å; P465-W494 HydrophobicContact CB-CZ3 4.15Å; P465-W494 HydrophobicContact CG-CH2 4.27Å; P465-W494 HydrophobicContact CG-CZ3 4.16Å; P465-N550 VanDerWaalsContact CD-OD1 3.22Å; P465-N550 WeakPolarHBondContact CD-OD1 3.26Å; P465-N550 PolarHBondContact O-ND2 2.98Å; P465-N550 PolarHBondContact O-OD1 2.85Å; P465-A552 HydrophobicContact CB-CB 3.86Å; P465-A552 HydrophobicContact CG-CB 4.18Å
466	E	96.5	Very high	94.4	Very high	160 Å²	160	63 Å²	63	75%	0.748	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-90.9	144.9	178.9	-61.1	-166.7	151.9	0	0	111.8	A552	E466-A552 WeakPolarHBondContact O-CB 3.35Å
467	T	97	Very high	94.8	Very high	95 Å²	95	64 Å²	64	58%	0.583	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-64.9	130.4	171.3	-77.9	0	0	0	0	110	K553	T467-K553 CarbonylContact C-O 3.57Å; T467-K553 WeakPolarHBondContact CA-O 3.45Å; T467-K553 HydrophobicContact CG2-CB 4.09Å; T467-K553 WeakPolarHBondContact CG2-O 3.44Å; T467-K553 PolarHBondContact OG1-N 3.03Å
468	A	95.1	Very high	95.1	Very high	26 Å²	26	64.2 Å²	64.2	22%	0.215	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	149	-173.3	0	0	0	0	0	112.4	V476 K553 L554 T555	A468-V476 HydrophobicContact CB-CG1 4.32Å; A468-K553 PolarHBondContact N-O 2.89Å; A468-L554 HydrophobicContact CB-CD1 4.14Å; A468-L554 WeakPolarHBondContact O-CA 3.39Å; A468-T555 PolarHBondContact O-N 3.19Å
469	T	94.9	Very high	95.4	Very high	97 Å²	97	64.2 Å²	64.2	60%	0.595	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.8	168.5	-58.8	0	0	0	0	108.2	T555 N557	T469-T555 CarbonylContact C-O 3.27Å; T469-T555 WeakPolarHBondContact CA-O 3.36Å; T469-N557 VanDerWaalsContact CG2-ND2 3.32Å; T469-N557 WeakPolarHBondContact CG2-ND2 3.26Å
470	A	95.4	Very high	95.6	Very high	9 Å²	9	64.2 Å²	64.2	7%	0.074	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	160.8	-174.7	0	0	0	0	0	111.4	V476 V528 L554 T555 N557	A470-V476 HydrophobicContact CB-CG2 3.5Å; A470-V476 VanDerWaalsContact CB-CG2 3.5Å; A470-V528 HydrophobicContact CB-CG2 3.84Å; A470-L554 HydrophobicContact CB-CD1 4.03Å; A470-T555 PolarHBondContact N-O 3.32Å; A470-N557 PolarHBondContact O-N 3.47Å
471	L	95	Very high	95.7	Very high	61 Å²	61	57.9 Å²	57.9	32%	0.319	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	142.3	166.8	-63.6	-180	0	0	0	109.7	G473 T474 N557 L559 A639	L471-G473 PolarHBondContact O-N 3.2Å; L471-T474 HydrophobicContact CB-CG2 3.91Å; L471-T474 PolarHBondContact N-OG1 2.84Å; L471-T474 WeakPolarHBondContact O-CB 3.29Å; L471-T474 WeakPolarHBondContact O-CG2 3.33Å; L471-T474 PolarHBondContact O-N 2.72Å; L471-T474 PolarHBondContact O-OG1 2.91Å; L471-N557 CarbonylContact C-O 3.25Å; L471-N557 WeakPolarHBondContact CA-O 3.27Å; L471-N557 HydrophobicContact CD2-CB 4.41Å; L471-L559 HydrophobicContact CD1-CD1 3.94Å; L471-L559 HydrophobicContact CD1-CG 4.18Å; L471-L559 HydrophobicContact CD2-CG 4.27Å; L471-A639 HydrophobicContact CD2-CB 3.57Å
472	R	95.4	Very high	95.8	Very high	135 Å²	135	57.1 Å²	57.1	51%	0.509	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	130.2	173.8	-174.8	-176.9	172	-139.3	-1.2	110.8	V528 V556 N557 E558	R472-V528 CarbonylContact C-O 3.22Å; R472-V528 WeakPolarHBondContact CA-O 3.32Å; R472-V556 HydrophobicContact CB-CG1 4.13Å; R472-N557 PolarHBondContact N-O 2.85Å; R472-E558 HydrophobicContact CB-CB 4.48Å; R472-E558 VanDerWaalsContact CD-OE1 3.31Å; R472-E558 WeakPolarHBondContact CD-OE1 3.15Å; R472-E558 IonicContact CZ-OE1 2.78Å; R472-E558 IonicContact NE-OE1 2.69Å; R472-E558 IonicContact NH1-OE1 3.94Å; R472-E558 PolarHBondContact NH1-OE1 3.02Å; R472-E558 IonicContact NH1-OE2 2.74Å
473	G	94	Very high	95.8	Very high	36 Å²	36	53.9 Å²	53.9	37%	0.371	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	2.2	-177.2	0	0	0	0	0	115.8	L471 V528	L471-G473 PolarHBondContact O-N 3.2Å; G473-V528 PolarHBondContact N-O 2.85Å
474	T	95.2	Very high	95.6	Very high	57 Å²	57	49.8 Å²	49.8	35%	0.35	28%	0.277	S	S	.	.			trans	-85.5	174.8	171.6	61.6	0	0	0	0	112.2	L471 N527 V528	L471-T474 HydrophobicContact CB-CG2 3.91Å; L471-T474 PolarHBondContact N-OG1 2.84Å; L471-T474 WeakPolarHBondContact O-CB 3.29Å; L471-T474 WeakPolarHBondContact O-CG2 3.33Å; L471-T474 PolarHBondContact O-N 2.72Å; L471-T474 PolarHBondContact O-OG1 2.91Å; T474-N527 CarbonylContact O-C 3.47Å; T474-N527 VanDerWaalsContact O-CA 3.24Å; T474-N527 WeakPolarHBondContact O-CA 3.06Å; T474-N527 PolarHBondContact O-N 3.43Å; T474-N527 VanDerWaalsContact O-N 3.08Å; T474-V528 WeakPolarHBondContact O-CG2 3.42Å; T474-V528 PolarHBondContact O-N 2.87Å
475	N	96.4	Very high	95.4	Very high	107 Å²	107	47.8 Å²	47.8	57%	0.572	27%	0.273	S	S	*	.			trans	-108.7	139.1	173.3	-64.6	-8.7	0	0	0	109.6	L525 L526 N527	N475-L525 CarbonylContact C-O 3.51Å; N475-L525 WeakPolarHBondContact CA-O 3.31Å; N475-L526 HydrophobicContact CB-CD2 4.23Å; N475-L526 WeakPolarHBondContact OD1-CA 3.39Å; N475-N527 PolarHBondContact OD1-N 2.88Å
476	V	96.3	Very high	94.9	Very high	17 Å²	17	48.9 Å²	48.9	10%	0.103	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	145.8	-179.7	-177.7	0	0	0	0	109.3	A468 A470 L478 L525 V528 L554	A468-V476 HydrophobicContact CB-CG1 4.32Å; A470-V476 HydrophobicContact CB-CG2 3.5Å; A470-V476 VanDerWaalsContact CB-CG2 3.5Å; V476-L478 HydrophobicContact CG1-CD2 4.45Å; V476-L525 HydrophobicContact CB-CB 4.34Å; V476-L525 PolarHBondContact N-O 3.24Å; V476-L525 PolarHBondContact O-N 3.34Å; V476-V528 HydrophobicContact CB-CG1 4.35Å; V476-V528 HydrophobicContact CG2-CG1 4.02Å; V476-V528 HydrophobicContact CG2-CG2 3.94Å; V476-L554 HydrophobicContact CG1-CD1 4.29Å; V476-L554 HydrophobicContact CG2-CD1 4.26Å
477	T	96.3	Very high	94.4	Very high	79 Å²	79	47 Å²	47	49%	0.485	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.1	174.7	55.6	0	0	0	0	110.8	L523 H524	T477-L523 CarbonylContact C-O 3.15Å; T477-L523 VanDerWaalsContact CA-O 3.28Å; T477-L523 WeakPolarHBondContact CA-O 3.08Å; T477-H524 WeakPolarHBondContact CG2-CE1 3.36Å; T477-H524 WeakPolarHBondContact CG2-ND1 3.39Å
478	L	97.3	Very high	94	Very high	8 Å²	8	43.7 Å²	43.7	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.9	174.9	-58.9	179.2	0	0	0	109.4	P465 V476 W494 V522 L523 Y536	P465-L478 HydrophobicContact CB-CB 4.23Å; V476-L478 HydrophobicContact CG1-CD2 4.45Å; L478-W494 HydrophobicContact CB-CH2 3.73Å; L478-W494 HydrophobicContact CB-CZ3 3.85Å; L478-W494 HydrophobicContact CD1-CZ3 4.4Å; L478-W494 WeakPolarHBondContact O-CH2 3.25Å; L478-W494 VanDerWaalsContact O-CZ2 3.3Å; L478-W494 WeakPolarHBondContact O-CZ2 3.26Å; L478-V522 WeakPolarHBondContact O-CA 3.43Å; L478-L523 HydrophobicContact CB-CB 4.49Å; L478-L523 PolarHBondContact N-O 2.84Å; L478-L523 PolarHBondContact O-N 2.99Å; L478-Y536 VanDerWaalsContact CD1-CB 3.44Å; L478-Y536 HydrophobicContact CD1-CD1 4.15Å; L478-Y536 HydrophobicContact CD1-CD2 4.09Å; L478-Y536 HydrophobicContact CD1-CG 3.63Å
479	S	96.3	Very high	93.8	Very high	41 Å²	41	47.7 Å²	47.7	29%	0.287	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	157.9	178.6	60.5	0	0	0	0	112.5	E463 P465 T521	E463-S479 PolarHBondContact OE1-OG 2.96Å; P465-S479 WeakPolarHBondContact CA-O 3.44Å; P465-S479 WeakPolarHBondContact CB-O 3.31Å; P465-S479 WeakPolarHBondContact CD-O 3.48Å; S479-T521 CarbonylContact C-O 2.94Å
480	C	96.4	Very high	93.6	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.007	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	134.7	173.2	172.7	0	0	0	0	108.8	W494 T520 T521 C538	C480-W494 HydrophobicContact CB-CH2 4.03Å; C480-W494 HydrophobicContact CB-CZ2 3.89Å; C480-T520 WeakPolarHBondContact O-CA 3.32Å; C480-T521 HydrophobicContact CB-CG2 3.68Å; C480-T521 PolarHBondContact N-O 3.43Å; C480-T521 PolarHBondContact O-N 2.71Å; C480-C538 HydrophobicContact CB-CB 3.38Å; C480-C538 WeakPolarHBondContact CB-SG 3.49Å; C480-C538 WeakPolarHBondContact SG-CB 3.49Å; C480-C538 CovalentContact SG-SG 2.03Å; C480-C538 PolarHBondContact SG-SG 3.05Å
481	L	95.5	Very high	93.5	Very high	22 Å²	22	46.8 Å²	46.8	12%	0.115	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.5	178.8	-165.2	72.8	0	0	0	109.5	I461 T462 E463 V518 Y519 T520	I461-L481 CarbonylContact C-O 3.56Å; I461-L481 WeakPolarHBondContact CA-O 3.12Å; I461-L481 WeakPolarHBondContact CG2-O 3.49Å; T462-L481 PolarHBondContact N-O 2.88Å; T462-L481 PolarHBondContact OG1-O 2.86Å; E463-L481 HydrophobicContact CB-CB 3.33Å; E463-L481 HydrophobicContact CB-CD2 4.34Å; E463-L481 HydrophobicContact CB-CG 4.47Å; E463-L481 HydrophobicContact CG-CB 4.5Å; E463-L481 PolarHBondContact N-O 3.27Å; E463-L481 PolarHBondContact O-N 3.4Å; E463-L481 VanDerWaalsContact O-N 3.08Å; L481-V518 HydrophobicContact CD1-CG1 3.63Å; L481-V518 HydrophobicContact CD2-CG1 4.34Å; L481-V518 HydrophobicContact CG-CG1 3.99Å; L481-Y519 WeakPolarHBondContact CA-O 3.49Å; L481-T520 HydrophobicContact CD1-CG2 4.14Å; L481-T520 WeakPolarHBondContact CD1-OG1 3.21Å
482	A	95.8	Very high	93.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	158.9	170.2	0	0	0	0	0	111.3	R460 I461 V518 Y519 V540	R460-A482 CarbonylContact O-C 3.59Å; R460-A482 WeakPolarHBondContact O-CA 3.3Å; R460-A482 WeakPolarHBondContact O-CB 3.46Å; I461-A482 HydrophobicContact CG1-CB 4.11Å; A482-V518 CarbonylContact O-C 3.58Å; A482-V518 WeakPolarHBondContact O-CA 3.4Å; A482-Y519 PolarHBondContact N-O 3.48Å; A482-Y519 PolarHBondContact O-N 3.39Å; A482-V540 HydrophobicContact CB-CB 4.18Å; A482-V540 HydrophobicContact CB-CG1 3.98Å; A482-V540 HydrophobicContact CB-CG2 3.94Å
483	S	94.1	Very high	93.3	Very high	6 Å²	6	40.7 Å²	40.7	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	163.1	165.9	74.2	0	0	0	0	112.5	R460 E516 L517	R460-S483 PolarHBondContact N-O 3.36Å; R460-S483 PolarHBondContact O-N 3.05Å; S483-E516 WeakPolarHBondContact CB-OE2 3.3Å; S483-E516 PolarHBondContact OG-OE2 3.21Å; S483-L517 CarbonylContact C-O 3.48Å; S483-L517 VanDerWaalsContact CA-O 3.26Å; S483-L517 WeakPolarHBondContact CA-O 3.5Å
484	S	92.7	Very high	93.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	148.7	166.9	-176.3	0	0	0	0	110.2	F456 P457 S486 L517	F456-S484 PolarHBondContact O-OG 2.73Å; P457-S484 PolarHBondContact O-OG 2.75Å; S484-S486 PolarHBondContact O-N 2.93Å; S484-S486 PolarHBondContact OG-N 3.03Å; S484-L517 PolarHBondContact N-O 2.87Å; S484-L517 PolarHBondContact O-N 2.85Å
485	S	90.3	Very high	93.3	Very high	46 Å²	46	37.7 Å²	37.7	32%	0.322	23%	0.229	S	C	.	.	S	Bend	trans	-79.7	3.6	170.8	69	0	0	0	0	113.7	D455 F456	D455-S485 WeakPolarHBondContact CB-OG 3.48Å; F456-S485 VanDerWaalsContact C-OG 3.29Å; F456-S485 PolarHBondContact N-OG 3.03Å; F456-S485 PolarHBondContact O-N 3.1Å; F456-S485 PolarHBondContact O-OG 2.8Å
486	S	87.6	Confident	93.1	Very high	24 Å²	24	34.4 Å²	34.4	17%	0.168	21%	0.209	C	C	.	.	S	Bend	trans	-109.2	135.9	177.2	-174.7	0	0	0	0	111.5	S484 S488	S484-S486 PolarHBondContact O-N 2.93Å; S484-S486 PolarHBondContact OG-N 3.03Å; S486-S488 PolarHBondContact O-N 2.78Å; S486-S488 WeakPolarHBondContact OG-CB 3.22Å; S486-S488 PolarHBondContact OG-N 3.24Å; S486-S488 PolarHBondContact OG-OG 2.69Å
487	D	86.2	Confident	92.6	Very high	121 Å²	121	37.3 Å²	37.3	65%	0.647	22%	0.224	S	C	*	.			trans	-64.4	1.5	169.3	-57.9	-42.6	0	0	0	113.8	P489	D487-P489 WeakPolarHBondContact O-CD 3.18Å
488	S	88.1	Confident	91.7	Very high	25 Å²	25	33.9 Å²	33.9	18%	0.175	20%	0.204	C	C	.	.	S	Bend	trans	-60.7	119.9	177.4	-67.2	0	0	0	0	111.1	S486 M490 F544	S486-S488 PolarHBondContact O-N 2.78Å; S486-S488 WeakPolarHBondContact OG-CB 3.22Å; S486-S488 PolarHBondContact OG-N 3.24Å; S486-S488 PolarHBondContact OG-OG 2.69Å; S488-M490 PolarHBondContact O-N 3.29Å; S488-M490 VanDerWaalsContact O-N 3.16Å; S488-F544 VanDerWaalsContact OG-CE2 3.3Å; S488-F544 WeakPolarHBondContact OG-CE2 2.97Å
489	P	90	Very high	91.1	Very high	109 Å²	109	36.6 Å²	36.6	71%	0.708	22%	0.217	S	C	*	.	P	Polyproline II helix	trans	-52.8	122.2	-175.7	-29.8	36	0	0	0	113	D487 N542	D487-P489 WeakPolarHBondContact O-CD 3.18Å; P489-N542 WeakPolarHBondContact O-CB 3.26Å
490	M	91.7	Very high	90.7	Very high	9 Å²	9	36.2 Å²	36.2	4%	0.044	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-81.8	141	172.2	-76.9	-172.7	-83.7	0	0	111	P459 S488 L517 Y519 V540 S541 N542	P459-M490 HydrophobicContact CB-SD 3.82Å; P459-M490 HydrophobicContact CG-CG 4.02Å; P459-M490 HydrophobicContact CG-SD 3.92Å; S488-M490 PolarHBondContact O-N 3.29Å; S488-M490 VanDerWaalsContact O-N 3.16Å; M490-L517 HydrophobicContact CE-CB 4.14Å; M490-L517 HydrophobicContact CE-CD2 3.87Å; M490-L517 HydrophobicContact CE-CG 3.67Å; M490-L517 WeakPolarHBondContact CE-O 3.26Å; M490-Y519 HydrophobicContact CB-CD2 3.83Å; M490-Y519 HydrophobicContact CB-CE2 4.2Å; M490-Y519 HydrophobicContact CB-CG 4.22Å; M490-V540 HydrophobicContact CB-CG1 4.3Å; M490-V540 HydrophobicContact CG-CG1 4.31Å; M490-V540 HydrophobicContact SD-CG1 3.81Å; M490-S541 WeakPolarHBondContact CA-O 3.4Å; M490-N542 HydrophobicContact CG-CB 4.16Å
491	T	93	Very high	90.5	Very high	79 Å²	79	38.7 Å²	38.7	49%	0.485	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	149.3	174.2	56.9	0	0	0	0	108.4	S541	T491-S541 PolarHBondContact N-O 3.25Å; T491-S541 PolarHBondContact O-N 2.8Å; T491-S541 PolarHBondContact OG1-O 2.94Å; T491-S541 PolarHBondContact OG1-OG 2.71Å
492	T	93	Very high	90.1	Very high	31 Å²	31	46.8 Å²	46.8	19%	0.19	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.3	-177.1	54.7	0	0	0	0	110.7	N508 Y519 T521 V539 V540	T492-N508 PolarHBondContact OG1-ND2 3.41Å; T492-N508 PolarHBondContact OG1-OD1 2.66Å; T492-Y519 HydrophobicContact CG2-CD1 3.65Å; T492-Y519 HydrophobicContact CG2-CE1 3.47Å; T492-Y519 VanDerWaalsContact CG2-CE1 3.47Å; T492-T521 HydrophobicContact CG2-CG2 3.95Å; T492-V539 VanDerWaalsContact CA-O 3.31Å; T492-V539 WeakPolarHBondContact CA-O 3.44Å; T492-V540 HydrophobicContact CG2-CG1 4.19Å; T492-V540 HydrophobicContact CG2-CG2 4.16Å
493	A	93.7	Very high	89.7	Confident	36 Å²	36	54.8 Å²	54.8	30%	0.298	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	134.4	170.1	0	0	0	0	0	108.7	V500 V539	A493-V500 HydrophobicContact CB-CG1 4.36Å; A493-V539 PolarHBondContact N-O 2.78Å; A493-V539 PolarHBondContact O-N 2.84Å
494	W	95.7	Very high	89.4	Confident	3 Å²	3	56.1 Å²	56.1	1%	0.011	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	145.6	169.1	-76.2	86.2	0	0	0	109.8	P465 L478 C480 L501 V506 T521 L523 Q537 C538	P465-W494 HydrophobicContact CB-CH2 4.07Å; P465-W494 HydrophobicContact CB-CZ3 4.15Å; P465-W494 HydrophobicContact CG-CH2 4.27Å; P465-W494 HydrophobicContact CG-CZ3 4.16Å; L478-W494 HydrophobicContact CB-CH2 3.73Å; L478-W494 HydrophobicContact CB-CZ3 3.85Å; L478-W494 HydrophobicContact CD1-CZ3 4.4Å; L478-W494 WeakPolarHBondContact O-CH2 3.25Å; L478-W494 VanDerWaalsContact O-CZ2 3.3Å; L478-W494 WeakPolarHBondContact O-CZ2 3.26Å; C480-W494 HydrophobicContact CB-CH2 4.03Å; C480-W494 HydrophobicContact CB-CZ2 3.89Å; W494-L501 HydrophobicContact CB-CD1 4.2Å; W494-L501 PolarHBondContact O-N 3.41Å; W494-V506 HydrophobicContact CG-CG2 4.49Å; W494-T521 HydrophobicContact CZ2-CG2 3.96Å; W494-T521 PolarHBondContact NE1-OG1 3.34Å; W494-L523 HydrophobicContact CB-CD2 4.18Å; W494-L523 HydrophobicContact CD2-CB 3.63Å; W494-L523 HydrophobicContact CD2-CD2 3.93Å; W494-L523 HydrophobicContact CD2-CG 4.37Å; W494-L523 HydrophobicContact CE3-CB 4.06Å; W494-L523 HydrophobicContact CE3-CD2 3.81Å; W494-L523 HydrophobicContact CG-CB 3.95Å; W494-L523 HydrophobicContact CG-CD2 4.1Å; W494-L523 HydrophobicContact CG-CG 4.45Å; W494-L523 HydrophobicContact CH2-CB 4.37Å; W494-L523 HydrophobicContact CZ2-CB 3.98Å; W494-L523 HydrophobicContact CZ3-CB 4.41Å; W494-L523 HydrophobicContact CZ3-CD2 4.48Å; W494-Q537 CarbonylContact C-O 3.52Å; W494-Q537 WeakPolarHBondContact CA-O 3.33Å; W494-C538 HydrophobicContact CD2-CB 4.41Å; W494-C538 HydrophobicContact CE3-CB 4.24Å; W494-C538 HydrophobicContact CH2-CB 3.94Å; W494-C538 HydrophobicContact CZ2-CB 4.1Å; W494-C538 HydrophobicContact CZ3-CB 4.01Å
495	R	92.1	Very high	89.5	Confident	27 Å²	27	61.5 Å²	61.5	10%	0.102	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	151	173.8	-68.3	178.8	178.8	-123.3	5.7	111	W334 G498 E499 V500 Y536 Q537 V539	W334-R495 VanDerWaalsContact CD1-NH1 3.35Å; W334-R495 VanDerWaalsContact CD1-NH2 3.28Å; W334-R495 VanDerWaalsContact CG-NH1 3.28Å; R495-G498 WeakPolarHBondContact CD-O 3.46Å; R495-G498 PolarHBondContact NH1-O 3.21Å; R495-E499 CarbonylContact C-O 3.19Å; R495-E499 WeakPolarHBondContact CA-O 3.37Å; R495-E499 VanDerWaalsContact CB-O 3.26Å; R495-E499 WeakPolarHBondContact CB-O 3.5Å; R495-V500 HydrophobicContact CG-CG2 4.08Å; R495-Y536 CarbonylContact O-C 3.52Å; R495-Y536 VanDerWaalsContact O-CA 3.26Å; R495-Y536 WeakPolarHBondContact O-CA 3.38Å; R495-Q537 HydrophobicContact CB-CB 4.35Å; R495-Q537 PolarHBondContact N-O 2.92Å; R495-Q537 PolarHBondContact O-N 2.68Å; R495-V539 HydrophobicContact CG-CG2 4.22Å
496	K	92.4	Very high	89.7	Confident	38 Å²	38	61.6 Å²	61.6	17%	0.165	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	122.8	168.5	-179.8	-177	-173	-65.5	0	108	G498 E499 L501 T531 E533 Y536	K496-G498 PolarHBondContact O-N 3.07Å; K496-G498 VanDerWaalsContact O-N 3.08Å; K496-E499 PolarHBondContact N-O 2.57Å; K496-E499 PolarHBondContact O-N 2.97Å; K496-L501 HydrophobicContact CB-CD1 4.15Å; K496-L501 HydrophobicContact CB-CD2 3.87Å; K496-L501 HydrophobicContact CB-CG 4.15Å; K496-T531 WeakPolarHBondContact CE-O 3.12Å; K496-T531 PolarHBondContact NZ-O 2.88Å; K496-E533 VanDerWaalsContact CE-O 3.29Å; K496-E533 WeakPolarHBondContact CE-O 3.36Å; K496-E533 PolarHBondContact NZ-O 3.19Å; K496-Y536 HydrophobicContact CB-CD1 4.24Å; K496-Y536 HydrophobicContact CB-CE1 4.02Å; K496-Y536 HydrophobicContact CD-CE1 4.16Å; K496-Y536 HydrophobicContact CD-CE2 4.3Å; K496-Y536 WeakPolarHBondContact CD-OH 3.39Å; K496-Y536 HydrophobicContact CG-CE1 4.13Å; K496-Y536 HydrophobicContact CG-CE2 4.23Å
497	D	85.9	Confident	90.1	Very high	79 Å²	79	64.6 Å²	64.6	42%	0.422	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	31.8	178.8	-55.3	-54.7	0	0	0	113.5	G534 R535	D497-G534 WeakPolarHBondContact OD1-CA 3.21Å; D497-G534 WeakPolarHBondContact OD2-CA 3.03Å; D497-R535 PolarHBondContact N-O 3.39Å; D497-R535 PolarHBondContact OD1-N 2.8Å
498	G	78.9	Confident	90.4	Very high	6 Å²	6	62 Å²	62	6%	0.062	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	-24.8	-177	0	0	0	0	0	114.8	R495 K496	R495-G498 WeakPolarHBondContact CD-O 3.46Å; R495-G498 PolarHBondContact NH1-O 3.21Å; K496-G498 PolarHBondContact O-N 3.07Å; K496-G498 VanDerWaalsContact O-N 3.08Å
499	E	82.9	Confident	90.6	Very high	65 Å²	65	66.5 Å²	66.5	30%	0.304	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	146.7	-179.7	-74.6	-63.6	173.6	0	0	113.6	R286 H310 R495 K496	R286-E499 IonicContact CZ-OE1 2.75Å; R286-E499 IonicContact NH1-OE1 2.71Å; R286-E499 PolarHBondContact NH1-OE1 3Å; R286-E499 IonicContact NH2-OE1 3.8Å; R286-E499 PolarHBondContact NH2-OE1 3.08Å; H310-E499 IonicContact CE1-OE1 3.58Å; H310-E499 PolarHBondContact CE1-OE1 3.18Å; H310-E499 IonicContact CG-OE1 2.81Å; H310-E499 IonicContact ND1-OE1 2.69Å; H310-E499 PolarHBondContact ND1-OE1 2.8Å; H310-E499 IonicContact ND1-OE2 3.15Å; R495-E499 CarbonylContact C-O 3.19Å; R495-E499 WeakPolarHBondContact CA-O 3.37Å; R495-E499 VanDerWaalsContact CB-O 3.26Å; R495-E499 WeakPolarHBondContact CB-O 3.5Å; K496-E499 PolarHBondContact N-O 2.57Å; K496-E499 PolarHBondContact O-N 2.97Å
500	V	88.4	Confident	90.5	Very high	34 Å²	34	64.5 Å²	64.5	21%	0.206	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	129.5	179.3	176.5	0	0	0	0	111	A493 R495 Y502	A493-V500 HydrophobicContact CB-CG1 4.36Å; R495-V500 HydrophobicContact CG-CG2 4.08Å; V500-Y502 HydrophobicContact CB-CE2 3.94Å; V500-Y502 HydrophobicContact CG1-CD1 4.28Å; V500-Y502 HydrophobicContact CG1-CD2 4.34Å; V500-Y502 HydrophobicContact CG1-CE1 3.98Å; V500-Y502 HydrophobicContact CG1-CE2 4.05Å; V500-Y502 HydrophobicContact CG1-CG 4.45Å; V500-Y502 WeakPolarHBondContact O-CD2 3.41Å; V500-Y502 PolarHBondContact O-N 3.19Å
501	L	92.5	Very high	90.4	Very high	52 Å²	52	69.5 Å²	69.5	27%	0.272	36%	0.356	S	S	.	.			trans	-87.1	98.4	175.2	-60.2	176.2	0	0	0	110	W494 K496 A504 L523 Y536	W494-L501 HydrophobicContact CB-CD1 4.2Å; W494-L501 PolarHBondContact O-N 3.41Å; K496-L501 HydrophobicContact CB-CD1 4.15Å; K496-L501 HydrophobicContact CB-CD2 3.87Å; K496-L501 HydrophobicContact CB-CG 4.15Å; L501-A504 HydrophobicContact CB-CB 3.84Å; L501-A504 HydrophobicContact CD1-CB 4.42Å; L501-L523 HydrophobicContact CD1-CD2 4.1Å; L501-Y536 HydrophobicContact CD1-CD1 4.13Å; L501-Y536 HydrophobicContact CD1-CE1 3.81Å
502	Y	87.8	Confident	90	Very high	192 Å²	192	72.8 Å²	72.8	75%	0.753	36%	0.361	S	S	*	.	S	Bend	trans	-76.1	-44	-178.9	-65.7	-82.6	0	0	0	113.2	V500	V500-Y502 HydrophobicContact CB-CE2 3.94Å; V500-Y502 HydrophobicContact CG1-CD1 4.28Å; V500-Y502 HydrophobicContact CG1-CD2 4.34Å; V500-Y502 HydrophobicContact CG1-CE1 3.98Å; V500-Y502 HydrophobicContact CG1-CE2 4.05Å; V500-Y502 HydrophobicContact CG1-CG 4.45Å; V500-Y502 WeakPolarHBondContact O-CD2 3.41Å; V500-Y502 PolarHBondContact O-N 3.19Å
503	D	87.1	Confident	89.5	Confident	168 Å²	168	75.6 Å²	75.6	90%	0.898	37%	0.372	S	S	*	.	S	Bend	trans	-99	23.5	-173.4	-56.3	-63.9	0	0	0	113.6
504	A	88.4	Confident	89	Confident	34 Å²	34	84 Å²	84	28%	0.281	41%	0.405	S	S	.	.			trans	-78	145.3	-178.1	0	0	0	0	0	113.4	L501 V506 L523	L501-A504 HydrophobicContact CB-CB 3.84Å; L501-A504 HydrophobicContact CD1-CB 4.42Å; A504-V506 HydrophobicContact CB-CG2 4Å; A504-V506 PolarHBondContact O-N 3.4Å; A504-L523 HydrophobicContact CB-CD1 3.67Å
505	E	93.9	Very high	88.2	Confident	113 Å²	113	87 Å²	87	53%	0.528	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	93.3	171.1	-70.3	-166.4	-169.5	0	0	110.7	H524 L526	E505-H524 HydrophobicContact CB-CB 4.09Å; E505-H524 PolarHBondContact O-N 3.14Å; E505-L526 WeakPolarHBondContact OE2-CD1 3.3Å
506	V	94.5	Very high	87.8	Confident	49 Å²	49	89 Å²	89	30%	0.297	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.9	-178.5	-179.4	0	0	0	0	110.8	W494 A504 N508 T521 V522 L523	W494-V506 HydrophobicContact CG-CG2 4.49Å; A504-V506 HydrophobicContact CB-CG2 4Å; A504-V506 PolarHBondContact O-N 3.4Å; V506-N508 WeakPolarHBondContact CG1-OD1 3.48Å; V506-T521 WeakPolarHBondContact CG1-OG1 3.37Å; V506-V522 CarbonylContact C-O 3.57Å; V506-V522 WeakPolarHBondContact CA-O 3.2Å; V506-L523 HydrophobicContact CG2-CD1 4.12Å
507	Q	95.4	Very high	87.4	Confident	86 Å²	86	87.9 Å²	87.9	40%	0.402	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	125	171.6	-63.2	-174.5	18.6	0	0	109.8	Y509 T521 V522	Q507-Y509 HydrophobicContact CB-CE2 4.04Å; Q507-Y509 PolarHBondContact OE1-OH 3.28Å; Q507-T521 WeakPolarHBondContact O-CA 3.25Å; Q507-V522 PolarHBondContact N-O 3.26Å; Q507-V522 PolarHBondContact O-N 3.37Å
508	N	93.1	Very high	87.6	Confident	67 Å²	67	84.5 Å²	84.5	36%	0.358	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.4	-175.3	-71.5	-33.9	0	0	0	110.9	T492 V506 Y519 T520 T521	T492-N508 PolarHBondContact OG1-ND2 3.41Å; T492-N508 PolarHBondContact OG1-OD1 2.66Å; V506-N508 WeakPolarHBondContact CG1-OD1 3.48Å; N508-Y519 HydrophobicContact CB-CE1 3.84Å; N508-T520 WeakPolarHBondContact CA-O 3.48Å; N508-T521 WeakPolarHBondContact OD1-CB 3.22Å; N508-T521 PolarHBondContact OD1-OG1 2.82Å
509	Y	91.3	Very high	88.3	Confident	119 Å²	119	86 Å²	86	47%	0.467	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	124.1	-179.1	-50.4	-84	0	0	0	110.3	Q507 Y519 T520 V522	Q507-Y509 HydrophobicContact CB-CE2 4.04Å; Q507-Y509 PolarHBondContact OE1-OH 3.28Å; Y509-Y519 CarbonylContact O-C 3.5Å; Y509-Y519 WeakPolarHBondContact O-CA 3.47Å; Y509-T520 PolarHBondContact N-O 3.36Å; Y509-T520 PolarHBondContact O-N 2.75Å; Y509-V522 HydrophobicContact CE2-CG2 4.4Å
510	A	89.6	Confident	88.8	Confident	67 Å²	67	84 Å²	84	55%	0.554	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	134.7	172.5	0	0	0	0	0	110.1	L517 V518 Y519	A510-L517 HydrophobicContact CB-CD1 4.29Å; A510-V518 WeakPolarHBondContact CA-O 3.4Å; A510-Y519 HydrophobicContact CB-CD2 3.93Å; A510-Y519 HydrophobicContact CB-CE2 4.09Å
511	R	88.3	Confident	89.2	Confident	114 Å²	114	82.4 Å²	82.4	43%	0.43	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	137	177.6	66.4	-171.1	-161.6	-148.4	4.9	110.1	Q513 V518	R511-Q513 HydrophobicContact CG-CG 4.22Å; R511-Q513 VanDerWaalsContact NE-CD 3.33Å; R511-V518 HydrophobicContact CG-CB 3.93Å; R511-V518 HydrophobicContact CG-CG1 4.32Å; R511-V518 PolarHBondContact N-O 3.45Å; R511-V518 WeakPolarHBondContact O-CA 3.37Å; R511-V518 WeakPolarHBondContact O-CB 3.49Å; R511-V518 PolarHBondContact O-N 3.14Å; R511-V518 VanDerWaalsContact O-O 3.11Å
512	Y	85.1	Confident	89.4	Confident	148 Å²	148	81 Å²	81	58%	0.58	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	131.1	169.9	-71.8	-89.7	0	0	0	109.6	E516 L517	Y512-E516 VanDerWaalsContact CA-O 3.32Å; Y512-E516 WeakPolarHBondContact CA-O 2.97Å; Y512-L517 HydrophobicContact CD1-CB 4.33Å; Y512-L517 HydrophobicContact CD1-CD1 4.41Å; Y512-L517 HydrophobicContact CD2-CD1 4.34Å; Y512-L517 HydrophobicContact CE1-CB 3.98Å; Y512-L517 HydrophobicContact CE1-CD1 4.06Å; Y512-L517 HydrophobicContact CE2-CD1 3.98Å
513	Q	82.9	Confident	89.9	Confident	90 Å²	90	71.9 Å²	71.9	42%	0.421	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	127.1	174.1	-64.4	-170	-78.5	0	0	109.5	R511 G515 E516 V518	R511-Q513 HydrophobicContact CG-CG 4.22Å; R511-Q513 VanDerWaalsContact NE-CD 3.33Å; Q513-G515 PolarHBondContact O-N 3.04Å; Q513-E516 PolarHBondContact N-O 3.04Å; Q513-E516 PolarHBondContact O-N 3.24Å; Q513-V518 HydrophobicContact CB-CG2 4.06Å; Q513-V518 HydrophobicContact CG-CG2 4.33Å
514	E	83	Confident	90.3	Very high	214 Å²	214	66.6 Å²	66.6	100%	1	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	10.9	177.3	-53.1	-166	162.2	0	0	116.3
515	G	77.8	Confident	90.6	Very high	65 Å²	65	65.8 Å²	65.8	67%	0.67	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.9	-12.9	-176.8	0	0	0	0	0	113.7	Q513	Q513-G515 PolarHBondContact O-N 3.04Å
516	E	84.8	Confident	90.7	Very high	69 Å²	69	64.4 Å²	64.4	32%	0.322	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	145.7	175.7	-58	-175.4	-175.1	0	0	111.7	F456 S483 Y512 Q513 V518	F456-E516 HydrophobicContact CZ-CG 4.32Å; F456-E516 WeakPolarHBondContact CZ-OE1 3.44Å; S483-E516 WeakPolarHBondContact CB-OE2 3.3Å; S483-E516 PolarHBondContact OG-OE2 3.21Å; Y512-E516 VanDerWaalsContact CA-O 3.32Å; Y512-E516 WeakPolarHBondContact CA-O 2.97Å; Q513-E516 PolarHBondContact N-O 3.04Å; Q513-E516 PolarHBondContact O-N 3.24Å; E516-V518 PolarHBondContact O-N 2.76Å
517	L	84	Confident	90.7	Very high	14 Å²	14	67.3 Å²	67.3	7%	0.073	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	111.7	164.9	178.7	61	0	0	0	108.4	S483 S484 M490 A510 Y512	S483-L517 CarbonylContact C-O 3.48Å; S483-L517 VanDerWaalsContact CA-O 3.26Å; S483-L517 WeakPolarHBondContact CA-O 3.5Å; S484-L517 PolarHBondContact N-O 2.87Å; S484-L517 PolarHBondContact O-N 2.85Å; M490-L517 HydrophobicContact CE-CB 4.14Å; M490-L517 HydrophobicContact CE-CD2 3.87Å; M490-L517 HydrophobicContact CE-CG 3.67Å; M490-L517 WeakPolarHBondContact CE-O 3.26Å; A510-L517 HydrophobicContact CB-CD1 4.29Å; Y512-L517 HydrophobicContact CD1-CB 4.33Å; Y512-L517 HydrophobicContact CD1-CD1 4.41Å; Y512-L517 HydrophobicContact CD2-CD1 4.34Å; Y512-L517 HydrophobicContact CE1-CB 3.98Å; Y512-L517 HydrophobicContact CE1-CD1 4.06Å; Y512-L517 HydrophobicContact CE2-CD1 3.98Å
