A0A096MY46_PAPAN Loading...

Leucine-rich repeats and immunoglobulin-like domains protein 2

AlphaFold DB , UniProt , Accession A0A096MY46, Species PAPAN (Papio anubis, Olive baboon), Gene LRIG2, Length 1,065 aa.

						>A0A096MY46_PAPAN|A0A096MY46|LRIG2
MAPAPLGIPEEQLLGCRSGLLSRLLFLAQSALLLLPAAGAGLCPAPCSCRIPLLDCSRRKLPAPSWRALSGLLPPDTAILDLSHNRLSNWNISLESQMLQEVKMNYNELTEIPYFGEPTSNITLLSLVHNIIPEINAQALQFYPALQSLDLSSNIISEIKTSSFPHMQLKYLNLSNNRITTLEAGCFDNLSSSLLVVKLNRNRISMIPPKIFKLPHLQFLELKRNRIKIVEGLTFQGLDSLRSLKMQRNGISKLKDGAFFGLNNMEELELEHNNLTRVNKGWLYGLRMLQQLYVSQNAIERISPDAWEFCQRLSELDLSYNQLTRLDESTFVGLSLLERLNLGDNRVTHIADGVFRFLSNLQTLDLRNNEISWAIEDASEAFAGLTSLTKLVLQGNQIKSITKKAFIGLESLEHLDLNNNAIMSIQENAFSQTHLKELILNTSSLLCDCHLKWLLQWLIDNNFQHSVNVSCAHPEWLAGQSILNVDLKDFVCDDFLKPQIRTHPETIIALRGMNVTLTCTAVSSSDSPMSTVWRKDSEILYDVDVENFVRYRQQAGEALEYTSILHLFNVNFTDEGKYQCIVTNHFGSNYSQKAKLTVNEMPSFLKTPMDLTIRTGAMARLECAAEGHPAPQISWQKDGGTDFPAARERRMHVMPEDDVFFIANVKIEDMGIYSCMAQNIAGGLSANASLTVLETPSFIRPLEDKTVTRGETAVLQCIAGGSPAPRLNWTKDDGPLLVTERHFFAAANQLLIIVDAGLEDAGKYTCIMSNTLGTERGHIYLNVISSPNCDSSQSSIGHEDDGWTTVGIVIIVVVCCVVGTSLIWVIVIYHMRRKNEDYSITNTEELNLPADIPSYLSSQGTLSEPQEGYSNSEAGSHQQLMPPANGYIHKGTDGGTSTRVICSDCYDNANIYSRTREYCPYTYIAEEDVLDQTLSSLMVQMPKETYLAHLPQDTTALESLISSADGEPSAFPTNHERISEKKLSSTPMSGETLQRPVWNINRELGLPHPPFSQQPVHESPQLHQNEGLAGLEPDCSASSMSCHRLQDHGFDFSRTRNIQDGSEGT
					

Structure Viewer

Loading PAE data...

(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	40.8	Very low	34.9	Very low	251 Å²	251	136.2 Å²	136.2	100%	1.236	82%	0.818	S	S	*	*				0	132.1	0	-73.5	174.3	169.5	0	0	108.8
2	A	29.8	Very low	34.5	Very low	99 Å²	99	136.6 Å²	136.6	82%	0.818	81%	0.805	S	S	*	*			trans	-153.6	150.9	165.3	0	0	0	0	0	108.5
3	P	42.6	Very low	34.1	Very low	126 Å²	126	135.2 Å²	135.2	82%	0.818	79%	0.791	S	S	*	*			trans	-106.7	143.9	-159.9	12.2	9.1	0	0	0	115.7
4	A	31.1	Very low	33.7	Very low	84 Å²	84	135.9 Å²	135.9	69%	0.694	79%	0.789	S	S	*	*			trans	37.7	127.9	140.6	0	0	0	0	0	122.1
5	P	40.8	Very low	33.2	Very low	133 Å²	133	132.3 Å²	132.3	86%	0.864	79%	0.792	S	S	*	*			trans	-87.9	148.3	137	34.7	-29.8	0	0	0	111.7
6	L	32.2	Very low	32.8	Very low	182 Å²	182	130.9 Å²	130.9	95%	0.953	79%	0.789	S	S	*	*			trans	-114.4	153.6	174.9	-86.4	159.5	0	0	0	110.5
7	G	28.3	Very low	32.6	Very low	78 Å²	78	137.2 Å²	137.2	80%	0.804	80%	0.796	S	S	*	*			trans	123.1	71.2	158.9	0	0	0	0	0	118.5
8	I	31.4	Very low	32.5	Very low	166 Å²	166	136.9 Å²	136.9	85%	0.851	80%	0.802	S	S	*	*			trans	-96.1	-177.7	155.1	17.9	172.6	0	0	0	109.1
9	P	49.3	Very low	32.4	Very low	104 Å²	104	133.2 Å²	133.2	68%	0.675	80%	0.797	S	S	*	*			cis	-116	-146.3	-4.3	32.9	-10.6	0	0	0	110.6
10	E	28.7	Very low	32.3	Very low	135 Å²	135	135 Å²	135	63%	0.631	80%	0.801	S	S	*	*			cis	-163.4	166.8	-0	-157.6	60.4	-110.6	0	0	104.9	Q12	E10-Q12 PolarHBondContact OE1-NE2 3.2Å
11	E	28.9	Very low	32.1	Very low	140 Å²	140	136.7 Å²	136.7	65%	0.654	81%	0.805	S	S	*	*			cis	-116.5	-171.4	-0.7	-98.3	-162.1	70.7	0	0	108.7
12	Q	30.5	Very low	31.4	Very low	141 Å²	141	129.1 Å²	129.1	66%	0.659	78%	0.777	S	S	*	*			cis	75.2	162.7	22.3	-45.9	-166.8	71.2	0	0	114.8	E10	E10-Q12 PolarHBondContact OE1-NE2 3.2Å
13	L	29.1	Very low	31.4	Very low	119 Å²	119	136.8 Å²	136.8	62%	0.623	79%	0.785	S	S	*	*			cis	-135.1	139.9	2.9	-133.7	125.6	0	0	0	112.5
14	L	28.9	Very low	30.8	Very low	145 Å²	145	137.2 Å²	137.2	76%	0.759	78%	0.78	S	S	*	*			trans	26.8	134.9	160.8	-83.6	57.9	0	0	0	124
15	G	26.1	Very low	30.6	Very low	82 Å²	82	140 Å²	140	85%	0.845	78%	0.782	S	S	*	*			trans	-161.6	99.5	156.4	0	0	0	0	0	111.8
16	C	27.2	Very low	30	Very low	110 Å²	110	141.9 Å²	141.9	74%	0.743	78%	0.777	S	S	*	*			trans	-89.8	135.1	-157	-84.3	0	0	0	0	118.2
17	R	29.3	Very low	29.8	Very low	238 Å²	238	140.5 Å²	140.5	90%	0.898	77%	0.769	S	S	*	*			trans	36.7	106.6	137.9	-66.9	-177.4	169.8	-169.2	-2.5	120.1
18	S	29.9	Very low	29.8	Very low	131 Å²	131	141.3 Å²	141.3	92%	0.916	77%	0.769	S	S	*	*				171.9	158.9	117.5	44	0	0	0	0	109.6
19	G	30	Very low	29.6	Very low	67 Å²	67	142.6 Å²	142.6	69%	0.691	77%	0.771	S	S	*	*			cis	161.7	100	-7.6	0	0	0	0	0	111.2
20	L	30.7	Very low	28.7	Very low	168 Å²	168	142.7 Å²	142.7	88%	0.88	77%	0.774	S	S	*	*			trans	48.1	93.9	167.5	-74.7	142.9	0	0	0	117.7
21	L	28.7	Very low	28.8	Very low	171 Å²	171	140.4 Å²	140.4	90%	0.895	78%	0.779	S	S	*	*				175.9	162.6	111.6	-93.1	156.7	0	0	0	112.2
22	S	26.1	Very low	28.8	Very low	92 Å²	92	141.1 Å²	141.1	64%	0.643	79%	0.786	S	S	*	*			trans	65.9	102.6	-177	-162	0	0	0	0	117.6	L24	S22-L24 PolarHBondContact OG-N 3.25Å
23	R	29.9	Very low	28.9	Very low	261 Å²	261	142.5 Å²	142.5	99%	0.985	80%	0.797	S	S	*	*			trans	-112.1	67.7	142	-94.8	-167.3	171.6	-165.6	-0.6	109
24	L	29.4	Very low	29	Very low	135 Å²	135	142.9 Å²	142.9	71%	0.707	80%	0.799	S	S	*	*			trans	-115.8	126.1	167.2	-95.9	166.2	0	0	0	109.8	S22	S22-L24 PolarHBondContact OG-N 3.25Å
25	L	27.7	Very low	29.1	Very low	141 Å²	141	143.7 Å²	143.7	74%	0.738	80%	0.803	S	S	*	*			trans	69.9	121.2	160.7	-57.8	163.3	0	0	0	119.4
26	F	27.7	Very low	29.9	Very low	174 Å²	174	145.1 Å²	145.1	76%	0.763	80%	0.798	S	S	*	*			trans	67.3	107.5	136.7	-79.7	-109.8	0	0	0	122.9
27	L	29.3	Very low	30	Very low	152 Å²	152	144.8 Å²	144.8	80%	0.796	80%	0.803	S	S	*	*				50.1	134.4	121.4	-65.1	179.6	0	0	0	123.6
28	A	27.9	Very low	30.2	Very low	96 Å²	96	138.8 Å²	138.8	79%	0.793	80%	0.804	S	S	*	*			trans	69.9	154	155.9	0	0	0	0	0	116.9
29	Q	27.2	Very low	30.5	Very low	193 Å²	193	135.4 Å²	135.4	90%	0.902	79%	0.79	S	S	*	*			cis	-118.8	-179.1	-0.9	-60.6	164	-34	0	0	108.3
30	S	30	Very low	30.9	Very low	105 Å²	105	137.1 Å²	137.1	73%	0.734	80%	0.797	S	S	*	*			cis	-153.8	151.7	10.9	49.1	0	0	0	0	108
31	A	31.2	Very low	32	Very low	88 Å²	88	131.2 Å²	131.2	73%	0.727	78%	0.777	S	S	*	*			cis	77.6	88.5	29.1	0	0	0	0	0	116.1
32	L	28.5	Very low	33.6	Very low	155 Å²	155	130 Å²	130	81%	0.812	77%	0.771	S	S	*	*				-168.3	121.3	128.2	-131.8	74.4	0	0	0	112.9
33	L	31.6	Very low	35.6	Very low	170 Å²	170	128.2 Å²	128.2	89%	0.89	76%	0.758	S	S	*	*	S	Bend	trans	150.3	121	155.5	-89.3	162.8	0	0	0	110.2
34	L	31.1	Very low	37.6	Very low	127 Å²	127	116.1 Å²	116.1	67%	0.665	71%	0.713	S	S	*	*			cis	-159.1	99.3	-43.5	-121.3	172.3	0	0	0	109
35	L	32	Very low	39.4	Very low	162 Å²	162	114.2 Å²	114.2	85%	0.848	72%	0.717	S	S	*	*			trans	64	164	166.9	-69.1	169.4	0	0	0	117.9
36	P	43.1	Very low	41.5	Very low	112 Å²	112	110.6 Å²	110.6	73%	0.727	70%	0.702	S	S	*	*			trans	-112.2	159	-151.7	40.6	-34	0	0	0	116.1
37	A	28.7	Very low	44	Very low	102 Å²	102	103 Å²	103	84%	0.843	67%	0.67	S	S	*	*			trans	-87.4	143.7	151.5	0	0	0	0	0	109.7
38	A	34.1	Very low	46.6	Very low	112 Å²	112	97.6 Å²	97.6	93%	0.926	65%	0.645	S	S	*	*	S	Bend	trans	-91	135.7	-170.5	0	0	0	0	0	113.2
39	G	35	Very low	49.1	Very low	61 Å²	61	95.1 Å²	95.1	63%	0.629	62%	0.621	S	S	*	*			trans	178.6	17.5	177.4	0	0	0	0	0	115.2	G41	G39-G41 PolarHBondContact O-N 2.71Å
40	A	39.1	Very low	51.8	Low	102 Å²	102	95.3 Å²	95.3	84%	0.843	61%	0.614	S	S	*	*			trans	-76.1	83.6	-171.3	0	0	0	0	0	112.7	L42	A40-L42 PolarHBondContact O-N 3.34Å
41	G	54.9	Low	54	Low	44 Å²	44	95.2 Å²	95.2	45%	0.454	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-57.2	125.4	162.5	0	0	0	0	0	110.1	G39 C43	G39-G41 PolarHBondContact O-N 2.71Å; G41-C43 PolarHBondContact O-N 3.05Å
42	L	61	Low	56.5	Low	147 Å²	147	94.3 Å²	94.3	77%	0.77	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-63.4	123.5	-179.7	-78.6	165.9	0	0	0	110	A40	A40-L42 PolarHBondContact O-N 3.34Å
43	C	69	Low	59.3	Low	53 Å²	53	89.8 Å²	89.8	36%	0.358	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-61	123.8	179.5	-168.2	0	0	0	0	110.6	G41 A45 C49	G41-C43 PolarHBondContact O-N 3.05Å; C43-A45 PolarHBondContact O-N 3.19Å; C43-C49 WeakPolarHBondContact CA-SG 3.49Å; C43-C49 HydrophobicContact CB-CB 3.9Å; C43-C49 WeakPolarHBondContact CB-SG 3.4Å; C43-C49 WeakPolarHBondContact SG-CB 3.17Å; C43-C49 PolarHBondContact SG-N 2.96Å; C43-C49 CovalentContact SG-SG 2.04Å; C43-C49 PolarHBondContact SG-SG 2.82Å
44	P	71.1	Confident	62	Low	7 Å²	7	81.7 Å²	81.7	5%	0.045	53%	0.525	C	S	.	.			trans	-71.4	105.4	-173.9	26.4	-33.7	0	0	0	110.8	C47 L54 L69 L72	P44-C47 WeakPolarHBondContact O-CA 3.32Å; P44-C47 WeakPolarHBondContact O-CB 3.3Å; P44-C47 PolarHBondContact O-N 2.88Å; P44-L54 HydrophobicContact CG-CD1 4.47Å; P44-L54 HydrophobicContact CG-CD2 4.31Å; P44-L69 HydrophobicContact CB-CD2 3.64Å; P44-L69 HydrophobicContact CG-CD2 3.68Å; P44-L72 HydrophobicContact CB-CB 4.13Å; P44-L72 WeakPolarHBondContact CD-O 3.38Å; P44-L72 WeakPolarHBondContact CG-O 2.97Å
45	A	66.6	Low	64.7	Low	95 Å²	95	77.4 Å²	77.4	79%	0.785	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	136	172.6	0	0	0	0	0	110.1	C43	C43-A45 PolarHBondContact O-N 3.19Å
46	P	72.4	Confident	67.3	Low	66 Å²	66	69.7 Å²	69.7	43%	0.429	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	cis	-95.1	16.1	15.1	38.5	-38.8	0	0	0	116	R59 L61	P46-R59 HydrophobicContact CB-CB 4.27Å; P46-R59 HydrophobicContact CB-CG 4.4Å; P46-R59 HydrophobicContact CG-CB 3.71Å; P46-R59 HydrophobicContact CG-CG 4.15Å; P46-R59 WeakPolarHBondContact O-CD 3.12Å; P46-R59 PolarHBondContact O-NH1 3.12Å; P46-L61 HydrophobicContact CG-CD2 3.67Å
47	C	80.4	Confident	69.5	Low	14 Å²	14	65.4 Å²	65.4	10%	0.095	44%	0.435	C	S	.	.	S	Bend	trans	-75.8	169.1	-178.4	-49.3	0	0	0	0	113.3	P44 L54 D55 C56	P44-C47 WeakPolarHBondContact O-CA 3.32Å; P44-C47 WeakPolarHBondContact O-CB 3.3Å; P44-C47 PolarHBondContact O-N 2.88Å; C47-L54 HydrophobicContact CB-CD1 3.69Å; C47-D55 CarbonylContact C-O 3.54Å; C47-D55 WeakPolarHBondContact CA-O 3.18Å; C47-D55 WeakPolarHBondContact CB-O 3.13Å; C47-C56 HydrophobicContact CB-CB 3.97Å; C47-C56 WeakPolarHBondContact CB-SG 3.43Å; C47-C56 VanDerWaalsContact SG-CA 3.54Å; C47-C56 WeakPolarHBondContact SG-CB 3.48Å; C47-C56 CovalentContact SG-SG 2.03Å; C47-C56 PolarHBondContact SG-SG 2.93Å
48	S	84.3	Confident	72.2	Confident	39 Å²	39	68.6 Å²	68.6	27%	0.273	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	114	-178.9	169.5	0	0	0	0	110.7	D55	S48-D55 PolarHBondContact N-O 3.47Å; S48-D55 PolarHBondContact O-N 2.72Å
49	C	80.8	Confident	74.6	Confident	44 Å²	44	68.1 Å²	68.1	30%	0.297	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.4	179.7	-58	0	0	0	0	111.2	C43 L54	C43-C49 WeakPolarHBondContact CA-SG 3.49Å; C43-C49 HydrophobicContact CB-CB 3.9Å; C43-C49 WeakPolarHBondContact CB-SG 3.4Å; C43-C49 WeakPolarHBondContact SG-CB 3.17Å; C43-C49 PolarHBondContact SG-N 2.96Å; C43-C49 CovalentContact SG-SG 2.04Å; C43-C49 PolarHBondContact SG-SG 2.82Å; C49-L54 VanDerWaalsContact SG-CD1 3.55Å
50	R	82.8	Confident	76.4	Confident	196 Å²	196	73.7 Å²	73.7	74%	0.74	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139	70.3	169.9	-71.4	-174	175.2	-168.7	-1	108.2	L53	R50-L53 CarbonylContact C-O 3.32Å; R50-L53 WeakPolarHBondContact CA-O 3.4Å; R50-L53 PolarHBondContact N-O 3.3Å; R50-L53 WeakPolarHBondContact O-CA 3.49Å; R50-L53 WeakPolarHBondContact O-CB 3.5Å; R50-L53 PolarHBondContact O-N 2.69Å
51	I	77.3	Confident	77.8	Confident	104 Å²	104	69.6 Å²	69.6	53%	0.533	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.9	125.7	-175.6	-64.2	172.3	0	0	0	110.2	D76	I51-D76 HydrophobicContact CD1-CB 4.38Å; I51-D76 HydrophobicContact CG2-CB 3.62Å
52	P	81.9	Confident	77.6	Confident	68 Å²	68	71 Å²	71	44%	0.442	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	cis	-84.7	1.1	11.6	34.3	-37.4	0	0	0	116.5	A78 I79	P52-A78 HydrophobicContact CB-CB 3.9Å; P52-A78 PolarHBondContact O-N 3.34Å; P52-I79 PolarHBondContact O-N 3.25Å
53	L	88	Confident	77.2	Confident	60 Å²	60	67.8 Å²	67.8	31%	0.314	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132	-178.7	172.9	65.5	0	0	0	113	R50 I79 D81	R50-L53 CarbonylContact C-O 3.32Å; R50-L53 WeakPolarHBondContact CA-O 3.4Å; R50-L53 PolarHBondContact N-O 3.3Å; R50-L53 WeakPolarHBondContact O-CA 3.49Å; R50-L53 WeakPolarHBondContact O-CB 3.5Å; R50-L53 PolarHBondContact O-N 2.69Å; L53-I79 CarbonylContact C-O 3.51Å; L53-I79 WeakPolarHBondContact CA-O 3.45Å; L53-I79 HydrophobicContact CB-CB 4.47Å; L53-I79 HydrophobicContact CD1-CB 3.98Å; L53-I79 HydrophobicContact CD1-CG2 3.56Å; L53-D81 HydrophobicContact CD1-CB 4.36Å
54	L	88.3	Confident	76.4	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.005	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	107.8	163	178.2	54.3	0	0	0	109.9	P44 C47 C49 L73 T77 I79 L80 D81	P44-L54 HydrophobicContact CG-CD1 4.47Å; P44-L54 HydrophobicContact CG-CD2 4.31Å; C47-L54 HydrophobicContact CB-CD1 3.69Å; C49-L54 VanDerWaalsContact SG-CD1 3.55Å; L54-L73 HydrophobicContact CD2-CD2 3.49Å; L54-L73 VanDerWaalsContact CD2-CD2 3.49Å; L54-T77 HydrophobicContact CB-CG2 3.6Å; L54-T77 HydrophobicContact CD2-CG2 4.41Å; L54-I79 PolarHBondContact N-O 3.02Å; L54-L80 HydrophobicContact CB-CD1 4.26Å; L54-L80 HydrophobicContact CD2-CD1 3.97Å; L54-L80 HydrophobicContact CG-CD1 4.05Å; L54-D81 PolarHBondContact O-N 2.83Å
55	D	88	Confident	75.5	Confident	37 Å²	37	72.5 Å²	72.5	20%	0.198	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	99.9	177.5	167.6	38.8	0	0	0	111.2	C47 S48 S57 R59	C47-D55 CarbonylContact C-O 3.54Å; C47-D55 WeakPolarHBondContact CA-O 3.18Å; C47-D55 WeakPolarHBondContact CB-O 3.13Å; S48-D55 PolarHBondContact N-O 3.47Å; S48-D55 PolarHBondContact O-N 2.72Å; D55-S57 WeakPolarHBondContact OD1-CB 3.38Å; D55-S57 PolarHBondContact OD1-N 3.02Å; D55-S57 PolarHBondContact OD1-OG 3.02Å; D55-R59 IonicContact OD2-NH2 3.86Å; D55-R59 PolarHBondContact OD2-NH2 3.19Å; D55-R59 VanDerWaalsContact OD2-NH2 3.16Å
56	C	87.1	Confident	75.1	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.366	C	S	.	.			trans	-100.2	14.7	168.4	-65.6	0	0	0	0	112.2	C47 R59 L61 D81 L82 N85	C47-C56 HydrophobicContact CB-CB 3.97Å; C47-C56 WeakPolarHBondContact CB-SG 3.43Å; C47-C56 VanDerWaalsContact SG-CA 3.54Å; C47-C56 WeakPolarHBondContact SG-CB 3.48Å; C47-C56 CovalentContact SG-SG 2.03Å; C47-C56 PolarHBondContact SG-SG 2.93Å; C56-R59 WeakPolarHBondContact O-CG 3.07Å; C56-L61 HydrophobicContact CB-CD1 4.36Å; C56-D81 CarbonylContact C-O 3.49Å; C56-D81 VanDerWaalsContact CA-O 3.25Å; C56-D81 WeakPolarHBondContact CA-O 3.46Å; C56-D81 VanDerWaalsContact CB-O 3.31Å; C56-D81 WeakPolarHBondContact CB-O 3.4Å; C56-D81 PolarHBondContact N-O 3.11Å; C56-L82 HydrophobicContact CB-CD2 3.59Å; C56-L82 HydrophobicContact CB-CG 4.32Å; C56-N85 PolarHBondContact O-ND2 2.87Å
57	S	88.1	Confident	74.2	Confident	22 Å²	22	75.5 Å²	75.5	15%	0.154	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	150.8	-173.6	78	0	0	0	0	112.9	D55 R59 D81 S83	D55-S57 WeakPolarHBondContact OD1-CB 3.38Å; D55-S57 PolarHBondContact OD1-N 3.02Å; D55-S57 PolarHBondContact OD1-OG 3.02Å; S57-R59 WeakPolarHBondContact O-CD 3.33Å; S57-R59 WeakPolarHBondContact O-CG 3.33Å; S57-R59 PolarHBondContact O-N 3.15Å; S57-R59 PolarHBondContact O-NE 3.09Å; S57-R59 VanDerWaalsContact O-NE 3.15Å; S57-D81 PolarHBondContact N-O 3.12Å; S57-S83 CarbonylContact C-O 3.54Å; S57-S83 WeakPolarHBondContact CA-O 3.09Å; S57-S83 VanDerWaalsContact CB-O 3.27Å; S57-S83 WeakPolarHBondContact CB-O 3.37Å
58	R	86.7	Confident	72.8	Confident	169 Å²	169	78 Å²	78	64%	0.638	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	11.3	177.3	-61.1	179.2	-179.9	-163.9	0.3	115.7	K60 S83 H84	R58-K60 PolarHBondContact O-N 3.5Å; R58-S83 PolarHBondContact N-O 3.39Å; R58-H84 WeakPolarHBondContact CA-O 3.33Å; R58-H84 HydrophobicContact CB-CB 4.45Å; R58-H84 HydrophobicContact CG-CB 3.47Å; R58-H84 VanDerWaalsContact CG-CB 3.47Å; R58-H84 PolarHBondContact NE-CD2 3.29Å; R58-H84 VanDerWaalsContact NE-CD2 3.26Å; R58-H84 PolarHBondContact NH2-NE2 2.99Å
59	R	83.1	Confident	71.5	Confident	101 Å²	101	76.9 Å²	76.9	38%	0.381	39%	0.392	S	S	.	.	S	Bend	trans	-79.4	1.8	-174.8	-54	-53.5	165.9	138.7	-8.8	114.9	P46 D55 C56 S57 L61 N85	P46-R59 HydrophobicContact CB-CB 4.27Å; P46-R59 HydrophobicContact CB-CG 4.4Å; P46-R59 HydrophobicContact CG-CB 3.71Å; P46-R59 HydrophobicContact CG-CG 4.15Å; P46-R59 WeakPolarHBondContact O-CD 3.12Å; P46-R59 PolarHBondContact O-NH1 3.12Å; D55-R59 IonicContact OD2-NH2 3.86Å; D55-R59 PolarHBondContact OD2-NH2 3.19Å; D55-R59 VanDerWaalsContact OD2-NH2 3.16Å; C56-R59 WeakPolarHBondContact O-CG 3.07Å; S57-R59 WeakPolarHBondContact O-CD 3.33Å; S57-R59 WeakPolarHBondContact O-CG 3.33Å; S57-R59 PolarHBondContact O-N 3.15Å; S57-R59 PolarHBondContact O-NE 3.09Å; S57-R59 VanDerWaalsContact O-NE 3.15Å; R59-L61 HydrophobicContact CB-CD2 3.99Å; R59-L61 HydrophobicContact CB-CG 4.19Å; R59-L61 PolarHBondContact O-N 3.07Å; R59-N85 PolarHBondContact N-OD1 3.2Å
60	K	73.3	Confident	70.1	Confident	179 Å²	179	77.5 Å²	77.5	78%	0.778	40%	0.397	S	S	*	.			trans	53.9	40.4	-176.4	-57.5	-179.5	179.4	177.8	0	112.1	R58 P62 N85	R58-K60 PolarHBondContact O-N 3.5Å; K60-P62 WeakPolarHBondContact O-CD 3.28Å; K60-P62 VanDerWaalsContact O-N 3.09Å; K60-N85 PolarHBondContact N-OD1 3.23Å
61	L	68.5	Low	68.7	Low	15 Å²	15	70.7 Å²	70.7	8%	0.079	39%	0.387	C	S	.	.			trans	-53.3	113.2	-176.6	-63.7	177	0	0	0	110.7	P46 C56 R59 L82 N85	P46-L61 HydrophobicContact CG-CD2 3.67Å; C56-L61 HydrophobicContact CB-CD1 4.36Å; R59-L61 HydrophobicContact CB-CD2 3.99Å; R59-L61 HydrophobicContact CB-CG 4.19Å; R59-L61 PolarHBondContact O-N 3.07Å; L61-L82 HydrophobicContact CD1-CD2 3.84Å; L61-N85 HydrophobicContact CB-CB 4.49Å; L61-N85 PolarHBondContact N-OD1 3.41Å; L61-N85 VanDerWaalsContact N-OD1 3.08Å
62	P	52	Low	67.9	Low	75 Å²	75	69.6 Å²	69.6	49%	0.487	38%	0.382	S	S	.	.			trans	-77.6	146.7	-179.5	-13	29.1	0	0	0	111.2	K60 S65	K60-P62 WeakPolarHBondContact O-CD 3.28Å; K60-P62 VanDerWaalsContact O-N 3.09Å; P62-S65 WeakPolarHBondContact O-CB 3.44Å; P62-S65 PolarHBondContact O-N 2.6Å; P62-S65 PolarHBondContact O-OG 2.63Å
63	A	52.4	Low	67.3	Low	79 Å²	79	67.5 Å²	67.5	65%	0.653	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	133.3	154.9	0	0	0	0	0	108.6
64	P	52.3	Low	66.6	Low	91 Å²	91	65 Å²	65	59%	0.591	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	cis	-103.6	21.8	5.5	40.5	-34.5	0	0	0	114.5	W66 R67	P64-W66 PolarHBondContact O-N 3.45Å; P64-W66 VanDerWaalsContact O-N 3.09Å; P64-R67 PolarHBondContact O-N 3.45Å
65	S	51	Low	65.8	Low	67 Å²	67	68.4 Å²	68.4	47%	0.469	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-61.6	-20.8	-167.9	-49.7	0	0	0	0	115.7	P62 R67 A68	P62-S65 WeakPolarHBondContact O-CB 3.44Å; P62-S65 PolarHBondContact O-N 2.6Å; P62-S65 PolarHBondContact O-OG 2.63Å; S65-R67 PolarHBondContact O-N 3.43Å; S65-R67 VanDerWaalsContact O-N 3.15Å; S65-A68 WeakPolarHBondContact O-CB 3.38Å; S65-A68 PolarHBondContact O-N 3.21Å
66	W	59.3	Low	65.3	Low	35 Å²	35	70.7 Å²	70.7	13%	0.133	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-65.1	-11.2	178.7	57.4	-73.8	0	0	0	113.9	P64 A68 L69 W90 N91 I92	P64-W66 PolarHBondContact O-N 3.45Å; P64-W66 VanDerWaalsContact O-N 3.09Å; W66-A68 PolarHBondContact O-N 3.04Å; W66-A68 VanDerWaalsContact O-N 3.12Å; W66-L69 HydrophobicContact CB-CD1 4.39Å; W66-L69 WeakPolarHBondContact O-CB 3.29Å; W66-L69 PolarHBondContact O-N 3.42Å; W66-W90 HydrophobicContact CE3-CD2 4.18Å; W66-W90 AromaticContact CE3-CE3 3.8Å; W66-W90 HydrophobicContact CE3-CE3 3.8Å; W66-W90 HydrophobicContact CE3-CH2 4.25Å; W66-W90 AromaticContact CE3-CZ3 3.85Å; W66-W90 HydrophobicContact CE3-CZ3 3.85Å; W66-W90 AromaticContact CZ3-CD2 3.95Å; W66-W90 HydrophobicContact CZ3-CD2 3.95Å; W66-W90 HydrophobicContact CZ3-CE3 4.03Å; W66-W90 HydrophobicContact CZ3-CG 4.32Å; W66-W90 HydrophobicContact CZ3-CZ3 4.46Å; W66-N91 HydrophobicContact CH2-CB 4.36Å; W66-N91 VanDerWaalsContact CH2-N 3.28Å; W66-I92 HydrophobicContact CD2-CD1 4.06Å; W66-I92 HydrophobicContact CE3-CB 4.12Å; W66-I92 HydrophobicContact CE3-CD1 3.4Å; W66-I92 HydrophobicContact CE3-CG1 3.8Å; W66-I92 HydrophobicContact CH2-CD1 4.22Å; W66-I92 HydrophobicContact CH2-CG1 3.94Å; W66-I92 HydrophobicContact CZ3-CB 3.62Å; W66-I92 HydrophobicContact CZ3-CD1 3.52Å; W66-I92 HydrophobicContact CZ3-CG1 3.34Å; W66-I92 WeakPolarHBondContact O-CD1 3.33Å
67	R	53.1	Low	65.1	Low	190 Å²	190	70.8 Å²	70.8	72%	0.717	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-61.4	-8.8	163.4	-73.5	-176.6	177.5	172.8	0.1	114.5	P64 S65 S70 I92	P64-R67 PolarHBondContact O-N 3.45Å; S65-R67 PolarHBondContact O-N 3.43Å; S65-R67 VanDerWaalsContact O-N 3.15Å; R67-S70 PolarHBondContact O-OG 3.31Å; R67-I92 HydrophobicContact CB-CD1 4.44Å; R67-I92 HydrophobicContact CG-CD1 4Å
68	A	51.4	Low	65.1	Low	66 Å²	66	70.5 Å²	70.5	55%	0.545	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-86	-6.2	169	0	0	0	0	0	114	S65 W66	S65-A68 WeakPolarHBondContact O-CB 3.38Å; S65-A68 PolarHBondContact O-N 3.21Å; W66-A68 PolarHBondContact O-N 3.04Å; W66-A68 VanDerWaalsContact O-N 3.12Å
69	L	55.2	Low	65.3	Low	16 Å²	16	64.1 Å²	64.1	8%	0.084	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-24.6	176.7	-74.7	163	0	0	0	113.2	P44 W66 G71 L72	P44-L69 HydrophobicContact CB-CD2 3.64Å; P44-L69 HydrophobicContact CG-CD2 3.68Å; W66-L69 HydrophobicContact CB-CD1 4.39Å; W66-L69 WeakPolarHBondContact O-CB 3.29Å; W66-L69 PolarHBondContact O-N 3.42Å; L69-G71 PolarHBondContact O-N 2.96Å; L69-L72 PolarHBondContact O-N 2.95Å
70	S	52	Low	65.6	Low	57 Å²	57	59.5 Å²	59.5	40%	0.399	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	117.4	171.3	47.6	0	0	0	0	110.1	R67	R67-S70 PolarHBondContact O-OG 3.31Å
71	G	54.7	Low	66.5	Low	52 Å²	52	52.7 Å²	52.7	54%	0.536	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	6.6	-176.9	0	0	0	0	0	116	L69	L69-G71 PolarHBondContact O-N 2.96Å
72	L	58.8	Low	67.5	Low	82 Å²	82	52 Å²	52	43%	0.429	32%	0.318	S	S	.	.			trans	-129.1	23.1	178.9	-73.5	-179.6	0	0	0	114.8	P44 L69	P44-L72 HydrophobicContact CB-CB 4.13Å; P44-L72 WeakPolarHBondContact CD-O 3.38Å; P44-L72 WeakPolarHBondContact CG-O 2.97Å; L69-L72 PolarHBondContact O-N 2.95Å
73	L	69.1	Low	69.5	Low	23 Å²	23	48.7 Å²	48.7	12%	0.12	30%	0.297	C	S	.	.			trans	-74.9	130.5	165.1	-70.4	-175.1	0	0	0	110.2	L54 L94	L54-L73 HydrophobicContact CD2-CD2 3.49Å; L54-L73 VanDerWaalsContact CD2-CD2 3.49Å; L73-L94 HydrophobicContact CD1-CB 3.85Å; L73-L94 HydrophobicContact CD1-CD1 4.2Å; L73-L94 HydrophobicContact CD1-CD2 4.03Å; L73-L94 HydrophobicContact CD1-CG 4.24Å; L73-L94 HydrophobicContact CG-CD2 4.47Å
74	P	73.6	Confident	71.4	Confident	7 Å²	7	48.2 Å²	48.2	5%	0.045	28%	0.281	C	S	.	.			trans	-60.2	135	163.9	-20.8	32	0	0	0	109.9	D76 T77	P74-D76 PolarHBondContact O-N 2.98Å; P74-D76 VanDerWaalsContact O-N 3.16Å; P74-T77 WeakPolarHBondContact CD-OG1 3.36Å; P74-T77 VanDerWaalsContact O-CB 3.26Å; P74-T77 WeakPolarHBondContact O-CB 3.28Å; P74-T77 PolarHBondContact O-N 3.22Å; P74-T77 PolarHBondContact O-OG1 3.04Å
75	P	71.1	Confident	73	Confident	74 Å²	74	44.4 Å²	44.4	48%	0.481	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-27.3	-172.2	24.6	-34.6	0	0	0	113.5	T77 M98	P75-T77 PolarHBondContact O-N 3.48Å; P75-M98 WeakPolarHBondContact O-CB 3.49Å; P75-M98 VanDerWaalsContact O-CG 3.23Å; P75-M98 WeakPolarHBondContact O-CG 3.5Å
76	D	77.9	Confident	74.7	Confident	84 Å²	84	50 Å²	50	45%	0.449	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	9.6	178.5	-47.2	-63	0	0	0	113.8	I51 P74 A78	I51-D76 HydrophobicContact CD1-CB 4.38Å; I51-D76 HydrophobicContact CG2-CB 3.62Å; P74-D76 PolarHBondContact O-N 2.98Å; P74-D76 VanDerWaalsContact O-N 3.16Å; D76-A78 PolarHBondContact O-N 3.14Å
77	T	83.8	Confident	76	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.012	26%	0.262	C	S	.	.			trans	-76.8	103.7	-178.8	-54.2	0	0	0	0	110.7	L54 P74 P75 S96 M98 L99	L54-T77 HydrophobicContact CB-CG2 3.6Å; L54-T77 HydrophobicContact CD2-CG2 4.41Å; P74-T77 WeakPolarHBondContact CD-OG1 3.36Å; P74-T77 VanDerWaalsContact O-CB 3.26Å; P74-T77 WeakPolarHBondContact O-CB 3.28Å; P74-T77 PolarHBondContact O-N 3.22Å; P74-T77 PolarHBondContact O-OG1 3.04Å; P75-T77 PolarHBondContact O-N 3.48Å; T77-S96 PolarHBondContact O-OG 3.49Å; T77-M98 CarbonylContact O-C 3.55Å; T77-L99 WeakPolarHBondContact O-CA 3.09Å; T77-L99 PolarHBondContact O-N 3.23Å
78	A	87.8	Confident	77.5	Confident	16 Å²	16	42.5 Å²	42.5	13%	0.132	25%	0.248	C	C	.	.			trans	-96.4	-20.9	175	0	0	0	0	0	114.1	P52 D76 M98 Q100 E101	P52-A78 HydrophobicContact CB-CB 3.9Å; P52-A78 PolarHBondContact O-N 3.34Å; D76-A78 PolarHBondContact O-N 3.14Å; A78-M98 VanDerWaalsContact CA-O 3.27Å; A78-M98 WeakPolarHBondContact CA-O 3.28Å; A78-M98 VanDerWaalsContact CB-O 3.32Å; A78-M98 WeakPolarHBondContact CB-O 3.35Å; A78-Q100 PolarHBondContact O-N 3.29Å; A78-E101 PolarHBondContact O-N 3.5Å
79	I	90.8	Very high	78.8	Confident	36 Å²	36	42.6 Å²	42.6	19%	0.185	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	123.6	178.4	-52.1	178.2	0	0	0	109.4	P52 L53 L54 E101	P52-I79 PolarHBondContact O-N 3.25Å; L53-I79 CarbonylContact C-O 3.51Å; L53-I79 WeakPolarHBondContact CA-O 3.45Å; L53-I79 HydrophobicContact CB-CB 4.47Å; L53-I79 HydrophobicContact CD1-CB 3.98Å; L53-I79 HydrophobicContact CD1-CG2 3.56Å; L54-I79 PolarHBondContact N-O 3.02Å; I79-E101 WeakPolarHBondContact CA-O 3.44Å; I79-E101 HydrophobicContact CB-CB 4.3Å; I79-E101 HydrophobicContact CG1-CB 4.1Å; I79-E101 HydrophobicContact CG1-CG 4.15Å; I79-E101 HydrophobicContact CG2-CB 4Å