518	V	90.2	Very high	90.7	Very high	9 Å²	9	63.2 Å²	63.2	6%	0.055	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	132.3	176.3	-177.3	0	0	0	0	109.4	L481 A482 A510 R511 Q513 E516	L481-V518 HydrophobicContact CD1-CG1 3.63Å; L481-V518 HydrophobicContact CD2-CG1 4.34Å; L481-V518 HydrophobicContact CG-CG1 3.99Å; A482-V518 CarbonylContact O-C 3.58Å; A482-V518 WeakPolarHBondContact O-CA 3.4Å; A510-V518 WeakPolarHBondContact CA-O 3.4Å; R511-V518 HydrophobicContact CG-CB 3.93Å; R511-V518 HydrophobicContact CG-CG1 4.32Å; R511-V518 PolarHBondContact N-O 3.45Å; R511-V518 WeakPolarHBondContact O-CA 3.37Å; R511-V518 WeakPolarHBondContact O-CB 3.49Å; R511-V518 PolarHBondContact O-N 3.14Å; R511-V518 VanDerWaalsContact O-O 3.11Å; Q513-V518 HydrophobicContact CB-CG2 4.06Å; Q513-V518 HydrophobicContact CG-CG2 4.33Å; E516-V518 PolarHBondContact O-N 2.76Å
519	Y	92.6	Very high	90.8	Very high	38 Å²	38	62.7 Å²	62.7	15%	0.149	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	122.7	-177.3	-151.1	-81.2	0	0	0	110.1	L481 A482 M490 T492 N508 Y509 A510	L481-Y519 WeakPolarHBondContact CA-O 3.49Å; A482-Y519 PolarHBondContact N-O 3.48Å; A482-Y519 PolarHBondContact O-N 3.39Å; M490-Y519 HydrophobicContact CB-CD2 3.83Å; M490-Y519 HydrophobicContact CB-CE2 4.2Å; M490-Y519 HydrophobicContact CB-CG 4.22Å; T492-Y519 HydrophobicContact CG2-CD1 3.65Å; T492-Y519 HydrophobicContact CG2-CE1 3.47Å; T492-Y519 VanDerWaalsContact CG2-CE1 3.47Å; N508-Y519 HydrophobicContact CB-CE1 3.84Å; Y509-Y519 CarbonylContact O-C 3.5Å; Y509-Y519 WeakPolarHBondContact O-CA 3.47Å; A510-Y519 HydrophobicContact CB-CD2 3.93Å; A510-Y519 HydrophobicContact CB-CE2 4.09Å
520	T	94.7	Very high	90.9	Very high	21 Å²	21	60.6 Å²	60.6	13%	0.129	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.4	172.4	-43.6	0	0	0	0	108.8	C480 L481 N508 Y509 V522	C480-T520 WeakPolarHBondContact O-CA 3.32Å; L481-T520 HydrophobicContact CD1-CG2 4.14Å; L481-T520 WeakPolarHBondContact CD1-OG1 3.21Å; N508-T520 WeakPolarHBondContact CA-O 3.48Å; Y509-T520 PolarHBondContact N-O 3.36Å; Y509-T520 PolarHBondContact O-N 2.75Å; T520-V522 HydrophobicContact CG2-CG2 4.3Å
521	T	96.1	Very high	91.2	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.012	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	136.7	168.1	-175.7	0	0	0	0	109.7	S479 C480 T492 W494 V506 Q507 N508 C538	S479-T521 CarbonylContact C-O 2.94Å; C480-T521 HydrophobicContact CB-CG2 3.68Å; C480-T521 PolarHBondContact N-O 3.43Å; C480-T521 PolarHBondContact O-N 2.71Å; T492-T521 HydrophobicContact CG2-CG2 3.95Å; W494-T521 HydrophobicContact CZ2-CG2 3.96Å; W494-T521 PolarHBondContact NE1-OG1 3.34Å; V506-T521 WeakPolarHBondContact CG1-OG1 3.37Å; Q507-T521 WeakPolarHBondContact O-CA 3.25Å; N508-T521 WeakPolarHBondContact OD1-CB 3.22Å; N508-T521 PolarHBondContact OD1-OG1 2.82Å; T521-C538 VanDerWaalsContact CG2-SG 3.54Å
522	V	96.9	Very high	91.5	Very high	22 Å²	22	58.3 Å²	58.3	13%	0.133	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	118.4	179.8	-174.3	0	0	0	0	108.3	L478 V506 Q507 Y509 T520	L478-V522 WeakPolarHBondContact O-CA 3.43Å; V506-V522 CarbonylContact C-O 3.57Å; V506-V522 WeakPolarHBondContact CA-O 3.2Å; Q507-V522 PolarHBondContact N-O 3.26Å; Q507-V522 PolarHBondContact O-N 3.37Å; Y509-V522 HydrophobicContact CE2-CG2 4.4Å; T520-V522 HydrophobicContact CG2-CG2 4.3Å
523	L	97.4	Very high	91.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.3	170.7	170.9	62.3	0	0	0	109.1	T477 L478 W494 L501 A504 V506 L525 Y536	T477-L523 CarbonylContact C-O 3.15Å; T477-L523 VanDerWaalsContact CA-O 3.28Å; T477-L523 WeakPolarHBondContact CA-O 3.08Å; L478-L523 HydrophobicContact CB-CB 4.49Å; L478-L523 PolarHBondContact N-O 2.84Å; L478-L523 PolarHBondContact O-N 2.99Å; W494-L523 HydrophobicContact CB-CD2 4.18Å; W494-L523 HydrophobicContact CD2-CB 3.63Å; W494-L523 HydrophobicContact CD2-CD2 3.93Å; W494-L523 HydrophobicContact CD2-CG 4.37Å; W494-L523 HydrophobicContact CE3-CB 4.06Å; W494-L523 HydrophobicContact CE3-CD2 3.81Å; W494-L523 HydrophobicContact CG-CB 3.95Å; W494-L523 HydrophobicContact CG-CD2 4.1Å; W494-L523 HydrophobicContact CG-CG 4.45Å; W494-L523 HydrophobicContact CH2-CB 4.37Å; W494-L523 HydrophobicContact CZ2-CB 3.98Å; W494-L523 HydrophobicContact CZ3-CB 4.41Å; W494-L523 HydrophobicContact CZ3-CD2 4.48Å; L501-L523 HydrophobicContact CD1-CD2 4.1Å; A504-L523 HydrophobicContact CB-CD1 3.67Å; V506-L523 HydrophobicContact CG2-CD1 4.12Å; L523-L525 HydrophobicContact CD1-CD2 4.1Å; L523-L525 HydrophobicContact CD2-CD2 4.14Å; L523-L525 HydrophobicContact CD2-CG 4.37Å; L523-L525 HydrophobicContact CG-CD2 4.07Å; L523-L525 HydrophobicContact CG-CG 4.16Å; L523-Y536 HydrophobicContact CD2-CD1 3.47Å; L523-Y536 VanDerWaalsContact CD2-CD1 3.47Å; L523-Y536 HydrophobicContact CD2-CE1 3.72Å
524	H	96.4	Very high	92.5	Very high	57 Å²	57	49.9 Å²	49.9	26%	0.264	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.8	172.7	-59.4	-95.7	0	0	0	109.4	T477 E505 L526	T477-H524 WeakPolarHBondContact CG2-CE1 3.36Å; T477-H524 WeakPolarHBondContact CG2-ND1 3.39Å; E505-H524 HydrophobicContact CB-CB 4.09Å; E505-H524 PolarHBondContact O-N 3.14Å; H524-L526 HydrophobicContact CB-CD2 4.48Å
525	L	95.7	Very high	93	Very high	18 Å²	18	45.1 Å²	45.1	9%	0.094	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	107.3	173.8	-58.1	171.9	0	0	0	107	N475 V476 L523 V528 Y536 L554	N475-L525 CarbonylContact C-O 3.51Å; N475-L525 WeakPolarHBondContact CA-O 3.31Å; V476-L525 HydrophobicContact CB-CB 4.34Å; V476-L525 PolarHBondContact N-O 3.24Å; V476-L525 PolarHBondContact O-N 3.34Å; L523-L525 HydrophobicContact CD1-CD2 4.1Å; L523-L525 HydrophobicContact CD2-CD2 4.14Å; L523-L525 HydrophobicContact CD2-CG 4.37Å; L523-L525 HydrophobicContact CG-CD2 4.07Å; L523-L525 HydrophobicContact CG-CG 4.16Å; L525-V528 HydrophobicContact CB-CG1 3.52Å; L525-Y536 HydrophobicContact CD1-CE1 3.87Å; L525-Y536 HydrophobicContact CD1-CE2 4.13Å; L525-Y536 HydrophobicContact CD2-CE1 4.06Å; L525-L554 HydrophobicContact CD1-CD2 3.62Å
526	L	94.5	Very high	93.9	Very high	83 Å²	83	42.1 Å²	42.1	44%	0.435	21%	0.212	S	C	.	.			trans	-95.5	138.6	-175.7	-54.8	-172.7	0	0	0	110.8	N475 E505 H524 V528	N475-L526 HydrophobicContact CB-CD2 4.23Å; N475-L526 WeakPolarHBondContact OD1-CA 3.39Å; E505-L526 WeakPolarHBondContact OE2-CD1 3.3Å; H524-L526 HydrophobicContact CB-CD2 4.48Å; L526-V528 PolarHBondContact O-N 2.96Å
527	N	94.2	Very high	94.3	Very high	110 Å²	110	39.1 Å²	39.1	59%	0.588	20%	0.198	S	C	*	.	S	Bend	trans	51.7	50	177.4	-174.9	80.2	0	0	0	112.5	T474 N475	T474-N527 CarbonylContact O-C 3.47Å; T474-N527 VanDerWaalsContact O-CA 3.24Å; T474-N527 WeakPolarHBondContact O-CA 3.06Å; T474-N527 PolarHBondContact O-N 3.43Å; T474-N527 VanDerWaalsContact O-N 3.08Å; N475-N527 PolarHBondContact OD1-N 2.88Å
528	V	95.3	Very high	94.9	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	19%	0.194	C	C	.	.			trans	-56.8	141.9	-169.6	-71.2	0	0	0	0	113.2	A470 R472 G473 T474 V476 L525 L526 D532 L554 V556	A470-V528 HydrophobicContact CB-CG2 3.84Å; R472-V528 CarbonylContact C-O 3.22Å; R472-V528 WeakPolarHBondContact CA-O 3.32Å; G473-V528 PolarHBondContact N-O 2.85Å; T474-V528 WeakPolarHBondContact O-CG2 3.42Å; T474-V528 PolarHBondContact O-N 2.87Å; V476-V528 HydrophobicContact CB-CG1 4.35Å; V476-V528 HydrophobicContact CG2-CG1 4.02Å; V476-V528 HydrophobicContact CG2-CG2 3.94Å; L525-V528 HydrophobicContact CB-CG1 3.52Å; L526-V528 PolarHBondContact O-N 2.96Å; V528-D532 WeakPolarHBondContact CA-OD2 3.02Å; V528-D532 HydrophobicContact CB-CB 4.33Å; V528-D532 HydrophobicContact CG1-CB 4.3Å; V528-L554 HydrophobicContact CG1-CD2 4.29Å; V528-V556 HydrophobicContact CB-CG2 4.32Å; V528-V556 HydrophobicContact CG2-CG2 4.3Å
529	N	95.7	Very high	95.1	Very high	56 Å²	56	38.6 Å²	38.6	30%	0.299	20%	0.195	S	C	.	.			trans	-134.2	178.4	-177.7	89	96.8	0	0	0	110.5	T531 D532	N529-T531 PolarHBondContact ND2-OG1 2.76Å; N529-T531 PolarHBondContact O-N 2.86Å; N529-T531 PolarHBondContact OD1-N 2.92Å; N529-T531 PolarHBondContact OD1-OG1 2.83Å; N529-D532 PolarHBondContact N-OD2 3.25Å; N529-D532 PolarHBondContact ND2-OD2 3.36Å; N529-D532 WeakPolarHBondContact O-CA 3.33Å; N529-D532 VanDerWaalsContact O-CB 3.31Å; N529-D532 WeakPolarHBondContact O-CB 3.24Å; N529-D532 PolarHBondContact O-N 2.87Å
530	F	94.6	Very high	95.1	Very high	74 Å²	74	36.8 Å²	36.8	33%	0.325	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-63.5	-24	-174.9	-53.1	-57.8	0	0	0	114.1	D532 E533 V556 E558 H586	F530-D532 PolarHBondContact O-N 3.27Å; F530-E533 WeakPolarHBondContact O-CB 3.38Å; F530-E533 PolarHBondContact O-N 3.18Å; F530-V556 HydrophobicContact CD1-CB 4.25Å; F530-V556 HydrophobicContact CD1-CG1 4.09Å; F530-V556 WeakPolarHBondContact CD1-O 3.35Å; F530-V556 HydrophobicContact CE1-CG1 4.22Å; F530-V556 WeakPolarHBondContact CE1-O 3.32Å; F530-E558 HydrophobicContact CE1-CB 4.41Å; F530-E558 HydrophobicContact CZ-CB 3.89Å; F530-E558 WeakPolarHBondContact CZ-OE2 3.42Å; F530-H586 AromaticContact CD1-ND1 3.73Å; F530-H586 HydrophobicContact CE1-CB 3.61Å; F530-H586 AromaticContact CE1-CG 3.6Å; F530-H586 AromaticContact CE1-ND1 3.37Å; F530-H586 WeakPolarHBondContact CE1-ND1 3.46Å; F530-H586 HydrophobicContact CZ-CB 3.61Å
531	T	94.2	Very high	95.1	Very high	100 Å²	100	37.4 Å²	37.4	61%	0.613	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-68.1	-18.7	172.3	68.1	0	0	0	0	113.2	K496 N529	K496-T531 WeakPolarHBondContact CE-O 3.12Å; K496-T531 PolarHBondContact NZ-O 2.88Å; N529-T531 PolarHBondContact ND2-OG1 2.76Å; N529-T531 PolarHBondContact O-N 2.86Å; N529-T531 PolarHBondContact OD1-N 2.92Å; N529-T531 PolarHBondContact OD1-OG1 2.83Å
532	D	94.6	Very high	94.9	Very high	34 Å²	34	37.7 Å²	37.7	18%	0.182	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-86	-8.2	176.7	-50.9	-51	0	0	0	111.9	V528 N529 F530 G534 Y536 L554	V528-D532 WeakPolarHBondContact CA-OD2 3.02Å; V528-D532 HydrophobicContact CB-CB 4.33Å; V528-D532 HydrophobicContact CG1-CB 4.3Å; N529-D532 PolarHBondContact N-OD2 3.25Å; N529-D532 PolarHBondContact ND2-OD2 3.36Å; N529-D532 WeakPolarHBondContact O-CA 3.33Å; N529-D532 VanDerWaalsContact O-CB 3.31Å; N529-D532 WeakPolarHBondContact O-CB 3.24Å; N529-D532 PolarHBondContact O-N 2.87Å; F530-D532 PolarHBondContact O-N 3.27Å; D532-G534 PolarHBondContact O-N 3.05Å; D532-Y536 VanDerWaalsContact O-CE2 3.26Å; D532-Y536 WeakPolarHBondContact O-CE2 3.05Å; D532-Y536 PolarHBondContact O-OH 3.16Å; D532-Y536 VanDerWaalsContact O-OH 3.05Å; D532-L554 HydrophobicContact CB-CD2 4.32Å; D532-L554 WeakPolarHBondContact O-CD2 3.31Å
533	E	95.1	Very high	94.5	Very high	52 Å²	52	43.2 Å²	43.2	24%	0.243	22%	0.219	C	C	.	.			trans	-62.5	130.2	168.9	-68.9	-151.7	107.5	0	0	110.7	K496 F530 T555 V556 H586	K496-E533 VanDerWaalsContact CE-O 3.29Å; K496-E533 WeakPolarHBondContact CE-O 3.36Å; K496-E533 PolarHBondContact NZ-O 3.19Å; F530-E533 WeakPolarHBondContact O-CB 3.38Å; F530-E533 PolarHBondContact O-N 3.18Å; E533-T555 VanDerWaalsContact OE1-CA 3.22Å; E533-T555 WeakPolarHBondContact OE1-CA 3.32Å; E533-T555 VanDerWaalsContact OE1-CG2 3.25Å; E533-T555 WeakPolarHBondContact OE1-CG2 3.32Å; E533-V556 HydrophobicContact CG-CB 3.71Å; E533-V556 HydrophobicContact CG-CG2 3.9Å; E533-V556 PolarHBondContact OE1-N 2.03Å; E533-H586 IonicContact OE2-CE1 3.6Å
534	G	94.4	Very high	94.1	Very high	9 Å²	9	44.5 Å²	44.5	9%	0.093	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.9	179.3	-177.8	0	0	0	0	0	114.4	D497 D532 K553 L554	D497-G534 WeakPolarHBondContact OD1-CA 3.21Å; D497-G534 WeakPolarHBondContact OD2-CA 3.03Å; D532-G534 PolarHBondContact O-N 3.05Å; G534-K553 CarbonylContact O-C 3.51Å; G534-K553 WeakPolarHBondContact O-CA 3.17Å; G534-L554 PolarHBondContact N-O 2.8Å; G534-L554 PolarHBondContact O-N 3.06Å
535	R	94.2	Very high	93.7	Very high	113 Å²	113	41.9 Å²	41.9	43%	0.426	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	102.1	174.2	-68.8	176	177.5	178.9	-0.8	109.6	E313 D497 R551 A552	E313-R535 VanDerWaalsContact CD-NH1 3.28Å; E313-R535 IonicContact OE1-CZ 2.87Å; E313-R535 IonicContact OE1-NH1 2.67Å; E313-R535 PolarHBondContact OE1-NH1 3.39Å; E313-R535 IonicContact OE1-NH2 2.78Å; E313-R535 IonicContact OE2-NH1 2.97Å; E313-R535 PolarHBondContact OE2-NH1 3.34Å; D497-R535 PolarHBondContact N-O 3.39Å; D497-R535 PolarHBondContact OD1-N 2.8Å; R535-R551 HydrophobicContact CB-CB 4.29Å; R535-A552 CarbonylContact C-O 3.56Å; R535-A552 WeakPolarHBondContact CA-O 3.32Å
536	Y	95.8	Very high	93.5	Very high	3 Å²	3	41.6 Å²	41.6	1%	0.012	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	142.8	177.3	-72.4	-95.3	0	0	0	112.1	L478 R495 K496 L501 L523 L525 D532 R551 A552 L554	L478-Y536 VanDerWaalsContact CD1-CB 3.44Å; L478-Y536 HydrophobicContact CD1-CD1 4.15Å; L478-Y536 HydrophobicContact CD1-CD2 4.09Å; L478-Y536 HydrophobicContact CD1-CG 3.63Å; R495-Y536 CarbonylContact O-C 3.52Å; R495-Y536 VanDerWaalsContact O-CA 3.26Å; R495-Y536 WeakPolarHBondContact O-CA 3.38Å; K496-Y536 HydrophobicContact CB-CD1 4.24Å; K496-Y536 HydrophobicContact CB-CE1 4.02Å; K496-Y536 HydrophobicContact CD-CE1 4.16Å; K496-Y536 HydrophobicContact CD-CE2 4.3Å; K496-Y536 WeakPolarHBondContact CD-OH 3.39Å; K496-Y536 HydrophobicContact CG-CE1 4.13Å; K496-Y536 HydrophobicContact CG-CE2 4.23Å; L501-Y536 HydrophobicContact CD1-CD1 4.13Å; L501-Y536 HydrophobicContact CD1-CE1 3.81Å; L523-Y536 HydrophobicContact CD2-CD1 3.47Å; L523-Y536 VanDerWaalsContact CD2-CD1 3.47Å; L523-Y536 HydrophobicContact CD2-CE1 3.72Å; L525-Y536 HydrophobicContact CD1-CE1 3.87Å; L525-Y536 HydrophobicContact CD1-CE2 4.13Å; L525-Y536 HydrophobicContact CD2-CE1 4.06Å; D532-Y536 VanDerWaalsContact O-CE2 3.26Å; D532-Y536 WeakPolarHBondContact O-CE2 3.05Å; D532-Y536 PolarHBondContact O-OH 3.16Å; D532-Y536 VanDerWaalsContact O-OH 3.05Å; Y536-R551 CarbonylContact O-C 3.55Å; Y536-R551 WeakPolarHBondContact O-CA 3.44Å; Y536-A552 PolarHBondContact N-O 3Å; Y536-A552 PolarHBondContact O-N 3.43Å; Y536-L554 HydrophobicContact CD2-CB 3.96Å; Y536-L554 HydrophobicContact CE2-CB 3.77Å; Y536-L554 HydrophobicContact CE2-CD2 4.04Å
537	Q	94.5	Very high	93.3	Very high	5 Å²	5	40.1 Å²	40.1	2%	0.023	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	136.4	179.9	-177.5	-178.6	62.7	0	0	110.9	D338 W494 R495 S549 R551	D338-Q537 VanDerWaalsContact CG-NE2 3.31Å; D338-Q537 PolarHBondContact OD1-NE2 2.99Å; D338-Q537 PolarHBondContact OD2-NE2 3.16Å; D338-Q537 PolarHBondContact OD2-OE1 3.47Å; W494-Q537 CarbonylContact C-O 3.52Å; W494-Q537 WeakPolarHBondContact CA-O 3.33Å; R495-Q537 HydrophobicContact CB-CB 4.35Å; R495-Q537 PolarHBondContact N-O 2.92Å; R495-Q537 PolarHBondContact O-N 2.68Å; Q537-S549 WeakPolarHBondContact CG-OG 3.2Å; Q537-S549 PolarHBondContact NE2-O 3.25Å; Q537-R551 HydrophobicContact CB-CG 4.32Å
538	C	95.4	Very high	93.2	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	132.3	170.5	167.8	0	0	0	0	109.9	C480 W494 T521 S549	C480-C538 HydrophobicContact CB-CB 3.38Å; C480-C538 WeakPolarHBondContact CB-SG 3.49Å; C480-C538 WeakPolarHBondContact SG-CB 3.49Å; C480-C538 CovalentContact SG-SG 2.03Å; C480-C538 PolarHBondContact SG-SG 3.05Å; W494-C538 HydrophobicContact CD2-CB 4.41Å; W494-C538 HydrophobicContact CE3-CB 4.24Å; W494-C538 HydrophobicContact CH2-CB 3.94Å; W494-C538 HydrophobicContact CZ2-CB 4.1Å; W494-C538 HydrophobicContact CZ3-CB 4.01Å; T521-C538 VanDerWaalsContact CG2-SG 3.54Å; C538-S549 PolarHBondContact N-OG 3.31Å; C538-S549 PolarHBondContact O-N 2.85Å; C538-S549 PolarHBondContact O-OG 3.36Å
539	V	94.1	Very high	93.2	Very high	12 Å²	12	36.3 Å²	36.3	7%	0.073	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	121.9	170.4	-171.7	0	0	0	0	108.5	T492 A493 R495 A546 N547 Y548	T492-V539 VanDerWaalsContact CA-O 3.31Å; T492-V539 WeakPolarHBondContact CA-O 3.44Å; A493-V539 PolarHBondContact N-O 2.78Å; A493-V539 PolarHBondContact O-N 2.84Å; R495-V539 HydrophobicContact CG-CG2 4.22Å; V539-A546 HydrophobicContact CG1-CB 4.1Å; V539-N547 WeakPolarHBondContact CA-O 3.4Å; V539-Y548 HydrophobicContact CB-CD1 4.36Å; V539-Y548 HydrophobicContact CB-CE1 4.46Å; V539-Y548 HydrophobicContact CG1-CD1 3.98Å; V539-Y548 HydrophobicContact CG1-CE1 3.77Å; V539-Y548 HydrophobicContact CG1-CE2 4.49Å; V539-Y548 HydrophobicContact CG1-CG 4.42Å; V539-Y548 HydrophobicContact CG2-CD1 3.55Å; V539-Y548 HydrophobicContact CG2-CE1 3.77Å; V539-Y548 HydrophobicContact CG2-CG 4.42Å
540	V	94.5	Very high	93	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.1	176	-169.5	0	0	0	0	108.6	P459 I461 A482 M490 T492 A546 N547	P459-V540 HydrophobicContact CB-CB 4.36Å; P459-V540 HydrophobicContact CB-CG1 3.98Å; P459-V540 HydrophobicContact CG-CG1 4.39Å; I461-V540 HydrophobicContact CD1-CG2 4.26Å; I461-V540 HydrophobicContact CG1-CG2 4.12Å; A482-V540 HydrophobicContact CB-CB 4.18Å; A482-V540 HydrophobicContact CB-CG1 3.98Å; A482-V540 HydrophobicContact CB-CG2 3.94Å; M490-V540 HydrophobicContact CB-CG1 4.3Å; M490-V540 HydrophobicContact CG-CG1 4.31Å; M490-V540 HydrophobicContact SD-CG1 3.81Å; T492-V540 HydrophobicContact CG2-CG1 4.19Å; T492-V540 HydrophobicContact CG2-CG2 4.16Å; V540-A546 CarbonylContact O-C 3.51Å; V540-A546 WeakPolarHBondContact O-CA 3.22Å; V540-N547 PolarHBondContact N-O 2.83Å; V540-N547 PolarHBondContact O-N 2.71Å
541	S	93.4	Very high	92.9	Very high	33 Å²	33	36.3 Å²	36.3	23%	0.231	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	149.1	-177.7	81.9	0	0	0	0	113.6	M490 T491 G545	M490-S541 WeakPolarHBondContact CA-O 3.4Å; T491-S541 PolarHBondContact N-O 3.25Å; T491-S541 PolarHBondContact O-N 2.8Å; T491-S541 PolarHBondContact OG1-O 2.94Å; T491-S541 PolarHBondContact OG1-OG 2.71Å; S541-G545 VanDerWaalsContact CA-O 3.27Å; S541-G545 WeakPolarHBondContact CA-O 3.28Å; S541-G545 WeakPolarHBondContact CB-O 3.43Å
542	N	92.1	Very high	93	Very high	8 Å²	8	31.6 Å²	31.6	4%	0.043	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	-163.7	166.7	72.4	12.3	0	0	0	109.4	P457 P459 P489 M490 F544 G545	P457-N542 PolarHBondContact O-ND2 2.75Å; P457-N542 PolarHBondContact O-OD1 2.89Å; P459-N542 WeakPolarHBondContact CD-OD1 3.36Å; P459-N542 HydrophobicContact CG-CB 4.17Å; P489-N542 WeakPolarHBondContact O-CB 3.26Å; M490-N542 HydrophobicContact CG-CB 4.16Å; N542-F544 PolarHBondContact O-N 3.08Å; N542-F544 WeakPolarHBondContact OD1-CA 3.13Å; N542-F544 WeakPolarHBondContact OD1-CB 3.45Å; N542-F544 PolarHBondContact OD1-N 3.39Å; N542-G545 PolarHBondContact N-O 2.68Å; N542-G545 PolarHBondContact O-N 2.8Å
543	H	88.9	Confident	93.1	Very high	139 Å²	139	34.6 Å²	34.6	64%	0.644	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-37.6	178.3	-174.5	72.4	0	0	0	113.2	G545	H543-G545 VanDerWaalsContact C-N 3.29Å; H543-G545 PolarHBondContact O-N 2.84Å
544	F	88.6	Confident	93.2	Very high	27 Å²	27	32.1 Å²	32.1	12%	0.118	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	4.2	-175.6	-58.4	-75.1	0	0	0	115	M384 L407 H434 P457 K458 S488 N542	M384-F544 HydrophobicContact CE-CD1 4.32Å; L407-F544 HydrophobicContact CD2-CB 4.35Å; L407-F544 HydrophobicContact CD2-CD1 3.64Å; L407-F544 HydrophobicContact CD2-CE1 4.32Å; L407-F544 HydrophobicContact CD2-CG 4.33Å; H434-F544 HydrophobicContact CB-CE1 4.09Å; P457-F544 HydrophobicContact CB-CB 4.48Å; P457-F544 HydrophobicContact CB-CD1 4.32Å; P457-F544 HydrophobicContact CB-CD2 3.65Å; P457-F544 HydrophobicContact CB-CE1 4.43Å; P457-F544 HydrophobicContact CB-CE2 3.76Å; P457-F544 HydrophobicContact CB-CG 3.91Å; P457-F544 HydrophobicContact CB-CZ 4.16Å; P457-F544 HydrophobicContact CG-CD1 4.48Å; P457-F544 HydrophobicContact CG-CG 4.34Å; P457-F544 VanDerWaalsContact O-CD2 3.29Å; P457-F544 WeakPolarHBondContact O-CD2 3.4Å; K458-F544 HydrophobicContact CB-CB 4.32Å; S488-F544 VanDerWaalsContact OG-CE2 3.3Å; S488-F544 WeakPolarHBondContact OG-CE2 2.97Å; N542-F544 PolarHBondContact O-N 3.08Å; N542-F544 WeakPolarHBondContact OD1-CA 3.13Å; N542-F544 WeakPolarHBondContact OD1-CB 3.45Å; N542-F544 PolarHBondContact OD1-N 3.39Å
545	G	89.1	Confident	93.3	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	131.1	179.3	170.8	0	0	0	0	0	114.3	S541 N542 H543	S541-G545 VanDerWaalsContact CA-O 3.27Å; S541-G545 WeakPolarHBondContact CA-O 3.28Å; S541-G545 WeakPolarHBondContact CB-O 3.43Å; N542-G545 PolarHBondContact N-O 2.68Å; N542-G545 PolarHBondContact O-N 2.8Å; H543-G545 VanDerWaalsContact C-N 3.29Å; H543-G545 PolarHBondContact O-N 2.84Å
546	A	90.3	Very high	93.4	Very high	12 Å²	12	27.5 Å²	27.5	10%	0.099	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	154.6	173.7	0	0	0	0	0	111.5	K458 V539 V540 Y548	K458-A546 WeakPolarHBondContact CE-O 3.26Å; K458-A546 PolarHBondContact NZ-O 2.84Å; V539-A546 HydrophobicContact CG1-CB 4.1Å; V540-A546 CarbonylContact O-C 3.51Å; V540-A546 WeakPolarHBondContact O-CA 3.22Å; A546-Y548 HydrophobicContact CB-CE2 3.8Å
547	N	91	Very high	93.4	Very high	53 Å²	53	27.9 Å²	27.9	28%	0.283	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	148.7	169.6	-158.7	-4.8	0	0	0	109.1	P459 I461 V539 V540	P459-N547 WeakPolarHBondContact O-CB 3.27Å; P459-N547 PolarHBondContact O-ND2 2.03Å; I461-N547 HydrophobicContact CD1-CB 4.42Å; V539-N547 WeakPolarHBondContact CA-O 3.4Å; V540-N547 PolarHBondContact N-O 2.83Å; V540-N547 PolarHBondContact O-N 2.71Å
548	Y	92.1	Very high	93.4	Very high	23 Å²	23	30.3 Å²	30.3	9%	0.09	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	136.6	-163.9	-60.8	-105.3	0	0	0	109.7	W334 E337 D338 I461 V539 A546	W334-Y548 HydrophobicContact CB-CE1 3.86Å; W334-Y548 WeakPolarHBondContact CB-OH 3.32Å; E337-Y548 HydrophobicContact CB-CD2 4.43Å; E337-Y548 HydrophobicContact CB-CE2 3.56Å; D338-Y548 HydrophobicContact CB-CD1 3.8Å; D338-Y548 HydrophobicContact CB-CD2 4.49Å; D338-Y548 HydrophobicContact CB-CE1 4.11Å; D338-Y548 HydrophobicContact CB-CG 4.04Å; D338-Y548 WeakPolarHBondContact OD1-CB 3.42Å; I461-Y548 VanDerWaalsContact CD1-C 3.43Å; V539-Y548 HydrophobicContact CB-CD1 4.36Å; V539-Y548 HydrophobicContact CB-CE1 4.46Å; V539-Y548 HydrophobicContact CG1-CD1 3.98Å; V539-Y548 HydrophobicContact CG1-CE1 3.77Å; V539-Y548 HydrophobicContact CG1-CE2 4.49Å; V539-Y548 HydrophobicContact CG1-CG 4.42Å; V539-Y548 HydrophobicContact CG2-CD1 3.55Å; V539-Y548 HydrophobicContact CG2-CE1 3.77Å; V539-Y548 HydrophobicContact CG2-CG 4.42Å; A546-Y548 HydrophobicContact CB-CE2 3.8Å
549	S	93.9	Very high	93.3	Very high	7 Å²	7	34.7 Å²	34.7	5%	0.049	17%	0.173	C	C	.	.			trans	-76.1	171.9	176.7	73.5	0	0	0	0	112	Q537 C538	Q537-S549 WeakPolarHBondContact CG-OG 3.2Å; Q537-S549 PolarHBondContact NE2-O 3.25Å; C538-S549 PolarHBondContact N-OG 3.31Å; C538-S549 PolarHBondContact O-N 2.85Å; C538-S549 PolarHBondContact O-OG 3.36Å
550	N	92.3	Very high	93.4	Very high	66 Å²	66	34.7 Å²	34.7	35%	0.353	17%	0.173	S	C	.	.			trans	-50.9	164.5	153.8	69.3	-32.1	0	0	0	111.6	H464 P465	H464-N550 VanDerWaalsContact CB-OD1 3.26Å; H464-N550 WeakPolarHBondContact CB-OD1 3.26Å; P465-N550 VanDerWaalsContact CD-OD1 3.22Å; P465-N550 WeakPolarHBondContact CD-OD1 3.26Å; P465-N550 PolarHBondContact O-ND2 2.98Å; P465-N550 PolarHBondContact O-OD1 2.85Å
551	R	91.9	Very high	93.4	Very high	65 Å²	65	36.7 Å²	36.7	25%	0.245	19%	0.187	C	C	.	.			trans	-98.8	105.7	174.4	-71.1	170.1	174.6	-153.1	-10.9	109.6	E313 D338 I340 R535 Y536 Q537	E313-R551 IonicContact OE2-CZ 2.93Å; E313-R551 IonicContact OE2-NH1 3.99Å; E313-R551 PolarHBondContact OE2-NH1 2.83Å; D338-R551 IonicContact OD2-CZ 3.27Å; D338-R551 IonicContact OD2-NE 3.69Å; D338-R551 IonicContact OD2-NH2 3.37Å; D338-R551 PolarHBondContact OD2-NH2 2.93Å; I340-R551 VanDerWaalsContact CG1-NH2 3.28Å; R535-R551 HydrophobicContact CB-CB 4.29Å; Y536-R551 CarbonylContact O-C 3.55Å; Y536-R551 WeakPolarHBondContact O-CA 3.44Å; Q537-R551 HydrophobicContact CB-CG 4.32Å
552	A	96.4	Very high	93.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	123.3	173.3	0	0	0	0	0	109.5	P465 E466 R535 Y536	P465-A552 HydrophobicContact CB-CB 3.86Å; P465-A552 HydrophobicContact CG-CB 4.18Å; E466-A552 WeakPolarHBondContact O-CB 3.35Å; R535-A552 CarbonylContact C-O 3.56Å; R535-A552 WeakPolarHBondContact CA-O 3.32Å; Y536-A552 PolarHBondContact N-O 3Å; Y536-A552 PolarHBondContact O-N 3.43Å
553	K	96.8	Very high	93.3	Very high	97 Å²	97	42.3 Å²	42.3	42%	0.422	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	130.6	172.1	-167	-165.4	176.2	-144.9	0	109	T467 A468 G534 T555	T467-K553 CarbonylContact C-O 3.57Å; T467-K553 WeakPolarHBondContact CA-O 3.45Å; T467-K553 HydrophobicContact CG2-CB 4.09Å; T467-K553 WeakPolarHBondContact CG2-O 3.44Å; T467-K553 PolarHBondContact OG1-N 3.03Å; A468-K553 PolarHBondContact N-O 2.89Å; G534-K553 CarbonylContact O-C 3.51Å; G534-K553 WeakPolarHBondContact O-CA 3.17Å; K553-T555 WeakPolarHBondContact CD-OG1 3.48Å; K553-T555 WeakPolarHBondContact CE-OG1 3.4Å; K553-T555 PolarHBondContact NZ-OG1 2.91Å
554	L	97.1	Very high	93.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.1	157.5	-179.7	54.4	0	0	0	108.9	A468 A470 V476 L525 V528 D532 G534 Y536 V556	A468-L554 HydrophobicContact CB-CD1 4.14Å; A468-L554 WeakPolarHBondContact O-CA 3.39Å; A470-L554 HydrophobicContact CB-CD1 4.03Å; V476-L554 HydrophobicContact CG1-CD1 4.29Å; V476-L554 HydrophobicContact CG2-CD1 4.26Å; L525-L554 HydrophobicContact CD1-CD2 3.62Å; V528-L554 HydrophobicContact CG1-CD2 4.29Å; D532-L554 HydrophobicContact CB-CD2 4.32Å; D532-L554 WeakPolarHBondContact O-CD2 3.31Å; G534-L554 PolarHBondContact N-O 2.8Å; G534-L554 PolarHBondContact O-N 3.06Å; Y536-L554 HydrophobicContact CD2-CB 3.96Å; Y536-L554 HydrophobicContact CE2-CB 3.77Å; Y536-L554 HydrophobicContact CE2-CD2 4.04Å; L554-V556 HydrophobicContact CD1-CG2 4.44Å; L554-V556 HydrophobicContact CD2-CG2 4.35Å; L554-V556 HydrophobicContact CG-CG2 4.09Å
555	T	96.3	Very high	93.5	Very high	26 Å²	26	41.8 Å²	41.8	16%	0.16	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.7	169.8	-47.5	0	0	0	0	108.6	A468 T469 A470 E533 K553	A468-T555 PolarHBondContact O-N 3.19Å; T469-T555 CarbonylContact C-O 3.27Å; T469-T555 WeakPolarHBondContact CA-O 3.36Å; A470-T555 PolarHBondContact N-O 3.32Å; E533-T555 VanDerWaalsContact OE1-CA 3.22Å; E533-T555 WeakPolarHBondContact OE1-CA 3.32Å; E533-T555 VanDerWaalsContact OE1-CG2 3.25Å; E533-T555 WeakPolarHBondContact OE1-CG2 3.32Å; K553-T555 WeakPolarHBondContact CD-OG1 3.48Å; K553-T555 WeakPolarHBondContact CE-OG1 3.4Å; K553-T555 PolarHBondContact NZ-OG1 2.91Å
556	V	96.7	Very high	93.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	109.9	-177.2	-179.5	0	0	0	0	108.9	R472 V528 F530 E533 L554 H586	R472-V556 HydrophobicContact CB-CG1 4.13Å; V528-V556 HydrophobicContact CB-CG2 4.32Å; V528-V556 HydrophobicContact CG2-CG2 4.3Å; F530-V556 HydrophobicContact CD1-CB 4.25Å; F530-V556 HydrophobicContact CD1-CG1 4.09Å; F530-V556 WeakPolarHBondContact CD1-O 3.35Å; F530-V556 HydrophobicContact CE1-CG1 4.22Å; F530-V556 WeakPolarHBondContact CE1-O 3.32Å; E533-V556 HydrophobicContact CG-CB 3.71Å; E533-V556 HydrophobicContact CG-CG2 3.9Å; E533-V556 PolarHBondContact OE1-N 2.03Å; L554-V556 HydrophobicContact CD1-CG2 4.44Å; L554-V556 HydrophobicContact CD2-CG2 4.35Å; L554-V556 HydrophobicContact CG-CG2 4.09Å; V556-H586 PolarHBondContact O-ND1 3.08Å
557	N	95.8	Very high	93.8	Very high	11 Å²	11	48.4 Å²	48.4	6%	0.059	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	159.1	178	-58.5	-25.9	0	0	0	110.5	T469 A470 L471 R472 H586 A639	T469-N557 VanDerWaalsContact CG2-ND2 3.32Å; T469-N557 WeakPolarHBondContact CG2-ND2 3.26Å; A470-N557 PolarHBondContact O-N 3.47Å; L471-N557 CarbonylContact C-O 3.25Å; L471-N557 WeakPolarHBondContact CA-O 3.27Å; L471-N557 HydrophobicContact CD2-CB 4.41Å; R472-N557 PolarHBondContact N-O 2.85Å; N557-H586 CarbonylContact C-O 3.54Å; N557-H586 VanDerWaalsContact CA-O 3.27Å; N557-H586 WeakPolarHBondContact CA-O 3.38Å; N557-H586 WeakPolarHBondContact CB-O 3.35Å; N557-A639 HydrophobicContact CB-CB 3.84Å
558	E	95.3	Very high	94.1	Very high	55 Å²	55	51.7 Å²	51.7	26%	0.257	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	127.8	173.5	177.5	153.2	-129.9	0	0	109.2	R472 F530 H586 N637	R472-E558 HydrophobicContact CB-CB 4.48Å; R472-E558 VanDerWaalsContact CD-OE1 3.31Å; R472-E558 WeakPolarHBondContact CD-OE1 3.15Å; R472-E558 IonicContact CZ-OE1 2.78Å; R472-E558 IonicContact NE-OE1 2.69Å; R472-E558 IonicContact NH1-OE1 3.94Å; R472-E558 PolarHBondContact NH1-OE1 3.02Å; R472-E558 IonicContact NH1-OE2 2.74Å; F530-E558 HydrophobicContact CE1-CB 4.41Å; F530-E558 HydrophobicContact CZ-CB 3.89Å; F530-E558 WeakPolarHBondContact CZ-OE2 3.42Å; E558-H586 HydrophobicContact CB-CB 3.91Å; E558-H586 PolarHBondContact N-O 2.94Å; E558-H586 PolarHBondContact O-N 2.9Å; E558-N637 PolarHBondContact O-ND2 2.96Å
559	L	93.8	Very high	94.2	Very high	93 Å²	93	52.7 Å²	52.7	49%	0.487	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	137	175.1	-79.9	166.7	0	0	0	109.3	L471 A639	L471-L559 HydrophobicContact CD1-CD1 3.94Å; L471-L559 HydrophobicContact CD1-CG 4.18Å; L471-L559 HydrophobicContact CD2-CG 4.27Å; L559-A639 HydrophobicContact CD2-CB 3.96Å; L559-A639 WeakPolarHBondContact CD2-O 3.37Å; L559-A639 HydrophobicContact CG-CB 4.19Å
560	P	94.8	Very high	94.1	Very high	12 Å²	12	56.8 Å²	56.8	8%	0.078	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	148.8	-174.9	21	-22.6	0	0	0	112.3	E584 P589 N637 L642	P560-E584 CarbonylContact C-O 3.14Å; P560-E584 WeakPolarHBondContact CA-O 2.97Å; P560-E584 VanDerWaalsContact CB-O 3.27Å; P560-E584 WeakPolarHBondContact CB-O 3.44Å; P560-P589 HydrophobicContact CB-CB 3.77Å; P560-P589 HydrophobicContact CB-CG 3.89Å; P560-P589 HydrophobicContact CG-CB 4.29Å; P560-N637 WeakPolarHBondContact CD-OD1 3.14Å; P560-L642 HydrophobicContact CB-CD2 3.61Å; P560-L642 HydrophobicContact CG-CD2 3.62Å; P560-L642 WeakPolarHBondContact O-CD1 3.29Å; P560-L642 VanDerWaalsContact O-CD2 3.22Å; P560-L642 WeakPolarHBondContact O-CD2 3.49Å
561	S	94.4	Very high	94.2	Very high	43 Å²	43	55.2 Å²	55.2	30%	0.301	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	142.3	-179.2	39.1	0	0	0	0	110.9	L563 A583 E584	S561-L563 PolarHBondContact O-N 3.13Å; S561-A583 CarbonylContact O-C 3.5Å; S561-A583 WeakPolarHBondContact O-CA 3.41Å; S561-A583 WeakPolarHBondContact O-CB 3.08Å; S561-E584 PolarHBondContact N-O 2.81Å; S561-E584 PolarHBondContact O-N 2.84Å; S561-E584 WeakPolarHBondContact OG-CG 3.35Å; S561-E584 PolarHBondContact OG-OE1 2.85Å
562	F	93.1	Very high	94.1	Very high	54 Å²	54	58.1 Å²	58.1	24%	0.237	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	117.1	179.8	-74.6	-56.9	0	0	0	111.6	T565 C581 A582 A583 A635 L642 A644	F562-T565 HydrophobicContact CB-CG2 3.79Å; F562-T565 HydrophobicContact CD1-CG2 4.37Å; F562-T565 HydrophobicContact CD2-CG2 3.64Å; F562-T565 HydrophobicContact CE2-CG2 4.29Å; F562-T565 HydrophobicContact CG-CG2 3.7Å; F562-C581 VanDerWaalsContact CE1-SG 3.55Å; F562-A582 CarbonylContact C-O 3.38Å; F562-A582 WeakPolarHBondContact CA-O 3.24Å; F562-A583 HydrophobicContact CD1-CB 4.19Å; F562-A635 HydrophobicContact CE1-CB 4.1Å; F562-L642 HydrophobicContact CD1-CD1 4.45Å; F562-L642 HydrophobicContact CD2-CD1 3.37Å; F562-L642 HydrophobicContact CD2-CG 3.94Å; F562-L642 HydrophobicContact CE1-CG 4.28Å; F562-L642 HydrophobicContact CE2-CB 4.28Å; F562-L642 HydrophobicContact CE2-CD1 3.53Å; F562-L642 HydrophobicContact CE2-CG 3.56Å; F562-L642 HydrophobicContact CG-CD1 3.87Å; F562-L642 HydrophobicContact CG-CG 4.45Å; F562-L642 HydrophobicContact CZ-CD1 4.14Å; F562-L642 HydrophobicContact CZ-CG 3.75Å; F562-A644 HydrophobicContact CD2-CB 4.22Å; F562-A644 HydrophobicContact CE2-CB 3.54Å; F562-A644 HydrophobicContact CZ-CB 3.73Å
563	L	91.1	Very high	93.8	Very high	105 Å²	105	60.1 Å²	60.1	55%	0.55	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	-34.8	162.2	-66.7	175.7	0	0	0	111	S561 A582 E584	S561-L563 PolarHBondContact O-N 3.13Å; L563-A582 HydrophobicContact CB-CB 3.93Å; L563-A582 PolarHBondContact N-O 2.86Å; L563-E584 HydrophobicContact CD1-CB 4.14Å; L563-E584 HydrophobicContact CD2-CG 4.36Å; L563-E584 HydrophobicContact CG-CB 4.19Å; L563-E584 HydrophobicContact CG-CG 4.34Å
564	K	90	Very high	93.4	Very high	90 Å²	90	57.5 Å²	57.5	39%	0.391	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	135.5	173	-58.5	177.6	-175.3	175.1	0	110.2	E580 C581 A582	K564-E580 HydrophobicContact CD-CB 4.01Å; K564-E580 VanDerWaalsContact CD-OE2 3.32Å; K564-E580 WeakPolarHBondContact CD-OE2 3.08Å; K564-E580 WeakPolarHBondContact CE-OE2 3.36Å; K564-E580 IonicContact NZ-OE2 2.77Å; K564-E580 PolarHBondContact NZ-OE2 2.96Å; K564-C581 WeakPolarHBondContact O-CA 3.15Å; K564-A582 HydrophobicContact CB-CB 3.85Å; K564-A582 HydrophobicContact CD-CB 4.06Å; K564-A582 HydrophobicContact CG-CB 3.92Å; K564-A582 PolarHBondContact N-O 2.9Å; K564-A582 PolarHBondContact O-N 3.44Å
565	T	92.4	Very high	93.1	Very high	65 Å²	65	59.4 Å²	59.4	40%	0.399	32%	0.32	S	S	.	.			trans	-105.1	148.9	166.8	54.3	0	0	0	0	110.3	F562 E580 A644	F562-T565 HydrophobicContact CB-CG2 3.79Å; F562-T565 HydrophobicContact CD1-CG2 4.37Å; F562-T565 HydrophobicContact CD2-CG2 3.64Å; F562-T565 HydrophobicContact CE2-CG2 4.29Å; F562-T565 HydrophobicContact CG-CG2 3.7Å; T565-E580 CarbonylContact C-O 3.55Å; T565-A644 HydrophobicContact CG2-CB 3.75Å
566	P	92.2	Very high	92.8	Very high	8 Å²	8	63.3 Å²	63.3	5%	0.052	34%	0.337	C	S	.	.			trans	-63.9	156.9	172.3	29.9	-36.5	0	0	0	111.1	L579 E580 W593 C633 A646	P566-L579 HydrophobicContact CB-CB 4.35Å; P566-E580 VanDerWaalsContact CA-O 3.26Å; P566-E580 WeakPolarHBondContact CA-O 3.27Å; P566-E580 VanDerWaalsContact N-O 3.1Å; P566-W593 HydrophobicContact CB-CH2 3.92Å; P566-W593 HydrophobicContact CB-CZ3 4.07Å; P566-W593 HydrophobicContact CG-CH2 4.26Å; P566-W593 HydrophobicContact CG-CZ3 4.2Å; P566-C633 HydrophobicContact CG-CB 4.24Å; P566-A646 HydrophobicContact CB-CB 3.67Å; P566-A646 HydrophobicContact CG-CB 4.08Å
567	M	92.9	Very high	92.6	Very high	144 Å²	144	63.4 Å²	63.4	71%	0.709	34%	0.338	S	S	*	.			trans	-129.3	150	-179.7	-62.8	-174.5	-178.6	0	0	110.8	L569 A646	M567-L569 PolarHBondContact O-N 3.31Å; M567-A646 VanDerWaalsContact C-CB 3.47Å; M567-A646 WeakPolarHBondContact O-CB 3.19Å
568	D	95.8	Very high	92.3	Very high	121 Å²	121	68.9 Å²	68.9	65%	0.647	36%	0.358	S	S	*	.			trans	-54.4	130.3	177.4	-70.4	-27.1	0	0	0	111.4	T647	D568-T647 WeakPolarHBondContact CA-O 3.38Å; D568-T647 WeakPolarHBondContact OD1-CA 3.5Å; D568-T647 WeakPolarHBondContact OD1-CB 3.43Å; D568-T647 PolarHBondContact OD1-N 3.48Å; D568-T647 PolarHBondContact OD1-OG1 3.38Å
569	L	94.4	Very high	92.1	Very high	45 Å²	45	66.5 Å²	66.5	24%	0.236	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	119.7	-173.9	179.4	58.6	0	0	0	110.6	M567 I571 A577 L579 T647 L648 T649	M567-L569 PolarHBondContact O-N 3.31Å; L569-I571 HydrophobicContact CG-CB 4.45Å; L569-A577 HydrophobicContact CD2-CB 3.78Å; L569-L579 HydrophobicContact CB-CD2 4.24Å; L569-L579 HydrophobicContact CD2-CD2 4.38Å; L569-T647 PolarHBondContact N-O 3.48Å; L569-L648 HydrophobicContact CB-CD1 4.22Å; L569-L648 HydrophobicContact CD2-CD1 4.15Å; L569-L648 HydrophobicContact CG-CD1 4.12Å; L569-L648 WeakPolarHBondContact O-CA 3.31Å; L569-T649 PolarHBondContact O-N 3.34Å
570	T	93.4	Very high	91.9	Very high	92 Å²	92	64.7 Å²	64.7	56%	0.564	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	121.7	169.9	-61.1	0	0	0	0	109.6	T649 L651	T570-T649 WeakPolarHBondContact CA-O 3.49Å; T570-T649 HydrophobicContact CG2-CG2 4.17Å; T570-L651 HydrophobicContact CG2-CD1 3.63Å; T570-L651 HydrophobicContact CG2-CD2 4.48Å; T570-L651 HydrophobicContact CG2-CG 3.9Å
571	I	92.8	Very high	91.6	Very high	33 Å²	33	64.1 Å²	64.1	17%	0.169	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	162.7	-171.9	-143.5	178.8	0	0	0	112.5	L569 T575 M576 A577 V623 L648 T649 V650 L651	L569-I571 HydrophobicContact CG-CB 4.45Å; I571-T575 VanDerWaalsContact CD1-OG1 3.28Å; I571-T575 WeakPolarHBondContact CD1-OG1 3.47Å; I571-T575 VanDerWaalsContact CG1-OG1 3.32Å; I571-T575 WeakPolarHBondContact CG1-OG1 3.28Å; I571-M576 WeakPolarHBondContact CD1-O 3.35Å; I571-A577 HydrophobicContact CD1-CB 4.42Å; I571-V623 HydrophobicContact CG2-CB 4.44Å; I571-V623 HydrophobicContact CG2-CG1 4.11Å; I571-V623 HydrophobicContact CG2-CG2 4.45Å; I571-L648 HydrophobicContact CG2-CD1 4.18Å; I571-T649 PolarHBondContact N-O 2.83Å; I571-V650 WeakPolarHBondContact O-CA 3.46Å; I571-L651 PolarHBondContact O-N 2.78Å
572	R	90.4	Very high	91.4	Very high	127 Å²	127	62.2 Å²	62.2	48%	0.479	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	143.4	177	-169.4	179.8	67.8	-158.6	-3.5	111.3	T575 L651 L730	R572-T575 HydrophobicContact CB-CG2 4.2Å; R572-T575 WeakPolarHBondContact O-CB 3.37Å; R572-T575 PolarHBondContact O-N 2.8Å; R572-T575 PolarHBondContact O-OG1 2.9Å; R572-L651 CarbonylContact C-O 3.37Å; R572-L651 WeakPolarHBondContact CA-O 3.44Å; R572-L730 HydrophobicContact CG-CD1 3.87Å
573	T	90.7	Very high	91.3	Very high	41 Å²	41	60.4 Å²	60.4	25%	0.252	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	145.5	168.2	-163.9	0	0	0	0	111.6	T575 V623 L651 E652	T573-T575 PolarHBondContact O-N 2.86Å; T573-V623 CarbonylContact C-O 3.18Å; T573-V623 VanDerWaalsContact CA-O 3.27Å; T573-V623 WeakPolarHBondContact CA-O 3.45Å; T573-V623 PolarHBondContact OG1-O 2.99Å; T573-L651 PolarHBondContact N-O 2.83Å; T573-E652 HydrophobicContact CG2-CB 4.15Å; T573-E652 HydrophobicContact CG2-CG 4.09Å
574	G	87.3	Confident	91.4	Very high	43 Å²	43	60.1 Å²	60.1	44%	0.443	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	3	-177.7	0	0	0	0	0	116	N622 V623	G574-N622 WeakPolarHBondContact CA-OD1 3.28Å; G574-V623 PolarHBondContact N-O 2.87Å
575	T	90.9	Very high	91.5	Very high	40 Å²	40	56.6 Å²	56.6	25%	0.245	30%	0.3	C	S	.	.	S	Bend	trans	-100.1	-172.1	174.2	69.9	0	0	0	0	111.5	I571 R572 T573 N622 V623	I571-T575 VanDerWaalsContact CD1-OG1 3.28Å; I571-T575 WeakPolarHBondContact CD1-OG1 3.47Å; I571-T575 VanDerWaalsContact CG1-OG1 3.32Å; I571-T575 WeakPolarHBondContact CG1-OG1 3.28Å; R572-T575 HydrophobicContact CB-CG2 4.2Å; R572-T575 WeakPolarHBondContact O-CB 3.37Å; R572-T575 PolarHBondContact O-N 2.8Å; R572-T575 PolarHBondContact O-OG1 2.9Å; T573-T575 PolarHBondContact O-N 2.86Å; T575-N622 WeakPolarHBondContact O-CA 3Å; T575-N622 PolarHBondContact O-N 2.9Å; T575-V623 WeakPolarHBondContact O-CG2 3.35Å; T575-V623 PolarHBondContact O-N 3.05Å
576	M	90.9	Very high	91.5	Very high	107 Å²	107	56.7 Å²	56.7	53%	0.527	30%	0.295	S	S	.	.			trans	-109.6	117.4	179.8	-179.5	-174.4	-73.2	0	0	110.4	I571 F619 I620	I571-M576 WeakPolarHBondContact CD1-O 3.35Å; M576-F619 HydrophobicContact CE-CD2 3.88Å; M576-F619 HydrophobicContact CE-CE2 3.85Å; M576-F619 HydrophobicContact CG-CB 4.34Å; M576-F619 HydrophobicContact CG-CD2 4.08Å; M576-F619 HydrophobicContact SD-CB 4.46Å; M576-F619 HydrophobicContact SD-CD2 3.75Å; M576-F619 HydrophobicContact SD-CE2 4.22Å; M576-F619 HydrophobicContact SD-CG 4.29Å; M576-I620 CarbonylContact C-O 3.52Å; M576-I620 VanDerWaalsContact CA-O 3.29Å; M576-I620 WeakPolarHBondContact CA-O 3.22Å
577	A	91.7	Very high	91.6	Very high	3 Å²	3	59 Å²	59	3%	0.025	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	141.8	169.8	0	0	0	0	0	110.1	L569 I571 F619 I620 V623 L648	L569-A577 HydrophobicContact CD2-CB 3.78Å; I571-A577 HydrophobicContact CD1-CB 4.42Å; A577-F619 CarbonylContact O-C 3.58Å; A577-F619 WeakPolarHBondContact O-CA 3.39Å; A577-F619 VanDerWaalsContact O-CB 3.24Å; A577-F619 WeakPolarHBondContact O-CB 3.34Å; A577-I620 HydrophobicContact CB-CB 4.45Å; A577-I620 PolarHBondContact N-O 2.92Å; A577-I620 PolarHBondContact O-N 2.91Å; A577-V623 HydrophobicContact CB-CG2 3.54Å; A577-L648 HydrophobicContact CB-CD1 3.89Å; A577-L648 HydrophobicContact CB-CD2 4.15Å
578	R	90.6	Very high	91.5	Very high	125 Å²	125	57 Å²	57	47%	0.472	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	122	179.8	177.9	-174.9	174.8	105.6	-2.1	108.6	E580 I617	R578-E580 HydrophobicContact CG-CG 4.48Å; R578-E580 IonicContact CZ-OE1 2.7Å; R578-E580 IonicContact NE-OE1 2.75Å; R578-E580 PolarHBondContact NE-OE1 2.92Å; R578-E580 IonicContact NH2-OE1 2.77Å; R578-E580 PolarHBondContact NH2-OE1 2.87Å; R578-I617 HydrophobicContact CG-CG2 3.91Å; R578-I617 VanDerWaalsContact NH1-CD1 3.35Å; R578-I617 VanDerWaalsContact NH2-CD1 3.3Å
579	L	90.5	Very high	91.3	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.026	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.9	170.3	-57.6	176.1	0	0	0	107.4	P566 L569 W593 F618 Y631	P566-L579 HydrophobicContact CB-CB 4.35Å; L569-L579 HydrophobicContact CB-CD2 4.24Å; L569-L579 HydrophobicContact CD2-CD2 4.38Å; L579-W593 HydrophobicContact CB-CH2 3.61Å; L579-W593 HydrophobicContact CB-CZ2 4.49Å; L579-W593 HydrophobicContact CB-CZ3 3.99Å; L579-W593 HydrophobicContact CD1-CH2 4.46Å; L579-W593 HydrophobicContact CD1-CZ3 3.97Å; L579-F618 HydrophobicContact CB-CB 4.49Å; L579-F618 HydrophobicContact CB-CD1 4.26Å; L579-F618 HydrophobicContact CD1-CD1 4.17Å; L579-F618 HydrophobicContact CD1-CE1 4.46Å; L579-F618 HydrophobicContact CG-CD1 4.44Å; L579-F618 PolarHBondContact N-O 2.84Å; L579-F618 PolarHBondContact O-N 3.01Å; L579-Y631 HydrophobicContact CD1-CD1 3.95Å; L579-Y631 HydrophobicContact CD1-CD2 4.36Å; L579-Y631 HydrophobicContact CD1-CG 3.7Å
580	E	88.8	Confident	91.1	Very high	56 Å²	56	57.6 Å²	57.6	26%	0.262	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	137	178.2	-58	-169.8	-173.3	0	0	108.8	K564 T565 P566 R578	K564-E580 HydrophobicContact CD-CB 4.01Å; K564-E580 VanDerWaalsContact CD-OE2 3.32Å; K564-E580 WeakPolarHBondContact CD-OE2 3.08Å; K564-E580 WeakPolarHBondContact CE-OE2 3.36Å; K564-E580 IonicContact NZ-OE2 2.77Å; K564-E580 PolarHBondContact NZ-OE2 2.96Å; T565-E580 CarbonylContact C-O 3.55Å; P566-E580 VanDerWaalsContact CA-O 3.26Å; P566-E580 WeakPolarHBondContact CA-O 3.27Å; P566-E580 VanDerWaalsContact N-O 3.1Å; R578-E580 HydrophobicContact CG-CG 4.48Å; R578-E580 IonicContact CZ-OE1 2.7Å; R578-E580 IonicContact NE-OE1 2.75Å; R578-E580 PolarHBondContact NE-OE1 2.92Å; R578-E580 IonicContact NH2-OE1 2.77Å; R578-E580 PolarHBondContact NH2-OE1 2.87Å
581	C	89.4	Confident	90.9	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.295	C	S	.	.			trans	-150.9	107.9	173.2	-171.8	0	0	0	0	110.1	F562 K564 W593 D616 C633	F562-C581 VanDerWaalsContact CE1-SG 3.55Å; K564-C581 WeakPolarHBondContact O-CA 3.15Å; C581-W593 HydrophobicContact CB-CH2 3.65Å; C581-W593 HydrophobicContact CB-CZ2 3.33Å; C581-D616 PolarHBondContact N-O 3.5Å; C581-D616 WeakPolarHBondContact O-CB 3.49Å; C581-C633 HydrophobicContact CB-CB 3.63Å; C581-C633 WeakPolarHBondContact CB-SG 2.98Å; C581-C633 WeakPolarHBondContact SG-CB 3.42Å; C581-C633 CovalentContact SG-SG 2.02Å; C581-C633 PolarHBondContact SG-SG 2.88Å
582	A	89.3	Confident	90.7	Very high	3 Å²	3	56.6 Å²	56.6	3%	0.025	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.1	-173.8	0	0	0	0	0	109.1	F562 L563 K564 D616	F562-A582 CarbonylContact C-O 3.38Å; F562-A582 WeakPolarHBondContact CA-O 3.24Å; L563-A582 HydrophobicContact CB-CB 3.93Å; L563-A582 PolarHBondContact N-O 2.86Å; K564-A582 HydrophobicContact CB-CB 3.85Å; K564-A582 HydrophobicContact CD-CB 4.06Å; K564-A582 HydrophobicContact CG-CB 3.92Å; K564-A582 PolarHBondContact N-O 2.9Å; K564-A582 PolarHBondContact O-N 3.44Å; A582-D616 WeakPolarHBondContact CA-OD2 3.4Å; A582-D616 HydrophobicContact CB-CB 3.59Å; A582-D616 WeakPolarHBondContact CB-OD2 3.39Å
583	A	91.3	Very high	90.7	Very high	15 Å²	15	51.9 Å²	51.9	12%	0.124	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	141	177.6	0	0	0	0	0	112.3	S561 F562 P589 I591 A635	S561-A583 CarbonylContact O-C 3.5Å; S561-A583 WeakPolarHBondContact O-CA 3.41Å; S561-A583 WeakPolarHBondContact O-CB 3.08Å; F562-A583 HydrophobicContact CD1-CB 4.19Å; A583-P589 HydrophobicContact CB-CG 3.73Å; A583-P589 VanDerWaalsContact O-CG 3.3Å; A583-P589 WeakPolarHBondContact O-CG 3.45Å; A583-I591 HydrophobicContact CB-CD1 3.94Å; A583-A635 HydrophobicContact CB-CB 3.45Å; A583-A635 VanDerWaalsContact CB-CB 3.45Å
584	E	93.1	Very high	90.7	Very high	99 Å²	99	53.5 Å²	53.5	46%	0.463	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	172.2	170.9	69.6	-165.6	161.8	0	0	110.2	P560 S561 L563	P560-E584 CarbonylContact C-O 3.14Å; P560-E584 WeakPolarHBondContact CA-O 2.97Å; P560-E584 VanDerWaalsContact CB-O 3.27Å; P560-E584 WeakPolarHBondContact CB-O 3.44Å; S561-E584 PolarHBondContact N-O 2.81Å; S561-E584 PolarHBondContact O-N 2.84Å; S561-E584 WeakPolarHBondContact OG-CG 3.35Å; S561-E584 PolarHBondContact OG-OE1 2.85Å; L563-E584 HydrophobicContact CD1-CB 4.14Å; L563-E584 HydrophobicContact CD2-CG 4.36Å; L563-E584 HydrophobicContact CG-CB 4.19Å; L563-E584 HydrophobicContact CG-CG 4.34Å
585	G	92.4	Very high	90.9	Very high	17 Å²	17	52.5 Å²	52.5	18%	0.175	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.5	168.5	179.5	0	0	0	0	0	111.8	P587 S588	G585-P587 CarbonylContact C-O 3.51Å; G585-P587 CarbonylContact O-C 3.57Å; G585-S588 WeakPolarHBondContact O-CA 3.49Å; G585-S588 PolarHBondContact O-N 2.85Å
586	H	92.9	Very high	90.9	Very high	66 Å²	66	55.2 Å²	55.2	31%	0.306	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	122.6	179.4	-169.3	-112.5	0	0	0	112.1	F530 E533 V556 N557 E558 N637	F530-H586 AromaticContact CD1-ND1 3.73Å; F530-H586 HydrophobicContact CE1-CB 3.61Å; F530-H586 AromaticContact CE1-CG 3.6Å; F530-H586 AromaticContact CE1-ND1 3.37Å; F530-H586 WeakPolarHBondContact CE1-ND1 3.46Å; F530-H586 HydrophobicContact CZ-CB 3.61Å; E533-H586 IonicContact OE2-CE1 3.6Å; V556-H586 PolarHBondContact O-ND1 3.08Å; N557-H586 CarbonylContact C-O 3.54Å; N557-H586 VanDerWaalsContact CA-O 3.27Å; N557-H586 WeakPolarHBondContact CA-O 3.38Å; N557-H586 WeakPolarHBondContact CB-O 3.35Å; E558-H586 HydrophobicContact CB-CB 3.91Å; E558-H586 PolarHBondContact N-O 2.94Å; E558-H586 PolarHBondContact O-N 2.9Å; H586-N637 PolarHBondContact O-ND2 2.81Å
587	P	94	Very high	90.6	Very high	56 Å²	56	53 Å²	53	36%	0.364	30%	0.297	S	S	.	.	S	Bend	cis	-55.7	162.1	-15.8	-23.5	35.1	0	0	0	112.7	G585 N637 V638	G585-P587 CarbonylContact C-O 3.51Å; G585-P587 CarbonylContact O-C 3.57Å; P587-N637 VanDerWaalsContact O-CB 3.26Å; P587-N637 WeakPolarHBondContact O-CB 3.46Å; P587-N637 PolarHBondContact O-ND2 2.71Å; P587-V638 HydrophobicContact CG-CG2 3.91Å
588	S	91.1	Very high	90.4	Very high	102 Å²	102	54.3 Å²	54.3	71%	0.713	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-54.6	131.8	-178.1	-51.1	0	0	0	0	111.8	G585	G585-S588 WeakPolarHBondContact O-CA 3.49Å; G585-S588 PolarHBondContact O-N 2.85Å
589	P	91.6	Very high	89.9	Confident	20 Å²	20	54 Å²	54	13%	0.13	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-73.6	146.1	-176.6	29.8	-35.1	0	0	0	112.6	P560 A583 A635 Q636 N637	P560-P589 HydrophobicContact CB-CB 3.77Å; P560-P589 HydrophobicContact CB-CG 3.89Å; P560-P589 HydrophobicContact CG-CB 4.29Å; A583-P589 HydrophobicContact CB-CG 3.73Å; A583-P589 VanDerWaalsContact O-CG 3.3Å; A583-P589 WeakPolarHBondContact O-CG 3.45Å; P589-A635 HydrophobicContact CB-CB 4.15Å; P589-Q636 CarbonylContact C-O 3.44Å; P589-Q636 VanDerWaalsContact CA-O 3.29Å; P589-Q636 WeakPolarHBondContact CA-O 3.26Å; P589-N637 HydrophobicContact CB-CB 4.47Å
590	Q	90.8	Very high	89.4	Confident	159 Å²	159	58.1 Å²	58.1	74%	0.743	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	132.7	167.9	-64.2	-176.4	-4.1	0	0	109.6	A635 Q636	Q590-A635 WeakPolarHBondContact O-CA 3.14Å; Q590-Q636 PolarHBondContact N-O 2.85Å; Q590-Q636 PolarHBondContact O-N 2.88Å
591	I	88.5	Confident	89.3	Confident	49 Å²	49	56.1 Å²	56.1	25%	0.251	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	120.3	176.3	-57.2	-58	0	0	0	109.9	A583 A635	A583-I591 HydrophobicContact CB-CD1 3.94Å; I591-A635 HydrophobicContact CD1-CB 3.66Å
592	A	89.1	Confident	89.1	Confident	56 Å²	56	56.8 Å²	56.8	46%	0.463	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	139.4	174.6	0	0	0	0	0	110.8	T634	A592-T634 PolarHBondContact N-O 2.74Å; A592-T634 PolarHBondContact O-N 2.9Å
593	W	89.4	Confident	88.8	Confident	28 Å²	28	56.6 Å²	56.6	11%	0.106	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	144.1	178.1	-67.9	84.7	0	0	0	111.7	P566 L579 C581 F601 F618 S632 C633	P566-W593 HydrophobicContact CB-CH2 3.92Å; P566-W593 HydrophobicContact CB-CZ3 4.07Å; P566-W593 HydrophobicContact CG-CH2 4.26Å; P566-W593 HydrophobicContact CG-CZ3 4.2Å; L579-W593 HydrophobicContact CB-CH2 3.61Å; L579-W593 HydrophobicContact CB-CZ2 4.49Å; L579-W593 HydrophobicContact CB-CZ3 3.99Å; L579-W593 HydrophobicContact CD1-CH2 4.46Å; L579-W593 HydrophobicContact CD1-CZ3 3.97Å; C581-W593 HydrophobicContact CB-CH2 3.65Å; C581-W593 HydrophobicContact CB-CZ2 3.33Å; W593-F601 HydrophobicContact CB-CZ 4.02Å; W593-F601 WeakPolarHBondContact O-CZ 3.44Å; W593-F618 HydrophobicContact CB-CD2 4.29Å; W593-F618 HydrophobicContact CB-CE2 4.27Å; W593-F618 AromaticContact CD1-CD2 3.89Å; W593-F618 HydrophobicContact CD2-CB 4.09Å; W593-F618 AromaticContact CD2-CD2 3.95Å; W593-F618 HydrophobicContact CD2-CD2 3.95Å; W593-F618 HydrophobicContact CD2-CG 4.03Å; W593-F618 VanDerWaalsContact CE2-CB 3.5Å; W593-F618 AromaticContact CE2-CG 3.96Å; W593-F618 HydrophobicContact CE3-CG 4.43Å; W593-F618 AromaticContact CG-CD2 3.79Å; W593-F618 HydrophobicContact CG-CD2 3.79Å; W593-F618 HydrophobicContact CG-CE2 4.25Å; W593-F618 HydrophobicContact CG-CG 4.36Å; W593-F618 HydrophobicContact CH2-CB 4.07Å; W593-F618 HydrophobicContact CZ2-CB 3.48Å; W593-F618 VanDerWaalsContact CZ2-CB 3.48Å; W593-F618 HydrophobicContact CZ2-CG 4.25Å; W593-S632 CarbonylContact C-O 3.58Å; W593-S632 WeakPolarHBondContact CA-O 3.44Å; W593-C633 HydrophobicContact CD2-CB 4.18Å; W593-C633 HydrophobicContact CE3-CB 3.96Å; W593-C633 HydrophobicContact CH2-CB 4.04Å; W593-C633 HydrophobicContact CZ2-CB 4.23Å; W593-C633 HydrophobicContact CZ3-CB 3.89Å
594	Q	91.2	Very high	88.4	Confident	75 Å²	75	58 Å²	58	35%	0.35	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	151.2	172.2	-65.2	177.4	-1.3	0	0	110	G598 Y631 S632	Q594-G598 CarbonylContact C-O 3.58Å; Q594-G598 VanDerWaalsContact CA-O 3.27Å; Q594-G598 WeakPolarHBondContact CA-O 3.39Å; Q594-G598 WeakPolarHBondContact CB-O 3.47Å; Q594-Y631 WeakPolarHBondContact O-CA 3.46Å; Q594-S632 PolarHBondContact N-O 2.86Å; Q594-S632 PolarHBondContact O-N 2.96Å
595	K	91.3	Very high	87.9	Confident	21 Å²	21	61 Å²	61	9%	0.091	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.3	172.1	-176.2	-177.6	-172.5	-67.4	0	109.2	G597 G598 F601 D627 M628 V630 Y631	K595-G597 PolarHBondContact O-N 2.86Å; K595-G597 VanDerWaalsContact O-N 3.09Å; K595-G598 PolarHBondContact N-O 3.47Å; K595-G598 PolarHBondContact O-N 2.9Å; K595-F601 HydrophobicContact CB-CD1 3.83Å; K595-F601 HydrophobicContact CB-CE1 3.65Å; K595-F601 HydrophobicContact CB-CG 4.47Å; K595-F601 HydrophobicContact CB-CZ 4.14Å; K595-F601 HydrophobicContact CD-CD1 4.39Å; K595-D627 VanDerWaalsContact CE-O 3.23Å; K595-D627 WeakPolarHBondContact CE-O 3.4Å; K595-M628 WeakPolarHBondContact CE-O 3.43Å; K595-M628 PolarHBondContact NZ-O 2.88Å; K595-V630 CarbonylContact C-O 3.59Å; K595-V630 WeakPolarHBondContact CA-O 3.32Å; K595-Y631 HydrophobicContact CB-CE1 4.5Å; K595-Y631 HydrophobicContact CD-CE2 4.25Å; K595-Y631 WeakPolarHBondContact CE-OH 3.36Å; K595-Y631 HydrophobicContact CG-CE1 4.49Å; K595-Y631 HydrophobicContact CG-CE2 4.17Å
596	D	91.3	Very high	87.5	Confident	97 Å²	97	64.4 Å²	64.4	52%	0.519	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	33.2	179.1	-55.6	-52.1	0	0	0	113.7	G629 V630	D596-G629 WeakPolarHBondContact OD1-CA 2.95Å; D596-V630 PolarHBondContact N-O 3.26Å; D596-V630 PolarHBondContact OD1-N 3.29Å
597	G	84.9	Confident	87.1	Confident	61 Å²	61	71.6 Å²	71.6	63%	0.629	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	7.4	-177.4	0	0	0	0	0	115.6	K595	K595-G597 PolarHBondContact O-N 2.86Å; K595-G597 VanDerWaalsContact O-N 3.09Å
598	G	86.6	Confident	86.8	Confident	31 Å²	31	69.8 Å²	69.8	32%	0.32	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-128.3	179.8	177.8	0	0	0	0	0	113.9	Q594 K595	Q594-G598 CarbonylContact C-O 3.58Å; Q594-G598 VanDerWaalsContact CA-O 3.27Å; Q594-G598 WeakPolarHBondContact CA-O 3.39Å; Q594-G598 WeakPolarHBondContact CB-O 3.47Å; K595-G598 PolarHBondContact N-O 3.47Å; K595-G598 PolarHBondContact O-N 2.9Å
599	T	80.8	Confident	86.5	Confident	117 Å²	117	67.3 Å²	67.3	72%	0.718	36%	0.356	S	S	*	.	S	Bend	trans	-103.2	7.9	178.7	54	0	0	0	0	113.4	F601	T599-F601 WeakPolarHBondContact O-CD2 3.02Å; T599-F601 PolarHBondContact O-N 3Å
600	D	80.4	Confident	85.9	Confident	93 Å²	93	70.1 Å²	70.1	50%	0.497	37%	0.368	S	S	.	.			trans	-86.2	104.2	177.3	-176.8	24.1	0	0	0	111.4	R605	D600-R605 IonicContact OD1-CZ 3.7Å; D600-R605 VanDerWaalsContact OD1-CZ 3.25Å; D600-R605 IonicContact OD1-NE 2.73Å; D600-R605 PolarHBondContact OD1-NE 3.33Å; D600-R605 IonicContact OD1-NH2 2.73Å; D600-R605 PolarHBondContact OD1-NH2 3.02Å; D600-R605 IonicContact OD2-CZ 3.4Å; D600-R605 IonicContact OD2-NE 3.1Å; D600-R605 IonicContact OD2-NH2 3.27Å; D600-R605 PolarHBondContact OD2-NH2 3.37Å
601	F	86.3	Confident	85	Confident	13 Å²	13	66.5 Å²	66.5	6%	0.057	36%	0.356	C	S	.	.			trans	-107	113.1	173.7	-64	-95.2	0	0	0	109.4	W593 K595 T599 A603 A604 R605 M609 F618 Y631	W593-F601 HydrophobicContact CB-CZ 4.02Å; W593-F601 WeakPolarHBondContact O-CZ 3.44Å; K595-F601 HydrophobicContact CB-CD1 3.83Å; K595-F601 HydrophobicContact CB-CE1 3.65Å; K595-F601 HydrophobicContact CB-CG 4.47Å; K595-F601 HydrophobicContact CB-CZ 4.14Å; K595-F601 HydrophobicContact CD-CD1 4.39Å; T599-F601 WeakPolarHBondContact O-CD2 3.02Å; T599-F601 PolarHBondContact O-N 3Å; F601-A603 PolarHBondContact O-N 3.02Å; F601-A604 HydrophobicContact CB-CB 3.74Å; F601-A604 WeakPolarHBondContact O-CB 3.33Å; F601-A604 PolarHBondContact O-N 2.85Å; F601-R605 PolarHBondContact O-N 2.64Å; F601-M609 HydrophobicContact CB-SD 3.77Å; F601-M609 HydrophobicContact CD1-SD 3.77Å; F601-M609 HydrophobicContact CD2-CE 4.27Å; F601-M609 HydrophobicContact CD2-SD 4.05Å; F601-M609 HydrophobicContact CE1-SD 4.31Å; F601-M609 HydrophobicContact CE2-CE 4.44Å; F601-M609 HydrophobicContact CG-CE 4.42Å; F601-M609 HydrophobicContact CG-SD 3.61Å; F601-F618 HydrophobicContact CD1-CZ 4.15Å; F601-F618 HydrophobicContact CE1-CE2 4.21Å; F601-F618 AromaticContact CE1-CZ 3.91Å; F601-F618 HydrophobicContact CE1-CZ 3.91Å; F601-Y631 AromaticContact CD1-CE1 3.84Å; F601-Y631 HydrophobicContact CD1-CE1 3.84Å; F601-Y631 AromaticContact CE1-CD1 3.93Å; F601-Y631 HydrophobicContact CE1-CD1 3.93Å; F601-Y631 AromaticContact CE1-CE1 3.62Å; F601-Y631 HydrophobicContact CE1-CE1 3.62Å