80	L	90	Very high	80	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.021	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.1	176.4	175.7	58.8	0	0	0	110.5	L54 L82 L94 L99 E101 V102 K103	L54-L80 HydrophobicContact CB-CD1 4.26Å; L54-L80 HydrophobicContact CD2-CD1 3.97Å; L54-L80 HydrophobicContact CG-CD1 4.05Å; L80-L82 HydrophobicContact CD1-CD1 4.25Å; L80-L82 HydrophobicContact CD1-CG 4.1Å; L80-L82 HydrophobicContact CD2-CD1 3.85Å; L80-L82 HydrophobicContact CG-CD1 3.93Å; L80-L82 HydrophobicContact CG-CG 4.14Å; L80-L94 HydrophobicContact CD2-CD1 3.64Å; L80-L99 HydrophobicContact CB-CD1 3.76Å; L80-L99 HydrophobicContact CD2-CD2 4.49Å; L80-E101 PolarHBondContact N-O 3.09Å; L80-V102 HydrophobicContact CB-CG2 4.46Å; L80-V102 HydrophobicContact CD2-CG1 4.47Å; L80-V102 WeakPolarHBondContact O-CA 3.19Å; L80-K103 PolarHBondContact O-N 3.24Å
81	D	91.4	Very high	80.8	Confident	35 Å²	35	45.5 Å²	45.5	19%	0.187	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	112.6	175.3	-158.7	-32.8	0	0	0	111.6	L53 L54 C56 S57 S83 K103	L53-D81 HydrophobicContact CD1-CB 4.36Å; L54-D81 PolarHBondContact O-N 2.83Å; C56-D81 CarbonylContact C-O 3.49Å; C56-D81 VanDerWaalsContact CA-O 3.25Å; C56-D81 WeakPolarHBondContact CA-O 3.46Å; C56-D81 VanDerWaalsContact CB-O 3.31Å; C56-D81 WeakPolarHBondContact CB-O 3.4Å; C56-D81 PolarHBondContact N-O 3.11Å; S57-D81 PolarHBondContact N-O 3.12Å; D81-S83 WeakPolarHBondContact OD1-CB 3.47Å; D81-S83 PolarHBondContact OD1-N 3.4Å; D81-S83 PolarHBondContact OD1-OG 3.23Å; D81-K103 HydrophobicContact CB-CB 4.42Å
82	L	90.6	Very high	81.5	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	23%	0.228	C	C	.	.			trans	-111.9	16.1	178.8	-74.3	160.8	0	0	0	111.6	C56 L61 L80 N85 L87 W90 K103 M104 N107	C56-L82 HydrophobicContact CB-CD2 3.59Å; C56-L82 HydrophobicContact CB-CG 4.32Å; L61-L82 HydrophobicContact CD1-CD2 3.84Å; L80-L82 HydrophobicContact CD1-CD1 4.25Å; L80-L82 HydrophobicContact CD1-CG 4.1Å; L80-L82 HydrophobicContact CD2-CD1 3.85Å; L80-L82 HydrophobicContact CG-CD1 3.93Å; L80-L82 HydrophobicContact CG-CG 4.14Å; L82-N85 PolarHBondContact O-ND2 3.08Å; L82-L87 HydrophobicContact CB-CD1 4.06Å; L82-W90 HydrophobicContact CD1-CH2 3.93Å; L82-W90 HydrophobicContact CD1-CZ3 3.85Å; L82-K103 PolarHBondContact N-O 2.93Å; L82-M104 HydrophobicContact CB-CG 4.05Å; L82-M104 HydrophobicContact CD1-CE 3.57Å; L82-M104 HydrophobicContact CD1-CG 4.38Å; L82-N107 PolarHBondContact O-ND2 3.12Å; L82-N107 VanDerWaalsContact O-ND2 3.09Å
83	S	93.3	Very high	82.1	Confident	5 Å²	5	43 Å²	43	4%	0.035	23%	0.229	C	C	.	.			trans	-70	159.5	-171.3	-53.1	0	0	0	0	114.1	S57 R58 D81 N85 N105	S57-S83 CarbonylContact C-O 3.54Å; S57-S83 WeakPolarHBondContact CA-O 3.09Å; S57-S83 VanDerWaalsContact CB-O 3.27Å; S57-S83 WeakPolarHBondContact CB-O 3.37Å; R58-S83 PolarHBondContact N-O 3.39Å; D81-S83 WeakPolarHBondContact OD1-CB 3.47Å; D81-S83 PolarHBondContact OD1-N 3.4Å; D81-S83 PolarHBondContact OD1-OG 3.23Å; S83-N85 VanDerWaalsContact C-N 3.33Å; S83-N85 PolarHBondContact O-N 3.22Å; S83-N85 PolarHBondContact O-ND2 2.66Å; S83-N105 CarbonylContact C-O 3.33Å; S83-N105 WeakPolarHBondContact CA-O 3.23Å; S83-N105 WeakPolarHBondContact CB-O 3.32Å; S83-N105 PolarHBondContact OG-N 3Å; S83-N105 VanDerWaalsContact OG-N 3.09Å
84	H	92.8	Very high	82.3	Confident	70 Å²	70	42 Å²	42	32%	0.324	22%	0.224	S	C	.	.	S	Bend	trans	56	42.1	-180	-56.6	-75.9	0	0	0	113.6	R58 N105 Y106	R58-H84 WeakPolarHBondContact CA-O 3.33Å; R58-H84 HydrophobicContact CB-CB 4.45Å; R58-H84 HydrophobicContact CG-CB 3.47Å; R58-H84 VanDerWaalsContact CG-CB 3.47Å; R58-H84 PolarHBondContact NE-CD2 3.29Å; R58-H84 VanDerWaalsContact NE-CD2 3.26Å; R58-H84 PolarHBondContact NH2-NE2 2.99Å; H84-N105 PolarHBondContact N-O 3.01Å; H84-Y106 WeakPolarHBondContact CA-O 3.45Å; H84-Y106 AromaticContact CE1-CD2 3.28Å; H84-Y106 WeakPolarHBondContact CE1-CD2 3.44Å; H84-Y106 AromaticContact CE1-CE2 3.73Å; H84-Y106 AromaticContact CE1-CG 3.6Å; H84-Y106 PolarHBondContact N-O 2.93Å; H84-Y106 WeakPolarHBondContact ND1-CB 3.4Å; H84-Y106 AromaticContact ND1-CD2 3.57Å; H84-Y106 AromaticContact ND1-CG 3.48Å; H84-Y106 AromaticContact NE2-CD2 3.94Å
85	N	86.3	Confident	82	Confident	11 Å²	11	48.5 Å²	48.5	6%	0.059	25%	0.254	C	S	.	.	S	Bend	trans	-111.4	-156.5	171.3	-75.2	-65.7	0	0	0	109.2	C56 R59 K60 L61 L82 S83 L87 Y106 N107	C56-N85 PolarHBondContact O-ND2 2.87Å; R59-N85 PolarHBondContact N-OD1 3.2Å; K60-N85 PolarHBondContact N-OD1 3.23Å; L61-N85 HydrophobicContact CB-CB 4.49Å; L61-N85 PolarHBondContact N-OD1 3.41Å; L61-N85 VanDerWaalsContact N-OD1 3.08Å; L82-N85 PolarHBondContact O-ND2 3.08Å; S83-N85 VanDerWaalsContact C-N 3.33Å; S83-N85 PolarHBondContact O-N 3.22Å; S83-N85 PolarHBondContact O-ND2 2.66Å; N85-L87 HydrophobicContact CB-CG 4.15Å; N85-Y106 PolarHBondContact N-O 2.93Å; N85-N107 VanDerWaalsContact CA-OD1 3.31Å; N85-N107 WeakPolarHBondContact CA-OD1 3.35Å; N85-N107 VanDerWaalsContact CB-OD1 3.25Å; N85-N107 WeakPolarHBondContact CB-OD1 3.17Å; N85-N107 PolarHBondContact N-OD1 2.84Å; N85-N107 PolarHBondContact O-OD1 3.17Å
86	R	86.9	Confident	82	Confident	185 Å²	185	45.4 Å²	45.4	70%	0.698	23%	0.233	S	C	*	.			trans	-130.5	47.6	173.4	-63.5	-169.6	-179.3	176.5	-2.9	110.5	S88 N107 E108	R86-S88 PolarHBondContact O-N 2.85Å; R86-N107 PolarHBondContact N-OD1 2.95Å; R86-E108 WeakPolarHBondContact CB-OE1 3.41Å; R86-E108 VanDerWaalsContact CD-OE1 3.3Å; R86-E108 WeakPolarHBondContact CD-OE1 3.47Å; R86-E108 VanDerWaalsContact CG-OE1 3.22Å; R86-E108 WeakPolarHBondContact CG-OE1 3.44Å; R86-E108 IonicContact NE-OE1 2.66Å
87	L	85.5	Confident	81.7	Confident	8 Å²	8	49.4 Å²	49.4	4%	0.042	25%	0.25	C	C	.	.			trans	-76.3	117.9	177.9	-56.9	175.8	0	0	0	108.4	L82 N85 W90 N107 E108 L109	L82-L87 HydrophobicContact CB-CD1 4.06Å; N85-L87 HydrophobicContact CB-CG 4.15Å; L87-W90 HydrophobicContact CD1-CE3 4.5Å; L87-N107 HydrophobicContact CB-CB 4.29Å; L87-N107 WeakPolarHBondContact CB-OD1 3.44Å; L87-N107 WeakPolarHBondContact CG-OD1 3.43Å; L87-N107 PolarHBondContact N-OD1 2.83Å; L87-E108 CarbonylContact O-C 3.59Å; L87-E108 WeakPolarHBondContact O-CA 3.11Å; L87-E108 PolarHBondContact O-N 3.34Å; L87-L109 HydrophobicContact CB-CD2 4.11Å; L87-L109 WeakPolarHBondContact O-CD2 3.24Å; L87-L109 WeakPolarHBondContact O-CG 3.42Å; L87-L109 PolarHBondContact O-N 3.21Å
88	S	84.7	Confident	81.5	Confident	59 Å²	59	54 Å²	54	41%	0.413	27%	0.272	S	S	.	.			trans	-108.9	-27	-178.5	54.4	0	0	0	0	114.5	R86 E108 T110	R86-S88 PolarHBondContact O-N 2.85Å; S88-E108 WeakPolarHBondContact CA-O 3.17Å; S88-T110 PolarHBondContact O-N 3.15Å
89	N	78.6	Confident	81.5	Confident	68 Å²	68	53.2 Å²	53.2	36%	0.364	27%	0.266	S	S	.	.			trans	-136.7	146.4	172	-174.7	-87.4	0	0	0	109	E111	N89-E111 PolarHBondContact ND2-OE1 3.15Å
90	W	79.8	Confident	81.5	Confident	8 Å²	8	56.1 Å²	56.1	3%	0.03	28%	0.278	C	S	.	.			trans	-132.4	120.8	174.3	-176.6	-79	0	0	0	111.2	W66 L82 L87 I92 L94 M104 P113 Y114 F115	W66-W90 HydrophobicContact CE3-CD2 4.18Å; W66-W90 AromaticContact CE3-CE3 3.8Å; W66-W90 HydrophobicContact CE3-CE3 3.8Å; W66-W90 HydrophobicContact CE3-CH2 4.25Å; W66-W90 AromaticContact CE3-CZ3 3.85Å; W66-W90 HydrophobicContact CE3-CZ3 3.85Å; W66-W90 AromaticContact CZ3-CD2 3.95Å; W66-W90 HydrophobicContact CZ3-CD2 3.95Å; W66-W90 HydrophobicContact CZ3-CE3 4.03Å; W66-W90 HydrophobicContact CZ3-CG 4.32Å; W66-W90 HydrophobicContact CZ3-CZ3 4.46Å; L82-W90 HydrophobicContact CD1-CH2 3.93Å; L82-W90 HydrophobicContact CD1-CZ3 3.85Å; L87-W90 HydrophobicContact CD1-CE3 4.5Å; W90-I92 HydrophobicContact CZ2-CB 4.31Å; W90-I92 HydrophobicContact CZ2-CG2 4.43Å; W90-I92 PolarHBondContact NE1-O 3.45Å; W90-I92 VanDerWaalsContact NE1-O 3.12Å; W90-L94 HydrophobicContact CH2-CD2 4.39Å; W90-L94 HydrophobicContact CZ2-CD1 4.28Å; W90-L94 HydrophobicContact CZ2-CD2 3.91Å; W90-L94 HydrophobicContact CZ2-CG 4.13Å; W90-M104 HydrophobicContact CD2-CE 3.58Å; W90-M104 HydrophobicContact CE3-CE 3.36Å; W90-M104 HydrophobicContact CG-CE 4.12Å; W90-M104 HydrophobicContact CH2-CE 4.27Å; W90-M104 HydrophobicContact CZ2-CE 4.46Å; W90-M104 HydrophobicContact CZ3-CE 3.73Å; W90-P113 HydrophobicContact CB-CB 3.79Å; W90-P113 HydrophobicContact CG-CB 3.92Å; W90-Y114 PolarHBondContact NE1-O 3.14Å; W90-F115 HydrophobicContact CD2-CE1 4.12Å; W90-F115 AromaticContact CE2-CD1 3.64Å; W90-F115 AromaticContact CE2-CE1 3.54Å; W90-F115 HydrophobicContact CG-CE1 4.43Å; W90-F115 AromaticContact CZ2-CD1 3.83Å; W90-F115 HydrophobicContact CZ2-CD1 3.83Å; W90-F115 AromaticContact CZ2-CE1 3.81Å; W90-F115 HydrophobicContact CZ2-CE1 3.81Å; W90-F115 AromaticContact NE1-CD1 3.33Å; W90-F115 VanDerWaalsContact NE1-CD1 3.33Å; W90-F115 AromaticContact NE1-CE1 3.55Å
91	N	68.6	Low	81.7	Confident	125 Å²	125	58.6 Å²	58.6	67%	0.668	29%	0.29	S	S	*	.	B	Isolated β-bridge	trans	-151.8	57.8	-174.3	-165.4	-8.2	0	0	0	110.1	W66	W66-N91 HydrophobicContact CH2-CB 4.36Å; W66-N91 VanDerWaalsContact CH2-N 3.28Å
92	I	69.4	Low	81.8	Confident	18 Å²	18	56.9 Å²	56.9	9%	0.092	28%	0.281	C	S	.	.			trans	-133.1	131.5	173.7	-82.1	-178.3	0	0	0	109.3	W66 R67 W90 L94	W66-I92 HydrophobicContact CD2-CD1 4.06Å; W66-I92 HydrophobicContact CE3-CB 4.12Å; W66-I92 HydrophobicContact CE3-CD1 3.4Å; W66-I92 HydrophobicContact CE3-CG1 3.8Å; W66-I92 HydrophobicContact CH2-CD1 4.22Å; W66-I92 HydrophobicContact CH2-CG1 3.94Å; W66-I92 HydrophobicContact CZ3-CB 3.62Å; W66-I92 HydrophobicContact CZ3-CD1 3.52Å; W66-I92 HydrophobicContact CZ3-CG1 3.34Å; W66-I92 WeakPolarHBondContact O-CD1 3.33Å; R67-I92 HydrophobicContact CB-CD1 4.44Å; R67-I92 HydrophobicContact CG-CD1 4Å; W90-I92 HydrophobicContact CZ2-CB 4.31Å; W90-I92 HydrophobicContact CZ2-CG2 4.43Å; W90-I92 PolarHBondContact NE1-O 3.45Å; W90-I92 VanDerWaalsContact NE1-O 3.12Å; I92-L94 HydrophobicContact CG2-CD2 4.29Å
93	S	72.4	Confident	82	Confident	63 Å²	63	59.4 Å²	59.4	44%	0.441	29%	0.292	S	S	.	.			trans	-69.1	126.3	162.7	-169	0	0	0	0	109.6	F115 G116	S93-F115 CarbonylContact C-O 3.58Å; S93-F115 WeakPolarHBondContact CA-O 3.42Å; S93-G116 WeakPolarHBondContact OG-CA 3.48Å
94	L	73.6	Confident	82.1	Confident	3 Å²	3	59.1 Å²	59.1	2%	0.016	29%	0.29	C	S	.	.			trans	-88.1	154.5	167.8	-65.6	-179.1	0	0	0	109.3	L73 L80 W90 I92 L99 F115 P118	L73-L94 HydrophobicContact CD1-CB 3.85Å; L73-L94 HydrophobicContact CD1-CD1 4.2Å; L73-L94 HydrophobicContact CD1-CD2 4.03Å; L73-L94 HydrophobicContact CD1-CG 4.24Å; L73-L94 HydrophobicContact CG-CD2 4.47Å; L80-L94 HydrophobicContact CD2-CD1 3.64Å; W90-L94 HydrophobicContact CH2-CD2 4.39Å; W90-L94 HydrophobicContact CZ2-CD1 4.28Å; W90-L94 HydrophobicContact CZ2-CD2 3.91Å; W90-L94 HydrophobicContact CZ2-CG 4.13Å; I92-L94 HydrophobicContact CG2-CD2 4.29Å; L94-L99 HydrophobicContact CD1-CD2 3.94Å; L94-F115 HydrophobicContact CD1-CB 4.25Å; L94-F115 HydrophobicContact CD1-CD1 3.48Å; L94-F115 VanDerWaalsContact CD1-CD1 3.48Å; L94-F115 HydrophobicContact CD1-CE1 4.15Å; L94-F115 HydrophobicContact CD1-CG 4.14Å; L94-F115 HydrophobicContact CG-CB 4.38Å; L94-F115 HydrophobicContact CG-CD1 4.01Å; L94-F115 PolarHBondContact N-O 3.31Å; L94-P118 HydrophobicContact CB-CG 3.94Å; L94-P118 WeakPolarHBondContact O-CD 3.4Å; L94-P118 VanDerWaalsContact O-CG 3.28Å; L94-P118 WeakPolarHBondContact O-CG 3.42Å
95	E	67.5	Low	82.2	Confident	144 Å²	144	57 Å²	57	67%	0.673	28%	0.281	S	S	*	.			trans	-122.2	86.6	174.9	-70.6	177.4	-173.4	0	0	108.2
96	S	70.4	Confident	82.7	Confident	8 Å²	8	61.7 Å²	61.7	6%	0.056	30%	0.299	C	S	.	.			trans	-151.7	116	171	173.6	0	0	0	0	109.9	T77 M98 P118	T77-S96 PolarHBondContact O-OG 3.49Å; S96-M98 PolarHBondContact O-N 2.99Å; S96-M98 PolarHBondContact OG-N 3.03Å; S96-P118 WeakPolarHBondContact O-CB 3.35Å
97	Q	71.8	Confident	82.9	Confident	169 Å²	169	53.5 Å²	53.5	79%	0.79	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-13.8	178.4	-66.5	-177.7	-10	0	0	112.9	N121	Q97-N121 PolarHBondContact O-ND2 3.42Å
98	M	80.4	Confident	83.3	Confident	97 Å²	97	57.1 Å²	57.1	48%	0.478	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-4.5	-175.6	-62.6	-62.8	-75.5	0	0	114.2	P75 T77 A78 S96 Q100	P75-M98 WeakPolarHBondContact O-CB 3.49Å; P75-M98 VanDerWaalsContact O-CG 3.23Å; P75-M98 WeakPolarHBondContact O-CG 3.5Å; T77-M98 CarbonylContact O-C 3.55Å; A78-M98 VanDerWaalsContact CA-O 3.27Å; A78-M98 WeakPolarHBondContact CA-O 3.28Å; A78-M98 VanDerWaalsContact CB-O 3.32Å; A78-M98 WeakPolarHBondContact CB-O 3.35Å; S96-M98 PolarHBondContact O-N 2.99Å; S96-M98 PolarHBondContact OG-N 3.03Å; M98-Q100 PolarHBondContact O-N 3.07Å