602	P	84.2	Confident	84	Confident	14 Å²	14	67.9 Å²	67.9	9%	0.091	36%	0.362	C	S	.	.	H	α-helix	trans	-53.8	-43.2	173	-27.8	36.1	0	0	0	112.1	A604 R605 E606 E626	P602-A604 VanDerWaalsContact C-N 3.28Å; P602-A604 PolarHBondContact O-N 2.86Å; P602-R605 PolarHBondContact O-N 3.03Å; P602-E606 PolarHBondContact O-N 2.84Å; P602-E626 HydrophobicContact CB-CG 3.95Å
603	A	83.7	Confident	82.5	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-56.4	-31.4	171.8	0	0	0	0	0	115.1	F601 R607 R608 M609 I620 D627	F601-A603 PolarHBondContact O-N 3.02Å; A603-R607 PolarHBondContact O-N 3.21Å; A603-R608 HydrophobicContact CB-CB 4.19Å; A603-R608 WeakPolarHBondContact O-CA 3.43Å; A603-R608 PolarHBondContact O-N 2.88Å; A603-M609 HydrophobicContact CB-CB 3.97Å; A603-M609 PolarHBondContact O-N 2.95Å; A603-M609 VanDerWaalsContact O-N 3.08Å; A603-I620 HydrophobicContact CB-CB 4.46Å; A603-I620 HydrophobicContact CB-CD1 4.07Å; A603-I620 HydrophobicContact CB-CG1 4.02Å; A603-I620 HydrophobicContact CB-CG2 3.67Å; A603-D627 PolarHBondContact N-OD1 2.88Å
604	A	82.5	Confident	81.1	Confident	44 Å²	44	76.3 Å²	76.3	36%	0.364	41%	0.408	S	S	.	.	H	α-helix	trans	-73.8	-42.1	176.3	0	0	0	0	0	111.6	F601 P602 E606 R607 M609	F601-A604 HydrophobicContact CB-CB 3.74Å; F601-A604 WeakPolarHBondContact O-CB 3.33Å; F601-A604 PolarHBondContact O-N 2.85Å; P602-A604 VanDerWaalsContact C-N 3.28Å; P602-A604 PolarHBondContact O-N 2.86Å; A604-E606 PolarHBondContact O-N 3Å; A604-R607 PolarHBondContact O-N 3.19Å; A604-M609 HydrophobicContact CB-CB 4.25Å; A604-M609 HydrophobicContact CB-SD 3.89Å
605	R	82.9	Confident	79.5	Confident	162 Å²	162	76.8 Å²	76.8	61%	0.611	41%	0.413	S	S	*	.	H	α-helix	trans	-58	-33.7	175.4	-65.5	-170	-102.1	131	-11.6	111.8	D600 F601 P602	D600-R605 IonicContact OD1-CZ 3.7Å; D600-R605 VanDerWaalsContact OD1-CZ 3.25Å; D600-R605 IonicContact OD1-NE 2.73Å; D600-R605 PolarHBondContact OD1-NE 3.33Å; D600-R605 IonicContact OD1-NH2 2.73Å; D600-R605 PolarHBondContact OD1-NH2 3.02Å; D600-R605 IonicContact OD2-CZ 3.4Å; D600-R605 IonicContact OD2-NE 3.1Å; D600-R605 IonicContact OD2-NH2 3.27Å; D600-R605 PolarHBondContact OD2-NH2 3.37Å; F601-R605 PolarHBondContact O-N 2.64Å; P602-R605 PolarHBondContact O-N 3.03Å
606	E	84.6	Confident	78.3	Confident	88 Å²	88	78.5 Å²	78.5	41%	0.411	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	5.8	176.8	-60.8	-167.1	129.4	0	0	115.1	P602 A604 R608 K624	P602-E606 PolarHBondContact O-N 2.84Å; A604-E606 PolarHBondContact O-N 3Å; E606-R608 HydrophobicContact CB-CG 4.07Å; E606-R608 PolarHBondContact O-N 3Å; E606-R608 IonicContact OE2-CZ 3.44Å; E606-R608 VanDerWaalsContact OE2-CZ 3.27Å; E606-R608 IonicContact OE2-NE 3.15Å; E606-R608 PolarHBondContact OE2-NE 3.08Å; E606-R608 IonicContact OE2-NH2 3.72Å; E606-R608 PolarHBondContact OE2-NH2 2.84Å; E606-K624 IonicContact OE1-NZ 3.42Å; E606-K624 PolarHBondContact OE1-NZ 2.02Å; E606-K624 WeakPolarHBondContact OE2-CE 3.37Å; E606-K624 IonicContact OE2-NZ 2.66Å; E606-K624 PolarHBondContact OE2-NZ 2.63Å
607	R	83	Confident	77.3	Confident	217 Å²	217	74.2 Å²	74.2	82%	0.819	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	28.7	-176.9	-52.8	-177	180	-168.5	-0.8	114.6	A603 A604	A603-R607 PolarHBondContact O-N 3.21Å; A604-R607 PolarHBondContact O-N 3.19Å
608	R	88.6	Confident	77.1	Confident	18 Å²	18	71.4 Å²	71.4	7%	0.068	37%	0.37	C	S	.	.			trans	-91.2	-18.8	174.2	-67.3	-170.8	-63.7	99.7	-1.3	113.3	A603 E606 H610 I620 A621 N622 D627	A603-R608 HydrophobicContact CB-CB 4.19Å; A603-R608 WeakPolarHBondContact O-CA 3.43Å; A603-R608 PolarHBondContact O-N 2.88Å; E606-R608 HydrophobicContact CB-CG 4.07Å; E606-R608 PolarHBondContact O-N 3Å; E606-R608 IonicContact OE2-CZ 3.44Å; E606-R608 VanDerWaalsContact OE2-CZ 3.27Å; E606-R608 IonicContact OE2-NE 3.15Å; E606-R608 PolarHBondContact OE2-NE 3.08Å; E606-R608 IonicContact OE2-NH2 3.72Å; E606-R608 PolarHBondContact OE2-NH2 2.84Å; R608-H610 PolarHBondContact O-CD2 2.86Å; R608-H610 VanDerWaalsContact O-CD2 3.31Å; R608-I620 VanDerWaalsContact NH1-CG2 3.35Å; R608-I620 WeakPolarHBondContact O-CA 3.42Å; R608-A621 WeakPolarHBondContact CB-O 3.49Å; R608-A621 WeakPolarHBondContact CD-O 3.26Å; R608-A621 PolarHBondContact NH1-O 3.23Å; R608-A621 PolarHBondContact O-N 2.64Å; R608-N622 PolarHBondContact NH1-O 3.22Å; R608-D627 IonicContact CZ-OD1 2.84Å; R608-D627 IonicContact CZ-OD2 3.87Å; R608-D627 IonicContact NH1-OD1 2.9Å; R608-D627 IonicContact NH1-OD2 3.25Å; R608-D627 PolarHBondContact NH1-OD2 3.24Å; R608-D627 IonicContact NH2-OD1 2.75Å; R608-D627 PolarHBondContact NH2-OD1 2.79Å; R608-D627 IonicContact NH2-OD2 3.95Å; R608-D627 PolarHBondContact NH2-OD2 2.88Å
609	M	83.9	Confident	77.1	Confident	50 Å²	50	71.7 Å²	71.7	25%	0.246	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	131.5	175.8	176.1	172.7	135.5	0	0	110.6	F601 A603 A604 F618	F601-M609 HydrophobicContact CB-SD 3.77Å; F601-M609 HydrophobicContact CD1-SD 3.77Å; F601-M609 HydrophobicContact CD2-CE 4.27Å; F601-M609 HydrophobicContact CD2-SD 4.05Å; F601-M609 HydrophobicContact CE1-SD 4.31Å; F601-M609 HydrophobicContact CE2-CE 4.44Å; F601-M609 HydrophobicContact CG-CE 4.42Å; F601-M609 HydrophobicContact CG-SD 3.61Å; A603-M609 HydrophobicContact CB-CB 3.97Å; A603-M609 PolarHBondContact O-N 2.95Å; A603-M609 VanDerWaalsContact O-N 3.08Å; A604-M609 HydrophobicContact CB-CB 4.25Å; A604-M609 HydrophobicContact CB-SD 3.89Å; M609-F618 HydrophobicContact CE-CE2 3.76Å; M609-F618 HydrophobicContact CG-CE2 3.72Å; M609-F618 HydrophobicContact CG-CZ 3.92Å; M609-F618 HydrophobicContact SD-CE2 3.54Å; M609-F618 VanDerWaalsContact SD-CE2 3.54Å; M609-F618 HydrophobicContact SD-CZ 3.75Å
610	H	80.3	Confident	77.5	Confident	80 Å²	80	66.2 Å²	66.2	37%	0.37	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	140.5	177.2	-56.8	-81.5	0	0	0	110.1	R608 F619	R608-H610 PolarHBondContact O-CD2 2.86Å; R608-H610 VanDerWaalsContact O-CD2 3.31Å; H610-F619 HydrophobicContact CB-CD1 3.99Å; H610-F619 HydrophobicContact CB-CD2 4.01Å; H610-F619 HydrophobicContact CB-CE1 3.6Å; H610-F619 HydrophobicContact CB-CE2 3.63Å; H610-F619 HydrophobicContact CB-CG 4.19Å; H610-F619 HydrophobicContact CB-CZ 3.42Å; H610-F619 VanDerWaalsContact CB-CZ 3.42Å; H610-F619 AromaticContact CD2-CD2 3.84Å; H610-F619 AromaticContact CD2-CE2 3.32Å; H610-F619 WeakPolarHBondContact CD2-CE2 3.3Å; H610-F619 AromaticContact CD2-CZ 3.9Å; H610-F619 AromaticContact CG-CE2 3.64Å; H610-F619 AromaticContact CG-CZ 3.74Å; H610-F619 PolarHBondContact N-O 2.87Å; H610-F619 PolarHBondContact O-N 2.81Å
611	V	71.1	Confident	77.9	Confident	82 Å²	82	62.9 Å²	62.9	50%	0.497	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.4	170.6	-177.5	0	0	0	0	106.5	F618	V611-F618 HydrophobicContact CG2-CD2 4.11Å
612	M	67.8	Low	78.1	Confident	78 Å²	78	66.8 Å²	66.8	38%	0.384	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	111.7	172.9	-72.9	-180	67.4	0	0	108.5	D614 D615 I617 F619	M612-D614 VanDerWaalsContact C-N 3.25Å; M612-D614 PolarHBondContact O-N 3.41Å; M612-D615 HydrophobicContact CB-CB 4.28Å; M612-D615 WeakPolarHBondContact CE-OD2 3.29Å; M612-I617 PolarHBondContact N-O 3.13Å; M612-I617 VanDerWaalsContact N-O 3.13Å; M612-F619 HydrophobicContact CG-CE1 4.01Å; M612-F619 HydrophobicContact SD-CE1 3.88Å
613	P	58.5	Low	78.5	Confident	107 Å²	107	66.1 Å²	66.1	70%	0.695	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-31.6	-173.7	-25.3	35.5	0	0	0	114.2
614	D	58.3	Low	78.8	Confident	155 Å²	155	69 Å²	69	83%	0.829	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-9.6	-170.2	-45.8	-66	0	0	0	114.2	M612	M612-D614 VanDerWaalsContact C-N 3.25Å; M612-D614 PolarHBondContact O-N 3.41Å
615	D	57.7	Low	79	Confident	85 Å²	85	70.1 Å²	70.1	46%	0.455	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-4	-171	-83.7	-42.6	0	0	0	114.5	M612 I617	M612-D615 HydrophobicContact CB-CB 4.28Å; M612-D615 WeakPolarHBondContact CE-OD2 3.29Å; D615-I617 VanDerWaalsContact C-N 3.29Å; D615-I617 HydrophobicContact CB-CD1 3.48Å; D615-I617 VanDerWaalsContact CB-CD1 3.48Å; D615-I617 HydrophobicContact CB-CG1 3.93Å; D615-I617 PolarHBondContact O-N 2.94Å
616	D	67.4	Low	79.4	Confident	56 Å²	56	66.6 Å²	66.6	30%	0.299	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	32.6	-175.3	-73.5	-36.7	0	0	0	114.9	C581 A582	C581-D616 PolarHBondContact N-O 3.5Å; C581-D616 WeakPolarHBondContact O-CB 3.49Å; A582-D616 WeakPolarHBondContact CA-OD2 3.4Å; A582-D616 HydrophobicContact CB-CB 3.59Å; A582-D616 WeakPolarHBondContact CB-OD2 3.39Å
617	I	70.8	Confident	79.7	Confident	7 Å²	7	62.4 Å²	62.4	4%	0.036	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129.7	-178.4	-55.4	155.7	0	0	0	111.7	R578 M612 D615 F619	R578-I617 HydrophobicContact CG-CG2 3.91Å; R578-I617 VanDerWaalsContact NH1-CD1 3.35Å; R578-I617 VanDerWaalsContact NH2-CD1 3.3Å; M612-I617 PolarHBondContact N-O 3.13Å; M612-I617 VanDerWaalsContact N-O 3.13Å; D615-I617 VanDerWaalsContact C-N 3.29Å; D615-I617 HydrophobicContact CB-CD1 3.48Å; D615-I617 VanDerWaalsContact CB-CD1 3.48Å; D615-I617 HydrophobicContact CB-CG1 3.93Å; D615-I617 PolarHBondContact O-N 2.94Å; I617-F619 HydrophobicContact CG2-CB 4.46Å; I617-F619 HydrophobicContact CG2-CD1 4.16Å
618	F	80	Confident	80.1	Confident	3 Å²	3	56 Å²	56	1%	0.013	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	126.3	162.5	178	-88.4	0	0	0	109.5	L579 W593 F601 M609 V611 I620 Y631	L579-F618 HydrophobicContact CB-CB 4.49Å; L579-F618 HydrophobicContact CB-CD1 4.26Å; L579-F618 HydrophobicContact CD1-CD1 4.17Å; L579-F618 HydrophobicContact CD1-CE1 4.46Å; L579-F618 HydrophobicContact CG-CD1 4.44Å; L579-F618 PolarHBondContact N-O 2.84Å; L579-F618 PolarHBondContact O-N 3.01Å; W593-F618 HydrophobicContact CB-CD2 4.29Å; W593-F618 HydrophobicContact CB-CE2 4.27Å; W593-F618 AromaticContact CD1-CD2 3.89Å; W593-F618 HydrophobicContact CD2-CB 4.09Å; W593-F618 AromaticContact CD2-CD2 3.95Å; W593-F618 HydrophobicContact CD2-CD2 3.95Å; W593-F618 HydrophobicContact CD2-CG 4.03Å; W593-F618 VanDerWaalsContact CE2-CB 3.5Å; W593-F618 AromaticContact CE2-CG 3.96Å; W593-F618 HydrophobicContact CE3-CG 4.43Å; W593-F618 AromaticContact CG-CD2 3.79Å; W593-F618 HydrophobicContact CG-CD2 3.79Å; W593-F618 HydrophobicContact CG-CE2 4.25Å; W593-F618 HydrophobicContact CG-CG 4.36Å; W593-F618 HydrophobicContact CH2-CB 4.07Å; W593-F618 HydrophobicContact CZ2-CB 3.48Å; W593-F618 VanDerWaalsContact CZ2-CB 3.48Å; W593-F618 HydrophobicContact CZ2-CG 4.25Å; F601-F618 HydrophobicContact CD1-CZ 4.15Å; F601-F618 HydrophobicContact CE1-CE2 4.21Å; F601-F618 AromaticContact CE1-CZ 3.91Å; F601-F618 HydrophobicContact CE1-CZ 3.91Å; M609-F618 HydrophobicContact CE-CE2 3.76Å; M609-F618 HydrophobicContact CG-CE2 3.72Å; M609-F618 HydrophobicContact CG-CZ 3.92Å; M609-F618 HydrophobicContact SD-CE2 3.54Å; M609-F618 VanDerWaalsContact SD-CE2 3.54Å; M609-F618 HydrophobicContact SD-CZ 3.75Å; V611-F618 HydrophobicContact CG2-CD2 4.11Å; F618-I620 HydrophobicContact CE1-CD1 3.79Å; F618-I620 HydrophobicContact CE1-CG1 3.76Å; F618-I620 HydrophobicContact CZ-CD1 4.11Å; F618-I620 HydrophobicContact CZ-CG1 4.09Å; F618-Y631 AromaticContact CE1-CD1 3.75Å; F618-Y631 HydrophobicContact CE1-CD1 3.75Å; F618-Y631 AromaticContact CE1-CE1 3.6Å; F618-Y631 HydrophobicContact CE1-CE1 3.6Å; F618-Y631 AromaticContact CZ-CD1 3.99Å; F618-Y631 HydrophobicContact CZ-CD1 3.99Å; F618-Y631 AromaticContact CZ-CE1 3.68Å; F618-Y631 HydrophobicContact CZ-CE1 3.68Å
619	F	86.2	Confident	80.3	Confident	37 Å²	37	55.7 Å²	55.7	16%	0.162	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	146.8	173.7	70.2	-92.1	0	0	0	114.1	M576 A577 H610 M612 I617	M576-F619 HydrophobicContact CE-CD2 3.88Å; M576-F619 HydrophobicContact CE-CE2 3.85Å; M576-F619 HydrophobicContact CG-CB 4.34Å; M576-F619 HydrophobicContact CG-CD2 4.08Å; M576-F619 HydrophobicContact SD-CB 4.46Å; M576-F619 HydrophobicContact SD-CD2 3.75Å; M576-F619 HydrophobicContact SD-CE2 4.22Å; M576-F619 HydrophobicContact SD-CG 4.29Å; A577-F619 CarbonylContact O-C 3.58Å; A577-F619 WeakPolarHBondContact O-CA 3.39Å; A577-F619 VanDerWaalsContact O-CB 3.24Å; A577-F619 WeakPolarHBondContact O-CB 3.34Å; H610-F619 HydrophobicContact CB-CD1 3.99Å; H610-F619 HydrophobicContact CB-CD2 4.01Å; H610-F619 HydrophobicContact CB-CE1 3.6Å; H610-F619 HydrophobicContact CB-CE2 3.63Å; H610-F619 HydrophobicContact CB-CG 4.19Å; H610-F619 HydrophobicContact CB-CZ 3.42Å; H610-F619 VanDerWaalsContact CB-CZ 3.42Å; H610-F619 AromaticContact CD2-CD2 3.84Å; H610-F619 AromaticContact CD2-CE2 3.32Å; H610-F619 WeakPolarHBondContact CD2-CE2 3.3Å; H610-F619 AromaticContact CD2-CZ 3.9Å; H610-F619 AromaticContact CG-CE2 3.64Å; H610-F619 AromaticContact CG-CZ 3.74Å; H610-F619 PolarHBondContact N-O 2.87Å; H610-F619 PolarHBondContact O-N 2.81Å; M612-F619 HydrophobicContact CG-CE1 4.01Å; M612-F619 HydrophobicContact SD-CE1 3.88Å; I617-F619 HydrophobicContact CG2-CB 4.46Å; I617-F619 HydrophobicContact CG2-CD1 4.16Å
620	I	89.9	Confident	80.8	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	113.7	174.5	-63.9	173.3	0	0	0	107.2	M576 A577 A603 R608 F618 V623 D627 Y631 L648	M576-I620 CarbonylContact C-O 3.52Å; M576-I620 VanDerWaalsContact CA-O 3.29Å; M576-I620 WeakPolarHBondContact CA-O 3.22Å; A577-I620 HydrophobicContact CB-CB 4.45Å; A577-I620 PolarHBondContact N-O 2.92Å; A577-I620 PolarHBondContact O-N 2.91Å; A603-I620 HydrophobicContact CB-CB 4.46Å; A603-I620 HydrophobicContact CB-CD1 4.07Å; A603-I620 HydrophobicContact CB-CG1 4.02Å; A603-I620 HydrophobicContact CB-CG2 3.67Å; R608-I620 VanDerWaalsContact NH1-CG2 3.35Å; R608-I620 WeakPolarHBondContact O-CA 3.42Å; F618-I620 HydrophobicContact CE1-CD1 3.79Å; F618-I620 HydrophobicContact CE1-CG1 3.76Å; F618-I620 HydrophobicContact CZ-CD1 4.11Å; F618-I620 HydrophobicContact CZ-CG1 4.09Å; I620-V623 HydrophobicContact CB-CG2 4.16Å; I620-V623 HydrophobicContact CG2-CG2 3.86Å; I620-V623 VanDerWaalsContact O-CG2 3.3Å; I620-V623 WeakPolarHBondContact O-CG2 3.36Å; I620-D627 HydrophobicContact CD1-CB 4.42Å; I620-Y631 HydrophobicContact CD1-CE1 3.89Å; I620-Y631 VanDerWaalsContact CD1-OH 3.26Å; I620-Y631 WeakPolarHBondContact CD1-OH 3.22Å; I620-L648 HydrophobicContact CD1-CD2 4.25Å
621	A	88.9	Confident	81.4	Confident	24 Å²	24	52 Å²	52	20%	0.198	29%	0.286	C	S	.	.	S	Bend	trans	-76.7	153	170.9	0	0	0	0	0	111	R608 V623	R608-A621 WeakPolarHBondContact CB-O 3.49Å; R608-A621 WeakPolarHBondContact CD-O 3.26Å; R608-A621 PolarHBondContact NH1-O 3.23Å; R608-A621 PolarHBondContact O-N 2.64Å; A621-V623 VanDerWaalsContact C-N 3.3Å; A621-V623 PolarHBondContact O-N 3.23Å
622	N	88.9	Confident	82.5	Confident	95 Å²	95	49 Å²	49	51%	0.508	27%	0.268	S	S	.	.	S	Bend	trans	46.8	52.9	174.7	-172.2	33.4	0	0	0	112.3	G574 T575 R608	G574-N622 WeakPolarHBondContact CA-OD1 3.28Å; T575-N622 WeakPolarHBondContact O-CA 3Å; T575-N622 PolarHBondContact O-N 2.9Å; R608-N622 PolarHBondContact NH1-O 3.22Å
623	V	92.5	Very high	83.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.25	C	S	.	.			trans	-55.6	136.6	-173.3	176.5	0	0	0	0	110.8	I571 T573 G574 T575 A577 I620 A621 D627 V650	I571-V623 HydrophobicContact CG2-CB 4.44Å; I571-V623 HydrophobicContact CG2-CG1 4.11Å; I571-V623 HydrophobicContact CG2-CG2 4.45Å; T573-V623 CarbonylContact C-O 3.18Å; T573-V623 VanDerWaalsContact CA-O 3.27Å; T573-V623 WeakPolarHBondContact CA-O 3.45Å; T573-V623 PolarHBondContact OG1-O 2.99Å; G574-V623 PolarHBondContact N-O 2.87Å; T575-V623 WeakPolarHBondContact O-CG2 3.35Å; T575-V623 PolarHBondContact O-N 3.05Å; A577-V623 HydrophobicContact CB-CG2 3.54Å; I620-V623 HydrophobicContact CB-CG2 4.16Å; I620-V623 HydrophobicContact CG2-CG2 3.86Å; I620-V623 VanDerWaalsContact O-CG2 3.3Å; I620-V623 WeakPolarHBondContact O-CG2 3.36Å; A621-V623 VanDerWaalsContact C-N 3.3Å; A621-V623 PolarHBondContact O-N 3.23Å; V623-D627 WeakPolarHBondContact CA-OD2 3.32Å; V623-D627 HydrophobicContact CG1-CB 4.33Å; V623-V650 HydrophobicContact CG1-CB 4.4Å; V623-V650 HydrophobicContact CG1-CG1 3.93Å; V623-V650 HydrophobicContact CG1-CG2 3.52Å
624	K	91.1	Very high	85.3	Confident	59 Å²	59	41.4 Å²	41.4	26%	0.257	23%	0.225	S	C	.	.			trans	-116.4	165.3	177	-66.1	-179.1	178.8	-176.5	0	111.6	E606 E626 D627	E606-K624 IonicContact OE1-NZ 3.42Å; E606-K624 PolarHBondContact OE1-NZ 2.02Å; E606-K624 WeakPolarHBondContact OE2-CE 3.37Å; E606-K624 IonicContact OE2-NZ 2.66Å; E606-K624 PolarHBondContact OE2-NZ 2.63Å; K624-E626 HydrophobicContact CB-CG 3.91Å; K624-E626 HydrophobicContact CD-CG 4.08Å; K624-E626 WeakPolarHBondContact CD-OE1 3.47Å; K624-E626 WeakPolarHBondContact CE-OE1 3.35Å; K624-E626 IonicContact NZ-OE1 2.72Å; K624-E626 PolarHBondContact NZ-OE1 3.28Å; K624-E626 PolarHBondContact O-N 3.3Å; K624-D627 PolarHBondContact N-OD2 3.18Å; K624-D627 WeakPolarHBondContact O-CB 3.35Å; K624-D627 PolarHBondContact O-N 3.38Å
625	T	87.6	Confident	86.9	Confident	68 Å²	68	34 Å²	34	42%	0.417	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-60.7	-27.6	175.7	45.4	0	0	0	0	113.8	D627 M628 V650	T625-D627 VanDerWaalsContact C-N 3.29Å; T625-D627 PolarHBondContact O-N 2.9Å; T625-M628 VanDerWaalsContact O-CB 3.24Å; T625-M628 WeakPolarHBondContact O-CB 3.09Å; T625-M628 PolarHBondContact O-N 3.2Å; T625-V650 HydrophobicContact CG2-CG1 4.38Å
626	E	89.6	Confident	88.7	Confident	88 Å²	88	35.6 Å²	35.6	41%	0.411	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-71.7	-17.3	173.6	64.2	-173.7	152.3	0	0	114.5	P602 K624 M628	P602-E626 HydrophobicContact CB-CG 3.95Å; K624-E626 HydrophobicContact CB-CG 3.91Å; K624-E626 HydrophobicContact CD-CG 4.08Å; K624-E626 WeakPolarHBondContact CD-OE1 3.47Å; K624-E626 WeakPolarHBondContact CE-OE1 3.35Å; K624-E626 IonicContact NZ-OE1 2.72Å; K624-E626 PolarHBondContact NZ-OE1 3.28Å; K624-E626 PolarHBondContact O-N 3.3Å; E626-M628 PolarHBondContact O-N 2.77Å
627	D	91.2	Very high	89.9	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-79.4	-7.9	174.1	-53.4	-42.7	0	0	0	112	K595 A603 R608 I620 V623 K624 T625 G629 Y631 L648	K595-D627 VanDerWaalsContact CE-O 3.23Å; K595-D627 WeakPolarHBondContact CE-O 3.4Å; A603-D627 PolarHBondContact N-OD1 2.88Å; R608-D627 IonicContact CZ-OD1 2.84Å; R608-D627 IonicContact CZ-OD2 3.87Å; R608-D627 IonicContact NH1-OD1 2.9Å; R608-D627 IonicContact NH1-OD2 3.25Å; R608-D627 PolarHBondContact NH1-OD2 3.24Å; R608-D627 IonicContact NH2-OD1 2.75Å; R608-D627 PolarHBondContact NH2-OD1 2.79Å; R608-D627 IonicContact NH2-OD2 3.95Å; R608-D627 PolarHBondContact NH2-OD2 2.88Å; I620-D627 HydrophobicContact CD1-CB 4.42Å; V623-D627 WeakPolarHBondContact CA-OD2 3.32Å; V623-D627 HydrophobicContact CG1-CB 4.33Å; K624-D627 PolarHBondContact N-OD2 3.18Å; K624-D627 WeakPolarHBondContact O-CB 3.35Å; K624-D627 PolarHBondContact O-N 3.38Å; T625-D627 VanDerWaalsContact C-N 3.29Å; T625-D627 PolarHBondContact O-N 2.9Å; D627-G629 PolarHBondContact O-N 2.9Å; D627-Y631 WeakPolarHBondContact O-CE2 3.27Å; D627-Y631 PolarHBondContact O-OH 2.67Å; D627-L648 HydrophobicContact CB-CD2 4.34Å
628	M	92	Very high	91	Very high	83 Å²	83	38.9 Å²	38.9	41%	0.409	21%	0.212	S	C	.	.			trans	-59.6	134.9	175.5	-177.7	-176.1	-71.4	0	0	111.2	K595 T625 E626 L648 T649 V650	K595-M628 WeakPolarHBondContact CE-O 3.43Å; K595-M628 PolarHBondContact NZ-O 2.88Å; T625-M628 VanDerWaalsContact O-CB 3.24Å; T625-M628 WeakPolarHBondContact O-CB 3.09Å; T625-M628 PolarHBondContact O-N 3.2Å; E626-M628 PolarHBondContact O-N 2.77Å; M628-L648 WeakPolarHBondContact CA-O 3.42Å; M628-L648 WeakPolarHBondContact CG-O 3.49Å; M628-T649 HydrophobicContact CE-CG2 4.37Å; M628-V650 HydrophobicContact CB-CG2 4.37Å; M628-V650 HydrophobicContact CE-CB 4.46Å
629	G	92.5	Very high	91.6	Very high	11 Å²	11	40 Å²	40	11%	0.113	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.3	-177.4	179.6	0	0	0	0	0	113.5	D596 D627 L648	D596-G629 WeakPolarHBondContact OD1-CA 2.95Å; D627-G629 PolarHBondContact O-N 2.9Å; G629-L648 PolarHBondContact N-O 3.26Å; G629-L648 PolarHBondContact O-N 2.91Å
630	V	95.3	Very high	91.9	Very high	54 Å²	54	39.3 Å²	39.3	33%	0.327	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	122.9	171.8	-178.7	0	0	0	0	109.3	K595 D596 N645 A646	K595-V630 CarbonylContact C-O 3.59Å; K595-V630 WeakPolarHBondContact CA-O 3.32Å; D596-V630 PolarHBondContact N-O 3.26Å; D596-V630 PolarHBondContact OD1-N 3.29Å; V630-N645 HydrophobicContact CG1-CB 4.11Å; V630-A646 CarbonylContact C-O 3.58Å; V630-A646 WeakPolarHBondContact CA-O 3.5Å
631	Y	92.9	Very high	92.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.9	176.8	-75.4	-105	0	0	0	108.9	L579 Q594 K595 F601 F618 I620 D627 N645 A646 L648	L579-Y631 HydrophobicContact CD1-CD1 3.95Å; L579-Y631 HydrophobicContact CD1-CD2 4.36Å; L579-Y631 HydrophobicContact CD1-CG 3.7Å; Q594-Y631 WeakPolarHBondContact O-CA 3.46Å; K595-Y631 HydrophobicContact CB-CE1 4.5Å; K595-Y631 HydrophobicContact CD-CE2 4.25Å; K595-Y631 WeakPolarHBondContact CE-OH 3.36Å; K595-Y631 HydrophobicContact CG-CE1 4.49Å; K595-Y631 HydrophobicContact CG-CE2 4.17Å; F601-Y631 AromaticContact CD1-CE1 3.84Å; F601-Y631 HydrophobicContact CD1-CE1 3.84Å; F601-Y631 AromaticContact CE1-CD1 3.93Å; F601-Y631 HydrophobicContact CE1-CD1 3.93Å; F601-Y631 AromaticContact CE1-CE1 3.62Å; F601-Y631 HydrophobicContact CE1-CE1 3.62Å; F618-Y631 AromaticContact CE1-CD1 3.75Å; F618-Y631 HydrophobicContact CE1-CD1 3.75Å; F618-Y631 AromaticContact CE1-CE1 3.6Å; F618-Y631 HydrophobicContact CE1-CE1 3.6Å; F618-Y631 AromaticContact CZ-CD1 3.99Å; F618-Y631 HydrophobicContact CZ-CD1 3.99Å; F618-Y631 AromaticContact CZ-CE1 3.68Å; F618-Y631 HydrophobicContact CZ-CE1 3.68Å; I620-Y631 HydrophobicContact CD1-CE1 3.89Å; I620-Y631 VanDerWaalsContact CD1-OH 3.26Å; I620-Y631 WeakPolarHBondContact CD1-OH 3.22Å; D627-Y631 WeakPolarHBondContact O-CE2 3.27Å; D627-Y631 PolarHBondContact O-OH 2.67Å; Y631-N645 CarbonylContact O-C 3.59Å; Y631-N645 WeakPolarHBondContact O-CA 3.41Å; Y631-A646 PolarHBondContact N-O 3.35Å; Y631-A646 PolarHBondContact O-N 2.87Å; Y631-L648 HydrophobicContact CD2-CB 3.88Å; Y631-L648 HydrophobicContact CE2-CB 3.72Å; Y631-L648 HydrophobicContact CE2-CD2 3.91Å; Y631-L648 HydrophobicContact CE2-CG 4.44Å
632	S	93.3	Very high	92.4	Very high	17 Å²	17	43.9 Å²	43.9	12%	0.119	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	120.7	176.5	-69	0	0	0	0	109.2	W593 Q594 N645	W593-S632 CarbonylContact C-O 3.58Å; W593-S632 WeakPolarHBondContact CA-O 3.44Å; Q594-S632 PolarHBondContact N-O 2.86Å; Q594-S632 PolarHBondContact O-N 2.96Å; S632-N645 VanDerWaalsContact CB-OD1 3.32Å; S632-N645 WeakPolarHBondContact CB-OD1 3.48Å; S632-N645 PolarHBondContact OG-OD1 2.78Å
633	C	91.8	Very high	92.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	134.1	165.2	174.1	0	0	0	0	109.4	P566 C581 W593 S643 A644	P566-C633 HydrophobicContact CG-CB 4.24Å; C581-C633 HydrophobicContact CB-CB 3.63Å; C581-C633 WeakPolarHBondContact CB-SG 2.98Å; C581-C633 WeakPolarHBondContact SG-CB 3.42Å; C581-C633 CovalentContact SG-SG 2.02Å; C581-C633 PolarHBondContact SG-SG 2.88Å; W593-C633 HydrophobicContact CD2-CB 4.18Å; W593-C633 HydrophobicContact CE3-CB 3.96Å; W593-C633 HydrophobicContact CH2-CB 4.04Å; W593-C633 HydrophobicContact CZ2-CB 4.23Å; W593-C633 HydrophobicContact CZ3-CB 3.89Å; C633-S643 CarbonylContact O-C 3.45Å; C633-S643 WeakPolarHBondContact O-CA 3.18Å; C633-S643 WeakPolarHBondContact O-CB 3.46Å; C633-A644 PolarHBondContact N-O 2.96Å; C633-A644 PolarHBondContact O-N 3.19Å
634	T	93	Very high	92.7	Very high	27 Å²	27	44 Å²	44	17%	0.166	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.3	172.2	-59.4	0	0	0	0	109.2	A592 L642	A592-T634 PolarHBondContact N-O 2.74Å; A592-T634 PolarHBondContact O-N 2.9Å; T634-L642 CarbonylContact C-O 3.21Å; T634-L642 WeakPolarHBondContact CA-O 3.33Å
635	A	93.1	Very high	92.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.7	171.2	0	0	0	0	0	109.1	F562 A583 P589 Q590 I591 S641 L642	F562-A635 HydrophobicContact CE1-CB 4.1Å; A583-A635 HydrophobicContact CB-CB 3.45Å; A583-A635 VanDerWaalsContact CB-CB 3.45Å; P589-A635 HydrophobicContact CB-CB 4.15Å; Q590-A635 WeakPolarHBondContact O-CA 3.14Å; I591-A635 HydrophobicContact CD1-CB 3.66Å; A635-S641 CarbonylContact O-C 3.58Å; A635-S641 VanDerWaalsContact O-CA 3.22Å; A635-S641 WeakPolarHBondContact O-CA 3.27Å; A635-L642 HydrophobicContact CB-CD2 3.73Å; A635-L642 PolarHBondContact N-O 2.75Å; A635-L642 PolarHBondContact O-N 2.89Å
636	Q	94.1	Very high	93.3	Very high	117 Å²	117	42.7 Å²	42.7	55%	0.547	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	136.1	-174.1	-179.3	172.2	10	0	0	113.1	P589 Q590 G640	P589-Q636 CarbonylContact C-O 3.44Å; P589-Q636 VanDerWaalsContact CA-O 3.29Å; P589-Q636 WeakPolarHBondContact CA-O 3.26Å; Q590-Q636 PolarHBondContact N-O 2.85Å; Q590-Q636 PolarHBondContact O-N 2.88Å; Q636-G640 WeakPolarHBondContact CA-O 3.28Å
637	N	94.1	Very high	93.6	Very high	20 Å²	20	41.1 Å²	41.1	11%	0.107	25%	0.251	C	S	.	.			trans	-135.2	-166.4	166.7	71.8	8.1	0	0	0	110.5	E558 P560 H586 P587 P589 A639 G640	E558-N637 PolarHBondContact O-ND2 2.96Å; P560-N637 WeakPolarHBondContact CD-OD1 3.14Å; H586-N637 PolarHBondContact O-ND2 2.81Å; P587-N637 VanDerWaalsContact O-CB 3.26Å; P587-N637 WeakPolarHBondContact O-CB 3.46Å; P587-N637 PolarHBondContact O-ND2 2.71Å; P589-N637 HydrophobicContact CB-CB 4.47Å; N637-A639 VanDerWaalsContact C-N 3.34Å; N637-A639 WeakPolarHBondContact OD1-CA 3.36Å; N637-A639 WeakPolarHBondContact OD1-CB 3.32Å; N637-A639 PolarHBondContact OD1-N 2.86Å; N637-G640 PolarHBondContact N-O 2.83Å; N637-G640 PolarHBondContact O-N 2.84Å; N637-G640 PolarHBondContact OD1-N 3.19Å; N637-G640 VanDerWaalsContact OD1-N 3.13Å; N637-G640 PolarHBondContact OD1-O 2.84Å
638	V	93.6	Very high	93.7	Very high	113 Å²	113	41.2 Å²	41.2	69%	0.685	25%	0.251	S	S	*	.	S	Bend	trans	-78.8	-8.9	179	-67.8	0	0	0	0	114.9	P587	P587-V638 HydrophobicContact CG-CG2 3.91Å
639	A	91.3	Very high	93.8	Very high	26 Å²	26	39.5 Å²	39.5	22%	0.215	25%	0.245	C	C	.	.	S	Bend	trans	-82.6	-35.1	168	0	0	0	0	0	112.2	L471 N557 L559 N637	L471-A639 HydrophobicContact CD2-CB 3.57Å; N557-A639 HydrophobicContact CB-CB 3.84Å; L559-A639 HydrophobicContact CD2-CB 3.96Å; L559-A639 WeakPolarHBondContact CD2-O 3.37Å; L559-A639 HydrophobicContact CG-CB 4.19Å; N637-A639 VanDerWaalsContact C-N 3.34Å; N637-A639 WeakPolarHBondContact OD1-CA 3.36Å; N637-A639 WeakPolarHBondContact OD1-CB 3.32Å; N637-A639 PolarHBondContact OD1-N 2.86Å
640	G	93.3	Very high	93.8	Very high	22 Å²	22	39 Å²	39	23%	0.227	24%	0.24	C	C	.	.			trans	166.1	-160.7	-179.5	0	0	0	0	0	113.8	Q636 N637	Q636-G640 WeakPolarHBondContact CA-O 3.28Å; N637-G640 PolarHBondContact N-O 2.83Å; N637-G640 PolarHBondContact O-N 2.84Å; N637-G640 PolarHBondContact OD1-N 3.19Å; N637-G640 VanDerWaalsContact OD1-N 3.13Å; N637-G640 PolarHBondContact OD1-O 2.84Å
641	S	94.4	Very high	93.6	Very high	76 Å²	76	38.2 Å²	38.2	53%	0.531	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	145.7	-176.7	59.4	0	0	0	0	112.2	A635	A635-S641 CarbonylContact O-C 3.58Å; A635-S641 VanDerWaalsContact O-CA 3.22Å; A635-S641 WeakPolarHBondContact O-CA 3.27Å