99	L	86.8	Confident	83.7	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.266	C	S	.	.			trans	-68.8	117.6	-171.2	-172.1	61.1	0	0	0	112.7	T77 L80 L94 V102 N121 I122	T77-L99 WeakPolarHBondContact O-CA 3.09Å; T77-L99 PolarHBondContact O-N 3.23Å; L80-L99 HydrophobicContact CB-CD1 3.76Å; L80-L99 HydrophobicContact CD2-CD2 4.49Å; L94-L99 HydrophobicContact CD1-CD2 3.94Å; L99-V102 HydrophobicContact CD1-CG2 4.13Å; L99-V102 HydrophobicContact CD2-CG2 3.87Å; L99-V102 HydrophobicContact CG-CG2 4.01Å; L99-N121 CarbonylContact O-C 3.18Å; L99-I122 HydrophobicContact CD2-CD1 4.25Å; L99-I122 HydrophobicContact CG-CG1 4.29Å
100	Q	91.1	Very high	84.4	Confident	96 Å²	96	54.5 Å²	54.5	45%	0.449	27%	0.269	S	S	.	.			trans	-120.3	-34.9	-175.8	-70.5	175.9	25.4	0	0	113.7	A78 M98 I122 T123 L124	A78-Q100 PolarHBondContact O-N 3.29Å; M98-Q100 PolarHBondContact O-N 3.07Å; Q100-I122 CarbonylContact O-C 3.34Å; Q100-I122 WeakPolarHBondContact O-CA 3.36Å; Q100-T123 PolarHBondContact O-N 2.03Å; Q100-T123 PolarHBondContact O-OG1 2.89Å; Q100-L124 PolarHBondContact O-N 3.14Å; Q100-L124 VanDerWaalsContact O-N 3.1Å
101	E	94.1	Very high	85	Confident	56 Å²	56	58.3 Å²	58.3	26%	0.262	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	132.9	176.9	-59.1	-170.5	-166.9	0	0	111.4	A78 I79 L80 K103 L124	A78-E101 PolarHBondContact O-N 3.5Å; I79-E101 WeakPolarHBondContact CA-O 3.44Å; I79-E101 HydrophobicContact CB-CB 4.3Å; I79-E101 HydrophobicContact CG1-CB 4.1Å; I79-E101 HydrophobicContact CG1-CG 4.15Å; I79-E101 HydrophobicContact CG2-CB 4Å; L80-E101 PolarHBondContact N-O 3.09Å; E101-K103 WeakPolarHBondContact OE2-CE 3.28Å; E101-K103 IonicContact OE2-NZ 3.93Å; E101-K103 PolarHBondContact OE2-NZ 3.4Å; E101-L124 WeakPolarHBondContact CA-O 3.43Å; E101-L124 HydrophobicContact CB-CB 4.45Å; E101-L124 HydrophobicContact CB-CD2 4.38Å; E101-L124 HydrophobicContact CG-CB 4.12Å
102	V	93.1	Very high	86.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	130.6	170	-173.3	0	0	0	0	111.4	L80 L99 M104 F115 I122 L124 L125 S126	L80-V102 HydrophobicContact CB-CG2 4.46Å; L80-V102 HydrophobicContact CD2-CG1 4.47Å; L80-V102 WeakPolarHBondContact O-CA 3.19Å; L99-V102 HydrophobicContact CD1-CG2 4.13Å; L99-V102 HydrophobicContact CD2-CG2 3.87Å; L99-V102 HydrophobicContact CG-CG2 4.01Å; V102-M104 HydrophobicContact CG1-CG 4.36Å; V102-F115 HydrophobicContact CB-CE2 4.44Å; V102-F115 HydrophobicContact CB-CZ 4.45Å; V102-F115 HydrophobicContact CG1-CE1 4.28Å; V102-F115 HydrophobicContact CG1-CE2 4.11Å; V102-F115 HydrophobicContact CG1-CZ 3.65Å; V102-F115 HydrophobicContact CG2-CE2 4.43Å; V102-I122 HydrophobicContact CG2-CD1 3.7Å; V102-I122 HydrophobicContact CG2-CG1 4.24Å; V102-I122 HydrophobicContact CG2-CG2 4.5Å; V102-L124 PolarHBondContact N-O 3.18Å; V102-L125 HydrophobicContact CB-CD1 4.08Å; V102-L125 HydrophobicContact CG1-CD1 4.42Å; V102-S126 PolarHBondContact O-N 3.42Å
103	K	95.3	Very high	87.2	Confident	53 Å²	53	52.1 Å²	52.1	23%	0.23	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120	-179.6	-66.4	157.7	-170.2	162.5	0	109.5	L80 D81 L82 E101	L80-K103 PolarHBondContact O-N 3.24Å; D81-K103 HydrophobicContact CB-CB 4.42Å; L82-K103 PolarHBondContact N-O 2.93Å; E101-K103 WeakPolarHBondContact OE2-CE 3.28Å; E101-K103 IonicContact OE2-NZ 3.93Å; E101-K103 PolarHBondContact OE2-NZ 3.4Å
104	M	94.3	Very high	87.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.251	C	S	.	.			trans	-126.4	36.8	176.4	-68.6	178.3	154.1	0	0	110.8	L82 W90 V102 N107 L109 P113 F115 S126 L127 N130	L82-M104 HydrophobicContact CB-CG 4.05Å; L82-M104 HydrophobicContact CD1-CE 3.57Å; L82-M104 HydrophobicContact CD1-CG 4.38Å; W90-M104 HydrophobicContact CD2-CE 3.58Å; W90-M104 HydrophobicContact CE3-CE 3.36Å; W90-M104 HydrophobicContact CG-CE 4.12Å; W90-M104 HydrophobicContact CH2-CE 4.27Å; W90-M104 HydrophobicContact CZ2-CE 4.46Å; W90-M104 HydrophobicContact CZ3-CE 3.73Å; V102-M104 HydrophobicContact CG1-CG 4.36Å; M104-N107 PolarHBondContact O-ND2 3.06Å; M104-L109 HydrophobicContact CB-CD1 3.95Å; M104-L109 HydrophobicContact SD-CD1 3.8Å; M104-P113 HydrophobicContact SD-CB 4.16Å; M104-P113 HydrophobicContact SD-CG 3.83Å; M104-F115 HydrophobicContact CE-CE1 3.45Å; M104-F115 VanDerWaalsContact CE-CE1 3.45Å; M104-F115 HydrophobicContact CE-CZ 3.55Å; M104-F115 HydrophobicContact SD-CE1 4.4Å; M104-F115 HydrophobicContact SD-CZ 3.9Å; M104-S126 PolarHBondContact N-O 2.98Å; M104-L127 HydrophobicContact CB-CD2 4.01Å; M104-L127 HydrophobicContact SD-CD2 4.34Å; M104-N130 PolarHBondContact O-ND2 3.01Å
105	N	96.3	Very high	88.2	Confident	25 Å²	25	53.3 Å²	53.3	13%	0.134	25%	0.25	C	C	.	.			trans	-69.7	149.7	-172.6	-60.3	-32.8	0	0	0	111.2	S83 H84 N107 S126 L127 V128	S83-N105 CarbonylContact C-O 3.33Å; S83-N105 WeakPolarHBondContact CA-O 3.23Å; S83-N105 WeakPolarHBondContact CB-O 3.32Å; S83-N105 PolarHBondContact OG-N 3Å; S83-N105 VanDerWaalsContact OG-N 3.09Å; H84-N105 PolarHBondContact N-O 3.01Å; N105-N107 PolarHBondContact O-ND2 2.96Å; N105-S126 PolarHBondContact ND2-OG 3.17Å; N105-S126 PolarHBondContact OD1-O 3.1Å; N105-S126 VanDerWaalsContact OD1-O 3.09Å; N105-S126 PolarHBondContact OD1-OG 3.42Å; N105-L127 PolarHBondContact OD1-N 3.17Å; N105-V128 CarbonylContact C-O 3.48Å; N105-V128 WeakPolarHBondContact CA-O 3.14Å; N105-V128 HydrophobicContact CB-CB 4.11Å; N105-V128 VanDerWaalsContact OD1-CB 3.3Å; N105-V128 WeakPolarHBondContact OD1-CB 3.3Å; N105-V128 WeakPolarHBondContact OD1-CG2 3.22Å; N105-V128 PolarHBondContact OD1-N 3.29Å
106	Y	95.7	Very high	88.5	Confident	110 Å²	110	46.7 Å²	46.7	43%	0.431	22%	0.22	S	C	.	.	S	Bend	trans	54.6	63.3	-178.5	-55	-88.2	0	0	0	112.3	H84 N85 V128 H129	H84-Y106 WeakPolarHBondContact CA-O 3.45Å; H84-Y106 AromaticContact CE1-CD2 3.28Å; H84-Y106 WeakPolarHBondContact CE1-CD2 3.44Å; H84-Y106 AromaticContact CE1-CE2 3.73Å; H84-Y106 AromaticContact CE1-CG 3.6Å; H84-Y106 PolarHBondContact N-O 2.93Å; H84-Y106 WeakPolarHBondContact ND1-CB 3.4Å; H84-Y106 AromaticContact ND1-CD2 3.57Å; H84-Y106 AromaticContact ND1-CG 3.48Å; H84-Y106 AromaticContact NE2-CD2 3.94Å; N85-Y106 PolarHBondContact N-O 2.93Å; Y106-V128 PolarHBondContact N-O 3.23Å; Y106-H129 VanDerWaalsContact CA-O 3.27Å; Y106-H129 WeakPolarHBondContact CA-O 3.46Å; Y106-H129 HydrophobicContact CD1-CB 3.67Å; Y106-H129 AromaticContact CD1-CD2 3.52Å; Y106-H129 AromaticContact CD1-CG 3.6Å; Y106-H129 HydrophobicContact CE1-CB 3.8Å; Y106-H129 AromaticContact CE1-CD2 3.94Å; Y106-H129 AromaticContact CE1-CG 3.67Å; Y106-H129 HydrophobicContact CG-CB 4.13Å; Y106-H129 PolarHBondContact N-O 3.23Å
107	N	92.5	Very high	88.4	Confident	12 Å²	12	54.6 Å²	54.6	6%	0.064	26%	0.256	C	S	.	.	S	Bend	trans	-133	-170.1	175.6	-86.3	-70.6	0	0	0	109.2	L82 N85 R86 L87 M104 N105 L109 H129 N130	L82-N107 PolarHBondContact O-ND2 3.12Å; L82-N107 VanDerWaalsContact O-ND2 3.09Å; N85-N107 VanDerWaalsContact CA-OD1 3.31Å; N85-N107 WeakPolarHBondContact CA-OD1 3.35Å; N85-N107 VanDerWaalsContact CB-OD1 3.25Å; N85-N107 WeakPolarHBondContact CB-OD1 3.17Å; N85-N107 PolarHBondContact N-OD1 2.84Å; N85-N107 PolarHBondContact O-OD1 3.17Å; R86-N107 PolarHBondContact N-OD1 2.95Å; L87-N107 HydrophobicContact CB-CB 4.29Å; L87-N107 WeakPolarHBondContact CB-OD1 3.44Å; L87-N107 WeakPolarHBondContact CG-OD1 3.43Å; L87-N107 PolarHBondContact N-OD1 2.83Å; M104-N107 PolarHBondContact O-ND2 3.06Å; N105-N107 PolarHBondContact O-ND2 2.96Å; N107-L109 HydrophobicContact CB-CG 4.31Å; N107-H129 PolarHBondContact N-O 2.93Å; N107-N130 WeakPolarHBondContact CA-OD1 3.39Å; N107-N130 WeakPolarHBondContact CB-OD1 3.34Å; N107-N130 PolarHBondContact O-OD1 3.35Å
108	E	93.2	Very high	88	Confident	84 Å²	84	46.9 Å²	46.9	39%	0.393	22%	0.221	S	C	.	.			trans	-114.8	23.8	-175.4	-63.9	174.6	-156.9	0	0	111.2	R86 L87 S88 T110 N130 I131	R86-E108 WeakPolarHBondContact CB-OE1 3.41Å; R86-E108 VanDerWaalsContact CD-OE1 3.3Å; R86-E108 WeakPolarHBondContact CD-OE1 3.47Å; R86-E108 VanDerWaalsContact CG-OE1 3.22Å; R86-E108 WeakPolarHBondContact CG-OE1 3.44Å; R86-E108 IonicContact NE-OE1 2.66Å; L87-E108 CarbonylContact O-C 3.59Å; L87-E108 WeakPolarHBondContact O-CA 3.11Å; L87-E108 PolarHBondContact O-N 3.34Å; S88-E108 WeakPolarHBondContact CA-O 3.17Å; E108-T110 PolarHBondContact O-N 2.7Å; E108-N130 PolarHBondContact N-OD1 3.26Å; E108-I131 WeakPolarHBondContact O-CD1 3.33Å; E108-I131 VanDerWaalsContact O-CG1 3.28Å; E108-I131 WeakPolarHBondContact O-CG1 3.04Å
109	L	92.7	Very high	87.4	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	20%	0.2	C	C	.	.			trans	-66.7	129.2	-172.5	-63.8	170.7	0	0	0	111.6	L87 M104 N107 L127 N130 I131 I132	L87-L109 HydrophobicContact CB-CD2 4.11Å; L87-L109 WeakPolarHBondContact O-CD2 3.24Å; L87-L109 WeakPolarHBondContact O-CG 3.42Å; L87-L109 PolarHBondContact O-N 3.21Å; M104-L109 HydrophobicContact CB-CD1 3.95Å; M104-L109 HydrophobicContact SD-CD1 3.8Å; N107-L109 HydrophobicContact CB-CG 4.31Å; L109-L127 HydrophobicContact CD1-CD2 4.23Å; L109-N130 HydrophobicContact CB-CB 4.16Å; L109-N130 VanDerWaalsContact CB-OD1 3.28Å; L109-N130 WeakPolarHBondContact CB-OD1 3.34Å; L109-N130 WeakPolarHBondContact CG-OD1 3.21Å; L109-N130 PolarHBondContact N-OD1 2.99Å; L109-I131 CarbonylContact O-C 3.52Å; L109-I131 WeakPolarHBondContact O-CA 3.36Å; L109-I131 VanDerWaalsContact O-CG1 3.28Å; L109-I131 WeakPolarHBondContact O-CG1 3.26Å; L109-I131 PolarHBondContact O-N 2.82Å; L109-I132 WeakPolarHBondContact O-CG1 3.28Å; L109-I132 PolarHBondContact O-N 3.39Å
110	T	93.3	Very high	86.9	Confident	71 Å²	71	45.1 Å²	45.1	44%	0.436	22%	0.217	S	C	.	.	S	Bend	trans	-91.5	-14.2	175.4	54.3	0	0	0	0	113.8	S88 E108 I131 P133	S88-T110 PolarHBondContact O-N 3.15Å; E108-T110 PolarHBondContact O-N 2.7Å; T110-I131 HydrophobicContact CG2-CD1 3.78Å; T110-I131 HydrophobicContact CG2-CG1 3.94Å; T110-P133 WeakPolarHBondContact O-CD 3.3Å
111	E	93	Very high	86.7	Confident	88 Å²	88	44 Å²	44	41%	0.411	22%	0.215	S	C	.	.	S	Bend	trans	-141.8	163.3	-175.1	65.9	-168.2	162.5	0	0	111.4	N89	N89-E111 PolarHBondContact ND2-OE1 3.15Å
112	I	92.9	Very high	86.6	Confident	12 Å²	12	41.4 Å²	41.4	6%	0.062	20%	0.202	C	C	.	.			trans	-72	124.9	171.6	-62.7	175	0	0	0	107.4	L125 L127 I132 I135 A139 L140 Y143 L151	I112-L125 HydrophobicContact CG2-CD2 4.26Å; I112-L127 HydrophobicContact CB-CD1 4.49Å; I112-L127 HydrophobicContact CG1-CD1 4.21Å; I112-L127 HydrophobicContact CG2-CD1 4.23Å; I112-I132 HydrophobicContact CG1-CD1 4.35Å; I112-I135 HydrophobicContact CD1-CG2 4.18Å; I112-A139 HydrophobicContact CB-CB 3.86Å; I112-A139 HydrophobicContact CG2-CB 4.08Å; I112-L140 HydrophobicContact CD1-CD1 4.49Å; I112-L140 HydrophobicContact CD1-CD2 3.98Å; I112-L140 HydrophobicContact CD1-CG 4.02Å; I112-L140 HydrophobicContact CG2-CD2 4.4Å; I112-Y143 HydrophobicContact CG2-CE2 4.47Å; I112-L151 HydrophobicContact CD1-CD1 4.5Å; I112-L151 HydrophobicContact CG1-CD2 4.45Å
113	P	90.3	Very high	86.6	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	21%	0.214	C	C	.	.			trans	-66.3	163.5	-174.4	29.8	-38.3	0	0	0	112.3	W90 M104 F115 L127 Y143	W90-P113 HydrophobicContact CB-CB 3.79Å; W90-P113 HydrophobicContact CG-CB 3.92Å; M104-P113 HydrophobicContact SD-CB 4.16Å; M104-P113 HydrophobicContact SD-CG 3.83Å; P113-F115 HydrophobicContact CB-CE1 4.44Å; P113-F115 HydrophobicContact CB-CE2 4.2Å; P113-F115 HydrophobicContact CB-CZ 3.91Å; P113-F115 HydrophobicContact CG-CE2 3.83Å; P113-F115 HydrophobicContact CG-CZ 3.72Å; P113-L127 HydrophobicContact CG-CD2 4.06Å; P113-Y143 PolarHBondContact O-OH 3.07Å
114	Y	86.7	Confident	86.7	Confident	92 Å²	92	42.9 Å²	42.9	36%	0.361	21%	0.214	S	C	.	.	B	Isolated β-bridge	trans	-126.4	130.8	168.4	174.8	-121	0	0	0	111.2	W90 G116 T119 F142	W90-Y114 PolarHBondContact NE1-O 3.14Å; Y114-G116 WeakPolarHBondContact CE2-O 3.34Å; Y114-G116 VanDerWaalsContact CZ-CA 3.42Å; Y114-G116 WeakPolarHBondContact OH-CA 3.28Å; Y114-T119 HydrophobicContact CD2-CG2 4.03Å; Y114-T119 HydrophobicContact CE2-CG2 4.1Å; Y114-F142 HydrophobicContact CD2-CB 3.77Å; Y114-F142 HydrophobicContact CD2-CD1 4.05Å; Y114-F142 AromaticContact CD2-CD2 3.57Å; Y114-F142 HydrophobicContact CD2-CD2 3.57Å; Y114-F142 HydrophobicContact CD2-CE2 4.15Å; Y114-F142 AromaticContact CD2-CG 3.52Å; Y114-F142 HydrophobicContact CD2-CG 3.52Å; Y114-F142 HydrophobicContact CE2-CB 3.75Å; Y114-F142 AromaticContact CE2-CD1 3.51Å; Y114-F142 HydrophobicContact CE2-CD1 3.51Å; Y114-F142 AromaticContact CE2-CD2 3.94Å; Y114-F142 HydrophobicContact CE2-CD2 3.94Å; Y114-F142 HydrophobicContact CE2-CE1 4.06Å; Y114-F142 HydrophobicContact CE2-CE2 4.43Å; Y114-F142 AromaticContact CE2-CG 3.46Å; Y114-F142 HydrophobicContact CE2-CG 3.46Å; Y114-F142 VanDerWaalsContact CE2-CG 3.46Å; Y114-F142 HydrophobicContact CE2-CZ 4.49Å; Y114-F142 HydrophobicContact CG-CD2 4.22Å; Y114-F142 HydrophobicContact CG-CE2 4.45Å
115	F	79.9	Confident	86.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.214	C	C	.	.			trans	-107.8	9.7	-173	-58.5	-73.9	0	0	0	115.1	W90 S93 L94 V102 M104 P113 P118 T119 I122 L125 Y143	W90-F115 HydrophobicContact CD2-CE1 4.12Å; W90-F115 AromaticContact CE2-CD1 3.64Å; W90-F115 AromaticContact CE2-CE1 3.54Å; W90-F115 HydrophobicContact CG-CE1 4.43Å; W90-F115 AromaticContact CZ2-CD1 3.83Å; W90-F115 HydrophobicContact CZ2-CD1 3.83Å; W90-F115 AromaticContact CZ2-CE1 3.81Å; W90-F115 HydrophobicContact CZ2-CE1 3.81Å; W90-F115 AromaticContact NE1-CD1 3.33Å; W90-F115 VanDerWaalsContact NE1-CD1 3.33Å; W90-F115 AromaticContact NE1-CE1 3.55Å; S93-F115 CarbonylContact C-O 3.58Å; S93-F115 WeakPolarHBondContact CA-O 3.42Å; L94-F115 HydrophobicContact CD1-CB 4.25Å; L94-F115 HydrophobicContact CD1-CD1 3.48Å; L94-F115 VanDerWaalsContact CD1-CD1 3.48Å; L94-F115 HydrophobicContact CD1-CE1 4.15Å; L94-F115 HydrophobicContact CD1-CG 4.14Å; L94-F115 HydrophobicContact CG-CB 4.38Å; L94-F115 HydrophobicContact CG-CD1 4.01Å; L94-F115 PolarHBondContact N-O 3.31Å; V102-F115 HydrophobicContact CB-CE2 4.44Å; V102-F115 HydrophobicContact CB-CZ 4.45Å; V102-F115 HydrophobicContact CG1-CE1 4.28Å; V102-F115 HydrophobicContact CG1-CE2 4.11Å; V102-F115 HydrophobicContact CG1-CZ 3.65Å; V102-F115 HydrophobicContact CG2-CE2 4.43Å; M104-F115 HydrophobicContact CE-CE1 3.45Å; M104-F115 VanDerWaalsContact CE-CE1 3.45Å; M104-F115 HydrophobicContact CE-CZ 3.55Å; M104-F115 HydrophobicContact SD-CE1 4.4Å; M104-F115 HydrophobicContact SD-CZ 3.9Å; P113-F115 HydrophobicContact CB-CE1 4.44Å; P113-F115 HydrophobicContact CB-CE2 4.2Å; P113-F115 HydrophobicContact CB-CZ 3.91Å; P113-F115 HydrophobicContact CG-CE2 3.83Å; P113-F115 HydrophobicContact CG-CZ 3.72Å; F115-P118 WeakPolarHBondContact O-CD 3.43Å; F115-P118 WeakPolarHBondContact O-CG 3.36Å; F115-T119 HydrophobicContact CB-CG2 3.71Å; F115-T119 HydrophobicContact CD2-CG2 4.18Å; F115-T119 HydrophobicContact CG-CG2 4.45Å; F115-I122 HydrophobicContact CD2-CD1 3.79Å; F115-I122 HydrophobicContact CE2-CD1 4.37Å; F115-I122 HydrophobicContact CG-CD1 4.45Å; F115-L125 HydrophobicContact CE2-CD1 4.18Å; F115-Y143 AromaticContact CD2-CE1 3.9Å; F115-Y143 HydrophobicContact CD2-CE1 3.9Å; F115-Y143 AromaticContact CD2-CZ 3.93Å; F115-Y143 WeakPolarHBondContact CD2-OH 3.47Å; F115-Y143 HydrophobicContact CE2-CE1 4.2Å; F115-Y143 WeakPolarHBondContact CE2-OH 3.08Å
116	G	75.4	Confident	86.9	Confident	4 Å²	4	42.4 Å²	42.4	4%	0.041	21%	0.213	C	C	.	.	S	Bend	trans	81.1	-149.1	-176.2	0	0	0	0	0	113.2	S93 Y114 T119	S93-G116 WeakPolarHBondContact OG-CA 3.48Å; Y114-G116 WeakPolarHBondContact CE2-O 3.34Å; Y114-G116 VanDerWaalsContact CZ-CA 3.42Å; Y114-G116 WeakPolarHBondContact OH-CA 3.28Å; G116-T119 WeakPolarHBondContact O-CG2 3.4Å; G116-T119 PolarHBondContact O-N 3.34Å; G116-T119 PolarHBondContact O-OG1 3.27Å; G116-T119 VanDerWaalsContact O-OG1 3.07Å
117	E	67.6	Low	87	Confident	174 Å²	174	37.1 Å²	37.1	81%	0.813	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-60.1	-32.1	-179.9	-62.5	-164.3	153.4	0	0	117.2	T119 S120	E117-T119 PolarHBondContact O-N 3.37Å; E117-T119 VanDerWaalsContact O-N 3.15Å; E117-S120 PolarHBondContact O-N 3.4Å; E117-S120 PolarHBondContact O-OG 2.85Å
118	P	64.1	Low	87.2	Confident	8 Å²	8	37.6 Å²	37.6	5%	0.052	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-73.1	-3.3	-177.4	31	-38.9	0	0	0	114.6	L94 S96 F115 S120 N121	L94-P118 HydrophobicContact CB-CG 3.94Å; L94-P118 WeakPolarHBondContact O-CD 3.4Å; L94-P118 VanDerWaalsContact O-CG 3.28Å; L94-P118 WeakPolarHBondContact O-CG 3.42Å; S96-P118 WeakPolarHBondContact O-CB 3.35Å; F115-P118 WeakPolarHBondContact O-CD 3.43Å; F115-P118 WeakPolarHBondContact O-CG 3.36Å; P118-S120 PolarHBondContact O-N 3.47Å; P118-S120 VanDerWaalsContact O-N 3.14Å; P118-N121 PolarHBondContact O-N 3.22Å; P118-N121 VanDerWaalsContact O-N 3.15Å
119	T	67.8	Low	87.4	Confident	7 Å²	7	38 Å²	38	4%	0.043	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-61.1	-20.4	173.3	58.1	0	0	0	0	112.9	Y114 F115 G116 E117 N121 I122 F142 Y143	Y114-T119 HydrophobicContact CD2-CG2 4.03Å; Y114-T119 HydrophobicContact CE2-CG2 4.1Å; F115-T119 HydrophobicContact CB-CG2 3.71Å; F115-T119 HydrophobicContact CD2-CG2 4.18Å; F115-T119 HydrophobicContact CG-CG2 4.45Å; G116-T119 WeakPolarHBondContact O-CG2 3.4Å; G116-T119 PolarHBondContact O-N 3.34Å; G116-T119 PolarHBondContact O-OG1 3.27Å; G116-T119 VanDerWaalsContact O-OG1 3.07Å; E117-T119 PolarHBondContact O-N 3.37Å; E117-T119 VanDerWaalsContact O-N 3.15Å; T119-N121 PolarHBondContact O-N 2.67Å; T119-I122 PolarHBondContact O-N 3.38Å; T119-F142 CarbonylContact C-O 3.59Å; T119-F142 WeakPolarHBondContact CB-O 3.19Å; T119-F142 PolarHBondContact OG1-O 2.8Å; T119-Y143 HydrophobicContact CG2-CD1 4.19Å; T119-Y143 HydrophobicContact CG2-CE1 3.77Å; T119-Y143 HydrophobicContact CG2-CE2 4.46Å
120	S	76.4	Confident	87.6	Confident	53 Å²	53	38.3 Å²	38.3	37%	0.371	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-55.6	-31.8	172.2	50.3	0	0	0	0	114.4	E117 P118 A145	E117-S120 PolarHBondContact O-N 3.4Å; E117-S120 PolarHBondContact O-OG 2.85Å; P118-S120 PolarHBondContact O-N 3.47Å; P118-S120 VanDerWaalsContact O-N 3.14Å; S120-A145 WeakPolarHBondContact O-CB 3.11Å
121	N	85.9	Confident	87.8	Confident	74 Å²	74	38.6 Å²	38.6	40%	0.396	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-105.4	-6.6	-173.8	-68.9	-8.1	0	0	0	114	Q97 L99 P118 T119 T123	Q97-N121 PolarHBondContact O-ND2 3.42Å; L99-N121 CarbonylContact O-C 3.18Å; P118-N121 PolarHBondContact O-N 3.22Å; P118-N121 VanDerWaalsContact O-N 3.15Å; T119-N121 PolarHBondContact O-N 2.67Å; N121-T123 PolarHBondContact O-N 2.88Å
122	I	91.4	Very high	87.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.			trans	-72.6	115.5	-179.3	-64.1	174	0	0	0	109.9	L99 Q100 V102 F115 T119 L124 Y143 A145 L146	L99-I122 HydrophobicContact CD2-CD1 4.25Å; L99-I122 HydrophobicContact CG-CG1 4.29Å; Q100-I122 CarbonylContact O-C 3.34Å; Q100-I122 WeakPolarHBondContact O-CA 3.36Å; V102-I122 HydrophobicContact CG2-CD1 3.7Å; V102-I122 HydrophobicContact CG2-CG1 4.24Å; V102-I122 HydrophobicContact CG2-CG2 4.5Å; F115-I122 HydrophobicContact CD2-CD1 3.79Å; F115-I122 HydrophobicContact CE2-CD1 4.37Å; F115-I122 HydrophobicContact CG-CD1 4.45Å; T119-I122 PolarHBondContact O-N 3.38Å; I122-L124 WeakPolarHBondContact CG2-O 3.21Å; I122-Y143 HydrophobicContact CB-CD1 4.12Å; I122-Y143 HydrophobicContact CB-CE1 4.48Å; I122-Y143 HydrophobicContact CD1-CD1 4.36Å; I122-Y143 HydrophobicContact CD1-CE1 3.94Å; I122-Y143 HydrophobicContact CG2-CD1 4.18Å; I122-Y143 HydrophobicContact CG2-CE1 4.38Å; I122-A145 CarbonylContact O-C 3.2Å; I122-L146 HydrophobicContact CG2-CD1 4.26Å; I122-L146 WeakPolarHBondContact O-CA 3.1Å; I122-L146 PolarHBondContact O-N 3.03Å
123	T	94.8	Very high	88	Confident	41 Å²	41	36.8 Å²	36.8	25%	0.252	19%	0.193	S	C	.	.			trans	-99.2	-21	178.2	63.6	0	0	0	0	113.1	Q100 N121 A145 Q147 S148	Q100-T123 PolarHBondContact O-N 2.03Å; Q100-T123 PolarHBondContact O-OG1 2.89Å; N121-T123 PolarHBondContact O-N 2.88Å; T123-A145 HydrophobicContact CG2-CB 4.46Å; T123-Q147 PolarHBondContact O-N 3.43Å; T123-S148 PolarHBondContact O-N 3.21Å
124	L	96.8	Very high	88.3	Confident	43 Å²	43	41 Å²	41	23%	0.225	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	126.5	177.4	-175.8	152	0	0	0	111.6	Q100 E101 V102 I122 S148	Q100-L124 PolarHBondContact O-N 3.14Å; Q100-L124 VanDerWaalsContact O-N 3.1Å; E101-L124 WeakPolarHBondContact CA-O 3.43Å; E101-L124 HydrophobicContact CB-CB 4.45Å; E101-L124 HydrophobicContact CB-CD2 4.38Å; E101-L124 HydrophobicContact CG-CB 4.12Å; V102-L124 PolarHBondContact N-O 3.18Å; I122-L124 WeakPolarHBondContact CG2-O 3.21Å; L124-S148 WeakPolarHBondContact CA-O 3.41Å
125	L	96.5	Very high	88.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	121.4	174.4	-176.1	59.7	0	0	0	110.3	V102 I112 F115 L127 Y143 L146 S148 L149 D150	V102-L125 HydrophobicContact CB-CD1 4.08Å; V102-L125 HydrophobicContact CG1-CD1 4.42Å; I112-L125 HydrophobicContact CG2-CD2 4.26Å; F115-L125 HydrophobicContact CE2-CD1 4.18Å; L125-L127 HydrophobicContact CD1-CD2 4.03Å; L125-L127 HydrophobicContact CD1-CG 4.34Å; L125-L127 HydrophobicContact CD2-CD1 4.11Å; L125-L127 HydrophobicContact CG-CD1 4.19Å; L125-L127 HydrophobicContact CG-CD2 4.29Å; L125-L127 HydrophobicContact CG-CG 4.05Å; L125-Y143 HydrophobicContact CD2-CE1 4.02Å; L125-Y143 HydrophobicContact CD2-CE2 4.4Å; L125-L146 HydrophobicContact CB-CD1 3.74Å; L125-S148 PolarHBondContact N-O 3Å; L125-L149 HydrophobicContact CB-CD1 4.21Å; L125-L149 HydrophobicContact CD2-CD1 4.25Å; L125-L149 HydrophobicContact CG-CD1 4.32Å; L125-L149 WeakPolarHBondContact O-CA 3.39Å; L125-D150 PolarHBondContact O-N 3.43Å
126	S	97.9	Very high	89.2	Confident	15 Å²	15	40.3 Å²	40.3	11%	0.105	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	115	-177.2	-161.4	0	0	0	0	110	V102 M104 N105	V102-S126 PolarHBondContact O-N 3.42Å; M104-S126 PolarHBondContact N-O 2.98Å; N105-S126 PolarHBondContact ND2-OG 3.17Å; N105-S126 PolarHBondContact OD1-O 3.1Å; N105-S126 VanDerWaalsContact OD1-O 3.09Å; N105-S126 PolarHBondContact OD1-OG 3.42Å
127	L	97.4	Very high	90	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.221	C	C	.	.			trans	-124.8	28.2	-174.2	-56.8	176.3	0	0	0	111.2	M104 N105 L109 I112 P113 L125 N130 I132 D150 L151 N154	M104-L127 HydrophobicContact CB-CD2 4.01Å; M104-L127 HydrophobicContact SD-CD2 4.34Å; N105-L127 PolarHBondContact OD1-N 3.17Å; L109-L127 HydrophobicContact CD1-CD2 4.23Å; I112-L127 HydrophobicContact CB-CD1 4.49Å; I112-L127 HydrophobicContact CG1-CD1 4.21Å; I112-L127 HydrophobicContact CG2-CD1 4.23Å; P113-L127 HydrophobicContact CG-CD2 4.06Å; L125-L127 HydrophobicContact CD1-CD2 4.03Å; L125-L127 HydrophobicContact CD1-CG 4.34Å; L125-L127 HydrophobicContact CD2-CD1 4.11Å; L125-L127 HydrophobicContact CG-CD1 4.19Å; L125-L127 HydrophobicContact CG-CD2 4.29Å; L125-L127 HydrophobicContact CG-CG 4.05Å; L127-N130 PolarHBondContact O-ND2 3.3Å; L127-I132 HydrophobicContact CB-CD1 4.22Å; L127-I132 HydrophobicContact CD1-CD1 3.93Å; L127-D150 PolarHBondContact N-O 3.39Å; L127-L151 HydrophobicContact CB-CD2 4.13Å; L127-L151 HydrophobicContact CD1-CD2 3.87Å; L127-N154 PolarHBondContact O-ND2 2.97Å
128	V	97.9	Very high	91.1	Very high	21 Å²	21	39.3 Å²	39.3	13%	0.127	21%	0.213	C	C	.	.			trans	-60.2	135.2	-174.1	-178.8	0	0	0	0	110.4	N105 Y106 D150 S152	N105-V128 CarbonylContact C-O 3.48Å; N105-V128 WeakPolarHBondContact CA-O 3.14Å; N105-V128 HydrophobicContact CB-CB 4.11Å; N105-V128 VanDerWaalsContact OD1-CB 3.3Å; N105-V128 WeakPolarHBondContact OD1-CB 3.3Å; N105-V128 WeakPolarHBondContact OD1-CG2 3.22Å; N105-V128 PolarHBondContact OD1-N 3.29Å; Y106-V128 PolarHBondContact N-O 3.23Å; V128-D150 HydrophobicContact CG2-CB 3.98Å; V128-D150 VanDerWaalsContact CG2-CG 3.45Å; V128-D150 WeakPolarHBondContact CG2-OD1 3.44Å; V128-S152 CarbonylContact C-O 3.52Å; V128-S152 VanDerWaalsContact CA-O 3.27Å; V128-S152 WeakPolarHBondContact CA-O 3.5Å
129	H	97.6	Very high	92.3	Very high	94 Å²	94	39.6 Å²	39.6	44%	0.435	22%	0.216	S	C	.	.	S	Bend	trans	61.2	57.8	175.1	-148.7	95.2	0	0	0	112.8	Y106 N107 S152 S153	Y106-H129 VanDerWaalsContact CA-O 3.27Å; Y106-H129 WeakPolarHBondContact CA-O 3.46Å; Y106-H129 HydrophobicContact CD1-CB 3.67Å; Y106-H129 AromaticContact CD1-CD2 3.52Å; Y106-H129 AromaticContact CD1-CG 3.6Å; Y106-H129 HydrophobicContact CE1-CB 3.8Å; Y106-H129 AromaticContact CE1-CD2 3.94Å; Y106-H129 AromaticContact CE1-CG 3.67Å; Y106-H129 HydrophobicContact CG-CB 4.13Å; Y106-H129 PolarHBondContact N-O 3.23Å; N107-H129 PolarHBondContact N-O 2.93Å; H129-S152 PolarHBondContact N-O 2.81Å; H129-S153 WeakPolarHBondContact CA-O 3.25Å
130	N	96.4	Very high	93.5	Very high	6 Å²	6	39.3 Å²	39.3	3%	0.032	21%	0.214	C	C	.	.	S	Bend	trans	-120.6	-167.7	170.4	-81.6	-82.8	0	0	0	109.6	M104 N107 E108 L109 L127 I132 N154	M104-N130 PolarHBondContact O-ND2 3.01Å; N107-N130 WeakPolarHBondContact CA-OD1 3.39Å; N107-N130 WeakPolarHBondContact CB-OD1 3.34Å; N107-N130 PolarHBondContact O-OD1 3.35Å; E108-N130 PolarHBondContact N-OD1 3.26Å; L109-N130 HydrophobicContact CB-CB 4.16Å; L109-N130 VanDerWaalsContact CB-OD1 3.28Å; L109-N130 WeakPolarHBondContact CB-OD1 3.34Å; L109-N130 WeakPolarHBondContact CG-OD1 3.21Å; L109-N130 PolarHBondContact N-OD1 2.99Å; L127-N130 PolarHBondContact O-ND2 3.3Å; N130-I132 HydrophobicContact CB-CG1 4.32Å; N130-N154 WeakPolarHBondContact CA-OD1 3.07Å; N130-N154 WeakPolarHBondContact CB-OD1 3.49Å; N130-N154 PolarHBondContact O-OD1 3.08Å