642	L	94.2	Very high	93.4	Very high	46 Å²	46	41 Å²	41	24%	0.241	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	155	170.3	73.1	169.3	0	0	0	110.9	P560 F562 T634 A635	P560-L642 HydrophobicContact CB-CD2 3.61Å; P560-L642 HydrophobicContact CG-CD2 3.62Å; P560-L642 WeakPolarHBondContact O-CD1 3.29Å; P560-L642 VanDerWaalsContact O-CD2 3.22Å; P560-L642 WeakPolarHBondContact O-CD2 3.49Å; F562-L642 HydrophobicContact CD1-CD1 4.45Å; F562-L642 HydrophobicContact CD2-CD1 3.37Å; F562-L642 HydrophobicContact CD2-CG 3.94Å; F562-L642 HydrophobicContact CE1-CG 4.28Å; F562-L642 HydrophobicContact CE2-CB 4.28Å; F562-L642 HydrophobicContact CE2-CD1 3.53Å; F562-L642 HydrophobicContact CE2-CG 3.56Å; F562-L642 HydrophobicContact CG-CD1 3.87Å; F562-L642 HydrophobicContact CG-CG 4.45Å; F562-L642 HydrophobicContact CZ-CD1 4.14Å; F562-L642 HydrophobicContact CZ-CG 3.75Å; T634-L642 CarbonylContact C-O 3.21Å; T634-L642 WeakPolarHBondContact CA-O 3.33Å; A635-L642 HydrophobicContact CB-CD2 3.73Å; A635-L642 PolarHBondContact N-O 2.75Å; A635-L642 PolarHBondContact O-N 2.89Å
643	S	94.4	Very high	93.2	Very high	79 Å²	79	42.8 Å²	42.8	55%	0.552	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.5	145.9	-175.8	59.8	0	0	0	0	113	C633	C633-S643 CarbonylContact O-C 3.45Å; C633-S643 WeakPolarHBondContact O-CA 3.18Å; C633-S643 WeakPolarHBondContact O-CB 3.46Å
644	A	94.6	Very high	93.1	Very high	17 Å²	17	43.1 Å²	43.1	14%	0.14	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	147.5	176.9	0	0	0	0	0	111.1	F562 T565 C633	F562-A644 HydrophobicContact CD2-CB 4.22Å; F562-A644 HydrophobicContact CE2-CB 3.54Å; F562-A644 HydrophobicContact CZ-CB 3.73Å; T565-A644 HydrophobicContact CG2-CB 3.75Å; C633-A644 PolarHBondContact N-O 2.96Å; C633-A644 PolarHBondContact O-N 3.19Å
645	N	95.5	Very high	92.9	Very high	99 Å²	99	43.6 Å²	43.6	53%	0.529	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	147.5	-169.2	-65	-9.5	0	0	0	111.7	V630 Y631 S632	V630-N645 HydrophobicContact CG1-CB 4.11Å; Y631-N645 CarbonylContact O-C 3.59Å; Y631-N645 WeakPolarHBondContact O-CA 3.41Å; S632-N645 VanDerWaalsContact CB-OD1 3.32Å; S632-N645 WeakPolarHBondContact CB-OD1 3.48Å; S632-N645 PolarHBondContact OG-OD1 2.78Å
646	A	94.9	Very high	92.7	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.008	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	154.5	171.2	0	0	0	0	0	111.9	P566 M567 V630 Y631	P566-A646 HydrophobicContact CB-CB 3.67Å; P566-A646 HydrophobicContact CG-CB 4.08Å; M567-A646 VanDerWaalsContact C-CB 3.47Å; M567-A646 WeakPolarHBondContact O-CB 3.19Å; V630-A646 CarbonylContact C-O 3.58Å; V630-A646 WeakPolarHBondContact CA-O 3.5Å; Y631-A646 PolarHBondContact N-O 3.35Å; Y631-A646 PolarHBondContact O-N 2.87Å
647	T	95.9	Very high	92.4	Very high	56 Å²	56	47 Å²	47	34%	0.344	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	121.4	-176.5	-40.4	0	0	0	0	110.8	D568 L569	D568-T647 WeakPolarHBondContact CA-O 3.38Å; D568-T647 WeakPolarHBondContact OD1-CA 3.5Å; D568-T647 WeakPolarHBondContact OD1-CB 3.43Å; D568-T647 PolarHBondContact OD1-N 3.48Å; D568-T647 PolarHBondContact OD1-OG1 3.38Å; L569-T647 PolarHBondContact N-O 3.48Å
648	L	94.3	Very high	92	Very high	1 Å²	1	54 Å²	54	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	115.4	171.3	179.5	57.4	0	0	0	109.9	L569 I571 A577 I620 D627 M628 G629 Y631 V650	L569-L648 HydrophobicContact CB-CD1 4.22Å; L569-L648 HydrophobicContact CD2-CD1 4.15Å; L569-L648 HydrophobicContact CG-CD1 4.12Å; L569-L648 WeakPolarHBondContact O-CA 3.31Å; I571-L648 HydrophobicContact CG2-CD1 4.18Å; A577-L648 HydrophobicContact CB-CD1 3.89Å; A577-L648 HydrophobicContact CB-CD2 4.15Å; I620-L648 HydrophobicContact CD1-CD2 4.25Å; D627-L648 HydrophobicContact CB-CD2 4.34Å; M628-L648 WeakPolarHBondContact CA-O 3.42Å; M628-L648 WeakPolarHBondContact CG-O 3.49Å; G629-L648 PolarHBondContact N-O 3.26Å; G629-L648 PolarHBondContact O-N 2.91Å; Y631-L648 HydrophobicContact CD2-CB 3.88Å; Y631-L648 HydrophobicContact CE2-CB 3.72Å; Y631-L648 HydrophobicContact CE2-CD2 3.91Å; Y631-L648 HydrophobicContact CE2-CG 4.44Å; L648-V650 HydrophobicContact CG-CG2 4.22Å
649	T	93.7	Very high	91.7	Very high	47 Å²	47	54 Å²	54	29%	0.288	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.5	176.3	-61.8	0	0	0	0	110.4	L569 T570 I571 M628 L651	L569-T649 PolarHBondContact O-N 3.34Å; T570-T649 WeakPolarHBondContact CA-O 3.49Å; T570-T649 HydrophobicContact CG2-CG2 4.17Å; I571-T649 PolarHBondContact N-O 2.83Å; M628-T649 HydrophobicContact CE-CG2 4.37Å; T649-L651 HydrophobicContact CG2-CD2 4.34Å
650	V	93.1	Very high	91.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.2	-175.3	-170.5	0	0	0	0	111.6	I571 V623 T625 M628 L648 S680	I571-V650 WeakPolarHBondContact O-CA 3.46Å; V623-V650 HydrophobicContact CG1-CB 4.4Å; V623-V650 HydrophobicContact CG1-CG1 3.93Å; V623-V650 HydrophobicContact CG1-CG2 3.52Å; T625-V650 HydrophobicContact CG2-CG1 4.38Å; M628-V650 HydrophobicContact CB-CG2 4.37Å; M628-V650 HydrophobicContact CE-CB 4.46Å; L648-V650 HydrophobicContact CG-CG2 4.22Å; V650-S680 PolarHBondContact O-OG 2.74Å
651	L	91	Very high	91.5	Very high	38 Å²	38	59 Å²	59	20%	0.199	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	144.6	-178.8	-55.8	-176.5	0	0	0	111.1	T570 I571 R572 T573 T649 S680 L730	T570-L651 HydrophobicContact CG2-CD1 3.63Å; T570-L651 HydrophobicContact CG2-CD2 4.48Å; T570-L651 HydrophobicContact CG2-CG 3.9Å; I571-L651 PolarHBondContact O-N 2.78Å; R572-L651 CarbonylContact C-O 3.37Å; R572-L651 WeakPolarHBondContact CA-O 3.44Å; T573-L651 PolarHBondContact N-O 2.83Å; T649-L651 HydrophobicContact CG2-CD2 4.34Å; L651-S680 CarbonylContact C-O 3.11Å; L651-S680 VanDerWaalsContact CA-O 3.31Å; L651-S680 WeakPolarHBondContact CA-O 3.4Å; L651-S680 WeakPolarHBondContact CB-O 3.4Å; L651-L730 HydrophobicContact CB-CD1 3.58Å; L651-L730 HydrophobicContact CB-CG 4.38Å
652	E	88.8	Confident	91.3	Very high	58 Å²	58	60.9 Å²	60.9	27%	0.271	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	135.6	-172.6	177.6	-178.9	-168.3	0	0	110.6	T573 S680 N728	T573-E652 HydrophobicContact CG2-CB 4.15Å; T573-E652 HydrophobicContact CG2-CG 4.09Å; E652-S680 PolarHBondContact N-O 3.09Å; E652-S680 CarbonylContact O-C 3.21Å; E652-S680 PolarHBondContact O-N 2.85Å; E652-S680 VanDerWaalsContact O-O 3.11Å; E652-N728 PolarHBondContact O-ND2 2.71Å
653	T	88.1	Confident	91.2	Very high	56 Å²	56	63.7 Å²	63.7	34%	0.344	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	157.7	175.4	39.4	0	0	0	0	112	S655 L730	T653-S655 PolarHBondContact O-N 2.83Å; T653-L730 HydrophobicContact CG2-CB 3.7Å; T653-L730 HydrophobicContact CG2-CD1 4.45Å
654	P	89.9	Confident	90.9	Very high	6 Å²	6	64.9 Å²	64.9	4%	0.039	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	134.5	177.3	-19.3	33.9	0	0	0	110.7	G678 P683 M726 N728 E733	P654-G678 WeakPolarHBondContact CA-O 3.4Å; P654-P683 HydrophobicContact CB-CB 3.87Å; P654-P683 HydrophobicContact CB-CG 4.39Å; P654-P683 HydrophobicContact CG-CB 4.14Å; P654-M726 HydrophobicContact CB-CB 3.77Å; P654-M726 WeakPolarHBondContact CB-O 3.33Å; P654-M726 WeakPolarHBondContact CG-O 3.21Å; P654-N728 WeakPolarHBondContact CD-OD1 3.47Å; P654-N728 HydrophobicContact CG-CB 4.1Å; P654-E733 HydrophobicContact CB-CB 4.14Å; P654-E733 VanDerWaalsContact O-CB 3.28Å; P654-E733 WeakPolarHBondContact O-CB 3.35Å
655	S	89.1	Confident	90.7	Very high	37 Å²	37	64.8 Å²	64.8	26%	0.259	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	150.8	-178.9	63.2	0	0	0	0	110.9	T653 M657 A677 G678	T653-S655 PolarHBondContact O-N 2.83Å; S655-M657 PolarHBondContact O-N 3.23Å; S655-A677 CarbonylContact O-C 3.05Å; S655-A677 WeakPolarHBondContact O-CA 3.3Å; S655-G678 PolarHBondContact N-O 2.84Å; S655-G678 VanDerWaalsContact N-O 3.1Å; S655-G678 PolarHBondContact O-N 2.81Å
656	L	89.3	Confident	90.2	Very high	61 Å²	61	61.5 Å²	61.5	32%	0.319	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	120.7	172.3	-77.1	162.9	0	0	0	109.8	R658 M660 M726	L656-R658 PolarHBondContact O-N 2.82Å; L656-M660 HydrophobicContact CD2-CG 3.98Å; L656-M660 HydrophobicContact CD2-SD 3.97Å; L656-M726 HydrophobicContact CD1-CE 4.37Å; L656-M726 HydrophobicContact CD2-CE 4.08Å; L656-M726 HydrophobicContact CD2-SD 3.61Å; L656-M726 HydrophobicContact CG-CE 3.87Å; L656-M726 HydrophobicContact CG-SD 3.77Å
657	M	87.1	Confident	89.9	Confident	127 Å²	127	69.9 Å²	69.9	63%	0.626	36%	0.355	S	S	*	.	S	Bend	trans	-72.5	-20.4	175.9	-59.4	-171.3	75.6	0	0	112.5	S655 I676	S655-M657 PolarHBondContact O-N 3.23Å; M657-I676 HydrophobicContact CB-CB 4.44Å; M657-I676 HydrophobicContact CB-CG2 3.97Å; M657-I676 HydrophobicContact CG-CG2 4.1Å; M657-I676 PolarHBondContact N-O 2.85Å; M657-I676 HydrophobicContact SD-CG2 3.73Å
658	R	84.9	Confident	89.3	Confident	167 Å²	167	69.1 Å²	69.1	63%	0.63	36%	0.358	S	S	*	.	S	Bend	trans	-146.5	145.6	174.9	-62	-173.8	-177.5	175.7	0.1	109.1	L656	L656-R658 PolarHBondContact O-N 2.82Å
659	P	87.2	Confident	89	Confident	115 Å²	115	74.3 Å²	74.3	75%	0.747	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-53.7	146.9	166.4	-23.2	34.2	0	0	0	110.9
660	M	91.1	Very high	88.8	Confident	20 Å²	20	75.4 Å²	75.4	10%	0.099	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-88.8	119.1	172	-54	175.6	59.6	0	0	107.3	L656 Q674 C675 W687 C724 G735 I737	L656-M660 HydrophobicContact CD2-CG 3.98Å; L656-M660 HydrophobicContact CD2-SD 3.97Å; M660-Q674 WeakPolarHBondContact CE-O 3.14Å; M660-Q674 WeakPolarHBondContact CG-O 3.36Å; M660-C675 HydrophobicContact CE-CB 3.92Å; M660-C675 HydrophobicContact SD-CB 4.16Å; M660-W687 HydrophobicContact CE-CH2 3.47Å; M660-W687 VanDerWaalsContact CE-CH2 3.47Å; M660-W687 HydrophobicContact CE-CZ2 4.41Å; M660-W687 HydrophobicContact CE-CZ3 3.66Å; M660-C724 HydrophobicContact CE-CB 3.91Å; M660-C724 HydrophobicContact SD-CB 4.03Å; M660-G735 VanDerWaalsContact SD-C 3.54Å; M660-G735 VanDerWaalsContact SD-CA 3.56Å; M660-I737 HydrophobicContact CB-CB 4Å; M660-I737 HydrophobicContact CE-CB 3.99Å; M660-I737 HydrophobicContact CE-CG2 3.62Å
661	E	89.2	Confident	88.7	Confident	133 Å²	133	75.4 Å²	75.4	62%	0.621	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-93	126.3	-173.1	-63.3	174	160.3	0	0	111.3	R663 I737	E661-R663 IonicContact OE2-NH2 3.76Å; E661-I737 WeakPolarHBondContact O-CD1 3.29Å; E661-I737 WeakPolarHBondContact O-CG1 3.31Å
662	D	92.1	Very high	88.8	Confident	114 Å²	114	76.5 Å²	76.5	61%	0.61	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-52.9	142.3	176.1	-73.1	-5.7	0	0	0	112.3	Y738	D662-Y738 WeakPolarHBondContact CA-O 3.39Å; D662-Y738 WeakPolarHBondContact OD1-CB 3.4Å; D662-Y738 PolarHBondContact OD1-N 2.92Å
663	R	91.1	Very high	89	Confident	105 Å²	105	73.7 Å²	73.7	40%	0.396	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.1	-173.6	-72.3	-74.8	161	140.5	-9.2	111.4	E661 V665 L673 I737 Y738 L739 S740	E661-R663 IonicContact OE2-NH2 3.76Å; R663-V665 HydrophobicContact CB-CG2 4.43Å; R663-L673 HydrophobicContact CB-CD2 4.41Å; R663-L673 HydrophobicContact CG-CD2 4.34Å; R663-I737 HydrophobicContact CG-CD1 4.28Å; R663-Y738 PolarHBondContact N-O 3.08Å; R663-L739 HydrophobicContact CB-CD1 3.98Å; R663-L739 CarbonylContact O-C 3.37Å; R663-L739 WeakPolarHBondContact O-CA 3.35Å; R663-S740 PolarHBondContact O-N 2.85Å; R663-S740 PolarHBondContact O-OG 2.91Å; R663-S740 VanDerWaalsContact O-OG 3.1Å
664	T	88.6	Confident	89.2	Confident	104 Å²	104	75.5 Å²	75.5	64%	0.638	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	130.2	162.8	-48.4	0	0	0	0	108.5	S740	T664-S740 WeakPolarHBondContact CA-O 3.46Å; T664-S740 WeakPolarHBondContact CA-OG 3.34Å; T664-S740 PolarHBondContact OG1-OG 2.87Å; T664-S740 VanDerWaalsContact OG1-OG 3.08Å
665	V	89.3	Confident	89.3	Confident	15 Å²	15	75.2 Å²	75.2	9%	0.091	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	139.1	-174	177.6	0	0	0	0	108.1	R663 E669 A671 T714 L739 S740 V741 S742	R663-V665 HydrophobicContact CB-CG2 4.43Å; V665-E669 HydrophobicContact CG1-CB 3.55Å; V665-A671 HydrophobicContact CG2-CB 4.02Å; V665-T714 HydrophobicContact CG1-CG2 4.37Å; V665-T714 WeakPolarHBondContact CG1-OG1 3.38Å; V665-L739 HydrophobicContact CB-CD1 4.37Å; V665-L739 HydrophobicContact CG2-CD1 3.9Å; V665-S740 PolarHBondContact N-O 2.99Å; V665-V741 VanDerWaalsContact O-CA 3.28Å; V665-V741 WeakPolarHBondContact O-CA 3.43Å; V665-S742 PolarHBondContact O-N 2.92Å
666	A	85.6	Confident	89.3	Confident	31 Å²	31	75 Å²	75	26%	0.256	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	147.2	178.2	0	0	0	0	0	110.5	G668 E669 T714	A666-G668 PolarHBondContact O-N 3.37Å; A666-G668 VanDerWaalsContact O-N 3.16Å; A666-E669 HydrophobicContact CB-CG 4.08Å; A666-E669 WeakPolarHBondContact CB-OE2 3.35Å; A666-E669 PolarHBondContact N-OE2 3.34Å; A666-E669 WeakPolarHBondContact O-CB 3.47Å; A666-E669 PolarHBondContact O-N 2.88Å; A666-T714 PolarHBondContact O-OG1 2.92Å
667	R	87.5	Confident	89.3	Confident	177 Å²	177	72.7 Å²	72.7	67%	0.668	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	123.7	-179.8	-178.2	-177.8	171.2	174.4	-2.4	111.2	T714 V741 S742	R667-T714 WeakPolarHBondContact CA-O 3.4Å; R667-V741 HydrophobicContact CB-CG1 3.92Å; R667-V741 HydrophobicContact CG-CG1 4.47Å; R667-S742 PolarHBondContact N-O 3.39Å
668	G	84.4	Confident	89.4	Confident	39 Å²	39	67.4 Å²	67.4	40%	0.402	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.1	-11.2	-177.6	0	0	0	0	0	115.2	A666 D713 T714	A666-G668 PolarHBondContact O-N 3.37Å; A666-G668 VanDerWaalsContact O-N 3.16Å; G668-D713 WeakPolarHBondContact CA-OD1 3.23Å; G668-T714 PolarHBondContact N-O 3.46Å
669	E	88.8	Confident	89.5	Confident	110 Å²	110	60.3 Å²	60.3	51%	0.514	33%	0.328	S	S	.	.	S	Bend	trans	-75.3	177.6	170.3	-64.9	-177.4	144.8	0	0	111.5	V665 A666 D713 T714	V665-E669 HydrophobicContact CG1-CB 3.55Å; A666-E669 HydrophobicContact CB-CG 4.08Å; A666-E669 WeakPolarHBondContact CB-OE2 3.35Å; A666-E669 PolarHBondContact N-OE2 3.34Å; A666-E669 WeakPolarHBondContact O-CB 3.47Å; A666-E669 PolarHBondContact O-N 2.88Å; E669-D713 PolarHBondContact O-N 3.23Å; E669-T714 PolarHBondContact O-N 3.04Å; E669-T714 PolarHBondContact O-OG1 3.02Å; E669-T714 VanDerWaalsContact O-OG1 3.12Å
670	T	89.4	Confident	89.4	Confident	71 Å²	71	56.3 Å²	56.3	44%	0.436	30%	0.303	S	S	.	.			trans	-104.9	120.5	178.4	-62.4	0	0	0	0	110.5	I710 I711 V712	T670-I710 HydrophobicContact CG2-CG2 3.56Å; T670-I711 CarbonylContact C-O 3.59Å; T670-I711 VanDerWaalsContact CA-O 3.3Å; T670-I711 WeakPolarHBondContact CA-O 3.33Å; T670-V712 HydrophobicContact CG2-CG2 4.04Å
671	A	91.1	Very high	89.3	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	144.2	169.6	0	0	0	0	0	111.1	V665 I710 I711 T714 L739	V665-A671 HydrophobicContact CG2-CB 4.02Å; A671-I710 WeakPolarHBondContact O-CA 3.2Å; A671-I711 HydrophobicContact CB-CB 4.36Å; A671-I711 PolarHBondContact N-O 2.77Å; A671-I711 PolarHBondContact O-N 2.77Å; A671-T714 HydrophobicContact CB-CG2 3.72Å; A671-L739 HydrophobicContact CB-CD1 3.72Å; A671-L739 HydrophobicContact CB-CD2 3.74Å; A671-L739 HydrophobicContact CB-CG 4.43Å
672	V	92.4	Very high	89.2	Confident	60 Å²	60	55.9 Å²	55.9	36%	0.364	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	113.5	169.7	-177.8	0	0	0	0	107.8	L708 I710	V672-L708 HydrophobicContact CG1-CD2 4.2Å; V672-I710 HydrophobicContact CG1-CG1 4.27Å; V672-I710 HydrophobicContact CG2-CG1 4.26Å; V672-I710 HydrophobicContact CG2-CG2 4.35Å
673	L	93	Very high	89.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	129.9	178.6	-50.1	179.2	0	0	0	108.1	R663 W687 L708 L709 I711 Y722 I737 L739	R663-L673 HydrophobicContact CB-CD2 4.41Å; R663-L673 HydrophobicContact CG-CD2 4.34Å; L673-W687 HydrophobicContact CB-CH2 3.83Å; L673-W687 HydrophobicContact CB-CZ3 4.03Å; L673-L708 WeakPolarHBondContact O-CA 3.24Å; L673-L709 HydrophobicContact CB-CB 4.34Å; L673-L709 HydrophobicContact CD1-CD2 4.27Å; L673-L709 PolarHBondContact N-O 3.4Å; L673-L709 PolarHBondContact O-N 2.9Å; L673-I711 HydrophobicContact CD1-CD1 4.14Å; L673-Y722 HydrophobicContact CD1-CD1 3.75Å; L673-Y722 HydrophobicContact CD1-CD2 3.59Å; L673-Y722 HydrophobicContact CD1-CE1 4.13Å; L673-Y722 HydrophobicContact CD1-CE2 4.02Å; L673-Y722 HydrophobicContact CD1-CG 3.45Å; L673-Y722 VanDerWaalsContact CD1-CG 3.45Å; L673-I737 HydrophobicContact CB-CD1 4.21Å; L673-I737 HydrophobicContact CB-CG2 4.28Å; L673-I737 HydrophobicContact CD1-CG2 4.35Å; L673-I737 HydrophobicContact CD2-CD1 3.73Å; L673-I737 HydrophobicContact CD2-CG1 4.26Å; L673-I737 HydrophobicContact CD2-CG2 4.42Å; L673-L739 HydrophobicContact CD2-CB 4.31Å; L673-L739 HydrophobicContact CD2-CD1 4.43Å
674	Q	92.6	Very high	89.1	Confident	93 Å²	93	56.2 Å²	56.2	44%	0.435	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	131	-170.3	178.8	164	58.8	0	0	111.9	M660 I676 L708	M660-Q674 WeakPolarHBondContact CE-O 3.14Å; M660-Q674 WeakPolarHBondContact CG-O 3.36Å; Q674-I676 HydrophobicContact CG-CD1 4.25Å; Q674-I676 HydrophobicContact CG-CG1 3.87Å; Q674-L708 HydrophobicContact CB-CD2 3.82Å; Q674-L708 HydrophobicContact CG-CD2 3.76Å
675	C	91.8	Very high	89.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.29	C	S	.	.			trans	-132.5	92.8	175.6	178.6	0	0	0	0	108.9	M660 W687 Q707 C724	M660-C675 HydrophobicContact CE-CB 3.92Å; M660-C675 HydrophobicContact SD-CB 4.16Å; C675-W687 HydrophobicContact CB-CH2 3.88Å; C675-W687 HydrophobicContact CB-CZ2 3.42Å; C675-W687 VanDerWaalsContact CB-CZ2 3.42Å; C675-Q707 PolarHBondContact N-O 2.73Å; C675-Q707 VanDerWaalsContact O-CA 3.28Å; C675-Q707 WeakPolarHBondContact O-CA 3.41Å; C675-Q707 WeakPolarHBondContact O-CB 3.25Å; C675-Q707 WeakPolarHBondContact O-CG 3.44Å; C675-C724 HydrophobicContact CB-CB 3.56Å; C675-C724 WeakPolarHBondContact CB-SG 3.2Å; C675-C724 WeakPolarHBondContact SG-CB 3.47Å; C675-C724 CovalentContact SG-SG 2.03Å; C675-C724 PolarHBondContact SG-SG 2.98Å
676	I	89.9	Confident	89.4	Confident	33 Å²	33	56.1 Å²	56.1	17%	0.169	31%	0.311	C	S	.	.			trans	-94.8	119.1	173.3	-54.8	173	0	0	0	107.9	M657 Q674	M657-I676 HydrophobicContact CB-CB 4.44Å; M657-I676 HydrophobicContact CB-CG2 3.97Å; M657-I676 HydrophobicContact CG-CG2 4.1Å; M657-I676 PolarHBondContact N-O 2.85Å; M657-I676 HydrophobicContact SD-CG2 3.73Å; Q674-I676 HydrophobicContact CG-CD1 4.25Å; Q674-I676 HydrophobicContact CG-CG1 3.87Å
677	A	89.3	Confident	89.8	Confident	13 Å²	13	54.9 Å²	54.9	11%	0.107	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	138	-177	0	0	0	0	0	112.9	S655 P683 L685 M726	S655-A677 CarbonylContact O-C 3.05Å; S655-A677 WeakPolarHBondContact O-CA 3.3Å; A677-P683 HydrophobicContact CB-CG 3.78Å; A677-L685 HydrophobicContact CB-CD2 3.84Å; A677-M726 HydrophobicContact CB-CB 4.24Å; A677-M726 HydrophobicContact CB-CG 3.64Å; A677-M726 HydrophobicContact CB-SD 3.55Å; A677-M726 VanDerWaalsContact CB-SD 3.55Å
678	G	87.7	Confident	90.1	Very high	15 Å²	15	47.5 Å²	47.5	16%	0.155	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	178.4	171.8	0	0	0	0	0	111.9	P654 S655 P683	P654-G678 WeakPolarHBondContact CA-O 3.4Å; S655-G678 PolarHBondContact N-O 2.84Å; S655-G678 VanDerWaalsContact N-O 3.1Å; S655-G678 PolarHBondContact O-N 2.81Å; G678-P683 WeakPolarHBondContact O-CG 3.5Å
679	G	86.8	Confident	90.5	Very high	18 Å²	18	47.4 Å²	47.4	19%	0.186	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	135.5	156.2	-178.7	0	0	0	0	0	112.8	P681 A682	G679-P681 CarbonylContact C-O 3.6Å; G679-P681 CarbonylContact O-C 3.48Å; G679-A682 WeakPolarHBondContact O-CA 3.36Å; G679-A682 PolarHBondContact O-N 2.88Å
680	S	86.8	Confident	90.5	Very high	32 Å²	32	46.3 Å²	46.3	22%	0.224	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	108.6	-178	175	0	0	0	0	109.1	V650 L651 E652	V650-S680 PolarHBondContact O-OG 2.74Å; L651-S680 CarbonylContact C-O 3.11Å; L651-S680 VanDerWaalsContact CA-O 3.31Å; L651-S680 WeakPolarHBondContact CA-O 3.4Å; L651-S680 WeakPolarHBondContact CB-O 3.4Å; E652-S680 PolarHBondContact N-O 3.09Å; E652-S680 CarbonylContact O-C 3.21Å; E652-S680 PolarHBondContact O-N 2.85Å; E652-S680 VanDerWaalsContact O-O 3.11Å
681	P	87.5	Confident	90.2	Very high	60 Å²	60	48 Å²	48	39%	0.39	27%	0.267	S	S	.	.	S	Bend	cis	-66	159.7	-0.4	-19	33.5	0	0	0	113.6	G679 N728 T729	G679-P681 CarbonylContact C-O 3.6Å; G679-P681 CarbonylContact O-C 3.48Å; P681-N728 WeakPolarHBondContact O-CB 3.36Å; P681-N728 PolarHBondContact O-ND2 3.32Å; P681-T729 VanDerWaalsContact CD-OG1 3.31Å; P681-T729 WeakPolarHBondContact CD-OG1 3.21Å
682	A	86.9	Confident	90	Very high	84 Å²	84	49.2 Å²	49.2	69%	0.694	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-57	134.3	-178.6	0	0	0	0	0	112.3	G679	G679-A682 WeakPolarHBondContact O-CA 3.36Å; G679-A682 PolarHBondContact O-N 2.88Å
683	P	90.5	Very high	89.7	Confident	22 Å²	22	51.8 Å²	51.8	14%	0.143	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-78.4	149.8	-172.8	32.2	-37.7	0	0	0	113.9	P654 A677 G678 M726 S727 N728	P654-P683 HydrophobicContact CB-CB 3.87Å; P654-P683 HydrophobicContact CB-CG 4.39Å; P654-P683 HydrophobicContact CG-CB 4.14Å; A677-P683 HydrophobicContact CB-CG 3.78Å; G678-P683 WeakPolarHBondContact O-CG 3.5Å; P683-M726 HydrophobicContact CB-CB 4.37Å; P683-S727 CarbonylContact C-O 3.3Å; P683-S727 VanDerWaalsContact CA-O 3.27Å; P683-S727 WeakPolarHBondContact CA-O 3.3Å; P683-N728 HydrophobicContact CB-CB 4.45Å
684	R	91.5	Very high	89.6	Confident	204 Å²	204	52.9 Å²	52.9	77%	0.77	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.8	168.5	-58.8	-177.6	-178	-164.8	0.7	110	S727	R684-S727 PolarHBondContact N-O 2.83Å; R684-S727 PolarHBondContact O-N 2.9Å; R684-S727 PolarHBondContact O-OG 3.28Å
685	L	93.1	Very high	89.2	Confident	18 Å²	18	53.9 Å²	53.9	9%	0.094	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132.8	-174.1	-55.6	-176.1	0	0	0	112.3	A677 N706 Q707 I725 M726	A677-L685 HydrophobicContact CB-CD2 3.84Å; L685-N706 HydrophobicContact CB-CB 3.98Å; L685-N706 PolarHBondContact O-ND2 2.76Å; L685-N706 VanDerWaalsContact O-ND2 3.1Å; L685-Q707 HydrophobicContact CD1-CB 4.2Å; L685-Q707 HydrophobicContact CD1-CG 3.46Å; L685-Q707 VanDerWaalsContact CD1-CG 3.46Å; L685-I725 WeakPolarHBondContact CA-O 3.21Å; L685-M726 HydrophobicContact CD2-CB 3.98Å; L685-M726 HydrophobicContact CD2-CG 3.46Å; L685-M726 VanDerWaalsContact CD2-CG 3.46Å
686	N	91.9	Very high	89	Confident	99 Å²	99	58.5 Å²	58.5	53%	0.529	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	149.1	176.5	-171.5	19.2	0	0	0	110.2	I725	N686-I725 PolarHBondContact N-O 2.8Å; N686-I725 PolarHBondContact O-N 2.83Å
687	W	93.2	Very high	88.8	Confident	5 Å²	5	60.1 Å²	60.1	2%	0.019	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	143.9	-174.5	-72.1	80	0	0	0	113	M660 L673 C675 L694 F702 N706 L709 T723 C724 I737	M660-W687 HydrophobicContact CE-CH2 3.47Å; M660-W687 VanDerWaalsContact CE-CH2 3.47Å; M660-W687 HydrophobicContact CE-CZ2 4.41Å; M660-W687 HydrophobicContact CE-CZ3 3.66Å; L673-W687 HydrophobicContact CB-CH2 3.83Å; L673-W687 HydrophobicContact CB-CZ3 4.03Å; C675-W687 HydrophobicContact CB-CH2 3.88Å; C675-W687 HydrophobicContact CB-CZ2 3.42Å; C675-W687 VanDerWaalsContact CB-CZ2 3.42Å; W687-L694 HydrophobicContact CB-CD2 3.84Å; W687-L694 WeakPolarHBondContact O-CB 3.27Å; W687-F702 HydrophobicContact CB-CE1 4.1Å; W687-F702 HydrophobicContact CB-CZ 4.3Å; W687-F702 AromaticContact CD1-CE1 3.46Å; W687-F702 VanDerWaalsContact CD1-CE1 3.46Å; W687-F702 AromaticContact CG-CE1 3.88Å; W687-F702 HydrophobicContact CG-CE1 3.88Å; W687-N706 PolarHBondContact NE1-O 3.46Å; W687-L709 HydrophobicContact CB-CD2 4.33Å; W687-L709 HydrophobicContact CD2-CB 4.11Å; W687-L709 HydrophobicContact CD2-CD2 3.96Å; W687-L709 HydrophobicContact CE3-CB 4.37Å; W687-L709 HydrophobicContact CE3-CD2 3.8Å; W687-L709 HydrophobicContact CG-CD2 4.24Å; W687-L709 HydrophobicContact CH2-CB 4.28Å; W687-L709 HydrophobicContact CZ2-CB 4.03Å; W687-L709 HydrophobicContact CZ3-CB 4.46Å; W687-L709 HydrophobicContact CZ3-CD2 4.33Å; W687-T723 CarbonylContact C-O 3.45Å; W687-T723 WeakPolarHBondContact CA-O 3.5Å; W687-C724 HydrophobicContact CD2-CB 4.16Å; W687-C724 HydrophobicContact CE3-CB 4.21Å; W687-C724 HydrophobicContact CH2-CB 4.37Å; W687-C724 HydrophobicContact CZ2-CB 4.3Å; W687-C724 HydrophobicContact CZ3-CB 4.31Å; W687-I737 HydrophobicContact CZ3-CG2 4.02Å
688	T	93.9	Very high	88.6	Confident	22 Å²	22	68.6 Å²	68.6	14%	0.135	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	159.6	176.2	44.4	0	0	0	0	110.6	G692 Y722 T723 I725	T688-G692 CarbonylContact C-O 3.5Å; T688-G692 WeakPolarHBondContact CA-O 3.41Å; T688-G692 WeakPolarHBondContact CB-O 3.44Å; T688-G692 WeakPolarHBondContact CG2-O 3.46Å; T688-Y722 CarbonylContact O-C 3.51Å; T688-Y722 WeakPolarHBondContact O-CA 3.35Å; T688-T723 PolarHBondContact N-O 3.08Å; T688-T723 PolarHBondContact O-N 2.71Å; T688-T723 VanDerWaalsContact OG1-CB 3.3Å; T688-T723 WeakPolarHBondContact OG1-CB 3.36Å; T688-T723 PolarHBondContact OG1-O 3.1Å; T688-I725 HydrophobicContact CG2-CD1 4.19Å
689	K	93	Very high	88.6	Confident	36 Å²	36	71.3 Å²	71.3	16%	0.157	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	134	176.9	-172.9	-175	-171.5	-79.9	0	110.2	D691 G692 L694 A717 D718 T719 K721 Y722	K689-D691 PolarHBondContact O-N 3.26Å; K689-G692 PolarHBondContact N-O 2.81Å; K689-G692 CarbonylContact O-C 3.59Å; K689-G692 PolarHBondContact O-N 2.66Å; K689-G692 VanDerWaalsContact O-O 3.12Å; K689-L694 HydrophobicContact CB-CD1 4Å; K689-A717 PolarHBondContact NZ-O 3.03Å; K689-A717 VanDerWaalsContact NZ-O 3.14Å; K689-D718 WeakPolarHBondContact CE-O 3.07Å; K689-T719 PolarHBondContact NZ-O 2.97Å; K689-K721 CarbonylContact C-O 3.59Å; K689-K721 WeakPolarHBondContact CA-O 3.44Å; K689-Y722 HydrophobicContact CB-CD1 4.17Å; K689-Y722 HydrophobicContact CB-CE1 4.13Å; K689-Y722 HydrophobicContact CD-CE1 3.86Å; K689-Y722 HydrophobicContact CD-CE2 3.98Å; K689-Y722 VanDerWaalsContact CD-CZ 3.49Å; K689-Y722 WeakPolarHBondContact CD-OH 3.43Å; K689-Y722 VanDerWaalsContact CE-CZ 3.45Å; K689-Y722 WeakPolarHBondContact CE-OH 3.39Å; K689-Y722 HydrophobicContact CG-CD1 4.22Å; K689-Y722 HydrophobicContact CG-CD2 4.34Å; K689-Y722 HydrophobicContact CG-CE1 3.98Å; K689-Y722 HydrophobicContact CG-CE2 4.07Å; K689-Y722 HydrophobicContact CG-CG 4.41Å
690	D	88.4	Confident	88.9	Confident	88 Å²	88	71.5 Å²	71.5	47%	0.471	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	42.1	-177.5	-56.9	-49.1	0	0	0	111.6	G692 G720 K721	D690-G692 PolarHBondContact O-N 3.47Å; D690-G720 VanDerWaalsContact OD1-CA 3.26Å; D690-G720 WeakPolarHBondContact OD1-CA 3.35Å; D690-K721 PolarHBondContact N-O 2.82Å; D690-K721 PolarHBondContact OD1-N 2.03Å
691	D	83.4	Confident	89	Confident	105 Å²	105	75.1 Å²	75.1	56%	0.561	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	7.2	-174.9	-59.9	-41.3	0	0	0	116.4	K689 K721 T723	K689-D691 PolarHBondContact O-N 3.26Å; D691-K721 IonicContact OD1-NZ 2.75Å; D691-K721 PolarHBondContact OD1-NZ 2.8Å; D691-K721 IonicContact OD2-NZ 2.74Å; D691-K721 PolarHBondContact OD2-NZ 3.14Å; D691-T723 PolarHBondContact OD1-OG1 3.41Å
692	G	86.5	Confident	89.2	Confident	27 Å²	27	75.7 Å²	75.7	28%	0.278	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	172.5	167.3	0	0	0	0	0	114	T688 K689 D690 L694	T688-G692 CarbonylContact C-O 3.5Å; T688-G692 WeakPolarHBondContact CA-O 3.41Å; T688-G692 WeakPolarHBondContact CB-O 3.44Å; T688-G692 WeakPolarHBondContact CG2-O 3.46Å; K689-G692 PolarHBondContact N-O 2.81Å; K689-G692 CarbonylContact O-C 3.59Å; K689-G692 PolarHBondContact O-N 2.66Å; K689-G692 VanDerWaalsContact O-O 3.12Å; D690-G692 PolarHBondContact O-N 3.47Å; G692-L694 PolarHBondContact O-N 2.8Å
693	P	86.1	Confident	89.2	Confident	113 Å²	113	73.5 Å²	73.5	73%	0.734	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.3	133.8	177.1	26.9	-34.5	0	0	0	111	V695	P693-V695 PolarHBondContact O-N 2.89Å; P693-V695 VanDerWaalsContact O-N 3.07Å
694	L	89.9	Confident	89	Confident	23 Å²	23	75.2 Å²	75.2	12%	0.12	40%	0.397	C	S	.	.			trans	-66.7	109.7	177	174.3	60.4	0	0	0	109.9	W687 K689 G692 L696 F702 L709 Y722	W687-L694 HydrophobicContact CB-CD2 3.84Å; W687-L694 WeakPolarHBondContact O-CB 3.27Å; K689-L694 HydrophobicContact CB-CD1 4Å; G692-L694 PolarHBondContact O-N 2.8Å; L694-L696 HydrophobicContact CD2-CD2 3.79Å; L694-L696 HydrophobicContact CG-CD2 3.89Å; L694-L696 PolarHBondContact O-N 3.24Å; L694-L696 VanDerWaalsContact O-N 3.09Å; L694-F702 HydrophobicContact CD2-CZ 3.99Å; L694-L709 HydrophobicContact CD2-CD1 4.13Å; L694-L709 HydrophobicContact CD2-CD2 3.53Å; L694-Y722 HydrophobicContact CD1-CD1 4.26Å; L694-Y722 HydrophobicContact CD1-CE1 3.74Å
695	V	86	Confident	88.7	Confident	115 Å²	115	69.8 Å²	69.8	70%	0.697	40%	0.395	S	S	*	.			trans	-76.3	97.2	176.3	-177.4	0	0	0	0	108.9	P693	P693-V695 PolarHBondContact O-N 2.89Å; P693-V695 VanDerWaalsContact O-N 3.07Å
696	L	85.9	Confident	88.5	Confident	97 Å²	97	71.8 Å²	71.8	51%	0.508	41%	0.406	S	S	.	.			trans	-68.7	143	178.3	-60.5	171.4	0	0	0	111.3	L694 H700 F702	L694-L696 HydrophobicContact CD2-CD2 3.79Å; L694-L696 HydrophobicContact CG-CD2 3.89Å; L694-L696 PolarHBondContact O-N 3.24Å; L694-L696 VanDerWaalsContact O-N 3.09Å; L696-H700 HydrophobicContact CD2-CB 3.89Å; L696-F702 HydrophobicContact CD1-CE2 3.91Å; L696-F702 HydrophobicContact CD2-CE2 3.68Å; L696-F702 HydrophobicContact CD2-CZ 3.93Å; L696-F702 HydrophobicContact CG-CE2 4.44Å
697	T	85.7	Confident	88.4	Confident	67 Å²	67	70.1 Å²	70.1	41%	0.411	40%	0.395	S	S	.	.			trans	-135.2	172	174	64.1	0	0	0	0	108.7	R699 H700	T697-R699 PolarHBondContact O-N 3.31Å; T697-R699 PolarHBondContact OG1-N 3.49Å; T697-H700 PolarHBondContact O-N 2.8Å; T697-H700 PolarHBondContact OG1-ND1 3.1Å
698	E	86.3	Confident	88.3	Confident	190 Å²	190	71.8 Å²	71.8	89%	0.888	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-8	176.2	-60.6	-178.6	169.6	0	0	114.4	F701	E698-F701 WeakPolarHBondContact O-CE2 3.4Å; E698-F701 WeakPolarHBondContact O-CZ 3.5Å
699	R	88.3	Confident	88.3	Confident	73 Å²	73	70.7 Å²	70.7	28%	0.275	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-13.2	172.3	-61.8	-170	-57	103.7	-0.3	114.1	T697 I711 V712 D713 D718	T697-R699 PolarHBondContact O-N 3.31Å; T697-R699 PolarHBondContact OG1-N 3.49Å; R699-I711 WeakPolarHBondContact O-CA 2.99Å; R699-V712 WeakPolarHBondContact CB-O 3.33Å; R699-V712 WeakPolarHBondContact CD-O 3.34Å; R699-V712 PolarHBondContact NH1-O 3.04Å; R699-V712 PolarHBondContact O-N 3.19Å; R699-D713 PolarHBondContact NH1-O 3.17Å; R699-D718 IonicContact CZ-OD1 3.69Å; R699-D718 IonicContact CZ-OD2 3.35Å; R699-D718 IonicContact NH1-OD1 3.68Å; R699-D718 IonicContact NH1-OD2 2.75Å; R699-D718 PolarHBondContact NH1-OD2 2.89Å; R699-D718 VanDerWaalsContact NH2-CG 3.33Å; R699-D718 IonicContact NH2-OD1 2.77Å; R699-D718 PolarHBondContact NH2-OD1 3.07Å; R699-D718 IonicContact NH2-OD2 3.07Å; R699-D718 PolarHBondContact NH2-OD2 2.76Å; R699-D718 VanDerWaalsContact NH2-OD2 3.07Å
700	H	91.9	Very high	88.3	Confident	21 Å²	21	71 Å²	71	10%	0.097	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.1	-175	-69.7	82.2	0	0	0	111.3	L696 T697 I710	L696-H700 HydrophobicContact CD2-CB 3.89Å; T697-H700 PolarHBondContact O-N 2.8Å; T697-H700 PolarHBondContact OG1-ND1 3.1Å; H700-I710 CarbonylContact C-O 3.44Å; H700-I710 WeakPolarHBondContact CA-O 3.01Å
701	F	89.7	Confident	88.5	Confident	109 Å²	109	66.9 Å²	66.9	48%	0.478	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	139.9	-179.9	-56.4	-89.8	0	0	0	111.5	E698 I710 V712	E698-F701 WeakPolarHBondContact O-CE2 3.4Å; E698-F701 WeakPolarHBondContact O-CZ 3.5Å; F701-I710 HydrophobicContact CB-CB 4.32Å; F701-I710 PolarHBondContact N-O 2.86Å; F701-I710 PolarHBondContact O-N 2.88Å; F701-V712 HydrophobicContact CD2-CG2 4.12Å; F701-V712 HydrophobicContact CE2-CG2 3.9Å
702	F	91.1	Very high	88.8	Confident	72 Å²	72	64.6 Å²	64.6	32%	0.316	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	138.4	169.6	-67.2	-69.1	0	0	0	111.2	W687 L694 L696 N706 L708 L709	W687-F702 HydrophobicContact CB-CE1 4.1Å; W687-F702 HydrophobicContact CB-CZ 4.3Å; W687-F702 AromaticContact CD1-CE1 3.46Å; W687-F702 VanDerWaalsContact CD1-CE1 3.46Å; W687-F702 AromaticContact CG-CE1 3.88Å; W687-F702 HydrophobicContact CG-CE1 3.88Å; L694-F702 HydrophobicContact CD2-CZ 3.99Å; L696-F702 HydrophobicContact CD1-CE2 3.91Å; L696-F702 HydrophobicContact CD2-CE2 3.68Å; L696-F702 HydrophobicContact CD2-CZ 3.93Å; L696-F702 HydrophobicContact CG-CE2 4.44Å; F702-N706 HydrophobicContact CD1-CB 4.28Å; F702-L708 WeakPolarHBondContact CA-O 3.26Å; F702-L709 HydrophobicContact CD1-CB 4.3Å; F702-L709 HydrophobicContact CD1-CD1 4.12Å; F702-L709 HydrophobicContact CE1-CB 4.13Å; F702-L709 HydrophobicContact CE1-CD1 3.73Å; F702-L709 HydrophobicContact CE1-CD2 4.5Å; F702-L709 HydrophobicContact CE1-CG 4.33Å; F702-L709 HydrophobicContact CZ-CD1 4.18Å
703	A	86.5	Confident	88.8	Confident	37 Å²	37	67.8 Å²	67.8	31%	0.306	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	166.2	172.7	0	0	0	0	0	111.4	A705 N706 Q707 L708 I710	A703-A705 PolarHBondContact O-N 2.88Å; A703-N706 PolarHBondContact O-N 2.82Å; A703-Q707 PolarHBondContact O-N 2.8Å; A703-L708 HydrophobicContact CB-CB 4.14Å; A703-L708 HydrophobicContact CB-CD1 4.32Å; A703-L708 PolarHBondContact N-O 3.3Å; A703-L708 PolarHBondContact O-N 2.8Å; A703-L708 VanDerWaalsContact O-N 3.07Å; A703-I710 HydrophobicContact CB-CD1 4.31Å
704	A	87	Confident	88.9	Confident	59 Å²	59	62.4 Å²	62.4	49%	0.488	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	57.6	-179.9	0	0	0	0	0	113.6	N706 Q707 L708	A704-N706 VanDerWaalsContact C-N 3.32Å; A704-N706 PolarHBondContact O-N 2.85Å; A704-Q707 HydrophobicContact CB-CB 4.17Å; A704-Q707 WeakPolarHBondContact O-CB 3.25Å; A704-Q707 WeakPolarHBondContact O-CG 3.41Å; A704-Q707 PolarHBondContact O-N 2.91Å; A704-L708 HydrophobicContact CB-CD1 4.48Å; A704-L708 HydrophobicContact CB-CG 4.43Å
705	A	84.9	Confident	88.8	Confident	89 Å²	89	62.1 Å²	62.1	74%	0.736	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	46.1	-178.6	0	0	0	0	0	113.8	A703 Q707	A703-A705 PolarHBondContact O-N 2.88Å; A705-Q707 PolarHBondContact O-N 3.41Å
706	N	89.5	Confident	88.7	Confident	61 Å²	61	60.7 Å²	60.7	33%	0.326	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	12.6	-175.3	-54.2	-7.6	0	0	0	115.3	L685 W687 F702 A703 A704 L708	L685-N706 HydrophobicContact CB-CB 3.98Å; L685-N706 PolarHBondContact O-ND2 2.76Å; L685-N706 VanDerWaalsContact O-ND2 3.1Å; W687-N706 PolarHBondContact NE1-O 3.46Å; F702-N706 HydrophobicContact CD1-CB 4.28Å; A703-N706 PolarHBondContact O-N 2.82Å; A704-N706 VanDerWaalsContact C-N 3.32Å; A704-N706 PolarHBondContact O-N 2.85Å; N706-L708 VanDerWaalsContact C-N 3.25Å; N706-L708 PolarHBondContact O-N 2.77Å
707	Q	89.8	Confident	88.6	Confident	64 Å²	64	60.1 Å²	60.1	30%	0.299	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-23.3	171.1	-68.3	178.9	10	0	0	112.9	C675 L685 A703 A704 A705	C675-Q707 PolarHBondContact N-O 2.73Å; C675-Q707 VanDerWaalsContact O-CA 3.28Å; C675-Q707 WeakPolarHBondContact O-CA 3.41Å; C675-Q707 WeakPolarHBondContact O-CB 3.25Å; C675-Q707 WeakPolarHBondContact O-CG 3.44Å; L685-Q707 HydrophobicContact CD1-CB 4.2Å; L685-Q707 HydrophobicContact CD1-CG 3.46Å; L685-Q707 VanDerWaalsContact CD1-CG 3.46Å; A703-Q707 PolarHBondContact O-N 2.8Å; A704-Q707 HydrophobicContact CB-CB 4.17Å; A704-Q707 WeakPolarHBondContact O-CB 3.25Å; A704-Q707 WeakPolarHBondContact O-CG 3.41Å; A704-Q707 PolarHBondContact O-N 2.91Å; A705-Q707 PolarHBondContact O-N 3.41Å
708	L	91.6	Very high	88.8	Confident	39 Å²	39	57.4 Å²	57.4	20%	0.204	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.2	176.5	-59.2	178.1	0	0	0	110.2	V672 L673 Q674 F702 A703 A704 N706	V672-L708 HydrophobicContact CG1-CD2 4.2Å; L673-L708 WeakPolarHBondContact O-CA 3.24Å; Q674-L708 HydrophobicContact CB-CD2 3.82Å; Q674-L708 HydrophobicContact CG-CD2 3.76Å; F702-L708 WeakPolarHBondContact CA-O 3.26Å; A703-L708 HydrophobicContact CB-CB 4.14Å; A703-L708 HydrophobicContact CB-CD1 4.32Å; A703-L708 PolarHBondContact N-O 3.3Å; A703-L708 PolarHBondContact O-N 2.8Å; A703-L708 VanDerWaalsContact O-N 3.07Å; A704-L708 HydrophobicContact CB-CD1 4.48Å; A704-L708 HydrophobicContact CB-CG 4.43Å; N706-L708 VanDerWaalsContact C-N 3.25Å; N706-L708 PolarHBondContact O-N 2.77Å
709	L	92.8	Very high	89	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	113.6	166.4	171.1	57.2	0	0	0	108.3	L673 W687 L694 F702 I711 Y722	L673-L709 HydrophobicContact CB-CB 4.34Å; L673-L709 HydrophobicContact CD1-CD2 4.27Å; L673-L709 PolarHBondContact N-O 3.4Å; L673-L709 PolarHBondContact O-N 2.9Å; W687-L709 HydrophobicContact CB-CD2 4.33Å; W687-L709 HydrophobicContact CD2-CB 4.11Å; W687-L709 HydrophobicContact CD2-CD2 3.96Å; W687-L709 HydrophobicContact CE3-CB 4.37Å; W687-L709 HydrophobicContact CE3-CD2 3.8Å; W687-L709 HydrophobicContact CG-CD2 4.24Å; W687-L709 HydrophobicContact CH2-CB 4.28Å; W687-L709 HydrophobicContact CZ2-CB 4.03Å; W687-L709 HydrophobicContact CZ3-CB 4.46Å; W687-L709 HydrophobicContact CZ3-CD2 4.33Å; L694-L709 HydrophobicContact CD2-CD1 4.13Å; L694-L709 HydrophobicContact CD2-CD2 3.53Å; F702-L709 HydrophobicContact CD1-CB 4.3Å; F702-L709 HydrophobicContact CD1-CD1 4.12Å; F702-L709 HydrophobicContact CE1-CB 4.13Å; F702-L709 HydrophobicContact CE1-CD1 3.73Å; F702-L709 HydrophobicContact CE1-CD2 4.5Å; F702-L709 HydrophobicContact CE1-CG 4.33Å; F702-L709 HydrophobicContact CZ-CD1 4.18Å; L709-I711 HydrophobicContact CG-CG1 4.37Å; L709-Y722 HydrophobicContact CD2-CD1 3.64Å; L709-Y722 HydrophobicContact CD2-CE1 3.95Å
710	I	92.1	Very high	89.1	Confident	43 Å²	43	46.9 Å²	46.9	22%	0.221	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	132.4	-176.6	-55.9	173.6	0	0	0	108.3	T670 A671 V672 H700 F701 A703 V712	T670-I710 HydrophobicContact CG2-CG2 3.56Å; A671-I710 WeakPolarHBondContact O-CA 3.2Å; V672-I710 HydrophobicContact CG1-CG1 4.27Å; V672-I710 HydrophobicContact CG2-CG1 4.26Å; V672-I710 HydrophobicContact CG2-CG2 4.35Å; H700-I710 CarbonylContact C-O 3.44Å; H700-I710 WeakPolarHBondContact CA-O 3.01Å; F701-I710 HydrophobicContact CB-CB 4.32Å; F701-I710 PolarHBondContact N-O 2.86Å; F701-I710 PolarHBondContact O-N 2.88Å; A703-I710 HydrophobicContact CB-CD1 4.31Å; I710-V712 HydrophobicContact CG2-CG2 4.41Å
711	I	93	Very high	89.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	109.1	-178.6	-47.2	-178.5	0	0	0	108.3	T670 A671 L673 R699 L709 T714 D718 Y722 L739	T670-I711 CarbonylContact C-O 3.59Å; T670-I711 VanDerWaalsContact CA-O 3.3Å; T670-I711 WeakPolarHBondContact CA-O 3.33Å; A671-I711 HydrophobicContact CB-CB 4.36Å; A671-I711 PolarHBondContact N-O 2.77Å; A671-I711 PolarHBondContact O-N 2.77Å; L673-I711 HydrophobicContact CD1-CD1 4.14Å; R699-I711 WeakPolarHBondContact O-CA 2.99Å; L709-I711 HydrophobicContact CG-CG1 4.37Å; I711-T714 HydrophobicContact CB-CG2 4.31Å; I711-T714 HydrophobicContact CG2-CG2 4.2Å; I711-T714 WeakPolarHBondContact O-CG2 3.28Å; I711-D718 HydrophobicContact CG2-CB 4.5Å; I711-Y722 HydrophobicContact CD1-CE1 3.69Å; I711-Y722 HydrophobicContact CD1-CE2 4.31Å; I711-Y722 VanDerWaalsContact CD1-CZ 3.48Å; I711-Y722 WeakPolarHBondContact CD1-OH 3.43Å; I711-L739 HydrophobicContact CD1-CD2 4.03Å
712	V	89.8	Confident	89.5	Confident	57 Å²	57	43.4 Å²	43.4	35%	0.345	27%	0.273	S	S	.	.	S	Bend	trans	-87.3	149.8	-178.1	-176.3	0	0	0	0	110.4	T670 R699 F701 I710	T670-V712 HydrophobicContact CG2-CG2 4.04Å; R699-V712 WeakPolarHBondContact CB-O 3.33Å; R699-V712 WeakPolarHBondContact CD-O 3.34Å; R699-V712 PolarHBondContact NH1-O 3.04Å; R699-V712 PolarHBondContact O-N 3.19Å; F701-V712 HydrophobicContact CD2-CG2 4.12Å; F701-V712 HydrophobicContact CE2-CG2 3.9Å; I710-V712 HydrophobicContact CG2-CG2 4.41Å
713	D	87.2	Confident	89.6	Confident	95 Å²	95	40.1 Å²	40.1	51%	0.508	26%	0.259	S	S	.	.	S	Bend	trans	50.9	63.7	-178.9	-179.6	34.1	0	0	0	111.6	G668 E669 R699 G715	G668-D713 WeakPolarHBondContact CA-OD1 3.23Å; E669-D713 PolarHBondContact O-N 3.23Å; R699-D713 PolarHBondContact NH1-O 3.17Å; D713-G715 PolarHBondContact O-N 2.79Å
714	T	88.6	Confident	89.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	25%	0.245	C	C	.	.			trans	-67.3	122.2	-173	51.4	0	0	0	0	111.9	V665 A666 R667 G668 E669 A671 I711 D718	V665-T714 HydrophobicContact CG1-CG2 4.37Å; V665-T714 WeakPolarHBondContact CG1-OG1 3.38Å; A666-T714 PolarHBondContact O-OG1 2.92Å; R667-T714 WeakPolarHBondContact CA-O 3.4Å; G668-T714 PolarHBondContact N-O 3.46Å; E669-T714 PolarHBondContact O-N 3.04Å; E669-T714 PolarHBondContact O-OG1 3.02Å; E669-T714 VanDerWaalsContact O-OG1 3.12Å; A671-T714 HydrophobicContact CB-CG2 3.72Å; I711-T714 HydrophobicContact CB-CG2 4.31Å; I711-T714 HydrophobicContact CG2-CG2 4.2Å; I711-T714 WeakPolarHBondContact O-CG2 3.28Å; T714-D718 WeakPolarHBondContact CA-OD2 3.41Å
715	G	86.8	Confident	90.2	Very high	17 Å²	17	37.1 Å²	37.1	18%	0.175	23%	0.23	C	C	.	.			trans	-105.8	167.5	175.8	0	0	0	0	0	112.7	D713 A717 D718	D713-G715 PolarHBondContact O-N 2.79Å; G715-A717 PolarHBondContact O-N 2.94Å; G715-A717 VanDerWaalsContact O-N 3.08Å; G715-D718 PolarHBondContact N-OD2 2.9Å; G715-D718 WeakPolarHBondContact O-CB 3.16Å; G715-D718 PolarHBondContact O-N 3.42Å
716	P	83.3	Confident	90.6	Very high	84 Å²	84	32.9 Å²	32.9	55%	0.545	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-55.2	-30.1	179.9	-28	36.1	0	0	0	114.7	D718 T719	P716-D718 VanDerWaalsContact C-N 3.27Å; P716-D718 PolarHBondContact O-N 2.93Å; P716-T719 WeakPolarHBondContact O-CB 3.41Å; P716-T719 PolarHBondContact O-N 2.81Å; P716-T719 PolarHBondContact O-OG1 2.93Å
717	A	85.6	Confident	90.7	Very high	86 Å²	86	31.9 Å²	31.9	71%	0.711	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-71.2	-17.9	177.2	0	0	0	0	0	114.3	K689 G715 T719	K689-A717 PolarHBondContact NZ-O 3.03Å; K689-A717 VanDerWaalsContact NZ-O 3.14Å; G715-A717 PolarHBondContact O-N 2.94Å; G715-A717 VanDerWaalsContact O-N 3.08Å; A717-T719 VanDerWaalsContact C-N 3.26Å
718	D	88.6	Confident	90.8	Very high	9 Å²	9	30.1 Å²	30.1	5%	0.048	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-79.5	-12.1	173.4	-53	-39.3	0	0	0	111.3	K689 R699 I711 T714 G715 P716 G720 Y722 L739	K689-D718 WeakPolarHBondContact CE-O 3.07Å; R699-D718 IonicContact CZ-OD1 3.69Å; R699-D718 IonicContact CZ-OD2 3.35Å; R699-D718 IonicContact NH1-OD1 3.68Å; R699-D718 IonicContact NH1-OD2 2.75Å; R699-D718 PolarHBondContact NH1-OD2 2.89Å; R699-D718 VanDerWaalsContact NH2-CG 3.33Å; R699-D718 IonicContact NH2-OD1 2.77Å; R699-D718 PolarHBondContact NH2-OD1 3.07Å; R699-D718 IonicContact NH2-OD2 3.07Å; R699-D718 PolarHBondContact NH2-OD2 2.76Å; R699-D718 VanDerWaalsContact NH2-OD2 3.07Å; I711-D718 HydrophobicContact CG2-CB 4.5Å; T714-D718 WeakPolarHBondContact CA-OD2 3.41Å; G715-D718 PolarHBondContact N-OD2 2.9Å; G715-D718 WeakPolarHBondContact O-CB 3.16Å; G715-D718 PolarHBondContact O-N 3.42Å; P716-D718 VanDerWaalsContact C-N 3.27Å; P716-D718 PolarHBondContact O-N 2.93Å; D718-G720 PolarHBondContact O-N 3.47Å; D718-Y722 WeakPolarHBondContact O-CE2 3.45Å; D718-Y722 PolarHBondContact O-OH 3.09Å; D718-L739 HydrophobicContact CB-CD2 4.34Å
719	T	90.3	Very high	90.6	Very high	42 Å²	42	33.7 Å²	33.7	26%	0.258	21%	0.209	S	C	.	.			trans	-60.6	135.1	168.9	-62	0	0	0	0	109.7	K689 P716 A717 Y738 L739 V741	K689-T719 PolarHBondContact NZ-O 2.97Å; P716-T719 WeakPolarHBondContact O-CB 3.41Å; P716-T719 PolarHBondContact O-N 2.81Å; P716-T719 PolarHBondContact O-OG1 2.93Å; A717-T719 VanDerWaalsContact C-N 3.26Å; T719-Y738 HydrophobicContact CG2-CE1 3.99Å; T719-L739 CarbonylContact C-O 3.49Å; T719-L739 VanDerWaalsContact CA-O 3.25Å; T719-L739 WeakPolarHBondContact CA-O 3.41Å; T719-L739 WeakPolarHBondContact CG2-O 3.35Å; T719-V741 PolarHBondContact OG1-N 3.12Å
720	G	91.8	Very high	90.3	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.6	176.7	-179.3	0	0	0	0	0	114.1	D690 D718 L739	D690-G720 VanDerWaalsContact OD1-CA 3.26Å; D690-G720 WeakPolarHBondContact OD1-CA 3.35Å; D718-G720 PolarHBondContact O-N 3.47Å; G720-L739 PolarHBondContact N-O 2.87Å; G720-L739 PolarHBondContact O-N 2.95Å
721	K	94.2	Very high	90	Very high	56 Å²	56	35.7 Å²	35.7	24%	0.243	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	108.1	178.8	179.5	-160	177.1	-159.8	0	109.5	K689 D690 D691 H736 Y738	K689-K721 CarbonylContact C-O 3.59Å; K689-K721 WeakPolarHBondContact CA-O 3.44Å; D690-K721 PolarHBondContact N-O 2.82Å; D690-K721 PolarHBondContact OD1-N 2.03Å; D691-K721 IonicContact OD1-NZ 2.75Å; D691-K721 PolarHBondContact OD1-NZ 2.8Å; D691-K721 IonicContact OD2-NZ 2.74Å; D691-K721 PolarHBondContact OD2-NZ 3.14Å; K721-H736 VanDerWaalsContact CE-ND1 3.33Å; K721-H736 WeakPolarHBondContact CE-ND1 3.05Å; K721-Y738 HydrophobicContact CB-CD2 4.09Å; K721-Y738 HydrophobicContact CB-CE2 4.41Å
722	Y	94.4	Very high	89.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	139	169.5	-68.4	-104.9	0	0	0	109.5	L673 T688 K689 L694 L709 I711 D718 H736 I737 L739	L673-Y722 HydrophobicContact CD1-CD1 3.75Å; L673-Y722 HydrophobicContact CD1-CD2 3.59Å; L673-Y722 HydrophobicContact CD1-CE1 4.13Å; L673-Y722 HydrophobicContact CD1-CE2 4.02Å; L673-Y722 HydrophobicContact CD1-CG 3.45Å; L673-Y722 VanDerWaalsContact CD1-CG 3.45Å; T688-Y722 CarbonylContact O-C 3.51Å; T688-Y722 WeakPolarHBondContact O-CA 3.35Å; K689-Y722 HydrophobicContact CB-CD1 4.17Å; K689-Y722 HydrophobicContact CB-CE1 4.13Å; K689-Y722 HydrophobicContact CD-CE1 3.86Å; K689-Y722 HydrophobicContact CD-CE2 3.98Å; K689-Y722 VanDerWaalsContact CD-CZ 3.49Å; K689-Y722 WeakPolarHBondContact CD-OH 3.43Å; K689-Y722 VanDerWaalsContact CE-CZ 3.45Å; K689-Y722 WeakPolarHBondContact CE-OH 3.39Å; K689-Y722 HydrophobicContact CG-CD1 4.22Å; K689-Y722 HydrophobicContact CG-CD2 4.34Å; K689-Y722 HydrophobicContact CG-CE1 3.98Å; K689-Y722 HydrophobicContact CG-CE2 4.07Å; K689-Y722 HydrophobicContact CG-CG 4.41Å; L694-Y722 HydrophobicContact CD1-CD1 4.26Å; L694-Y722 HydrophobicContact CD1-CE1 3.74Å; L709-Y722 HydrophobicContact CD2-CD1 3.64Å; L709-Y722 HydrophobicContact CD2-CE1 3.95Å; I711-Y722 HydrophobicContact CD1-CE1 3.69Å; I711-Y722 HydrophobicContact CD1-CE2 4.31Å; I711-Y722 VanDerWaalsContact CD1-CZ 3.48Å; I711-Y722 WeakPolarHBondContact CD1-OH 3.43Å; D718-Y722 WeakPolarHBondContact O-CE2 3.45Å; D718-Y722 PolarHBondContact O-OH 3.09Å; Y722-H736 WeakPolarHBondContact O-CA 3.44Å; Y722-I737 PolarHBondContact N-O 2.93Å; Y722-I737 PolarHBondContact O-N 3.1Å; Y722-L739 HydrophobicContact CD2-CB 4.15Å; Y722-L739 HydrophobicContact CE2-CB 3.93Å; Y722-L739 HydrophobicContact CE2-CD2 4.12Å
723	T	93.9	Very high	89.9	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.018	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.9	-177.5	-68	0	0	0	0	109.2	W687 T688 D691 I725 R734 G735 H736	W687-T723 CarbonylContact C-O 3.45Å; W687-T723 WeakPolarHBondContact CA-O 3.5Å; T688-T723 PolarHBondContact N-O 3.08Å; T688-T723 PolarHBondContact O-N 2.71Å; T688-T723 VanDerWaalsContact OG1-CB 3.3Å; T688-T723 WeakPolarHBondContact OG1-CB 3.36Å; T688-T723 PolarHBondContact OG1-O 3.1Å; D691-T723 PolarHBondContact OD1-OG1 3.41Å; T723-I725 HydrophobicContact CG2-CG1 4.24Å; T723-R734 HydrophobicContact CG2-CB 4.39Å; T723-R734 HydrophobicContact CG2-CG 4.48Å; T723-G735 CarbonylContact C-O 3.54Å; T723-G735 VanDerWaalsContact CA-O 3.25Å; T723-G735 WeakPolarHBondContact CA-O 3.41Å; T723-H736 PolarHBondContact OG1-CE1 3.41Å; T723-H736 PolarHBondContact OG1-ND1 2.77Å
724	C	93.4	Very high	90.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	127.3	172.6	-179.3	0	0	0	0	109.4	M660 C675 W687 R734 G735	M660-C724 HydrophobicContact CE-CB 3.91Å; M660-C724 HydrophobicContact SD-CB 4.03Å; C675-C724 HydrophobicContact CB-CB 3.56Å; C675-C724 WeakPolarHBondContact CB-SG 3.2Å; C675-C724 WeakPolarHBondContact SG-CB 3.47Å; C675-C724 CovalentContact SG-SG 2.03Å; C675-C724 PolarHBondContact SG-SG 2.98Å; W687-C724 HydrophobicContact CD2-CB 4.16Å; W687-C724 HydrophobicContact CE3-CB 4.21Å; W687-C724 HydrophobicContact CH2-CB 4.37Å; W687-C724 HydrophobicContact CZ2-CB 4.3Å; W687-C724 HydrophobicContact CZ3-CB 4.31Å; C724-R734 CarbonylContact O-C 3.57Å; C724-R734 VanDerWaalsContact O-CA 3.3Å; C724-R734 WeakPolarHBondContact O-CA 3.43Å; C724-G735 PolarHBondContact N-O 3.18Å; C724-G735 PolarHBondContact O-N 3.23Å
725	I	92.4	Very high	90.3	Very high	34 Å²	34	42.7 Å²	42.7	17%	0.174	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120.3	-180	-51.1	179.2	0	0	0	108.1	L685 N686 T688 T723 T732 R734	L685-I725 WeakPolarHBondContact CA-O 3.21Å; N686-I725 PolarHBondContact N-O 2.8Å; N686-I725 PolarHBondContact O-N 2.83Å; T688-I725 HydrophobicContact CG2-CD1 4.19Å; T723-I725 HydrophobicContact CG2-CG1 4.24Å; I725-T732 HydrophobicContact CG2-CG2 3.5Å; I725-T732 VanDerWaalsContact CG2-CG2 3.5Å; I725-R734 HydrophobicContact CG1-CG 4.24Å; I725-R734 HydrophobicContact CG2-CG 4.42Å
726	M	93.5	Very high	90.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	120.2	-172.8	-59.4	155.2	-75	0	0	109.1	P654 L656 A677 P683 L685 T732 E733 R734 G735	P654-M726 HydrophobicContact CB-CB 3.77Å; P654-M726 WeakPolarHBondContact CB-O 3.33Å; P654-M726 WeakPolarHBondContact CG-O 3.21Å; L656-M726 HydrophobicContact CD1-CE 4.37Å; L656-M726 HydrophobicContact CD2-CE 4.08Å; L656-M726 HydrophobicContact CD2-SD 3.61Å; L656-M726 HydrophobicContact CG-CE 3.87Å; L656-M726 HydrophobicContact CG-SD 3.77Å; A677-M726 HydrophobicContact CB-CB 4.24Å; A677-M726 HydrophobicContact CB-CG 3.64Å; A677-M726 HydrophobicContact CB-SD 3.55Å; A677-M726 VanDerWaalsContact CB-SD 3.55Å; P683-M726 HydrophobicContact CB-CB 4.37Å; L685-M726 HydrophobicContact CD2-CB 3.98Å; L685-M726 HydrophobicContact CD2-CG 3.46Å; L685-M726 VanDerWaalsContact CD2-CG 3.46Å; M726-T732 CarbonylContact O-C 3.51Å; M726-T732 WeakPolarHBondContact O-CA 3.28Å; M726-E733 VanDerWaalsContact CE-C 3.49Å; M726-E733 HydrophobicContact CE-CB 3.98Å; M726-E733 HydrophobicContact CE-CG 3.96Å; M726-E733 PolarHBondContact N-O 3.32Å; M726-E733 PolarHBondContact O-N 3.25Å; M726-R734 VanDerWaalsContact CE-C 3.44Å; M726-G735 VanDerWaalsContact CE-N 3.34Å
727	S	91.1	Very high	91.1	Very high	40 Å²	40	42.4 Å²	42.4	28%	0.28	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	132.3	-169.4	55.6	0	0	0	0	114.1	P683 R684 T732	P683-S727 CarbonylContact C-O 3.3Å; P683-S727 VanDerWaalsContact CA-O 3.27Å; P683-S727 WeakPolarHBondContact CA-O 3.3Å; R684-S727 PolarHBondContact N-O 2.83Å; R684-S727 PolarHBondContact O-N 2.9Å; R684-S727 PolarHBondContact O-OG 3.28Å; S727-T732 VanDerWaalsContact CB-OG1 3.29Å; S727-T732 WeakPolarHBondContact CB-OG1 3.44Å
728	N	91.7	Very high	91.5	Very high	27 Å²	27	43.4 Å²	43.4	14%	0.144	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	-170.8	171	79.6	3.4	0	0	0	111	E652 P654 P681 P683 L730 G731	E652-N728 PolarHBondContact O-ND2 2.71Å; P654-N728 WeakPolarHBondContact CD-OD1 3.47Å; P654-N728 HydrophobicContact CG-CB 4.1Å; P681-N728 WeakPolarHBondContact O-CB 3.36Å; P681-N728 PolarHBondContact O-ND2 3.32Å; P683-N728 HydrophobicContact CB-CB 4.45Å; N728-L730 PolarHBondContact O-N 2.98Å; N728-L730 WeakPolarHBondContact OD1-CB 3.4Å; N728-L730 PolarHBondContact OD1-N 2.98Å; N728-G731 PolarHBondContact N-O 3.21Å; N728-G731 PolarHBondContact O-N 3.46Å; N728-G731 PolarHBondContact OD1-N 3.07Å
729	T	88	Confident	91.7	Very high	114 Å²	114	43 Å²	43	70%	0.699	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.5	-178	47.6	0	0	0	0	114.8	P681	P681-T729 VanDerWaalsContact CD-OG1 3.31Å; P681-T729 WeakPolarHBondContact CD-OG1 3.21Å
730	L	85.9	Confident	91.7	Very high	57 Å²	57	42.5 Å²	42.5	30%	0.298	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-18.5	179.9	-68.7	178.7	0	0	0	114.3	R572 L651 T653 N728	R572-L730 HydrophobicContact CG-CD1 3.87Å; L651-L730 HydrophobicContact CB-CD1 3.58Å; L651-L730 HydrophobicContact CB-CG 4.38Å; T653-L730 HydrophobicContact CG2-CB 3.7Å; T653-L730 HydrophobicContact CG2-CD1 4.45Å; N728-L730 PolarHBondContact O-N 2.98Å; N728-L730 WeakPolarHBondContact OD1-CB 3.4Å; N728-L730 PolarHBondContact OD1-N 2.98Å
731	G	86.3	Confident	91.6	Very high	28 Å²	28	43.7 Å²	43.7	29%	0.289	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	173	-172.2	-175.1	0	0	0	0	0	115.2	N728	N728-G731 PolarHBondContact N-O 3.21Å; N728-G731 PolarHBondContact O-N 3.46Å; N728-G731 PolarHBondContact OD1-N 3.07Å
732	T	90	Very high	91	Very high	71 Å²	71	43.1 Å²	43.1	44%	0.436	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	121.8	176.1	-65.2	0	0	0	0	110.8	I725 M726 S727	I725-T732 HydrophobicContact CG2-CG2 3.5Å; I725-T732 VanDerWaalsContact CG2-CG2 3.5Å; M726-T732 CarbonylContact O-C 3.51Å; M726-T732 WeakPolarHBondContact O-CA 3.28Å; S727-T732 VanDerWaalsContact CB-OG1 3.29Å; S727-T732 WeakPolarHBondContact CB-OG1 3.44Å
733	E	91.8	Very high	90	Very high	94 Å²	94	48.7 Å²	48.7	44%	0.439	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	163.3	-174.7	-169.2	45.3	-106.7	0	0	110.9	P654 M726	P654-E733 HydrophobicContact CB-CB 4.14Å; P654-E733 VanDerWaalsContact O-CB 3.28Å; P654-E733 WeakPolarHBondContact O-CB 3.35Å; M726-E733 VanDerWaalsContact CE-C 3.49Å; M726-E733 HydrophobicContact CE-CB 3.98Å; M726-E733 HydrophobicContact CE-CG 3.96Å; M726-E733 PolarHBondContact N-O 3.32Å; M726-E733 PolarHBondContact O-N 3.25Å
734	R	92.3	Very high	88.6	Confident	131 Å²	131	53.9 Å²	53.9	49%	0.494	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	133.5	-179.6	-67	-178.8	-175.8	72.5	-1	113.8	T723 C724 I725 M726	T723-R734 HydrophobicContact CG2-CB 4.39Å; T723-R734 HydrophobicContact CG2-CG 4.48Å; C724-R734 CarbonylContact O-C 3.57Å; C724-R734 VanDerWaalsContact O-CA 3.3Å; C724-R734 WeakPolarHBondContact O-CA 3.43Å; I725-R734 HydrophobicContact CG1-CG 4.24Å; I725-R734 HydrophobicContact CG2-CG 4.42Å; M726-R734 VanDerWaalsContact CE-C 3.44Å
735	G	91.1	Very high	86.6	Confident	2 Å²	2	59.6 Å²	59.6	2%	0.021	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	153.5	169.1	0	0	0	0	0	111.7	M660 T723 C724 M726	M660-G735 VanDerWaalsContact SD-C 3.54Å; M660-G735 VanDerWaalsContact SD-CA 3.56Å; T723-G735 CarbonylContact C-O 3.54Å; T723-G735 VanDerWaalsContact CA-O 3.25Å; T723-G735 WeakPolarHBondContact CA-O 3.41Å; C724-G735 PolarHBondContact N-O 3.18Å; C724-G735 PolarHBondContact O-N 3.23Å; M726-G735 VanDerWaalsContact CE-N 3.34Å
736	H	92.9	Very high	84.7	Confident	91 Å²	91	65.9 Å²	65.9	42%	0.421	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	140.7	-177.3	-58.8	-50	0	0	0	110.5	K721 Y722 T723	K721-H736 VanDerWaalsContact CE-ND1 3.33Å; K721-H736 WeakPolarHBondContact CE-ND1 3.05Å; Y722-H736 WeakPolarHBondContact O-CA 3.44Å; T723-H736 PolarHBondContact OG1-CE1 3.41Å; T723-H736 PolarHBondContact OG1-ND1 2.77Å