131	I	96.6	Very high	94.1	Very high	78 Å²	78	42.1 Å²	42.1	40%	0.4	22%	0.221	S	C	.	.			trans	-118.7	33.9	-179.2	60.7	173.8	0	0	0	112.8	E108 L109 T110 P133 N154 I155	E108-I131 WeakPolarHBondContact O-CD1 3.33Å; E108-I131 VanDerWaalsContact O-CG1 3.28Å; E108-I131 WeakPolarHBondContact O-CG1 3.04Å; L109-I131 CarbonylContact O-C 3.52Å; L109-I131 WeakPolarHBondContact O-CA 3.36Å; L109-I131 VanDerWaalsContact O-CG1 3.28Å; L109-I131 WeakPolarHBondContact O-CG1 3.26Å; L109-I131 PolarHBondContact O-N 2.82Å; T110-I131 HydrophobicContact CG2-CD1 3.78Å; T110-I131 HydrophobicContact CG2-CG1 3.94Å; I131-P133 WeakPolarHBondContact O-CD 3.47Å; I131-N154 PolarHBondContact N-OD1 3.3Å; I131-I155 HydrophobicContact CB-CD1 4.23Å; I131-I155 WeakPolarHBondContact O-CD1 3.47Å; I131-I155 WeakPolarHBondContact O-CG1 3.05Å
132	I	96.3	Very high	94.1	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.219	C	C	.	.			trans	-69.8	125.8	178	-56.8	173.8	0	0	0	109.7	L109 I112 L127 N130 E134 L151 N154 I155 I156	L109-I132 WeakPolarHBondContact O-CG1 3.28Å; L109-I132 PolarHBondContact O-N 3.39Å; I112-I132 HydrophobicContact CG1-CD1 4.35Å; L127-I132 HydrophobicContact CB-CD1 4.22Å; L127-I132 HydrophobicContact CD1-CD1 3.93Å; N130-I132 HydrophobicContact CB-CG1 4.32Å; I132-E134 VanDerWaalsContact CG2-O 3.28Å; I132-E134 WeakPolarHBondContact CG2-O 3.49Å; I132-L151 HydrophobicContact CD1-CD2 3.78Å; I132-N154 HydrophobicContact CB-CB 4.35Å; I132-N154 WeakPolarHBondContact CB-OD1 3.49Å; I132-N154 WeakPolarHBondContact CG1-OD1 3.49Å; I132-N154 PolarHBondContact N-OD1 3.36Å; I132-I155 CarbonylContact O-C 3.59Å; I132-I155 WeakPolarHBondContact O-CG1 3.39Å; I132-I155 PolarHBondContact O-N 3.09Å; I132-I155 VanDerWaalsContact O-N 3.14Å; I132-I156 WeakPolarHBondContact O-CG1 3.45Å; I132-I156 PolarHBondContact O-N 3.43Å
133	P	95.3	Very high	94.2	Very high	61 Å²	61	42.4 Å²	42.4	40%	0.396	22%	0.219	S	C	.	.			trans	-96.1	-22.1	-174.9	36.6	-34.7	0	0	0	114.9	T110 I131 I155 I156	T110-P133 WeakPolarHBondContact O-CD 3.3Å; I131-P133 WeakPolarHBondContact O-CD 3.47Å; P133-I155 HydrophobicContact CB-CD1 4.41Å; P133-I155 HydrophobicContact CB-CG1 4.24Å; P133-I156 WeakPolarHBondContact O-CA 3.24Å
134	E	94.8	Very high	93.9	Very high	90 Å²	90	44.6 Å²	44.6	42%	0.421	23%	0.234	S	C	.	.	S	Bend	trans	-150.5	163.7	175.3	67.3	177.4	171.3	0	0	111.7	I132 K160	I132-E134 VanDerWaalsContact CG2-O 3.28Å; I132-E134 WeakPolarHBondContact CG2-O 3.49Å; E134-K160 IonicContact OE2-NZ 3.2Å; E134-K160 PolarHBondContact OE2-NZ 3Å
135	I	95.5	Very high	93.7	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	24%	0.237	C	C	.	.			trans	-96.4	112.5	176.3	-45.6	177.9	0	0	0	107.6	I112 L140 L151 I156 S163 F164 L174	I112-I135 HydrophobicContact CD1-CG2 4.18Å; I135-L140 HydrophobicContact CG2-CD1 3.63Å; I135-L151 HydrophobicContact CD1-CD1 4.24Å; I135-L151 HydrophobicContact CG1-CD1 4.2Å; I135-L151 HydrophobicContact CG2-CD1 4.37Å; I135-I156 HydrophobicContact CD1-CD1 4.42Å; I135-I156 HydrophobicContact CG1-CD1 3.95Å; I135-I156 HydrophobicContact CG1-CG2 4.39Å; I135-S163 WeakPolarHBondContact CG2-O 3.13Å; I135-S163 WeakPolarHBondContact O-CA 3.27Å; I135-S163 PolarHBondContact O-OG 3.41Å; I135-F164 HydrophobicContact CD1-CE1 4.13Å; I135-F164 HydrophobicContact CD1-CE2 4.13Å; I135-F164 HydrophobicContact CD1-CZ 3.5Å; I135-F164 VanDerWaalsContact CD1-CZ 3.5Å; I135-F164 HydrophobicContact CG2-CD1 4.31Å; I135-F164 HydrophobicContact CG2-CE1 3.91Å; I135-F164 HydrophobicContact CG2-CZ 4.25Å; I135-L174 HydrophobicContact CD1-CD1 4Å; I135-L174 HydrophobicContact CD1-CD2 3.68Å; I135-L174 HydrophobicContact CD1-CG 4.5Å
136	N	91.2	Very high	93.7	Very high	73 Å²	73	44.2 Å²	44.2	39%	0.39	24%	0.237	S	C	.	.			trans	-98.4	113.3	-179.5	-176.7	-4.2	0	0	0	110.9	Q138 A139 L140	N136-Q138 PolarHBondContact O-N 3.36Å; N136-Q138 VanDerWaalsContact OD1-CB 3.3Å; N136-Q138 WeakPolarHBondContact OD1-CB 3.45Å; N136-Q138 PolarHBondContact OD1-N 3.41Å; N136-A139 PolarHBondContact O-N 3.27Å; N136-L140 PolarHBondContact O-N 2.78Å
137	A	91.6	Very high	93.6	Very high	18 Å²	18	47 Å²	47	15%	0.149	25%	0.249	C	C	.	.	H	α-helix	trans	-59.3	-27.7	176.9	0	0	0	0	0	113.6	A139 L140 Q141 S162 S163 P165	A137-A139 PolarHBondContact O-N 2.77Å; A137-L140 PolarHBondContact O-N 2.89Å; A137-Q141 PolarHBondContact O-N 2.91Å; A137-S162 VanDerWaalsContact CB-O 3.23Å; A137-S162 WeakPolarHBondContact CB-O 3.4Å; A137-S163 PolarHBondContact N-O 2.91Å; A137-P165 HydrophobicContact CB-CB 4.37Å; A137-P165 HydrophobicContact CB-CG 4.27Å
138	Q	90.1	Very high	93.6	Very high	138 Å²	138	48.3 Å²	48.3	65%	0.645	26%	0.258	S	S	*	.	H	α-helix	trans	-69.6	-19.1	177.3	-60.8	-175.7	-15.3	0	0	113.4	N136 Q141 F142	N136-Q138 PolarHBondContact O-N 3.36Å; N136-Q138 VanDerWaalsContact OD1-CB 3.3Å; N136-Q138 WeakPolarHBondContact OD1-CB 3.45Å; N136-Q138 PolarHBondContact OD1-N 3.41Å; Q138-Q141 VanDerWaalsContact O-CG 3.32Å; Q138-Q141 WeakPolarHBondContact O-CG 3.45Å; Q138-Q141 PolarHBondContact O-NE2 3.4Å; Q138-F142 WeakPolarHBondContact O-CE2 3.43Å
139	A	89.9	Confident	93.6	Very high	15 Å²	15	47.3 Å²	47.3	12%	0.124	25%	0.252	C	S	.	.	H	α-helix	trans	-87.6	-36.4	169.6	0	0	0	0	0	111.5	I112 N136 A137 F142 Y143	I112-A139 HydrophobicContact CB-CB 3.86Å; I112-A139 HydrophobicContact CG2-CB 4.08Å; N136-A139 PolarHBondContact O-N 3.27Å; A137-A139 PolarHBondContact O-N 2.77Å; A139-F142 WeakPolarHBondContact O-CD2 3.2Å; A139-Y143 WeakPolarHBondContact O-CD2 3.43Å; A139-Y143 WeakPolarHBondContact O-CE2 3.45Å
140	L	92.5	Very high	93.7	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-72.5	-30.4	-178.7	-72.1	178.3	0	0	0	114	I112 I135 N136 A137 F142 Y143 L146 L149 F164 P165 M167	I112-L140 HydrophobicContact CD1-CD1 4.49Å; I112-L140 HydrophobicContact CD1-CD2 3.98Å; I112-L140 HydrophobicContact CD1-CG 4.02Å; I112-L140 HydrophobicContact CG2-CD2 4.4Å; I135-L140 HydrophobicContact CG2-CD1 3.63Å; N136-L140 PolarHBondContact O-N 2.78Å; A137-L140 PolarHBondContact O-N 2.89Å; L140-F142 PolarHBondContact O-N 3.27Å; L140-Y143 PolarHBondContact O-N 2.89Å; L140-L146 HydrophobicContact CD2-CD2 4.4Å; L140-L149 HydrophobicContact CD1-CD2 4.31Å; L140-L149 HydrophobicContact CD2-CD2 3.87Å; L140-F164 HydrophobicContact CD1-CD1 3.68Å; L140-F164 HydrophobicContact CD1-CE1 4.09Å; L140-P165 HydrophobicContact CB-CG 3.97Å; L140-M167 HydrophobicContact CB-CE 4.36Å; L140-M167 HydrophobicContact CB-SD 3.86Å; L140-M167 HydrophobicContact CD1-SD 4.49Å; L140-M167 VanDerWaalsContact O-CE 3.29Å; L140-M167 WeakPolarHBondContact O-CE 3.03Å
141	Q	88.8	Confident	93.8	Very high	113 Å²	113	43.8 Å²	43.8	53%	0.528	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.4	177.3	65	-177	-8.6	0	0	114.1	A137 Q138 Y143 P165	A137-Q141 PolarHBondContact O-N 2.91Å; Q138-Q141 VanDerWaalsContact O-CG 3.32Å; Q138-Q141 WeakPolarHBondContact O-CG 3.45Å; Q138-Q141 PolarHBondContact O-NE2 3.4Å; Q141-Y143 PolarHBondContact O-N 2.95Å; Q141-P165 HydrophobicContact CB-CG 4.31Å
142	F	87.9	Confident	93.8	Very high	79 Å²	79	40.5 Å²	40.5	35%	0.346	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-12.5	174.6	-64.5	-61.6	0	0	0	113.7	Y114 T119 Q138 A139 L140 P144	Y114-F142 HydrophobicContact CD2-CB 3.77Å; Y114-F142 HydrophobicContact CD2-CD1 4.05Å; Y114-F142 AromaticContact CD2-CD2 3.57Å; Y114-F142 HydrophobicContact CD2-CD2 3.57Å; Y114-F142 HydrophobicContact CD2-CE2 4.15Å; Y114-F142 AromaticContact CD2-CG 3.52Å; Y114-F142 HydrophobicContact CD2-CG 3.52Å; Y114-F142 HydrophobicContact CE2-CB 3.75Å; Y114-F142 AromaticContact CE2-CD1 3.51Å; Y114-F142 HydrophobicContact CE2-CD1 3.51Å; Y114-F142 AromaticContact CE2-CD2 3.94Å; Y114-F142 HydrophobicContact CE2-CD2 3.94Å; Y114-F142 HydrophobicContact CE2-CE1 4.06Å; Y114-F142 HydrophobicContact CE2-CE2 4.43Å; Y114-F142 AromaticContact CE2-CG 3.46Å; Y114-F142 HydrophobicContact CE2-CG 3.46Å; Y114-F142 VanDerWaalsContact CE2-CG 3.46Å; Y114-F142 HydrophobicContact CE2-CZ 4.49Å; Y114-F142 HydrophobicContact CG-CD2 4.22Å; Y114-F142 HydrophobicContact CG-CE2 4.45Å; T119-F142 CarbonylContact C-O 3.59Å; T119-F142 WeakPolarHBondContact CB-O 3.19Å; T119-F142 PolarHBondContact OG1-O 2.8Å; Q138-F142 WeakPolarHBondContact O-CE2 3.43Å; A139-F142 WeakPolarHBondContact O-CD2 3.2Å; L140-F142 PolarHBondContact O-N 3.27Å; F142-P144 WeakPolarHBondContact O-CD 3.48Å
143	Y	91.9	Very high	93.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.23	C	C	.	.			trans	-113.7	63	-171.8	-61.3	-95.6	0	0	0	112.9	I112 P113 F115 T119 I122 L125 A139 L140 Q141 A145 L146 M167	I112-Y143 HydrophobicContact CG2-CE2 4.47Å; P113-Y143 PolarHBondContact O-OH 3.07Å; F115-Y143 AromaticContact CD2-CE1 3.9Å; F115-Y143 HydrophobicContact CD2-CE1 3.9Å; F115-Y143 AromaticContact CD2-CZ 3.93Å; F115-Y143 WeakPolarHBondContact CD2-OH 3.47Å; F115-Y143 HydrophobicContact CE2-CE1 4.2Å; F115-Y143 WeakPolarHBondContact CE2-OH 3.08Å; T119-Y143 HydrophobicContact CG2-CD1 4.19Å; T119-Y143 HydrophobicContact CG2-CE1 3.77Å; T119-Y143 HydrophobicContact CG2-CE2 4.46Å; I122-Y143 HydrophobicContact CB-CD1 4.12Å; I122-Y143 HydrophobicContact CB-CE1 4.48Å; I122-Y143 HydrophobicContact CD1-CD1 4.36Å; I122-Y143 HydrophobicContact CD1-CE1 3.94Å; I122-Y143 HydrophobicContact CG2-CD1 4.18Å; I122-Y143 HydrophobicContact CG2-CE1 4.38Å; L125-Y143 HydrophobicContact CD2-CE1 4.02Å; L125-Y143 HydrophobicContact CD2-CE2 4.4Å; A139-Y143 WeakPolarHBondContact O-CD2 3.43Å; A139-Y143 WeakPolarHBondContact O-CE2 3.45Å; L140-Y143 PolarHBondContact O-N 2.89Å; Q141-Y143 PolarHBondContact O-N 2.95Å; Y143-A145 VanDerWaalsContact C-N 3.26Å; Y143-A145 PolarHBondContact O-N 3.42Å; Y143-L146 VanDerWaalsContact O-CB 3.28Å; Y143-L146 WeakPolarHBondContact O-CB 3.31Å; Y143-L146 PolarHBondContact O-N 3.31Å; Y143-L146 VanDerWaalsContact O-N 3.14Å; Y143-M167 WeakPolarHBondContact O-CE 3.5Å
144	P	89.9	Confident	94.1	Very high	87 Å²	87	39.2 Å²	39.2	57%	0.565	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-24.7	-170.9	27.1	-36.6	0	0	0	114.6	F142	F142-P144 WeakPolarHBondContact O-CD 3.48Å
145	A	92.3	Very high	94.2	Very high	35 Å²	35	37.5 Å²	37.5	29%	0.289	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	3.7	178.9	0	0	0	0	0	114.5	S120 I122 T123 Y143 Q147	S120-A145 WeakPolarHBondContact O-CB 3.11Å; I122-A145 CarbonylContact O-C 3.2Å; T123-A145 HydrophobicContact CG2-CB 4.46Å; Y143-A145 VanDerWaalsContact C-N 3.26Å; Y143-A145 PolarHBondContact O-N 3.42Å; A145-Q147 PolarHBondContact O-N 2.81Å
146	L	95.1	Very high	94.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.204	C	C	.	.			trans	-67	118	-172.1	-165.5	70	0	0	0	112.1	I122 L125 L140 Y143 S148 L149 M167 L169	I122-L146 HydrophobicContact CG2-CD1 4.26Å; I122-L146 WeakPolarHBondContact O-CA 3.1Å; I122-L146 PolarHBondContact O-N 3.03Å; L125-L146 HydrophobicContact CB-CD1 3.74Å; L140-L146 HydrophobicContact CD2-CD2 4.4Å; Y143-L146 VanDerWaalsContact O-CB 3.28Å; Y143-L146 WeakPolarHBondContact O-CB 3.31Å; Y143-L146 PolarHBondContact O-N 3.31Å; Y143-L146 VanDerWaalsContact O-N 3.14Å; L146-S148 WeakPolarHBondContact CD1-O 3.25Å; L146-L149 HydrophobicContact CD2-CB 4.14Å; L146-L149 HydrophobicContact CD2-CD1 4.36Å; L146-L149 HydrophobicContact CD2-CD2 4.45Å; L146-M167 HydrophobicContact CB-CE 3.89Å; L146-M167 HydrophobicContact CD2-CE 4.1Å; L146-L169 HydrophobicContact CD2-CD1 4.16Å; L146-L169 HydrophobicContact CG-CD1 3.98Å; L146-L169 WeakPolarHBondContact O-CA 3.31Å
147	Q	96.4	Very high	94.5	Very high	74 Å²	74	36.4 Å²	36.4	35%	0.346	20%	0.203	S	C	.	.			trans	-107.6	-22.9	179	-71.6	174	67	0	0	112.6	T123 A145 K170 Y171	T123-Q147 PolarHBondContact O-N 3.43Å; A145-Q147 PolarHBondContact O-N 2.81Å; Q147-K170 HydrophobicContact CB-CD 4.38Å; Q147-K170 HydrophobicContact CG-CD 4.33Å; Q147-K170 WeakPolarHBondContact O-CA 3.42Å; Q147-K170 PolarHBondContact O-N 3.35Å; Q147-Y171 PolarHBondContact O-N 3.43Å
148	S	98	Very high	94.6	Very high	27 Å²	27	38.7 Å²	38.7	19%	0.189	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	125.9	179.1	-174.1	0	0	0	0	111.9	T123 L124 L125 L146 Y171	T123-S148 PolarHBondContact O-N 3.21Å; L124-S148 WeakPolarHBondContact CA-O 3.41Å; L125-S148 PolarHBondContact N-O 3Å; L146-S148 WeakPolarHBondContact CD1-O 3.25Å; S148-Y171 WeakPolarHBondContact OG-CD1 3.41Å