737	I	94	Very high	82.4	Confident	4 Å²	4	71.9 Å²	71.9	2%	0.021	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	131.7	175.3	-175.3	169.6	0	0	0	109.1	M660 E661 R663 L673 W687 Y722	M660-I737 HydrophobicContact CB-CB 4Å; M660-I737 HydrophobicContact CE-CB 3.99Å; M660-I737 HydrophobicContact CE-CG2 3.62Å; E661-I737 WeakPolarHBondContact O-CD1 3.29Å; E661-I737 WeakPolarHBondContact O-CG1 3.31Å; R663-I737 HydrophobicContact CG-CD1 4.28Å; L673-I737 HydrophobicContact CB-CD1 4.21Å; L673-I737 HydrophobicContact CB-CG2 4.28Å; L673-I737 HydrophobicContact CD1-CG2 4.35Å; L673-I737 HydrophobicContact CD2-CD1 3.73Å; L673-I737 HydrophobicContact CD2-CG1 4.26Å; L673-I737 HydrophobicContact CD2-CG2 4.42Å; W687-I737 HydrophobicContact CZ3-CG2 4.02Å; Y722-I737 PolarHBondContact N-O 2.93Å; Y722-I737 PolarHBondContact O-N 3.1Å
738	Y	94.1	Very high	80.3	Confident	107 Å²	107	77.2 Å²	77.2	42%	0.42	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.8	173.3	-155.6	-96.6	0	0	0	110.3	D662 R663 T719 K721	D662-Y738 WeakPolarHBondContact CA-O 3.39Å; D662-Y738 WeakPolarHBondContact OD1-CB 3.4Å; D662-Y738 PolarHBondContact OD1-N 2.92Å; R663-Y738 PolarHBondContact N-O 3.08Å; T719-Y738 HydrophobicContact CG2-CE1 3.99Å; K721-Y738 HydrophobicContact CB-CD2 4.09Å; K721-Y738 HydrophobicContact CB-CE2 4.41Å
739	L	93.4	Very high	78	Confident	0 Å²	0	82.2 Å²	82.2	0%	0	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.5	168.5	179.3	58	0	0	0	108.8	R663 V665 A671 L673 I711 D718 T719 G720 Y722	R663-L739 HydrophobicContact CB-CD1 3.98Å; R663-L739 CarbonylContact O-C 3.37Å; R663-L739 WeakPolarHBondContact O-CA 3.35Å; V665-L739 HydrophobicContact CB-CD1 4.37Å; V665-L739 HydrophobicContact CG2-CD1 3.9Å; A671-L739 HydrophobicContact CB-CD1 3.72Å; A671-L739 HydrophobicContact CB-CD2 3.74Å; A671-L739 HydrophobicContact CB-CG 4.43Å; L673-L739 HydrophobicContact CD2-CB 4.31Å; L673-L739 HydrophobicContact CD2-CD1 4.43Å; I711-L739 HydrophobicContact CD1-CD2 4.03Å; D718-L739 HydrophobicContact CB-CD2 4.34Å; T719-L739 CarbonylContact C-O 3.49Å; T719-L739 VanDerWaalsContact CA-O 3.25Å; T719-L739 WeakPolarHBondContact CA-O 3.41Å; T719-L739 WeakPolarHBondContact CG2-O 3.35Å; G720-L739 PolarHBondContact N-O 2.87Å; G720-L739 PolarHBondContact O-N 2.95Å; Y722-L739 HydrophobicContact CD2-CB 4.15Å; Y722-L739 HydrophobicContact CE2-CB 3.93Å; Y722-L739 HydrophobicContact CE2-CD2 4.12Å
740	S	90.1	Very high	75.7	Confident	32 Å²	32	81.6 Å²	81.6	22%	0.224	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	138.8	176.3	60.9	0	0	0	0	111	R663 T664 V665	R663-S740 PolarHBondContact O-N 2.85Å; R663-S740 PolarHBondContact O-OG 2.91Å; R663-S740 VanDerWaalsContact O-OG 3.1Å; T664-S740 WeakPolarHBondContact CA-O 3.46Å; T664-S740 WeakPolarHBondContact CA-OG 3.34Å; T664-S740 PolarHBondContact OG1-OG 2.87Å; T664-S740 VanDerWaalsContact OG1-OG 3.08Å; V665-S740 PolarHBondContact N-O 2.99Å
741	V	89.6	Confident	73.2	Confident	26 Å²	26	83 Å²	83	16%	0.158	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119.5	-172.7	-176.3	0	0	0	0	111.2	V665 R667 T719	V665-V741 VanDerWaalsContact O-CA 3.28Å; V665-V741 WeakPolarHBondContact O-CA 3.43Å; R667-V741 HydrophobicContact CB-CG1 3.92Å; R667-V741 HydrophobicContact CG-CG1 4.47Å; T719-V741 PolarHBondContact OG1-N 3.12Å
742	S	81.2	Confident	70.7	Confident	45 Å²	45	85.2 Å²	85.2	32%	0.315	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	148.3	-173	59.8	0	0	0	0	114.1	V665 R667	V665-S742 PolarHBondContact O-N 2.92Å; R667-S742 PolarHBondContact N-O 3.39Å
743	P	72.6	Confident	67.9	Low	117 Å²	117	91.8 Å²	91.8	76%	0.76	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-82.7	153.2	174.3	33.8	-34.5	0	0	0	112.7
744	S	64.6	Low	65.2	Low	112 Å²	112	93.9 Å²	93.9	78%	0.783	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-93.5	141.1	-174.6	-170.2	0	0	0	0	113.7
745	P	53.3	Low	62.6	Low	120 Å²	120	95 Å²	95	78%	0.779	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-89.5	161.3	177.9	36.3	-35.5	0	0	0	113.9
746	N	51.3	Low	59.9	Low	165 Å²	165	101.6 Å²	101.6	88%	0.882	61%	0.608	S	S	*	*			trans	-148.7	145	-176.4	-153.5	36.1	0	0	0	110.5
747	C	44.8	Very low	57.1	Low	126 Å²	126	100 Å²	100	85%	0.851	62%	0.617	S	S	*	*			trans	-159.4	158.4	-179.7	-149	0	0	0	0	114.7
748	D	48.5	Very low	54.1	Low	152 Å²	152	111 Å²	111	81%	0.813	66%	0.658	S	S	*	*			trans	-114.2	179.4	-173	-88.7	-60.4	0	0	0	114.3
749	T	43.3	Very low	51.3	Low	133 Å²	133	111.9 Å²	111.9	82%	0.816	68%	0.675	S	S	*	*			trans	-57.6	168.5	-177.6	52.4	0	0	0	0	116.9
750	A	39.1	Very low	48.7	Very low	100 Å²	100	118.2 Å²	118.2	83%	0.826	71%	0.714	S	S	*	*			cis	-174.7	160.9	-26.7	0	0	0	0	0	108.9
751	G	33.6	Very low	46	Very low	87 Å²	87	123.5 Å²	123.5	90%	0.897	74%	0.744	S	S	*	*			trans	147.9	85.5	164.6	0	0	0	0	0	117.4
752	G	33.2	Very low	43.4	Very low	75 Å²	75	125.6 Å²	125.6	77%	0.773	77%	0.771	S	S	*	*			trans	177.3	135.6	172.9	0	0	0	0	0	109.2
753	Y	32.1	Very low	41.6	Very low	208 Å²	208	130.3 Å²	130.3	82%	0.816	79%	0.791	S	S	*	*			trans	-100.9	172.5	-161.4	-105.4	-97.9	0	0	0	115.4
754	D	35	Very low	39.9	Very low	139 Å²	139	130.3 Å²	130.3	74%	0.743	79%	0.789	S	S	*	*			trans	69.6	87	173.1	-56.8	-7.7	0	0	0	114.8
755	Q	37	Very low	38.7	Very low	153 Å²	153	129.5 Å²	129.5	72%	0.715	78%	0.779	S	S	*	*				94.1	136.8	52	-70.4	-157.9	-74.3	0	0	114.8
756	D	35.1	Very low	37.9	Very low	141 Å²	141	130.4 Å²	130.4	75%	0.754	78%	0.776	S	S	*	*			trans	58.6	122.9	162.9	-57.7	-11.9	0	0	0	120.3
757	G	33.1	Very low	37.4	Very low	59 Å²	59	125.8 Å²	125.8	61%	0.608	75%	0.753	S	S	*	*			cis	146.6	146.2	-13	0	0	0	0	0	114.8
758	W	32.1	Very low	37.2	Very low	234 Å²	234	125.3 Å²	125.3	89%	0.886	75%	0.746	S	S	*	*			trans	69.5	148.1	163	-38.4	98.5	0	0	0	116.4
759	T	35.4	Very low	36.8	Very low	126 Å²	126	122.2 Å²	122.2	77%	0.773	73%	0.732	S	S	*	*			cis	-150.9	158.9	-0.4	-13.8	0	0	0	0	111.8
760	T	37.6	Very low	36.7	Very low	133 Å²	133	121 Å²	121	82%	0.816	73%	0.729	S	S	*	*			trans	-78.6	144.7	171.5	5.3	0	0	0	0	113.6
761	V	34.6	Very low	36.6	Very low	143 Å²	143	122.4 Å²	122.4	87%	0.867	73%	0.731	S	S	*	*			trans	-142.6	132.1	151.1	-175.3	0	0	0	0	108.2
762	G	34.3	Very low	37.1	Very low	69 Å²	69	124.1 Å²	124.1	71%	0.711	72%	0.724	S	S	*	*			trans	-107.5	166.1	175.1	0	0	0	0	0	112.6
763	I	43.6	Very low	37.6	Very low	144 Å²	144	127.7 Å²	127.7	74%	0.738	73%	0.73	S	S	*	*			trans	-129.2	134	171.9	-66.3	-178.1	0	0	0	109.5
764	V	35.4	Very low	38.3	Very low	118 Å²	118	120.6 Å²	120.6	72%	0.715	72%	0.72	S	S	*	*			trans	-86.8	135.4	176.2	171.2	0	0	0	0	109.7	I766	V764-I766 HydrophobicContact CG1-CD1 4.01Å; V764-I766 HydrophobicContact CG1-CG1 3.81Å
765	V	39.4	Very low	39.4	Very low	95 Å²	95	120.9 Å²	120.9	58%	0.576	73%	0.727	S	S	*	*			trans	-111.3	105.1	168	-179.4	0	0	0	0	108.9	V767	V765-V767 HydrophobicContact CG1-CG2 4.31Å
766	I	37.7	Very low	39.3	Very low	138 Å²	138	118 Å²	118	71%	0.708	72%	0.723	S	S	*	*			trans	-102.9	119.7	165.6	-68.1	162.6	0	0	0	107	V764 V768	V764-I766 HydrophobicContact CG1-CD1 4.01Å; V764-I766 HydrophobicContact CG1-CG1 3.81Å; I766-V768 HydrophobicContact CG2-CG2 4.17Å
767	V	41.3	Very low	39.7	Very low	69 Å²	69	119 Å²	119	42%	0.418	73%	0.728	S	S	.	*			trans	-128.5	113.4	159.9	-178	0	0	0	0	108.1	V765 V769 V780	V765-V767 HydrophobicContact CG1-CG2 4.31Å; V767-V769 HydrophobicContact CG1-CG2 4.06Å; V767-V780 HydrophobicContact CG1-CG2 4.37Å; V767-V780 HydrophobicContact CG2-CG1 4.29Å
768	V	38.9	Very low	40	Very low	116 Å²	116	119.9 Å²	119.9	70%	0.703	72%	0.721	S	S	*	*			trans	-84.5	127.8	171.5	176.9	0	0	0	0	108.1	I766	I766-V768 HydrophobicContact CG2-CG2 4.17Å
769	V	40.2	Very low	40.4	Very low	86 Å²	86	118.9 Å²	118.9	52%	0.521	72%	0.718	S	S	.	*			trans	-120.8	104.9	172	-175.2	0	0	0	0	108.5	V767 V778	V767-V769 HydrophobicContact CG1-CG2 4.06Å; V769-V778 HydrophobicContact CG1-CG2 4.13Å; V769-V778 HydrophobicContact CG2-CG1 3.89Å
770	C	41.4	Very low	40.6	Very low	109 Å²	109	117.2 Å²	117.2	74%	0.736	71%	0.707	S	S	*	*			trans	-79.6	126.7	173.5	-69	0	0	0	0	110.3	V772	C770-V772 PolarHBondContact O-N 3.26Å
771	C	36.9	Very low	40.9	Very low	129 Å²	129	117.1 Å²	117.1	87%	0.872	70%	0.7	S	S	*	*			trans	-76.1	108.5	177.2	-62.1	0	0	0	0	111.5
772	V	43.9	Very low	41.1	Very low	123 Å²	123	115 Å²	115	75%	0.745	69%	0.688	S	S	*	*			trans	-128.3	139.4	155.9	-177.8	0	0	0	0	107.9	C770	C770-V772 PolarHBondContact O-N 3.26Å
773	V	44	Very low	41.4	Very low	149 Å²	149	117.8 Å²	117.8	90%	0.903	69%	0.685	S	S	*	*	S	Bend	trans	-72.4	135.6	-170.1	-179.3	0	0	0	0	111.1
774	G	48.3	Very low	40.9	Very low	59 Å²	59	119.3 Å²	119.3	61%	0.608	68%	0.683	S	S	*	*	S	Bend	trans	126	-7.9	143.7	0	0	0	0	0	120.2
775	T	56.4	Low	40.8	Very low	145 Å²	145	122 Å²	122	89%	0.89	69%	0.687	S	S	*	*			trans	-174.3	93.9	161.1	40.1	0	0	0	0	110
776	S	36.5	Very low	40.4	Very low	92 Å²	92	124.7 Å²	124.7	64%	0.643	70%	0.695	S	S	*	*			trans	-115.6	90.8	-168.2	-54.2	0	0	0	0	113.3
777	L	42.9	Very low	40	Very low	163 Å²	163	129.1 Å²	129.1	85%	0.853	70%	0.703	S	S	*	*			trans	-80.5	110.4	158.4	-75.3	172.2	0	0	0	108.8
778	V	39.1	Very low	39.5	Very low	77 Å²	77	138.1 Å²	138.1	47%	0.467	73%	0.729	S	S	.	*			trans	-109.5	116.5	177.1	-179.7	0	0	0	0	109.3	V769 V780	V769-V778 HydrophobicContact CG1-CG2 4.13Å; V769-V778 HydrophobicContact CG2-CG1 3.89Å; V778-V780 HydrophobicContact CG1-CG2 4.47Å
779	W	40.3	Very low	38.9	Very low	213 Å²	213	140.7 Å²	140.7	81%	0.807	73%	0.731	S	S	*	*			trans	-87.1	117.6	176.3	-72	85.9	0	0	0	110.7
780	V	39	Very low	38.5	Very low	92 Å²	92	140 Å²	140	56%	0.558	73%	0.73	S	S	*	*			trans	-106.2	101.5	170.4	177.5	0	0	0	0	108.1	V767 V778 V782	V767-V780 HydrophobicContact CG1-CG2 4.37Å; V767-V780 HydrophobicContact CG2-CG1 4.29Å; V778-V780 HydrophobicContact CG1-CG2 4.47Å; V780-V782 HydrophobicContact CG1-CG2 4.18Å
781	I	44	Very low	38.1	Very low	130 Å²	130	142 Å²	142	67%	0.667	73%	0.728	S	S	*	*			trans	-97.8	115.3	177.5	-61.2	176.4	0	0	0	108.6	I783	I781-I783 HydrophobicContact CG2-CD1 4.45Å; I781-I783 HydrophobicContact CG2-CG1 3.92Å
782	V	38.7	Very low	37.7	Very low	99 Å²	99	142.1 Å²	142.1	60%	0.6	72%	0.721	S	S	*	*			trans	-111	110	172.1	-179.5	0	0	0	0	108.2	V780	V780-V782 HydrophobicContact CG1-CG2 4.18Å
783	I	41.2	Very low	37.1	Very low	127 Å²	127	145.4 Å²	145.4	65%	0.651	72%	0.721	S	S	*	*			trans	-90.3	120	178.1	-58.6	-179.5	0	0	0	109	I781	I781-I783 HydrophobicContact CG2-CD1 4.45Å; I781-I783 HydrophobicContact CG2-CG1 3.92Å
784	Y	34.3	Very low	36.5	Very low	177 Å²	177	143.5 Å²	143.5	69%	0.694	71%	0.714	S	S	*	*			trans	-110.3	130.9	175.1	-173.9	-97.9	0	0	0	109.8	M786	Y784-M786 HydrophobicContact CE1-CB 4.08Å; Y784-M786 HydrophobicContact CE1-CG 3.72Å; Y784-M786 HydrophobicContact CE1-SD 4.27Å; Y784-M786 WeakPolarHBondContact OH-CE 3.3Å; Y784-M786 PolarHBondContact OH-SD 3.46Å
785	H	32.4	Very low	35.9	Very low	174 Å²	174	147 Å²	147	81%	0.806	72%	0.717	S	S	*	*			trans	-133.6	96.5	-178.7	-125.9	-46.4	0	0	0	111.1
786	M	31.4	Very low	34.8	Very low	151 Å²	151	145.4 Å²	145.4	74%	0.744	71%	0.708	S	S	*	*			trans	-93.7	151.9	162	-91.8	-164.6	166.2	0	0	110.8	Y784	Y784-M786 HydrophobicContact CE1-CB 4.08Å; Y784-M786 HydrophobicContact CE1-CG 3.72Å; Y784-M786 HydrophobicContact CE1-SD 4.27Å; Y784-M786 WeakPolarHBondContact OH-CE 3.3Å; Y784-M786 PolarHBondContact OH-SD 3.46Å
787	R	29.8	Very low	34.7	Very low	232 Å²	232	146.9 Å²	146.9	88%	0.875	71%	0.708	S	S	*	*			trans	-143.4	113.3	175.9	-166.1	180	-167.3	179.3	5.7	110
788	R	30.1	Very low	34.2	Very low	258 Å²	258	144.2 Å²	144.2	97%	0.974	70%	0.699	S	S	*	*			trans	-109.3	157.3	159.8	-114.8	178.9	177.2	177.1	-1.2	108.3
789	K	26.2	Very low	34	Very low	169 Å²	169	146.9 Å²	146.9	74%	0.735	71%	0.711	S	S	*	*			trans	-147.4	135.1	-171.8	-168.4	-146.8	174.1	-147.4	0	109.7
790	S	30.8	Very low	33.7	Very low	72 Å²	72	144.1 Å²	144.1	50%	0.503	71%	0.707	S	S	.	*			trans	59.8	143.9	156.6	54.6	0	0	0	0	118.8
791	E	33.6	Very low	33.6	Very low	150 Å²	150	145.2 Å²	145.2	70%	0.701	71%	0.709	S	S	*	*			cis	-154.6	-165.1	-13.3	-128.7	73.7	-90.4	0	0	104.2
792	D	29.8	Very low	33	Very low	133 Å²	133	145 Å²	145	71%	0.711	71%	0.709	S	S	*	*			cis	-151.5	133.5	5.1	-105.4	-40.1	0	0	0	105.9
793	Y	30.6	Very low	32.7	Very low	192 Å²	192	147.2 Å²	147.2	75%	0.753	72%	0.717	S	S	*	*				78.8	109.8	86.3	-105.5	-75.2	0	0	0	119.4	I795	Y793-I795 HydrophobicContact CD1-CD1 3.91Å; Y793-I795 HydrophobicContact CD1-CG1 4.26Å; Y793-I795 HydrophobicContact CE1-CD1 4.2Å; Y793-I795 HydrophobicContact CE1-CG1 4.47Å
794	S	30.5	Very low	32.8	Very low	109 Å²	109	146.1 Å²	146.1	76%	0.762	72%	0.718	S	S	*	*			trans	175.6	121.9	131.4	29.1	0	0	0	0	109.9
795	I	36.6	Very low	32.7	Very low	131 Å²	131	141.5 Å²	141.5	67%	0.672	72%	0.716	S	S	*	*				77.2	124.1	63.5	-69.3	166.7	0	0	0	111.3	Y793	Y793-I795 HydrophobicContact CD1-CD1 3.91Å; Y793-I795 HydrophobicContact CD1-CG1 4.26Å; Y793-I795 HydrophobicContact CE1-CD1 4.2Å; Y793-I795 HydrophobicContact CE1-CG1 4.47Å
796	T	33.3	Very low	32.6	Very low	113 Å²	113	140.5 Å²	140.5	69%	0.693	72%	0.717	S	S	*	*			cis	-161	-176.3	-5.3	28.4	0	0	0	0	107.6
797	N	33.3	Very low	32.6	Very low	122 Å²	122	140.8 Å²	140.8	65%	0.652	72%	0.72	S	S	*	*			cis	-163.8	172.4	22	-144.6	15.6	0	0	0	114.7
798	T	34	Very low	33.1	Very low	107 Å²	107	135.6 Å²	135.6	66%	0.656	72%	0.717	S	S	*	*			trans	64.5	116.6	159.2	46.8	0	0	0	0	118.6
799	D	34.8	Very low	33.3	Very low	133 Å²	133	128 Å²	128	71%	0.711	70%	0.702	S	S	*	*				89.4	141.9	51.1	-65.2	-20.8	0	0	0	111.3
800	E	34.1	Very low	33.5	Very low	155 Å²	155	130 Å²	130	72%	0.724	71%	0.707	S	S	*	*			cis	-163.8	175.7	-0.5	-113.2	-167.3	140.2	0	0	106.8
801	L	35.1	Very low	33.7	Very low	115 Å²	115	133.7 Å²	133.7	60%	0.602	72%	0.72	S	S	*	*			cis	-161	138.1	5.7	-111	164.3	0	0	0	109.7
802	N	31.6	Very low	33.6	Very low	126 Å²	126	131.2 Å²	131.2	67%	0.674	72%	0.72	S	S	*	*				43.9	158.5	124.2	-73.8	3.9	0	0	0	124.3
803	L	32.4	Very low	33.9	Very low	145 Å²	145	130.1 Å²	130.1	76%	0.759	72%	0.722	S	S	*	*			cis	-163.2	-164.4	0.9	-102.5	161.2	0	0	0	107.4
804	P	43.2	Very low	34.1	Very low	104 Å²	104	128.6 Å²	128.6	68%	0.675	72%	0.722	S	S	*	*				-133.3	165.2	-77.1	39.6	-20.5	0	0	0	118.9
805	A	32.2	Very low	34.3	Very low	80 Å²	80	133.5 Å²	133.5	66%	0.661	72%	0.724	S	S	*	*			trans	39	130.5	135.5	0	0	0	0	0	125.8
806	D	31.7	Very low	34	Very low	153 Å²	153	133.7 Å²	133.7	82%	0.818	73%	0.731	S	S	*	*			trans	60.8	154.4	135.6	-51	-18.2	0	0	0	121.1
807	I	30.1	Very low	33.9	Very low	158 Å²	158	136.3 Å²	136.3	81%	0.81	74%	0.74	S	S	*	*			cis	-155.1	-177.9	7.9	4.1	174.5	0	0	0	107.6
808	P	40.8	Very low	33.6	Very low	123 Å²	123	135.8 Å²	135.8	80%	0.799	75%	0.746	S	S	*	*			cis	-128	-155.6	-23.7	37.9	-16.8	0	0	0	113.1
809	S	34.5	Very low	33.3	Very low	97 Å²	97	139.3 Å²	139.3	68%	0.678	76%	0.755	S	S	*	*			trans	-109.3	165.2	-165.2	53.9	0	0	0	0	117.1
810	Y	30.5	Very low	34.2	Very low	211 Å²	211	138.4 Å²	138.4	83%	0.827	76%	0.757	S	S	*	*				177.8	140.5	117.2	-114.2	-94.9	0	0	0	117
811	L	34	Very low	33.9	Very low	150 Å²	150	139 Å²	139	79%	0.785	76%	0.759	S	S	*	*			trans	63.2	144.5	152.7	-95.4	171	0	0	0	126.7
812	S	32.6	Very low	33.5	Very low	99 Å²	99	141.6 Å²	141.6	69%	0.692	77%	0.768	S	S	*	*			trans	88.5	88.9	149.4	61.4	0	0	0	0	125.2
813	S	37	Very low	33.3	Very low	109 Å²	109	138.6 Å²	138.6	76%	0.762	77%	0.767	S	S	*	*				62.6	130.1	118.9	65.5	0	0	0	0	127
814	Q	34.8	Very low	33	Very low	160 Å²	160	142.2 Å²	142.2	75%	0.748	77%	0.772	S	S	*	*			trans	96.9	132	139.1	-89.6	-160.8	43.3	0	0	123.9
815	R	33.6	Very low	32.2	Very low	213 Å²	213	141.2 Å²	141.2	80%	0.804	77%	0.768	S	S	*	*			trans	67.3	155.5	161.9	-61.2	-179	-169.6	-153.9	-2.3	116.5
816	T	30.5	Very low	32	Very low	134 Å²	134	144.3 Å²	144.3	82%	0.822	77%	0.773	S	S	*	*			cis	-146.6	176.8	6.2	-18	0	0	0	0	110.4
817	L	30.6	Very low	31.8	Very low	169 Å²	169	142.3 Å²	142.3	89%	0.885	77%	0.771	S	S	*	*			trans	-141	165.9	176.8	-108.6	169.8	0	0	0	113.1
818	S	28.1	Very low	31.7	Very low	111 Å²	111	143.2 Å²	143.2	78%	0.776	77%	0.772	S	S	*	*			trans	-147	172.2	-165.6	58.4	0	0	0	0	115
819	E	27	Very low	31	Very low	181 Å²	181	142.2 Å²	142.2	85%	0.846	77%	0.774	S	S	*	*			trans	-81.5	-160.7	-178.5	-56.4	-179.1	114	0	0	114.2
820	P	53.1	Low	30.6	Very low	114 Å²	114	141.4 Å²	141.4	74%	0.74	78%	0.78	S	S	*	*				-133.1	-179.2	-72.5	39	-22.3	0	0	0	114.6
821	Q	27.7	Very low	30.4	Very low	167 Å²	167	136.2 Å²	136.2	78%	0.78	78%	0.775	S	S	*	*			trans	-171.3	141.1	150.4	-103.9	-177.6	-34.6	0	0	110
822	E	28.3	Very low	30.1	Very low	170 Å²	170	137.4 Å²	137.4	79%	0.794	78%	0.777	S	S	*	*				59.1	140.9	77.6	-57.8	-166.6	136.2	0	0	116.1
823	G	26.2	Very low	29.9	Very low	62 Å²	62	141.2 Å²	141.2	64%	0.639	78%	0.783	S	S	*	*			cis	173.2	-171.3	-2.7	0	0	0	0	0	113
824	Y	26.6	Very low	29.5	Very low	221 Å²	221	144.6 Å²	144.6	87%	0.867	79%	0.787	S	S	*	*			trans	68.1	156.8	167	-68.5	-102.1	0	0	0	119.6
825	S	26.6	Very low	29.1	Very low	84 Å²	84	145.2 Å²	145.2	59%	0.587	80%	0.795	S	S	*	*			cis	-174.7	150	-28.2	59.3	0	0	0	0	115.2
826	N	27.2	Very low	28.6	Very low	145 Å²	145	143.3 Å²	143.3	78%	0.775	80%	0.797	S	S	*	*			trans	66.8	138.4	142.5	-64.5	-4.9	0	0	0	126.3
827	S	28.1	Very low	29.5	Very low	110 Å²	110	142.4 Å²	142.4	77%	0.769	79%	0.793	S	S	*	*			trans	74.3	157.3	140.9	72.9	0	0	0	0	119.9
828	E	28.2	Very low	30.1	Very low	178 Å²	178	139.3 Å²	139.3	83%	0.832	78%	0.784	S	S	*	*			cis	-159.8	163.8	1.1	-140	174.6	-146.9	0	0	114
829	A	26.6	Very low	30	Very low	102 Å²	102	142.1 Å²	142.1	84%	0.843	79%	0.789	S	S	*	*			trans	52.9	156.9	148	0	0	0	0	0	124.7
830	G	25.3	Very low	30.2	Very low	79 Å²	79	138.3 Å²	138.3	81%	0.814	78%	0.782	S	S	*	*			trans	144.1	146.6	161.6	0	0	0	0	0	116.7
831	S	26.7	Very low	29	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	79%	0.788	S	S	*	*			trans	-156	159.2	-178.4	67	0	0	0	0	116.2
832	H	27.7	Very low	29.3	Very low	175 Å²	175	136 Å²	136	81%	0.81	79%	0.786	S	S	*	*			trans	69.2	156.1	177.6	-61.4	-67.5	0	0	0	116.3
833	Q	27.1	Very low	29.8	Very low	179 Å²	179	137.9 Å²	137.9	84%	0.836	79%	0.787	S	S	*	*			cis	-142.9	-171.6	12.9	-146.7	167	11.2	0	0	112.8
834	Q	29.1	Very low	30.5	Very low	179 Å²	179	140 Å²	140	84%	0.836	79%	0.787	S	S	*	*			trans	-82	153.6	-166.2	-58.8	165	-70.8	0	0	115.9
835	L	27.2	Very low	31.6	Very low	174 Å²	174	134.5 Å²	134.5	91%	0.911	77%	0.769	S	S	*	*			trans	-167.2	160.8	136.4	-105.1	160.9	0	0	0	112.1
836	M	23.6	Very low	32.5	Very low	172 Å²	172	137.4 Å²	137.4	85%	0.847	77%	0.771	S	S	*	*			trans	-132.2	171.3	177.3	-94.1	-170.5	176.3	0	0	108.1
837	P	49	Very low	33.4	Very low	115 Å²	115	131.7 Å²	131.7	75%	0.747	75%	0.746	S	S	*	*			cis	-120.4	-150.8	-18.8	35.3	-13.2	0	0	0	108.4
838	P	41.9	Very low	34.2	Very low	105 Å²	105	134.1 Å²	134.1	68%	0.682	76%	0.757	S	S	*	*			cis	-140.8	179	-1.1	45.3	-26.8	0	0	0	118.7
839	L	27.2	Very low	35	Very low	169 Å²	169	130.4 Å²	130.4	89%	0.885	74%	0.743	S	S	*	*			trans	72.4	106.2	157	-76.3	161.7	0	0	0	119.2
840	S	30.1	Very low	36.2	Very low	101 Å²	101	127.5 Å²	127.5	71%	0.706	72%	0.722	S	S	*	*			trans	-98.5	151.3	174	52.6	0	0	0	0	113
841	N	28.7	Very low	37.2	Very low	163 Å²	163	127.3 Å²	127.3	87%	0.872	71%	0.705	S	S	*	*			trans	-104.3	114.7	147.7	-80.2	-20.5	0	0	0	107.9
842	G	33.8	Very low	37.9	Very low	70 Å²	70	124.6 Å²	124.6	72%	0.722	69%	0.685	S	S	*	*			trans	-98.1	156.9	179.4	0	0	0	0	0	112.8
843	Y	38	Very low	38.9	Very low	210 Å²	210	120.9 Å²	120.9	82%	0.824	67%	0.665	S	S	*	*			trans	-113.8	140.4	178	-72.7	-91.4	0	0	0	111.2
844	V	40.8	Very low	39.9	Very low	106 Å²	106	114.6 Å²	114.6	64%	0.642	65%	0.648	S	S	*	*			trans	-82	140.3	175.4	175.3	0	0	0	0	109.9	C852	V844-C852 HydrophobicContact CG1-CB 4Å
845	H	49.8	Very low	40.7	Very low	106 Å²	106	112.9 Å²	112.9	49%	0.491	65%	0.645	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.1	167.8	176.4	58.6	-89.6	0	0	0	111.8	Y853 D855	H845-Y853 PolarHBondContact O-N 2.75Å; H845-D855 IonicContact CE1-OD1 2.75Å; H845-D855 PolarHBondContact CE1-OD1 2.91Å
846	K	45.8	Very low	41.5	Very low	145 Å²	145	110.6 Å²	110.6	63%	0.63	64%	0.638	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.8	130.5	-168.5	-169.4	179.9	178.3	-176.3	0	111.6	G850	K846-G850 WeakPolarHBondContact CE-O 3.47Å
847	G	46.1	Very low	42.4	Very low	24 Å²	24	105.8 Å²	105.8	25%	0.247	63%	0.633	C	S	.	*			trans	-73	161.6	176	0	0	0	0	0	113.4	D849 G850 V851	G847-D849 PolarHBondContact O-N 2.83Å; G847-G850 PolarHBondContact O-N 2.87Å; G847-G850 VanDerWaalsContact O-N 3.12Å; G847-V851 PolarHBondContact N-O 2.87Å
848	T	44.5	Very low	41.9	Very low	162 Å²	162	104.1 Å²	104.1	99%	0.994	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-12.2	177.5	45.5	0	0	0	0	113.6
849	D	45.9	Very low	41.6	Very low	100 Å²	100	108.2 Å²	108.2	54%	0.535	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.3	-14.4	169.4	50.9	20.4	0	0	0	113.7	G847 V851 Y853	G847-D849 PolarHBondContact O-N 2.83Å; D849-V851 PolarHBondContact OD1-N 2.93Å; D849-Y853 WeakPolarHBondContact OD2-CE2 3.37Å; D849-Y853 PolarHBondContact OD2-OH 2.84Å
850	G	52.8	Low	41.9	Very low	40 Å²	40	106.7 Å²	106.7	41%	0.412	63%	0.631	S	S	.	*	S	Bend	trans	102.3	-5	-178.8	0	0	0	0	0	115.6	K846 G847	K846-G850 WeakPolarHBondContact CE-O 3.47Å; G847-G850 PolarHBondContact O-N 2.87Å; G847-G850 VanDerWaalsContact O-N 3.12Å
851	V	45.7	Very low	42	Very low	76 Å²	76	109 Å²	109	46%	0.461	64%	0.636	S	S	.	*			trans	-86.6	146.1	-178.2	-175.9	0	0	0	0	110.7	G847 D849 Y853	G847-V851 PolarHBondContact N-O 2.87Å; D849-V851 PolarHBondContact OD1-N 2.93Å; V851-Y853 HydrophobicContact CB-CD2 4.34Å; V851-Y853 HydrophobicContact CB-CE2 3.77Å; V851-Y853 HydrophobicContact CG1-CD2 4.48Å; V851-Y853 HydrophobicContact CG1-CE2 4.12Å
852	C	42.1	Very low	42.2	Very low	45 Å²	45	108 Å²	108	30%	0.304	64%	0.636	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.3	121.9	173.2	-63.9	0	0	0	0	109.3	V844 C870	V844-C852 HydrophobicContact CG1-CB 4Å; C852-C870 WeakPolarHBondContact CB-SG 3.15Å; C852-C870 WeakPolarHBondContact SG-CB 3.41Å; C852-C870 CovalentContact SG-SG 2.06Å; C852-C870 PolarHBondContact SG-SG 3.07Å
853	Y	47.3	Very low	42	Very low	98 Å²	98	113.8 Å²	113.8	38%	0.384	64%	0.644	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.8	151.3	-174	-76.7	-80.3	0	0	0	112.7	H845 D849 V851	H845-Y853 PolarHBondContact O-N 2.75Å; D849-Y853 WeakPolarHBondContact OD2-CE2 3.37Å; D849-Y853 PolarHBondContact OD2-OH 2.84Å; V851-Y853 HydrophobicContact CB-CD2 4.34Å; V851-Y853 HydrophobicContact CB-CE2 3.77Å; V851-Y853 HydrophobicContact CG1-CD2 4.48Å; V851-Y853 HydrophobicContact CG1-CE2 4.12Å
854	G	47.9	Very low	41.7	Very low	46 Å²	46	108.4 Å²	108.4	47%	0.474	64%	0.643	S	S	.	*			trans	-106.8	151.5	167.2	0	0	0	0	0	112	T856 G857	G854-T856 PolarHBondContact O-N 2.94Å; G854-G857 PolarHBondContact O-N 3.26Å
855	D	46.5	Very low	41.6	Very low	143 Å²	143	112 Å²	112	77%	0.765	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	11	-169.4	-90.4	-24.3	0	0	0	117.2	H845	H845-D855 IonicContact CE1-OD1 2.75Å; H845-D855 PolarHBondContact CE1-OD1 2.91Å
856	T	44.8	Very low	40.8	Very low	126 Å²	126	109.7 Å²	109.7	77%	0.773	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.4	0.2	175.4	60.5	0	0	0	0	114.5	G854 S858	G854-T856 PolarHBondContact O-N 2.94Å; T856-S858 PolarHBondContact O-N 2.89Å
857	G	42.5	Very low	40	Very low	72 Å²	72	112 Å²	112	74%	0.742	68%	0.679	S	S	*	*			trans	66.4	30	167.8	0	0	0	0	0	116	G854	G854-G857 PolarHBondContact O-N 3.26Å
858	S	36.8	Very low	39.3	Very low	80 Å²	80	118.6 Å²	118.6	56%	0.559	71%	0.707	S	S	*	*			trans	-123.8	132.3	179	56.8	0	0	0	0	111.1	T856	T856-S858 PolarHBondContact O-N 2.89Å
859	E	36.6	Very low	38.8	Very low	190 Å²	190	118.7 Å²	118.7	89%	0.888	70%	0.696	S	S	*	*			trans	-63.5	156.6	175	-68.2	179.8	114.5	0	0	112.4
860	V	34.1	Very low	38	Very low	137 Å²	137	118.3 Å²	118.3	83%	0.83	70%	0.701	S	S	*	*			trans	-126.9	103.8	178.8	-178.6	0	0	0	0	109.5
861	D	32.4	Very low	37	Very low	151 Å²	151	127 Å²	127	81%	0.807	72%	0.721	S	S	*	*			trans	-68.6	134.8	168.3	-87.9	-46.8	0	0	0	111.1
862	T	31.9	Very low	36.2	Very low	141 Å²	141	130.5 Å²	130.5	87%	0.865	74%	0.742	S	S	*	*				-179.5	160.7	108.5	25.6	0	0	0	0	113.6
863	E	29.9	Very low	35.5	Very low	192 Å²	192	131.6 Å²	131.6	90%	0.897	76%	0.761	S	S	*	*			trans	-74.1	130	-173.5	-50.3	164.4	119.9	0	0	113.5
864	A	32.1	Very low	34.5	Very low	96 Å²	96	132.7 Å²	132.7	79%	0.793	78%	0.783	S	S	*	*			trans	-178.9	144.8	137.5	0	0	0	0	0	112.1	G866	A864-G866 PolarHBondContact O-N 2.93Å
865	N	38.8	Very low	33.4	Very low	182 Å²	182	137.1 Å²	137.1	97%	0.973	80%	0.795	S	S	*	*	S	Bend	trans	-41.6	100.7	179.7	-68.7	-29.8	0	0	0	115.9
866	G	31.3	Very low	32.5	Very low	58 Å²	58	138.3 Å²	138.3	60%	0.598	79%	0.793	S	S	*	*			trans	164.6	102	167	0	0	0	0	0	113.8	A864 L868	A864-G866 PolarHBondContact O-N 2.93Å; G866-L868 PolarHBondContact O-N 3.47Å
867	M	30.9	Very low	31.6	Very low	192 Å²	192	139 Å²	139	95%	0.946	80%	0.797	S	S	*	*			trans	-78.6	103.7	179	-160.1	177	-67.4	0	0	110.3
868	L	30	Very low	30.8	Very low	163 Å²	163	138.7 Å²	138.7	85%	0.853	80%	0.795	S	S	*	*			trans	-75.8	135.9	-179.4	-90	115.6	0	0	0	112.6	G866	G866-L868 PolarHBondContact O-N 3.47Å
869	H	34.8	Very low	30.3	Very low	165 Å²	165	147 Å²	147	76%	0.764	81%	0.814	S	S	*	*			trans	-79.3	125.5	163.6	-76.6	-102.4	0	0	0	110.3	R871	H869-R871 PolarHBondContact O-N 3.38Å
870	C	28.1	Very low	29.9	Very low	92 Å²	92	143 Å²	143	62%	0.622	81%	0.807	S	S	*	*			trans	-63.6	98.9	162.7	-58.5	0	0	0	0	108.3	C852	C852-C870 WeakPolarHBondContact CB-SG 3.15Å; C852-C870 WeakPolarHBondContact SG-CB 3.41Å; C852-C870 CovalentContact SG-SG 2.06Å; C852-C870 PolarHBondContact SG-SG 3.07Å
871	R	32.7	Very low	29.5	Very low	223 Å²	223	141 Å²	141	84%	0.842	80%	0.799	S	S	*	*			trans	-124.3	117.1	-169.2	-157.1	-178.4	-159.2	-177.1	7	110.6	H869 G873	H869-R871 PolarHBondContact O-N 3.38Å; R871-G873 PolarHBondContact O-N 2.95Å
872	V	28.8	Very low	29.2	Very low	149 Å²	149	143.5 Å²	143.5	90%	0.903	80%	0.803	S	S	*	*			trans	-70.9	122.6	171.5	-178.2	0	0	0	0	108.3
873	G	26.6	Very low	29	Very low	68 Å²	68	145.2 Å²	145.2	70%	0.701	80%	0.801	S	S	*	*			trans	-111.3	120.4	-173.4	0	0	0	0	0	113.2	R871	R871-G873 PolarHBondContact O-N 2.95Å
874	S	26.2	Very low	29.7	Very low	120 Å²	120	142.1 Å²	142.1	84%	0.839	80%	0.797	S	S	*	*			trans	-95.5	123.6	166.6	46.9	0	0	0	0	110.8
875	L	26.2	Very low	29.3	Very low	139 Å²	139	141.4 Å²	141.4	73%	0.728	80%	0.799	S	S	*	*			trans	-153.9	151.2	-179.2	-72.3	176.6	0	0	0	107.4
876	F	26.3	Very low	28.8	Very low	168 Å²	168	141.7 Å²	141.7	74%	0.737	80%	0.795	S	S	*	*			cis	-143.5	161.7	3	-105.8	-64.2	0	0	0	108.2
877	T	27.5	Very low	29.8	Very low	140 Å²	140	143.7 Å²	143.7	86%	0.859	80%	0.797	S	S	*	*				161.9	162.5	99.5	40.9	0	0	0	0	108.4
878	G	24.2	Very low	29.6	Very low	67 Å²	67	145.1 Å²	145.1	69%	0.691	79%	0.792	S	S	*	*			cis	151	107.2	-12.7	0	0	0	0	0	114.8
879	R	27	Very low	29.5	Very low	255 Å²	255	145.9 Å²	145.9	96%	0.962	79%	0.791	S	S	*	*			trans	74.4	155.3	174.7	-63.7	177.9	172.4	176.4	-2.9	114.8
880	S	27.4	Very low	29.1	Very low	106 Å²	106	141.5 Å²	141.5	74%	0.741	79%	0.791	S	S	*	*			cis	-144.4	149.4	30.4	58	0	0	0	0	118.7
881	S	26.9	Very low	29.1	Very low	93 Å²	93	145.2 Å²	145.2	65%	0.65	80%	0.803	S	S	*	*			trans	-10.8	145.9	150.7	49.9	0	0	0	0	119.5
882	F	25	Very low	28.9	Very low	204 Å²	204	139.5 Å²	139.5	90%	0.895	80%	0.804	S	S	*	*				-152.8	167.8	77.7	-105.4	-90.5	0	0	0	115.7
883	H	28.1	Very low	28.8	Very low	178 Å²	178	136.2 Å²	136.2	82%	0.824	80%	0.8	S	S	*	*			trans	-92.2	-171.1	173	-71.6	-52.5	0	0	0	112.1
884	P	45	Very low	28.9	Very low	127 Å²	127	139.6 Å²	139.6	83%	0.825	81%	0.807	S	S	*	*				-130.2	177.4	-66.6	40	-24.7	0	0	0	112.6
885	G	24.8	Very low	29.8	Very low	80 Å²	80	138.8 Å²	138.8	83%	0.825	80%	0.799	S	S	*	*			trans	170.1	121.9	164.4	0	0	0	0	0	118.7
886	E	27.9	Very low	29.9	Very low	189 Å²	189	138.7 Å²	138.7	88%	0.883	80%	0.804	S	S	*	*			trans	-112.1	176.3	161.7	-83.1	-166	154.3	0	0	108.9
887	P	51.6	Low	30	Very low	100 Å²	100	134.7 Å²	134.7	65%	0.649	81%	0.81	S	S	*	*			cis	-135.7	-153.6	-43	37.5	-18.5	0	0	0	111.5
888	R	26.9	Very low	30	Very low	222 Å²	222	132.1 Å²	132.1	84%	0.838	81%	0.811	S	S	*	*			trans	84.9	155.1	169.1	-46.1	-177	175.4	-173	-1.4	116.1
889	E	28.4	Very low	30.2	Very low	179 Å²	179	134.4 Å²	134.4	84%	0.836	82%	0.823	S	S	*	*			cis	-117.5	161.5	-0.9	-68.8	-179	154.9	0	0	110.2
890	G	26.2	Very low	30.2	Very low	73 Å²	73	125.4 Å²	125.4	75%	0.753	81%	0.81	S	S	*	*				74.5	128.9	82.8	0	0	0	0	0	112.5
891	L	27.8	Very low	30.5	Very low	170 Å²	170	126.1 Å²	126.1	89%	0.89	81%	0.812	S	S	*	*			cis	-161.9	155.2	14.5	-100	161.1	0	0	0	111.5
892	A	28.4	Very low	30.4	Very low	103 Å²	103	129.7 Å²	129.7	85%	0.851	82%	0.823	S	S	*	*			trans	56.7	138.9	152.9	0	0	0	0	0	121.8
893	G	27.7	Very low	30.4	Very low	79 Å²	79	125.7 Å²	125.7	81%	0.814	82%	0.815	S	S	*	*			trans	147.8	85.1	162.6	0	0	0	0	0	116.9
894	V	28.6	Very low	30.3	Very low	140 Å²	140	124.2 Å²	124.2	85%	0.848	81%	0.812	S	S	*	*			trans	-127.2	146.9	165.5	-148.4	0	0	0	0	104.3
895	P	43.3	Very low	29.3	Very low	103 Å²	103	123.2 Å²	123.2	67%	0.669	81%	0.807	S	S	*	*			cis	-152.6	-172.6	33.4	46.7	-26	0	0	0	119.1
896	T	29.3	Very low	29.3	Very low	137 Å²	137	124.1 Å²	124.1	84%	0.84	80%	0.8	S	S	*	*			trans	61.5	129.3	154.1	54.4	0	0	0	0	121.4
897	G	28	Very low	29.2	Very low	83 Å²	83	122.7 Å²	122.7	86%	0.856	80%	0.799	S	S	*	*			trans	152.6	114.7	146.3	0	0	0	0	0	115.7
898	G	27.6	Very low	27.9	Very low	87 Å²	87	123.4 Å²	123.4	90%	0.897	81%	0.805	S	S	*	*			trans	98.1	104.3	162.5	0	0	0	0	0	116.3
899	A	28.5	Very low	27.8	Very low	114 Å²	114	123.4 Å²	123.4	94%	0.942	81%	0.806	S	S	*	*			trans	-103.1	135.3	161.1	0	0	0	0	0	109.2
900	G	27.9	Very low	27.7	Very low	66 Å²	66	122.4 Å²	122.4	68%	0.68	81%	0.807	S	S	*	*			trans	-143.1	156.4	176.3	0	0	0	0	0	109.7
901	P	33	Very low	27.8	Very low	122 Å²	122	126.2 Å²	126.2	79%	0.792	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-79.4	144.5	-157.1	30	-35.8	0	0	0	114.4	V903	P901-V903 PolarHBondContact O-N 2.98Å
902	L	24.3	Very low	27.7	Very low	167 Å²	167	122.4 Å²	122.4	87%	0.874	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-71.1	118	155.2	-83.7	104.2	0	0	0	109.1
903	V	26.3	Very low	27.6	Very low	121 Å²	121	125.2 Å²	125.2	73%	0.733	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-84.6	130	159.9	176.7	0	0	0	0	107.5	P901	P901-V903 PolarHBondContact O-N 2.98Å
904	I	26	Very low	27.6	Very low	147 Å²	147	128.4 Å²	128.4	75%	0.754	80%	0.8	S	S	*	*			trans	-103.7	104.7	174.1	-60.1	174.5	0	0	0	108.1
905	C	23.7	Very low	27.5	Very low	106 Å²	106	132.8 Å²	132.8	72%	0.716	80%	0.803	S	S	*	*			trans	-106.1	124	147.6	-56.9	0	0	0	0	105.3
906	S	24.6	Very low	26.7	Very low	98 Å²	98	133.1 Å²	133.1	69%	0.685	81%	0.808	S	S	*	*			cis	68.2	83.7	41.6	89	0	0	0	0	112.2
907	D	24.5	Very low	26.7	Very low	159 Å²	159	137.7 Å²	137.7	85%	0.85	81%	0.81	S	S	*	*			trans	-152	163.5	166.3	-135.4	-29.5	0	0	0	111.9
908	C	25.3	Very low	26.7	Very low	115 Å²	115	139.8 Å²	139.8	78%	0.777	81%	0.806	S	S	*	*			trans	59.8	102.3	175.8	-65.9	0	0	0	0	118.2
909	Y	25.4	Very low	26.6	Very low	222 Å²	222	146.8 Å²	146.8	87%	0.871	81%	0.805	S	S	*	*			trans	-49.2	152.9	148.1	-86.7	-116.9	0	0	0	111.9
910	D	26.1	Very low	26.5	Very low	159 Å²	159	149.4 Å²	149.4	85%	0.85	80%	0.798	S	S	*	*			trans	-136.1	137.2	162.5	-148.8	-15	0	0	0	111.5
911	N	26.9	Very low	26.4	Very low	152 Å²	152	156.8 Å²	156.8	81%	0.813	81%	0.807	S	S	*	*			trans	-99	90	-168.6	-100	-43.3	0	0	0	111.6	N913	N911-N913 PolarHBondContact O-N 3.16Å
912	A	26.4	Very low	25.9	Very low	90 Å²	90	156.3 Å²	156.3	74%	0.744	81%	0.805	S	S	*	*			trans	-94.8	76.5	-176.5	0	0	0	0	0	114	I914	A912-I914 PolarHBondContact O-N 3Å
913	N	27.1	Very low	27.2	Very low	162 Å²	162	153.3 Å²	153.3	87%	0.866	80%	0.796	S	S	*	*			trans	-75.5	109.4	168.8	-109.9	-37.9	0	0	0	110.8	N911	N911-N913 PolarHBondContact O-N 3.16Å
914	I	27.3	Very low	27.3	Very low	146 Å²	146	158.1 Å²	158.1	75%	0.749	80%	0.803	S	S	*	*			trans	-121.4	107.2	175.5	-60.7	-178.6	0	0	0	110.8	A912 S916	A912-I914 PolarHBondContact O-N 3Å; I914-S916 PolarHBondContact O-N 3.28Å
915	Y	26.3	Very low	27.2	Very low	233 Å²	233	156 Å²	156	91%	0.914	81%	0.807	S	S	*	*			trans	-69.4	121.8	160.6	-93.8	-92.3	0	0	0	109.7
916	S	26.4	Very low	27.5	Very low	109 Å²	109	161.4 Å²	161.4	76%	0.762	81%	0.814	S	S	*	*			trans	-122.4	126.3	162.4	67.5	0	0	0	0	110.9	I914	I914-S916 PolarHBondContact O-N 3.28Å
917	R	28.4	Very low	27.6	Very low	234 Å²	234	164.9 Å²	164.9	88%	0.883	82%	0.824	S	S	*	*			trans	-97.9	129.8	160.7	-72.4	-179.2	175.9	-179.7	-0.4	107
918	T	28	Very low	27.8	Very low	127 Å²	127	161.1 Å²	161.1	78%	0.779	82%	0.815	S	S	*	*				-171.8	138.9	123.6	15.6	0	0	0	0	114.7
919	R	26.7	Very low	27.9	Very low	233 Å²	233	164.4 Å²	164.4	88%	0.879	82%	0.819	S	S	*	*			trans	70.8	140.7	146.6	-71.8	176.1	175.8	169.9	-0.7	121
920	E	25.8	Very low	28.1	Very low	169 Å²	169	161 Å²	161	79%	0.79	82%	0.816	S	S	*	*			trans	-80.2	151.1	164.7	-54.6	126.7	128.6	0	0	110.5
921	Y	25.4	Very low	28.2	Very low	221 Å²	221	160.1 Å²	160.1	87%	0.867	81%	0.811	S	S	*	*				177.5	156.9	119	-108.6	-90	0	0	0	109.7
922	C	23.8	Very low	28.3	Very low	112 Å²	112	157.6 Å²	157.6	76%	0.757	81%	0.806	S	S	*	*			trans	-123.9	-179	171.6	-55.3	0	0	0	0	107.7
923	P	50.1	Low	28.4	Very low	104 Å²	104	161 Å²	161	68%	0.675	81%	0.81	S	S	*	*			cis	-141.1	-173.8	4.2	42.1	-22.3	0	0	0	116.2
924	Y	28.2	Very low	28.6	Very low	223 Å²	223	158.4 Å²	158.4	88%	0.875	80%	0.797	S	S	*	*			trans	31.1	127.6	153.1	-73.5	-66.5	0	0	0	122.5
925	A	25.6	Very low	28.6	Very low	103 Å²	103	159.1 Å²	159.1	85%	0.851	79%	0.794	S	S	*	*			trans	-144.4	136.6	138.6	0	0	0	0	0	110.8
926	Y	28.7	Very low	28.7	Very low	219 Å²	219	153 Å²	153	86%	0.859	79%	0.785	S	S	*	*			trans	-83.2	152.3	161.2	-103.2	-107.5	0	0	0	109.1
927	L	27.8	Very low	28.7	Very low	171 Å²	171	154.9 Å²	154.9	90%	0.895	79%	0.786	S	S	*	*			trans	-165.5	164	137.3	-107.3	165.6	0	0	0	110.1
928	A	28.7	Very low	28.7	Very low	80 Å²	80	148.8 Å²	148.8	66%	0.661	78%	0.779	S	S	*	*			trans	-130.7	-163.8	-179.1	0	0	0	0	0	109.6
929	E	26.9	Very low	28.6	Very low	183 Å²	183	146.3 Å²	146.3	86%	0.855	78%	0.779	S	S	*	*			trans	73.9	150.7	176.4	-56	174.1	-174.4	0	0	116.2
930	D	29	Very low	28.6	Very low	150 Å²	150	143.1 Å²	143.1	80%	0.802	78%	0.778	S	S	*	*			cis	-163.9	171.4	-43.7	-141.6	-28.1	0	0	0	111.1
931	D	29.1	Very low	28.6	Very low	141 Å²	141	143.7 Å²	143.7	75%	0.754	78%	0.783	S	S	*	*			trans	66.8	156.7	143.6	-132.2	-13.5	0	0	0	124.9
932	S	28.2	Very low	28.8	Very low	100 Å²	100	136.6 Å²	136.6	70%	0.699	77%	0.77	S	S	*	*			trans	72.4	165.5	164.3	80.2	0	0	0	0	119.4
933	L	29.2	Very low	28.9	Very low	160 Å²	160	140.4 Å²	140.4	84%	0.838	78%	0.776	S	S	*	*			cis	-171.9	157.7	-30.6	-96.2	171.1	0	0	0	107
934	D	30	Very low	27.7	Very low	109 Å²	109	143.3 Å²	143.3	58%	0.583	78%	0.778	S	S	*	*			cis	-163.7	156.1	-43.7	-170.9	30.7	0	0	0	112.4
935	K	28	Very low	28.4	Very low	160 Å²	160	138.4 Å²	138.4	70%	0.696	77%	0.774	S	S	*	*			trans	32.2	142.4	158.4	-81.1	168.1	-151.9	71.6	0	125.6
936	S	29	Very low	28.6	Very low	105 Å²	105	140.3 Å²	140.3	73%	0.734	76%	0.763	S	S	*	*			trans	74.8	159.9	146.3	74.4	0	0	0	0	118.9
937	L	26.3	Very low	28.6	Very low	149 Å²	149	137 Å²	137	78%	0.78	76%	0.756	S	S	*	*			cis	-124.8	162.7	0.2	-75.3	87.4	0	0	0	109.7
938	S	27.2	Very low	28.7	Very low	105 Å²	105	133 Å²	133	73%	0.734	74%	0.742	S	S	*	*			cis	98.8	89.4	9.2	83.8	0	0	0	0	119
939	G	26.7	Very low	28.5	Very low	76 Å²	76	139.1 Å²	139.1	78%	0.784	75%	0.749	S	S	*	*			trans	131.7	152.4	170.2	0	0	0	0	0	113.8
940	I	26.9	Very low	28.5	Very low	165 Å²	165	139.4 Å²	139.4	85%	0.846	74%	0.742	S	S	*	*			cis	-146.4	152.8	3	-71.2	-175.4	0	0	0	111.2
941	M	25.6	Very low	28.4	Very low	181 Å²	181	138.3 Å²	138.3	89%	0.892	73%	0.733	S	S	*	*			trans	-24.3	166	162.7	-67.3	173.9	-179.2	0	0	120.5
942	A	29.4	Very low	28.3	Very low	72 Å²	72	139 Å²	139	60%	0.595	73%	0.731	S	S	*	*			cis	176.4	169.1	-19.4	0	0	0	0	0	109.9
943	H	26.9	Very low	28.4	Very low	192 Å²	192	142.3 Å²	142.3	89%	0.889	74%	0.735	S	S	*	*				-165.9	164.7	129.6	-107.5	65.7	0	0	0	113.2
944	F	25	Very low	28.2	Very low	165 Å²	165	141.1 Å²	141.1	72%	0.724	74%	0.735	S	S	*	*			trans	-133	164.8	-165.5	-105.3	-74.1	0	0	0	110.5	K946	F944-K946 HydrophobicContact CD1-CB 4.39Å; F944-K946 HydrophobicContact CD1-CG 3.76Å; F944-K946 HydrophobicContact CE1-CG 4.08Å; F944-K946 HydrophobicContact CG-CG 4.46Å
945	P	42	Very low	28.1	Very low	121 Å²	121	143 Å²	143	79%	0.786	74%	0.741	S	S	*	*				-133.7	163.2	61.8	25.8	-2.4	0	0	0	115.5
946	K	29.3	Very low	28	Very low	142 Å²	142	141.8 Å²	141.8	62%	0.617	74%	0.737	S	S	*	*			cis	83.8	139.4	31.9	-87.7	-158.2	151.7	-154.7	0	115.2	F944	F944-K946 HydrophobicContact CD1-CB 4.39Å; F944-K946 HydrophobicContact CD1-CG 3.76Å; F944-K946 HydrophobicContact CE1-CG 4.08Å; F944-K946 HydrophobicContact CG-CG 4.46Å
947	E	29.2	Very low	27.9	Very low	151 Å²	151	144.1 Å²	144.1	71%	0.706	74%	0.736	S	S	*	*			cis	-132.8	-165.5	-14.7	-52.4	-159.4	-150.9	0	0	108
948	S	30.4	Very low	27.9	Very low	87 Å²	87	143.1 Å²	143.1	61%	0.608	73%	0.732	S	S	*	*			cis	-164.5	176.7	4.3	44.1	0	0	0	0	106.2
949	Y	25.1	Very low	27.9	Very low	207 Å²	207	144.1 Å²	144.1	81%	0.812	73%	0.734	S	S	*	*			cis	-110.6	-176.5	4.9	-89.4	-118.5	0	0	0	109.2
950	R	25.7	Very low	28	Very low	189 Å²	189	144.9 Å²	144.9	71%	0.713	73%	0.732	S	S	*	*			cis	79.3	121.9	26.5	-48.7	-152.9	79.6	175.5	4	113.9
951	E	27	Very low	27.9	Very low	128 Å²	128	145.3 Å²	145.3	60%	0.598	74%	0.736	S	S	*	*			cis	102	149.6	40.4	-79.7	-174.7	142.8	0	0	112.3
952	Q	27	Very low	27.8	Very low	154 Å²	154	144.9 Å²	144.9	72%	0.72	73%	0.731	S	S	*	*			cis	-157.7	179.2	6.4	-130.1	170.9	28.1	0	0	113.7
953	H	30.3	Very low	27.6	Very low	170 Å²	170	146.2 Å²	146.2	79%	0.787	74%	0.736	S	S	*	*			trans	-73.6	173.7	173.6	-90.4	-99.3	0	0	0	115.5
954	T	24.6	Very low	27.4	Very low	136 Å²	136	144.5 Å²	144.5	83%	0.834	73%	0.733	S	S	*	*			trans	-155.7	170.3	136.3	12.8	0	0	0	0	110.4
955	Q	28.2	Very low	27.5	Very low	149 Å²	149	144.1 Å²	144.1	70%	0.696	74%	0.737	S	S	*	*				-155	179.3	-97.6	-174.6	167.6	-2.7	0	0	110.3
956	H	25.7	Very low	26.7	Very low	134 Å²	134	144.9 Å²	144.9	62%	0.62	73%	0.734	S	S	*	*			trans	79.9	144.4	167.3	-52	-81.9	0	0	0	117.1
957	E	28.2	Very low	26.5	Very low	153 Å²	153	143.7 Å²	143.7	72%	0.715	74%	0.735	S	S	*	*			cis	-159.2	150.5	-11.7	-123.8	161.2	-157.2	0	0	114.1
958	D	26.5	Very low	26.4	Very low	129 Å²	129	144.1 Å²	144.1	69%	0.69	74%	0.737	S	S	*	*			trans	49.4	126.1	137.6	-76.7	18.9	0	0	0	127
959	T	27.3	Very low	26.3	Very low	126 Å²	126	145.5 Å²	145.5	77%	0.773	74%	0.737	S	S	*	*			trans	85.1	118.3	133.2	57.8	0	0	0	0	123.8
960	A	26.7	Very low	26.3	Very low	92 Å²	92	140 Å²	140	76%	0.76	73%	0.729	S	S	*	*				45	126.2	128.6	0	0	0	0	0	122.3
961	L	24.9	Very low	26.3	Very low	174 Å²	174	136.2 Å²	136.2	91%	0.911	73%	0.731	S	S	*	*				-166.3	166.7	89.3	-149.8	70.3	0	0	0	111.5
962	E	25.2	Very low	26.3	Very low	171 Å²	171	137 Å²	137	80%	0.799	74%	0.744	S	S	*	*			trans	-89.8	158.1	170.7	-66.8	-169.7	108.1	0	0	113.7
963	S	24.1	Very low	26.2	Very low	101 Å²	101	138.3 Å²	138.3	71%	0.706	75%	0.748	S	S	*	*			trans	93.2	152.4	137.9	83.9	0	0	0	0	122
964	L	23.7	Very low	26	Very low	156 Å²	156	138.3 Å²	138.3	82%	0.817	75%	0.753	S	S	*	*			trans	82.8	146.3	154.7	-74.3	164	0	0	0	121.1
965	I	27.3	Very low	26.1	Very low	156 Å²	156	137 Å²	137	80%	0.8	75%	0.745	S	S	*	*			trans	63.8	89.9	174.6	-53.7	161.4	0	0	0	112.7
966	N	23.4	Very low	26.1	Very low	138 Å²	138	134.4 Å²	134.4	74%	0.738	74%	0.743	S	S	*	*			cis	70.7	144.9	36.9	-159.6	34.8	0	0	0	115.2
967	N	26	Very low	26.1	Very low	117 Å²	117	135.9 Å²	135.9	63%	0.626	75%	0.75	S	S	*	*			trans	75.4	126.2	174.1	-76.5	0.8	0	0	0	120.2
968	Q	27.5	Very low	26.1	Very low	160 Å²	160	134.3 Å²	134.3	75%	0.748	75%	0.747	S	S	*	*			trans	75	142	135.5	-69.3	-165.1	-78.1	0	0	120.2
969	D	27.2	Very low	26	Very low	115 Å²	115	136.3 Å²	136.3	62%	0.615	76%	0.756	S	S	*	*			cis	-157.4	169.9	-14.7	-139.3	-47	0	0	0	112.1
970	S	26	Very low	26	Very low	91 Å²	91	135.4 Å²	135.4	64%	0.636	75%	0.751	S	S	*	*			trans	33.6	96	142.8	-66.4	0	0	0	0	119.6
971	S	26.2	Very low	26.1	Very low	110 Å²	110	139.3 Å²	139.3	77%	0.769	75%	0.751	S	S	*	*				17.4	129.8	126.4	60.9	0	0	0	0	120.6
972	V	25.5	Very low	26.1	Very low	144 Å²	144	140.6 Å²	140.6	87%	0.873	74%	0.744	S	S	*	*			trans	-147.3	150.7	136.8	144.1	0	0	0	0	109.3
973	F	26.2	Very low	26.2	Very low	182 Å²	182	141 Å²	141	80%	0.798	75%	0.75	S	S	*	*			trans	-72	151.2	175.6	-75.5	-117.2	0	0	0	112.3
974	L	25.7	Very low	26.3	Very low	170 Å²	170	140 Å²	140	89%	0.89	74%	0.744	S	S	*	*				-157.1	163.4	127.7	-111.9	168.5	0	0	0	111
975	T	26.8	Very low	26.5	Very low	109 Å²	109	139.1 Å²	139.1	67%	0.669	75%	0.745	S	S	*	*			trans	-124.1	155.6	-165	53.2	0	0	0	0	112.7
976	S	27.4	Very low	26.4	Very low	94 Å²	94	135.8 Å²	135.8	66%	0.657	74%	0.74	S	S	*	*			trans	81.4	125	139.3	-179.2	0	0	0	0	120.3
977	H	27.1	Very low	26.6	Very low	166 Å²	166	137.3 Å²	137.3	77%	0.769	75%	0.748	S	S	*	*			trans	78.6	136.7	147.4	-83.7	75.2	0	0	0	122.5
978	D	26.5	Very low	26.7	Very low	120 Å²	120	137 Å²	137	64%	0.642	76%	0.755	S	S	*	*			trans	44.2	126	148.9	-92.2	-55.2	0	0	0	122.1
979	L	25.5	Very low	28.1	Very low	170 Å²	170	134.8 Å²	134.8	89%	0.89	75%	0.754	S	S	*	*				-156.3	108.1	116.8	-116	165.7	0	0	0	112.7
980	T	27.8	Very low	29	Very low	107 Å²	107	135.5 Å²	135.5	66%	0.656	77%	0.765	S	S	*	*			trans	-81.9	125.3	161.8	36.8	0	0	0	0	110.9
981	K	27.9	Very low	29.2	Very low	174 Å²	174	138.4 Å²	138.4	76%	0.757	77%	0.768	S	S	*	*				174.6	137.3	128.8	-98.2	158.1	-174.5	165.1	0	115.5
982	R	25.7	Very low	29.3	Very low	202 Å²	202	139.6 Å²	139.6	76%	0.762	76%	0.762	S	S	*	*			trans	41.8	124.4	136.4	-62.4	174.3	177	-175.1	-4.5	119.5
983	L	26.1	Very low	29.5	Very low	179 Å²	179	141.2 Å²	141.2	94%	0.937	76%	0.759	S	S	*	*				-120.5	139.2	114.3	-100	166.3	0	0	0	108.9
984	S	26.1	Very low	29.6	Very low	81 Å²	81	143 Å²	143	57%	0.566	76%	0.762	S	S	*	*			trans	-156.5	96.7	-171	59.7	0	0	0	0	112.4
985	T	27.5	Very low	29.5	Very low	137 Å²	137	140.3 Å²	140.3	84%	0.84	76%	0.758	S	S	*	*			trans	-173.3	148.4	165.3	36.6	0	0	0	0	108.2
986	A	26.3	Very low	29.7	Very low	85 Å²	85	140.2 Å²	140.2	70%	0.702	76%	0.757	S	S	*	*			cis	-174.1	153.8	-20.3	0	0	0	0	0	107
987	L	26.8	Very low	29.7	Very low	171 Å²	171	142.8 Å²	142.8	90%	0.895	76%	0.764	S	S	*	*			trans	170.7	145.2	142.9	-95.9	160.9	0	0	0	111.8
988	S	28	Very low	30	Very low	111 Å²	111	141.3 Å²	141.3	78%	0.776	77%	0.766	S	S	*	*			trans	-171	165.3	175.1	-57	0	0	0	0	108.5
989	P	57	Low	30.9	Very low	112 Å²	112	140.9 Å²	140.9	73%	0.727	77%	0.77	S	S	*	*			cis	-109.2	-152.3	-37.9	32.3	-13.5	0	0	0	109.4
990	P	46.3	Very low	31.3	Very low	130 Å²	130	137.7 Å²	137.7	84%	0.844	76%	0.761	S	S	*	*				-142.6	-167	94.5	40.1	-24.6	0	0	0	114.3
991	E	29.9	Very low	31.5	Very low	152 Å²	152	142.2 Å²	142.2	71%	0.71	77%	0.766	S	S	*	*			trans	-107.6	166.9	-161.4	-64.4	-174.6	77	0	0	116.7
992	Q	30	Very low	31.5	Very low	136 Å²	136	140.8 Å²	140.8	64%	0.636	77%	0.766	S	S	*	*			trans	53.4	126.5	143.8	-73.7	175.4	60.8	0	0	121.4
993	H	27.9	Very low	31.8	Very low	177 Å²	177	139 Å²	139	82%	0.819	76%	0.764	S	S	*	*				-169.3	172.4	103.1	-101.6	-46.5	0	0	0	114.5
994	Y	28.6	Very low	32.2	Very low	220 Å²	220	141.1 Å²	141.1	86%	0.863	76%	0.76	S	S	*	*			trans	-81	154.3	-178.4	-82	-118.5	0	0	0	113.4
995	S	25	Very low	32.3	Very low	113 Å²	113	139.9 Å²	139.9	79%	0.79	76%	0.76	S	S	*	*				-158	151.9	125.4	-166.4	0	0	0	0	111.7
996	T	30.5	Very low	32.4	Very low	108 Å²	108	141 Å²	141	66%	0.663	75%	0.753	S	S	*	*			trans	-80	162.1	162.6	51.3	0	0	0	0	110.9
997	D	26.3	Very low	32.5	Very low	148 Å²	148	140.6 Å²	140.6	79%	0.791	76%	0.757	S	S	*	*				-176.3	152.8	110.5	-92.1	2.2	0	0	0	114.2
998	V	34.2	Very low	32.7	Very low	134 Å²	134	139.3 Å²	139.3	81%	0.812	75%	0.747	S	S	*	*			trans	-150.5	127.8	-179.4	165.4	0	0	0	0	106.2
999	P	45.8	Very low	32.9	Very low	111 Å²	111	141.4 Å²	141.4	72%	0.721	75%	0.749	S	S	*	*				-159.2	137.3	108.8	36.6	-15.5	0	0	0	119.3
1000	S	32.8	Very low	31.6	Very low	103 Å²	103	142.8 Å²	142.8	72%	0.72	75%	0.75	S	S	*	*			trans	73.7	165.3	137.4	81.6	0	0	0	0	119.1
1001	R	33.2	Very low	30.7	Very low	202 Å²	202	140.9 Å²	140.9	76%	0.762	74%	0.739	S	S	*	*			cis	-160.8	174.6	14.8	-148.6	164.3	-167.2	-177.6	5.6	113.3
1002	L	28.4	Very low	30.7	Very low	144 Å²	144	140 Å²	140	75%	0.754	74%	0.744	S	S	*	*			trans	80	114.2	170.5	-57.2	129.5	0	0	0	114.3
1003	F	31.5	Very low	31	Very low	164 Å²	164	140 Å²	140	72%	0.719	75%	0.754	S	S	*	*				81.6	136.3	56.2	-65.9	-3.4	0	0	0	112.2
1004	W	34.3	Very low	31.7	Very low	225 Å²	225	137.4 Å²	137.4	85%	0.852	75%	0.752	S	S	*	*			cis	-153.8	173	9.4	-121.5	22.6	0	0	0	109.1
1005	G	27.7	Very low	32	Very low	55 Å²	55	135.5 Å²	135.5	57%	0.567	75%	0.752	S	S	*	*			cis	161.8	153.6	-3.8	0	0	0	0	0	112.9
1006	K	29.7	Very low	33.4	Very low	160 Å²	160	136 Å²	136	70%	0.696	75%	0.752	S	S	*	*			trans	67.4	142.9	176.9	-56.5	173.1	164	-92.7	0	116.4	E1008	K1006-E1008 HydrophobicContact CB-CG 4.45Å; K1006-E1008 WeakPolarHBondContact CG-OE1 3.37Å; K1006-E1008 IonicContact NZ-OE1 2.71Å; K1006-E1008 PolarHBondContact NZ-OE1 3.47Å; K1006-E1008 IonicContact NZ-OE2 3.59Å
1007	G	29.2	Very low	33.2	Very low	76 Å²	76	134 Å²	134	78%	0.784	75%	0.752	S	S	*	*			cis	145.5	-174.6	-0.5	0	0	0	0	0	111.9
1008	E	31.1	Very low	33.3	Very low	145 Å²	145	135.2 Å²	135.2	68%	0.678	76%	0.758	S	S	*	*			cis	-150.6	105.2	-2.2	-60.4	-175.1	143.2	0	0	110.8	K1006	K1006-E1008 HydrophobicContact CB-CG 4.45Å; K1006-E1008 WeakPolarHBondContact CG-OE1 3.37Å; K1006-E1008 IonicContact NZ-OE1 2.71Å; K1006-E1008 PolarHBondContact NZ-OE1 3.47Å; K1006-E1008 IonicContact NZ-OE2 3.59Å
1009	D	31.6	Very low	32.9	Very low	155 Å²	155	133.2 Å²	133.2	83%	0.829	75%	0.75	S	S	*	*			trans	80.3	148	148.8	-87.9	-41	0	0	0	128.8
1010	L	29.1	Very low	32.2	Very low	141 Å²	141	137.4 Å²	137.4	74%	0.738	76%	0.76	S	S	*	*			trans	71.9	113.1	139.2	-74.1	166.7	0	0	0	127.4
1011	S	29	Very low	32	Very low	89 Å²	89	141.1 Å²	141.1	62%	0.622	77%	0.766	S	S	*	*				48.1	136.4	127.9	70.5	0	0	0	0	122.9
1012	T	28.8	Very low	32.7	Very low	133 Å²	133	136.5 Å²	136.5	82%	0.816	76%	0.762	S	S	*	*				-177.9	172.4	76.6	29.5	0	0	0	0	113.3
1013	V	35.8	Very low	32.8	Very low	138 Å²	138	135.5 Å²	135.5	84%	0.836	76%	0.762	S	S	*	*			trans	-130	131.5	173.9	165.8	0	0	0	0	107.6
1014	P	43.8	Very low	32.7	Very low	121 Å²	121	134.7 Å²	134.7	79%	0.786	77%	0.765	S	S	*	*				-158.3	176.2	97	43.2	-23.2	0	0	0	118.2
1015	Q	33.3	Very low	32.5	Very low	181 Å²	181	130.4 Å²	130.4	85%	0.846	76%	0.763	S	S	*	*			trans	-95.7	-166.2	158.2	-53	-174.6	-15.9	0	0	109.7
1016	P	54.7	Low	32.6	Very low	124 Å²	124	134.7 Å²	134.7	81%	0.805	77%	0.768	S	S	*	*			cis	-136.3	-174.8	-11.2	41.8	-23.7	0	0	0	115.4
1017	G	27.6	Very low	32.6	Very low	64 Å²	64	135.1 Å²	135.1	66%	0.66	77%	0.77	S	S	*	*			trans	130.2	121.7	165.3	0	0	0	0	0	113.5
1018	L	28.1	Very low	32.6	Very low	174 Å²	174	137.5 Å²	137.5	91%	0.911	77%	0.77	S	S	*	*				60.8	130.3	68.5	-65.7	170.3	0	0	0	113.7
1019	S	26.4	Very low	33.1	Very low	93 Å²	93	136 Å²	136	65%	0.65	77%	0.772	S	S	*	*			cis	-175.4	152.7	-7.8	57	0	0	0	0	110.4
1020	Q	29.4	Very low	33	Very low	198 Å²	198	136 Å²	136	93%	0.925	77%	0.772	S	S	*	*			trans	-171.5	157.3	139.6	-107.3	162	43.3	0	0	114.5
1021	Q	28.7	Very low	33	Very low	181 Å²	181	135.4 Å²	135.4	85%	0.846	77%	0.773	S	S	*	*			trans	-127.4	-176.4	-179.5	-91.5	-168.5	-6	0	0	108.2
1022	P	49.4	Very low	33.1	Very low	106 Å²	106	136.3 Å²	136.3	69%	0.688	78%	0.78	S	S	*	*			cis	-134	-176.3	4.5	40.2	-22	0	0	0	115.5
1023	V	29.6	Very low	33.2	Very low	123 Å²	123	134.8 Å²	134.8	75%	0.745	78%	0.775	S	S	*	*				178.3	112.8	119.8	152.9	0	0	0	0	110.3
1024	N	29	Very low	33	Very low	147 Å²	147	135.5 Å²	135.5	79%	0.786	78%	0.779	S	S	*	*			trans	41.4	137.2	140.3	-66	-4.9	0	0	0	122
1025	V	29.9	Very low	32.3	Very low	134 Å²	134	132.9 Å²	132.9	81%	0.812	77%	0.774	S	S	*	*			cis	-146	161.6	7	-167	0	0	0	0	111.7
1026	H	29.7	Very low	32.3	Very low	146 Å²	146	133.9 Å²	133.9	68%	0.676	78%	0.781	S	S	*	*			trans	-55.2	171.7	161.1	-73.4	-1.6	0	0	0	116
1027	K	30.3	Very low	31	Very low	168 Å²	168	131.8 Å²	131.8	73%	0.73	78%	0.783	S	S	*	*			cis	-167.2	172.2	-16.9	-103.8	170.4	178.9	159.1	0	109.1
1028	T	30.4	Very low	31	Very low	127 Å²	127	132.4 Å²	132.4	78%	0.779	79%	0.789	S	S	*	*			trans	-50.8	167.1	165.7	54.5	0	0	0	0	115.1
1029	P	41.6	Very low	31.1	Very low	113 Å²	113	132.8 Å²	132.8	73%	0.734	79%	0.786	S	S	*	*			cis	-146.2	-168.8	19.8	44.5	-23.4	0	0	0	117.6
1030	L	28.7	Very low	31.3	Very low	155 Å²	155	135 Å²	135	81%	0.812	79%	0.786	S	S	*	*			trans	28.5	130.8	145.9	-75.4	158.3	0	0	0	124.1
1031	V	29.5	Very low	31.3	Very low	128 Å²	128	134.7 Å²	134.7	78%	0.776	78%	0.776	S	S	*	*			trans	83.2	152.2	139.9	172.6	0	0	0	0	121.7
1032	S	30.3	Very low	31.4	Very low	108 Å²	108	131.4 Å²	131.4	76%	0.755	77%	0.773	S	S	*	*			trans	93.7	151.8	169.1	78.5	0	0	0	0	116.8
1033	S	30.7	Very low	30.4	Very low	101 Å²	101	130.2 Å²	130.2	71%	0.706	78%	0.78	S	S	*	*			cis	-163.7	140	-4.3	22.5	0	0	0	0	109.1
1034	V	32.3	Very low	30.6	Very low	153 Å²	153	134.6 Å²	134.6	93%	0.927	79%	0.789	S	S	*	*				80.7	128.2	68.6	174.4	0	0	0	0	116.7
1035	G	29.6	Very low	30.6	Very low	67 Å²	67	131.3 Å²	131.3	69%	0.691	79%	0.79	S	S	*	*			trans	126	137.3	158.8	0	0	0	0	0	114.4
1036	M	32.1	Very low	30.5	Very low	201 Å²	201	132.7 Å²	132.7	99%	0.99	79%	0.793	S	S	*	*			cis	-152.4	164	-10.2	-73.9	-174.8	170.3	0	0	106.9
1037	G	26.9	Very low	30.5	Very low	81 Å²	81	130 Å²	130	84%	0.835	80%	0.795	S	S	*	*			cis	168.1	172.8	-1	0	0	0	0	0	109.7
1038	G	29	Very low	30.4	Very low	76 Å²	76	126.7 Å²	126.7	78%	0.784	79%	0.794	S	S	*	*			trans	140.8	111.5	169.1	0	0	0	0	0	117.8
1039	E	28.8	Very low	30.3	Very low	182 Å²	182	128 Å²	128	85%	0.85	80%	0.795	S	S	*	*			trans	30.6	116.6	146.1	-59.7	-178.1	144.6	0	0	121.2
1040	E	30.6	Very low	29.6	Very low	140 Å²	140	128.1 Å²	128.1	65%	0.654	80%	0.798	S	S	*	*				79.6	141	98.8	-63.9	-136.7	137.6	0	0	115.7
1041	R	29.7	Very low	29.6	Very low	191 Å²	191	129.1 Å²	129.1	72%	0.721	80%	0.799	S	S	*	*			cis	-157	146.4	-1.6	-127.6	-177	-151.3	166.1	25.8	113.6
1042	S	30.8	Very low	29.7	Very low	112 Å²	112	128.4 Å²	128.4	78%	0.783	80%	0.8	S	S	*	*			trans	18	134.2	147.6	61.7	0	0	0	0	123.3
1043	G	29.2	Very low	29.5	Very low	81 Å²	81	128.9 Å²	128.9	84%	0.835	80%	0.798	S	S	*	*			trans	-169.1	115.9	154.1	0	0	0	0	0	114.3
1044	K	33.3	Very low	29.6	Very low	216 Å²	216	131.6 Å²	131.6	94%	0.939	80%	0.8	S	S	*	*			trans	-103	151.9	166.1	-81.8	-170.1	174.3	-170	0	109.8
1045	G	28.4	Very low	29.6	Very low	77 Å²	77	129.9 Å²	129.9	79%	0.794	79%	0.785	S	S	*	*			trans	-162.9	124.8	167.3	0	0	0	0	0	112.3
1046	D	29.4	Very low	29.6	Very low	164 Å²	164	134.6 Å²	134.6	88%	0.877	79%	0.789	S	S	*	*			trans	-92.1	-174.6	172.8	-68.9	-75.2	0	0	0	111.5
1047	A	29.4	Very low	29.5	Very low	88 Å²	88	133.1 Å²	133.1	73%	0.727	78%	0.784	S	S	*	*			trans	92.8	85.8	159.5	0	0	0	0	0	120.5
1048	S	27.3	Very low	29.6	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	78%	0.781	S	S	*	*				41.5	145	110.9	68.8	0	0	0	0	124.3
1049	L	28.5	Very low	29.6	Very low	155 Å²	155	136.1 Å²	136.1	81%	0.812	79%	0.786	S	S	*	*			trans	90.2	157.6	143	-81.4	160.9	0	0	0	121.5
1050	S	26.8	Very low	29.6	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	78%	0.782	S	S	*	*			trans	63.3	126	-170.1	65.7	0	0	0	0	115.2
1051	Q	29.6	Very low	29.4	Very low	176 Å²	176	137.5 Å²	137.5	82%	0.822	80%	0.796	S	S	*	*			cis	83.3	120.6	4.5	-149	-177.8	30.1	0	0	118.1
1052	S	30.2	Very low	29.4	Very low	113 Å²	113	139.7 Å²	139.7	79%	0.79	80%	0.804	S	S	*	*			trans	65.8	156.4	171.3	82.7	0	0	0	0	116.9
1053	T	28	Very low	29.4	Very low	119 Å²	119	141.2 Å²	141.2	73%	0.73	81%	0.809	S	S	*	*			cis	-131.1	161.8	-0.3	51.7	0	0	0	0	109.4
1054	Q	32.3	Very low	29.4	Very low	158 Å²	158	146.5 Å²	146.5	74%	0.738	81%	0.809	S	S	*	*				39.1	134.3	75.5	-74.3	-165.6	-94.4	0	0	114.4
1055	D	30.9	Very low	29.4	Very low	117 Å²	117	141.9 Å²	141.9	63%	0.626	80%	0.801	S	S	*	*			cis	-156.4	170.5	15.1	-95.2	-27.9	0	0	0	112.9
1056	H	31.2	Very low	29.4	Very low	166 Å²	166	146.2 Å²	146.2	77%	0.769	80%	0.8	S	S	*	*			trans	25.4	130.5	153.2	-64.3	-67	0	0	0	123.2
1057	I	29.4	Very low	29.3	Very low	170 Å²	170	147 Å²	147	87%	0.872	80%	0.799	S	S	*	*				-169.4	158.4	105.2	-98.1	164.3	0	0	0	111.7
1058	S	28.9	Very low	29.4	Very low	112 Å²	112	150.8 Å²	150.8	78%	0.783	80%	0.801	S	S	*	*			trans	-87.2	147.9	-170.5	56.7	0	0	0	0	116.4
1059	A	28.9	Very low	29.4	Very low	107 Å²	107	152.4 Å²	152.4	88%	0.884	81%	0.807	S	S	*	*			trans	-149.6	145.3	148.7	0	0	0	0	0	110.7
1060	S	28.8	Very low	29.4	Very low	109 Å²	109	154 Å²	154	76%	0.762	81%	0.81	S	S	*	*			trans	-110.6	134	-176.6	59.6	0	0	0	0	112.6
1061	Y	27.4	Very low	29.3	Very low	242 Å²	242	153.5 Å²	153.5	95%	0.949	81%	0.807	S	S	*	*			trans	-144.1	151.2	157.4	-103.1	-81.6	0	0	0	111.9
1062	R	28.8	Very low	29.8	Very low	237 Å²	237	151.3 Å²	151.3	89%	0.894	81%	0.807	S	S	*	*			trans	-88.5	137.9	178.9	-73.6	172.5	164.3	174.1	-6	111.6
1063	T	29.9	Very low	29.9	Very low	144 Å²	144	156 Å²	156	88%	0.883	83%	0.832	S	S	*	*			trans	-157.3	156.4	145.3	10.1	0	0	0	0	110.8
1064	K	30.6	Very low	30	Very low	193 Å²	193	157.9 Å²	157.9	84%	0.839	84%	0.837	S	S	*	*			trans	-85.2	155.1	168.2	-67.3	-176.6	175.1	-173.7	0	110.1
1065	P	33.5	Very low	29.9	Very low	119 Å²	119	157.9 Å²	157.9	77%	0.773	84%	0.842	S	S	*	*				-117.3	145.8	107.8	34.7	-33.3	0	0	0	110
1066	Q	27.7	Very low	29.8	Very low	167 Å²	167	160.2 Å²	160.2	78%	0.78	85%	0.854	S	S	*	*			cis	77.8	110.1	43.7	-164.2	168.6	3.6	0	0	112.2
1067	E	28.3	Very low	29.7	Very low	181 Å²	181	159.8 Å²	159.8	85%	0.846	86%	0.859	S	S	*	*			trans	-79.5	150.3	-177.4	-62	147.3	128.2	0	0	111
1068	H	29.4	Very low	29.8	Very low	167 Å²	167	159.2 Å²	159.2	77%	0.773	86%	0.858	S	S	*	*			trans	-135	126.6	158.4	-95.8	-75.4	0	0	0	110.3
1069	T	28.7	Very low	29.8	Very low	134 Å²	134	162.3 Å²	162.3	82%	0.822	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-77.3	129.9	178.1	48	0	0	0	0	111
1070	H	28.8	Very low	29.9	Very low	190 Å²	190	166.3 Å²	166.3	88%	0.88	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-90.4	116.9	164	-87.5	-82	0	0	0	110.2
1071	S	23.7	Very low	30	Very low	103 Å²	103	170.7 Å²	170.7	72%	0.72	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-81	137.1	161.6	49.9	0	0	0	0	109.7
1072	P	40.1	Very low	30.2	Very low	129 Å²	129	164.8 Å²	164.8	84%	0.838	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-77.8	160.9	-178.6	32.6	-35.8	0	0	0	113.1
1073	T	32.4	Very low	30.3	Very low	213 Å²	213	158.2 Å²	158.2	100%	1.307	86%	0.86	S	S	*	*			trans	-114	0	164.8	53.8	0	0	0	0	109.3

Retrieved 1,073 of 1,073 residues in 4149.2 ms (Link to these results)

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