149	L	98	Very high	94.8	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	118.2	177.7	179.5	58.4	0	0	0	110.1	L125 L140 L146 L151 F164 L169 Y171 L172 N173	L125-L149 HydrophobicContact CB-CD1 4.21Å; L125-L149 HydrophobicContact CD2-CD1 4.25Å; L125-L149 HydrophobicContact CG-CD1 4.32Å; L125-L149 WeakPolarHBondContact O-CA 3.39Å; L140-L149 HydrophobicContact CD1-CD2 4.31Å; L140-L149 HydrophobicContact CD2-CD2 3.87Å; L146-L149 HydrophobicContact CD2-CB 4.14Å; L146-L149 HydrophobicContact CD2-CD1 4.36Å; L146-L149 HydrophobicContact CD2-CD2 4.45Å; L149-L151 HydrophobicContact CD1-CD1 4.24Å; L149-L151 HydrophobicContact CD1-CG 4.1Å; L149-L151 HydrophobicContact CD2-CD1 3.82Å; L149-L151 HydrophobicContact CG-CD1 3.99Å; L149-L151 HydrophobicContact CG-CG 4.17Å; L149-F164 HydrophobicContact CD2-CE1 4.46Å; L149-L169 HydrophobicContact CB-CD1 3.85Å; L149-L169 HydrophobicContact CB-CD2 4.23Å; L149-Y171 PolarHBondContact N-O 3.38Å; L149-L172 HydrophobicContact CB-CD1 4.37Å; L149-L172 HydrophobicContact CD2-CD1 4.16Å; L149-L172 HydrophobicContact CG-CD1 4.33Å; L149-N173 PolarHBondContact O-N 2.97Å
150	D	98.5	Very high	95	Very high	24 Å²	24	34 Å²	34	13%	0.128	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	109.7	173	-158.1	-37.3	0	0	0	111.2	L125 L127 V128 S152 N173	L125-D150 PolarHBondContact O-N 3.43Å; L127-D150 PolarHBondContact N-O 3.39Å; V128-D150 HydrophobicContact CG2-CB 3.98Å; V128-D150 VanDerWaalsContact CG2-CG 3.45Å; V128-D150 WeakPolarHBondContact CG2-OD1 3.44Å; D150-S152 WeakPolarHBondContact OD1-CB 3.19Å; D150-S152 PolarHBondContact OD1-N 2.77Å; D150-S152 PolarHBondContact OD1-OG 3.03Å; D150-N173 HydrophobicContact CB-CB 4.36Å; D150-N173 VanDerWaalsContact CG-ND2 3.28Å; D150-N173 PolarHBondContact OD1-ND2 3.3Å; D150-N173 VanDerWaalsContact OD1-ND2 3.16Å; D150-N173 PolarHBondContact OD2-ND2 3.09Å
151	L	98.3	Very high	94.9	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.203	C	C	.	.			trans	-112.7	18.2	177.4	-81.1	164.8	0	0	0	111.1	I112 L127 I132 I135 L149 N154 I156 N173 L174 N177	I112-L151 HydrophobicContact CD1-CD1 4.5Å; I112-L151 HydrophobicContact CG1-CD2 4.45Å; L127-L151 HydrophobicContact CB-CD2 4.13Å; L127-L151 HydrophobicContact CD1-CD2 3.87Å; I132-L151 HydrophobicContact CD1-CD2 3.78Å; I135-L151 HydrophobicContact CD1-CD1 4.24Å; I135-L151 HydrophobicContact CG1-CD1 4.2Å; I135-L151 HydrophobicContact CG2-CD1 4.37Å; L149-L151 HydrophobicContact CD1-CD1 4.24Å; L149-L151 HydrophobicContact CD1-CG 4.1Å; L149-L151 HydrophobicContact CD2-CD1 3.82Å; L149-L151 HydrophobicContact CG-CD1 3.99Å; L149-L151 HydrophobicContact CG-CG 4.17Å; L151-N154 PolarHBondContact O-ND2 3.24Å; L151-I156 HydrophobicContact CB-CD1 4.15Å; L151-I156 HydrophobicContact CD1-CD1 4.46Å; L151-N173 CarbonylContact C-O 3.32Å; L151-N173 PolarHBondContact N-O 2.83Å; L151-L174 HydrophobicContact CB-CD2 3.65Å; L151-L174 HydrophobicContact CD1-CD2 4.07Å; L151-N177 PolarHBondContact O-ND2 3.25Å
152	S	98.4	Very high	95.1	Very high	10 Å²	10	35.3 Å²	35.3	7%	0.07	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	154.1	-175	64	0	0	0	0	113.6	V128 H129 D150 N154 N173 S175	V128-S152 CarbonylContact C-O 3.52Å; V128-S152 VanDerWaalsContact CA-O 3.27Å; V128-S152 WeakPolarHBondContact CA-O 3.5Å; H129-S152 PolarHBondContact N-O 2.81Å; D150-S152 WeakPolarHBondContact OD1-CB 3.19Å; D150-S152 PolarHBondContact OD1-N 2.77Å; D150-S152 PolarHBondContact OD1-OG 3.03Å; S152-N154 PolarHBondContact O-N 2.98Å; S152-N154 PolarHBondContact O-ND2 2.84Å; S152-N173 WeakPolarHBondContact CB-ND2 3.45Å; S152-N173 PolarHBondContact N-O 3.34Å; S152-N173 PolarHBondContact OG-ND2 2.81Å; S152-S175 CarbonylContact C-O 3.19Å; S152-S175 WeakPolarHBondContact CA-O 3.2Å; S152-S175 WeakPolarHBondContact CB-O 3.46Å
153	S	98.3	Very high	95.4	Very high	29 Å²	29	31.7 Å²	31.7	20%	0.203	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	27.1	-175.9	-50.4	0	0	0	0	115.5	H129 S175 N176	H129-S153 WeakPolarHBondContact CA-O 3.25Å; S153-S175 PolarHBondContact N-O 2.94Å; S153-N176 WeakPolarHBondContact CA-O 3.47Å; S153-N176 PolarHBondContact OG-ND2 3.19Å
154	N	97.9	Very high	95.5	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.027	19%	0.19	C	C	.	.	S	Bend	trans	-89.1	-165.8	168.9	-82.3	-87.3	0	0	0	110.8	L127 N130 I131 I132 L151 S152 I156 N177	L127-N154 PolarHBondContact O-ND2 2.97Å; N130-N154 WeakPolarHBondContact CA-OD1 3.07Å; N130-N154 WeakPolarHBondContact CB-OD1 3.49Å; N130-N154 PolarHBondContact O-OD1 3.08Å; I131-N154 PolarHBondContact N-OD1 3.3Å; I132-N154 HydrophobicContact CB-CB 4.35Å; I132-N154 WeakPolarHBondContact CB-OD1 3.49Å; I132-N154 WeakPolarHBondContact CG1-OD1 3.49Å; I132-N154 PolarHBondContact N-OD1 3.36Å; L151-N154 PolarHBondContact O-ND2 3.24Å; S152-N154 PolarHBondContact O-N 2.98Å; S152-N154 PolarHBondContact O-ND2 2.84Å; N154-I156 HydrophobicContact CB-CD1 4.31Å; N154-I156 HydrophobicContact CB-CG1 4.18Å; N154-N177 WeakPolarHBondContact CA-OD1 3.04Å; N154-N177 WeakPolarHBondContact CB-OD1 3.24Å; N154-N177 PolarHBondContact N-OD1 3.07Å; N154-N177 PolarHBondContact O-OD1 2.88Å
155	I	97.4	Very high	95.7	Very high	55 Å²	55	29 Å²	29	28%	0.282	17%	0.172	S	C	.	.			trans	-110.1	17.2	-179.8	65.3	176.8	0	0	0	113.5	I131 I132 P133 S157 N177	I131-I155 HydrophobicContact CB-CD1 4.23Å; I131-I155 WeakPolarHBondContact O-CD1 3.47Å; I131-I155 WeakPolarHBondContact O-CG1 3.05Å; I132-I155 CarbonylContact O-C 3.59Å; I132-I155 WeakPolarHBondContact O-CG1 3.39Å; I132-I155 PolarHBondContact O-N 3.09Å; I132-I155 VanDerWaalsContact O-N 3.14Å; P133-I155 HydrophobicContact CB-CD1 4.41Å; P133-I155 HydrophobicContact CB-CG1 4.24Å; I155-S157 PolarHBondContact O-N 2.91Å; I155-N177 PolarHBondContact N-OD1 2.9Å
156	I	97.7	Very high	95.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.192	C	C	.	.			trans	-57.5	126.3	-175.8	-56	167.2	0	0	0	111	I132 P133 I135 L151 N154 E158 L174 N177 R178 I179	I132-I156 WeakPolarHBondContact O-CG1 3.45Å; I132-I156 PolarHBondContact O-N 3.43Å; P133-I156 WeakPolarHBondContact O-CA 3.24Å; I135-I156 HydrophobicContact CD1-CD1 4.42Å; I135-I156 HydrophobicContact CG1-CD1 3.95Å; I135-I156 HydrophobicContact CG1-CG2 4.39Å; L151-I156 HydrophobicContact CB-CD1 4.15Å; L151-I156 HydrophobicContact CD1-CD1 4.46Å; N154-I156 HydrophobicContact CB-CD1 4.31Å; N154-I156 HydrophobicContact CB-CG1 4.18Å; I156-E158 WeakPolarHBondContact CG2-O 3.16Å; I156-L174 HydrophobicContact CD1-CD2 3.77Å; I156-N177 HydrophobicContact CB-CB 4.23Å; I156-N177 WeakPolarHBondContact CB-OD1 3.4Å; I156-N177 WeakPolarHBondContact CG1-OD1 3.37Å; I156-N177 PolarHBondContact N-OD1 3.36Å; I156-N177 VanDerWaalsContact N-OD1 3.1Å; I156-R178 CarbonylContact O-C 3.21Å; I156-R178 VanDerWaalsContact O-CA 3.25Å; I156-R178 WeakPolarHBondContact O-CA 3.5Å; I156-R178 WeakPolarHBondContact O-CB 3.35Å; I156-R178 PolarHBondContact O-N 2.96Å; I156-I179 HydrophobicContact CB-CG1 4.4Å; I156-I179 HydrophobicContact CG2-CD1 4.44Å; I156-I179 HydrophobicContact CG2-CG1 4.1Å; I156-I179 WeakPolarHBondContact O-CG1 3.27Å; I156-I179 PolarHBondContact O-N 2.88Å
157	S	95.4	Very high	95.6	Very high	53 Å²	53	35.3 Å²	35.3	37%	0.371	20%	0.195	S	C	.	.			trans	-103.5	-18.7	-174.9	49	0	0	0	0	115.6	I155 I179 T180	I155-S157 PolarHBondContact O-N 2.91Å; S157-I179 WeakPolarHBondContact O-CA 3.44Å; S157-T180 PolarHBondContact O-N 2.85Å; S157-T180 PolarHBondContact O-OG1 3.26Å
158	E	94.1	Very high	95.4	Very high	67 Å²	67	36.8 Å²	36.8	31%	0.313	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	158.4	-174.7	58.2	-173.8	171.7	0	0	110.9	I156 K160 T181	I156-E158 WeakPolarHBondContact CG2-O 3.16Å; E158-K160 WeakPolarHBondContact OE1-CE 3.5Å; E158-K160 IonicContact OE1-NZ 2.93Å; E158-K160 PolarHBondContact OE1-NZ 2.84Å; E158-T181 WeakPolarHBondContact CB-OG1 3.3Å
159	I	95	Very high	95.3	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	123.1	167.4	-44.6	-177.8	0	0	0	108.4	F164 L174 I179 T181 L182 E183 C186 F187 L199	I159-F164 HydrophobicContact CG2-CD2 4.47Å; I159-F164 HydrophobicContact CG2-CE2 3.79Å; I159-L174 HydrophobicContact CD1-CD1 3.59Å; I159-I179 HydrophobicContact CD1-CD1 4.11Å; I159-I179 HydrophobicContact CG1-CD1 4.14Å; I159-I179 HydrophobicContact CG1-CG2 4.27Å; I159-T181 PolarHBondContact N-O 2.98Å; I159-L182 HydrophobicContact CB-CD2 4.17Å; I159-L182 HydrophobicContact CD1-CD2 3.61Å; I159-L182 HydrophobicContact CG1-CD2 3.87Å; I159-E183 WeakPolarHBondContact O-CB 3.48Å; I159-E183 PolarHBondContact O-N 2.98Å; I159-C186 HydrophobicContact CB-CB 4.3Å; I159-C186 HydrophobicContact CG2-CB 3.88Å; I159-F187 HydrophobicContact CD1-CE1 3.93Å; I159-F187 HydrophobicContact CD1-CZ 3.69Å; I159-L199 HydrophobicContact CD1-CD2 3.95Å
160	K	93.3	Very high	95.2	Very high	52 Å²	52	40 Å²	40	23%	0.226	21%	0.213	C	C	.	.			trans	-99.4	162	-175.9	-65.7	167.6	179.9	137.7	0	111.5	E134 E158 S162 S163 E183 C186	E134-K160 IonicContact OE2-NZ 3.2Å; E134-K160 PolarHBondContact OE2-NZ 3Å; E158-K160 WeakPolarHBondContact OE1-CE 3.5Å; E158-K160 IonicContact OE1-NZ 2.93Å; E158-K160 PolarHBondContact OE1-NZ 2.84Å; K160-S162 PolarHBondContact O-N 3.26Å; K160-S163 PolarHBondContact N-OG 2.93Å; K160-S163 WeakPolarHBondContact O-CB 3.22Å; K160-S163 PolarHBondContact O-N 2.98Å; K160-S163 VanDerWaalsContact O-N 3.09Å; K160-E183 WeakPolarHBondContact CA-OE2 3.47Å; K160-E183 WeakPolarHBondContact CB-OE2 3.19Å; K160-C186 WeakPolarHBondContact O-CB 3.46Å
161	T	91.1	Very high	95.2	Very high	60 Å²	60	42 Å²	42	37%	0.368	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-30.6	165.6	46	0	0	0	0	112.4	E183 A184	T161-E183 WeakPolarHBondContact CB-OE1 3.41Å; T161-E183 HydrophobicContact CG2-CB 4.48Å; T161-E183 HydrophobicContact CG2-CG 4.04Å; T161-E183 WeakPolarHBondContact CG2-OE1 3.46Å; T161-E183 PolarHBondContact N-OE2 3.48Å; T161-E183 VanDerWaalsContact OG1-CD 3.27Å; T161-E183 PolarHBondContact OG1-OE1 2.68Å; T161-E183 PolarHBondContact OG1-OE2 3.15Å; T161-A184 WeakPolarHBondContact CG2-O 3.43Å
162	S	91.9	Very high	95.2	Very high	80 Å²	80	42 Å²	42	56%	0.559	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	3.2	177.1	58	0	0	0	0	115.5	A137 K160 F164	A137-S162 VanDerWaalsContact CB-O 3.23Å; A137-S162 WeakPolarHBondContact CB-O 3.4Å; K160-S162 PolarHBondContact O-N 3.26Å; S162-F164 PolarHBondContact O-N 3.03Å
163	S	94.5	Very high	95.2	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.021	22%	0.219	C	C	.	.	S	Bend	trans	-71.8	-26.2	-175.4	-79.3	0	0	0	0	114.4	I135 A137 K160	I135-S163 WeakPolarHBondContact CG2-O 3.13Å; I135-S163 WeakPolarHBondContact O-CA 3.27Å; I135-S163 PolarHBondContact O-OG 3.41Å; A137-S163 PolarHBondContact N-O 2.91Å; K160-S163 PolarHBondContact N-OG 2.93Å; K160-S163 WeakPolarHBondContact O-CB 3.22Å; K160-S163 PolarHBondContact O-N 2.98Å; K160-S163 VanDerWaalsContact O-N 3.09Å
164	F	94.8	Very high	95.2	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.018	21%	0.21	C	C	.	.			trans	-128.7	135.5	-178.3	-60.7	-79.5	0	0	0	111.2	I135 L140 L149 I159 S162 L172 L174 C186 F187 N189 L190	I135-F164 HydrophobicContact CD1-CE1 4.13Å; I135-F164 HydrophobicContact CD1-CE2 4.13Å; I135-F164 HydrophobicContact CD1-CZ 3.5Å; I135-F164 VanDerWaalsContact CD1-CZ 3.5Å; I135-F164 HydrophobicContact CG2-CD1 4.31Å; I135-F164 HydrophobicContact CG2-CE1 3.91Å; I135-F164 HydrophobicContact CG2-CZ 4.25Å; L140-F164 HydrophobicContact CD1-CD1 3.68Å; L140-F164 HydrophobicContact CD1-CE1 4.09Å; L149-F164 HydrophobicContact CD2-CE1 4.46Å; I159-F164 HydrophobicContact CG2-CD2 4.47Å; I159-F164 HydrophobicContact CG2-CE2 3.79Å; S162-F164 PolarHBondContact O-N 3.03Å; F164-L172 HydrophobicContact CE1-CD1 4.11Å; F164-L172 HydrophobicContact CE1-CD2 4.19Å; F164-L172 HydrophobicContact CE2-CD2 4.24Å; F164-L172 HydrophobicContact CZ-CD1 4.09Å; F164-L172 HydrophobicContact CZ-CD2 3.63Å; F164-L174 HydrophobicContact CZ-CD1 4.45Å; F164-C186 WeakPolarHBondContact CD2-O 3.1Å; F164-F187 HydrophobicContact CE2-CD1 4.28Å; F164-F187 HydrophobicContact CE2-CE1 4.33Å; F164-N189 PolarHBondContact O-ND2 2.98Å; F164-L190 HydrophobicContact CB-CD1 4.35Å; F164-L190 HydrophobicContact CB-CD2 4.05Å; F164-L190 HydrophobicContact CB-CG 4.16Å; F164-L190 HydrophobicContact CD1-CD1 3.98Å; F164-L190 HydrophobicContact CD1-CD2 4.39Å; F164-L190 HydrophobicContact CD2-CD1 4.02Å; F164-L190 HydrophobicContact CE1-CD1 4.25Å; F164-L190 HydrophobicContact CE2-CD1 4.29Å; F164-L190 HydrophobicContact CG-CD1 3.86Å; F164-L190 HydrophobicContact CG-CD2 4.32Å; F164-L190 HydrophobicContact CG-CG 4.22Å; F164-L190 HydrophobicContact CZ-CD1 4.4Å
165	P	93.4	Very high	95.3	Very high	27 Å²	27	41.4 Å²	41.4	18%	0.175	21%	0.214	C	C	.	.			trans	-77.8	176	165	32.1	-24.9	0	0	0	109.9	A137 L140 Q141 M167	A137-P165 HydrophobicContact CB-CB 4.37Å; A137-P165 HydrophobicContact CB-CG 4.27Å; L140-P165 HydrophobicContact CB-CG 3.97Å; Q141-P165 HydrophobicContact CB-CG 4.31Å; P165-M167 HydrophobicContact CG-CG 3.8Å; P165-M167 HydrophobicContact CG-SD 3.79Å; P165-M167 PolarHBondContact O-N 2.84Å
166	H	92.5	Very high	95.3	Very high	156 Å²	156	42 Å²	42	72%	0.722	22%	0.218	S	C	*	.	S	Bend	trans	-65.6	117.8	170.3	-72.6	-57.3	0	0	0	110.5	N189	H166-N189 WeakPolarHBondContact CA-O 3.42Å; H166-N189 PolarHBondContact CE1-OD1 3Å; H166-N189 PolarHBondContact ND1-O 3.22Å
167	M	92.1	Very high	95.3	Very high	11 Å²	11	42.4 Å²	42.4	5%	0.054	22%	0.22	C	C	.	.			trans	-144.1	152.6	-175.2	-60.4	-175.4	84.5	0	0	111.5	L140 Y143 L146 P165 L169 L190	L140-M167 HydrophobicContact CB-CE 4.36Å; L140-M167 HydrophobicContact CB-SD 3.86Å; L140-M167 HydrophobicContact CD1-SD 4.49Å; L140-M167 VanDerWaalsContact O-CE 3.29Å; L140-M167 WeakPolarHBondContact O-CE 3.03Å; Y143-M167 WeakPolarHBondContact O-CE 3.5Å; L146-M167 HydrophobicContact CB-CE 3.89Å; L146-M167 HydrophobicContact CD2-CE 4.1Å; P165-M167 HydrophobicContact CG-CG 3.8Å; P165-M167 HydrophobicContact CG-SD 3.79Å; P165-M167 PolarHBondContact O-N 2.84Å; M167-L169 PolarHBondContact O-N 3.28Å; M167-L190 HydrophobicContact CB-CD2 4.09Å
168	Q	92.1	Very high	95.4	Very high	106 Å²	106	45.7 Å²	45.7	50%	0.495	22%	0.224	S	C	.	.			trans	-89.4	45.2	176.8	-65	-58.1	-26.6	0	0	113.1	S192 S193	Q168-S192 PolarHBondContact NE2-OG 2.8Å; Q168-S192 PolarHBondContact OE1-OG 3.33Å; Q168-S193 VanDerWaalsContact C-OG 3.26Å; Q168-S193 VanDerWaalsContact CA-OG 3.22Å; Q168-S193 WeakPolarHBondContact CA-OG 3.05Å; Q168-S193 PolarHBondContact OE1-OG 3.16Å
169	L	95.9	Very high	95.6	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.01	21%	0.209	C	C	.	.			trans	-77.2	125.4	-175.5	-167.7	76.1	0	0	0	111	L146 L149 M167 L172 L190 S193 L194	L146-L169 HydrophobicContact CD2-CD1 4.16Å; L146-L169 HydrophobicContact CG-CD1 3.98Å; L146-L169 WeakPolarHBondContact O-CA 3.31Å; L149-L169 HydrophobicContact CB-CD1 3.85Å; L149-L169 HydrophobicContact CB-CD2 4.23Å; M167-L169 PolarHBondContact O-N 3.28Å; L169-L172 HydrophobicContact CD2-CB 3.95Å; L169-L172 HydrophobicContact CD2-CD1 4.15Å; L169-L172 HydrophobicContact CD2-CG 4.47Å; L169-L190 HydrophobicContact CB-CD2 4.18Å; L169-L190 HydrophobicContact CD2-CD1 4.23Å; L169-S193 CarbonylContact O-C 3.52Å; L169-L194 HydrophobicContact CD2-CD1 4.32Å; L169-L194 HydrophobicContact CG-CD1 4.38Å; L169-L194 WeakPolarHBondContact O-CA 3.44Å; L169-L194 WeakPolarHBondContact O-CD1 3.02Å; L169-L194 PolarHBondContact O-N 3.05Å
170	K	97.6	Very high	95.6	Very high	93 Å²	93	45.3 Å²	45.3	40%	0.404	23%	0.226	S	C	.	.			trans	-97.4	-30.2	179.7	-63.6	175.3	-179.4	168.9	0	113.4	Q147 L195 V196	Q147-K170 HydrophobicContact CB-CD 4.38Å; Q147-K170 HydrophobicContact CG-CD 4.33Å; Q147-K170 WeakPolarHBondContact O-CA 3.42Å; Q147-K170 PolarHBondContact O-N 3.35Å; K170-L195 HydrophobicContact CB-CG 4.45Å; K170-L195 PolarHBondContact O-N 3.25Å; K170-V196 PolarHBondContact O-N 3.43Å; K170-V196 VanDerWaalsContact O-N 3.07Å
171	Y	98.4	Very high	95.4	Very high	66 Å²	66	46.4 Å²	46.4	26%	0.259	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	126	-176	-179.7	-82.6	0	0	0	111.2	Q147 S148 L149 N173 V196	Q147-Y171 PolarHBondContact O-N 3.43Å; S148-Y171 WeakPolarHBondContact OG-CD1 3.41Å; L149-Y171 PolarHBondContact N-O 3.38Å; Y171-N173 HydrophobicContact CE1-CB 3.6Å; Y171-V196 HydrophobicContact CD2-CB 3.74Å; Y171-V196 HydrophobicContact CD2-CG1 3.75Å; Y171-V196 HydrophobicContact CD2-CG2 4.23Å; Y171-V196 HydrophobicContact CE2-CB 4.35Å; Y171-V196 HydrophobicContact CE2-CG1 3.83Å; Y171-V196 HydrophobicContact CG-CB 4.5Å
172	L	98.1	Very high	95.5	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	115.7	176.2	178.9	61.1	0	0	0	110.7	L149 F164 L169 L174 F187 L190 L194 V196 V197 K198	L149-L172 HydrophobicContact CB-CD1 4.37Å; L149-L172 HydrophobicContact CD2-CD1 4.16Å; L149-L172 HydrophobicContact CG-CD1 4.33Å; F164-L172 HydrophobicContact CE1-CD1 4.11Å; F164-L172 HydrophobicContact CE1-CD2 4.19Å; F164-L172 HydrophobicContact CE2-CD2 4.24Å; F164-L172 HydrophobicContact CZ-CD1 4.09Å; F164-L172 HydrophobicContact CZ-CD2 3.63Å; L169-L172 HydrophobicContact CD2-CB 3.95Å; L169-L172 HydrophobicContact CD2-CD1 4.15Å; L169-L172 HydrophobicContact CD2-CG 4.47Å; L172-L174 HydrophobicContact CD1-CD1 4.13Å; L172-L174 HydrophobicContact CD1-CG 4.06Å; L172-L174 HydrophobicContact CD2-CD1 3.93Å; L172-L174 HydrophobicContact CG-CD1 4Å; L172-L174 HydrophobicContact CG-CG 4.18Å; L172-F187 HydrophobicContact CD2-CD1 4.34Å; L172-F187 HydrophobicContact CD2-CE1 4.06Å; L172-L190 HydrophobicContact CD2-CD1 4.13Å; L172-L194 HydrophobicContact CB-CD1 3.99Å; L172-V196 PolarHBondContact N-O 3.08Å; L172-V197 WeakPolarHBondContact O-CA 3.4Å; L172-K198 PolarHBondContact O-N 3.29Å
173	N	98.6	Very high	95.5	Very high	15 Å²	15	44.3 Å²	44.3	8%	0.08	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	115.7	173.4	-176.9	16.9	0	0	0	111.4	L149 D150 L151 S152 Y171 S175 K198	L149-N173 PolarHBondContact O-N 2.97Å; D150-N173 HydrophobicContact CB-CB 4.36Å; D150-N173 VanDerWaalsContact CG-ND2 3.28Å; D150-N173 PolarHBondContact OD1-ND2 3.3Å; D150-N173 VanDerWaalsContact OD1-ND2 3.16Å; D150-N173 PolarHBondContact OD2-ND2 3.09Å; L151-N173 CarbonylContact C-O 3.32Å; L151-N173 PolarHBondContact N-O 2.83Å; S152-N173 WeakPolarHBondContact CB-ND2 3.45Å; S152-N173 PolarHBondContact N-O 3.34Å; S152-N173 PolarHBondContact OG-ND2 2.81Å; Y171-N173 HydrophobicContact CE1-CB 3.6Å; N173-S175 WeakPolarHBondContact OD1-CB 3.15Å; N173-S175 PolarHBondContact OD1-N 2.76Å; N173-S175 PolarHBondContact OD1-OG 3.14Å; N173-K198 HydrophobicContact CB-CB 4.41Å
174	L	98.3	Very high	95.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.			trans	-120.6	18.1	177.3	-71.6	167.2	0	0	0	111.5	I135 L151 I156 I159 F164 L172 N177 I179 K198 L199 N202	I135-L174 HydrophobicContact CD1-CD1 4Å; I135-L174 HydrophobicContact CD1-CD2 3.68Å; I135-L174 HydrophobicContact CD1-CG 4.5Å; L151-L174 HydrophobicContact CB-CD2 3.65Å; L151-L174 HydrophobicContact CD1-CD2 4.07Å; I156-L174 HydrophobicContact CD1-CD2 3.77Å; I159-L174 HydrophobicContact CD1-CD1 3.59Å; F164-L174 HydrophobicContact CZ-CD1 4.45Å; L172-L174 HydrophobicContact CD1-CD1 4.13Å; L172-L174 HydrophobicContact CD1-CG 4.06Å; L172-L174 HydrophobicContact CD2-CD1 3.93Å; L172-L174 HydrophobicContact CG-CD1 4Å; L172-L174 HydrophobicContact CG-CG 4.18Å; L174-N177 PolarHBondContact O-ND2 3.45Å; L174-I179 HydrophobicContact CB-CD1 4.09Å; L174-K198 CarbonylContact C-O 3.42Å; L174-K198 WeakPolarHBondContact CA-O 3.23Å; L174-K198 PolarHBondContact N-O 3.2Å; L174-L199 HydrophobicContact CB-CD2 4.03Å; L174-L199 HydrophobicContact CD1-CD2 4.2Å; L174-N202 PolarHBondContact O-ND2 2.87Å
175	S	98.6	Very high	94.7	Very high	16 Å²	16	48.1 Å²	48.1	11%	0.112	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	152.8	-178.6	-58.6	0	0	0	0	112.5	S152 S153 N173 N177 K198 N200	S152-S175 CarbonylContact C-O 3.19Å; S152-S175 WeakPolarHBondContact CA-O 3.2Å; S152-S175 WeakPolarHBondContact CB-O 3.46Å; S153-S175 PolarHBondContact N-O 2.94Å; N173-S175 WeakPolarHBondContact OD1-CB 3.15Å; N173-S175 PolarHBondContact OD1-N 2.76Å; N173-S175 PolarHBondContact OD1-OG 3.14Å; S175-N177 PolarHBondContact O-N 2.93Å; S175-N177 PolarHBondContact O-ND2 3.4Å; S175-K198 PolarHBondContact N-O 2.98Å; S175-K198 WeakPolarHBondContact OG-CB 3.23Å; S175-N200 CarbonylContact C-O 3.57Å; S175-N200 WeakPolarHBondContact CA-O 3.12Å; S175-N200 PolarHBondContact OG-ND2 2.95Å
176	N	98.3	Very high	94.6	Very high	68 Å²	68	47 Å²	47	36%	0.364	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	25.7	171.7	-158.3	62.9	0	0	0	114.3	S153 N200 R201	S153-N176 WeakPolarHBondContact CA-O 3.47Å; S153-N176 PolarHBondContact OG-ND2 3.19Å; N176-N200 PolarHBondContact N-O 3.29Å; N176-R201 HydrophobicContact CB-CB 4.25Å
177	N	98.3	Very high	94.6	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.043	21%	0.207	C	C	.	.	S	Bend	trans	-89.7	-161.7	171.9	-86.2	-80.7	0	0	0	110.6	L151 N154 I155 I156 L174 S175 I179 N202	L151-N177 PolarHBondContact O-ND2 3.25Å; N154-N177 WeakPolarHBondContact CA-OD1 3.04Å; N154-N177 WeakPolarHBondContact CB-OD1 3.24Å; N154-N177 PolarHBondContact N-OD1 3.07Å; N154-N177 PolarHBondContact O-OD1 2.88Å; I155-N177 PolarHBondContact N-OD1 2.9Å; I156-N177 HydrophobicContact CB-CB 4.23Å; I156-N177 WeakPolarHBondContact CB-OD1 3.4Å; I156-N177 WeakPolarHBondContact CG1-OD1 3.37Å; I156-N177 PolarHBondContact N-OD1 3.36Å; I156-N177 VanDerWaalsContact N-OD1 3.1Å; L174-N177 PolarHBondContact O-ND2 3.45Å; S175-N177 PolarHBondContact O-N 2.93Å; S175-N177 PolarHBondContact O-ND2 3.4Å; N177-I179 HydrophobicContact CB-CD1 4.14Å; N177-I179 HydrophobicContact CB-CG1 4.03Å; N177-N202 VanDerWaalsContact CA-OD1 3.23Å; N177-N202 WeakPolarHBondContact CA-OD1 3.27Å; N177-N202 WeakPolarHBondContact CB-OD1 3.33Å; N177-N202 PolarHBondContact N-OD1 2.93Å; N177-N202 PolarHBondContact O-OD1 2.97Å
178	R	97.2	Very high	94.5	Very high	123 Å²	123	41 Å²	41	46%	0.464	22%	0.215	S	C	.	.			trans	-111.2	13.4	180	-58.9	-179.8	179.9	-174.6	0.4	112.8	I156 T180 N202	I156-R178 CarbonylContact O-C 3.21Å; I156-R178 VanDerWaalsContact O-CA 3.25Å; I156-R178 WeakPolarHBondContact O-CA 3.5Å; I156-R178 WeakPolarHBondContact O-CB 3.35Å; I156-R178 PolarHBondContact O-N 2.96Å; R178-T180 PolarHBondContact O-N 3.24Å; R178-N202 PolarHBondContact N-OD1 3.2Å
179	I	97.5	Very high	94.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.203	C	C	.	.			trans	-59.7	117.9	-165.2	-58.6	166	0	0	0	110.7	I156 S157 I159 L174 N177 L182 L199 N202 R203 I204	I156-I179 HydrophobicContact CB-CG1 4.4Å; I156-I179 HydrophobicContact CG2-CD1 4.44Å; I156-I179 HydrophobicContact CG2-CG1 4.1Å; I156-I179 WeakPolarHBondContact O-CG1 3.27Å; I156-I179 PolarHBondContact O-N 2.88Å; S157-I179 WeakPolarHBondContact O-CA 3.44Å; I159-I179 HydrophobicContact CD1-CD1 4.11Å; I159-I179 HydrophobicContact CG1-CD1 4.14Å; I159-I179 HydrophobicContact CG1-CG2 4.27Å; L174-I179 HydrophobicContact CB-CD1 4.09Å; N177-I179 HydrophobicContact CB-CD1 4.14Å; N177-I179 HydrophobicContact CB-CG1 4.03Å; I179-L182 HydrophobicContact CG2-CD2 3.98Å; I179-L199 HydrophobicContact CD1-CD2 4.14Å; I179-N202 HydrophobicContact CB-CB 4.09Å; I179-N202 WeakPolarHBondContact CB-OD1 3.25Å; I179-N202 WeakPolarHBondContact CG1-OD1 3.37Å; I179-N202 PolarHBondContact N-OD1 3.35Å; I179-R203 CarbonylContact O-C 3.58Å; I179-R203 VanDerWaalsContact O-CA 3.26Å; I179-R203 WeakPolarHBondContact O-CA 3.27Å; I179-R203 WeakPolarHBondContact O-CB 3.16Å; I179-R203 PolarHBondContact O-N 3.3Å; I179-I204 HydrophobicContact CG2-CD1 4.45Å; I179-I204 HydrophobicContact CG2-CG1 4.13Å; I179-I204 WeakPolarHBondContact O-CG1 3.5Å; I179-I204 PolarHBondContact O-N 3.37Å
180	T	95.1	Very high	94.4	Very high	61 Å²	61	38.1 Å²	38.1	37%	0.374	20%	0.203	S	C	.	.			trans	-100	-31.2	175.1	42	0	0	0	0	113	S157 R178 R203	S157-T180 PolarHBondContact O-N 2.85Å; S157-T180 PolarHBondContact O-OG1 3.26Å; R178-T180 PolarHBondContact O-N 3.24Å; T180-R203 HydrophobicContact CG2-CB 3.7Å
181	T	90.3	Very high	94.1	Very high	74 Å²	74	35.7 Å²	35.7	45%	0.454	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.9	-166.6	35.1	0	0	0	0	111.1	E158 I159	E158-T181 WeakPolarHBondContact CB-OG1 3.3Å; I159-T181 PolarHBondContact N-O 2.98Å
182	L	93	Very high	93.8	Very high	14 Å²	14	35.3 Å²	35.3	7%	0.073	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.8	172.1	-58.9	177.1	0	0	0	107.1	I159 I179 F187 L199 I204 I211	I159-L182 HydrophobicContact CB-CD2 4.17Å; I159-L182 HydrophobicContact CD1-CD2 3.61Å; I159-L182 HydrophobicContact CG1-CD2 3.87Å; I179-L182 HydrophobicContact CG2-CD2 3.98Å; L182-F187 HydrophobicContact CD2-CZ 4.42Å; L182-L199 HydrophobicContact CD1-CD1 4.43Å; L182-I204 HydrophobicContact CD1-CD1 4.18Å; L182-I204 HydrophobicContact CD2-CD1 4.49Å; L182-I204 HydrophobicContact CG-CD1 4.43Å; L182-I211 HydrophobicContact CB-CD1 3.52Å
183	E	90.5	Very high	93.6	Very high	83 Å²	83	36 Å²	36	39%	0.388	21%	0.209	S	C	.	.			trans	-73.5	146.2	177.7	-159.8	-173	145.8	0	0	110.8	I159 K160 T161 G185 C186 I211	I159-E183 WeakPolarHBondContact O-CB 3.48Å; I159-E183 PolarHBondContact O-N 2.98Å; K160-E183 WeakPolarHBondContact CA-OE2 3.47Å; K160-E183 WeakPolarHBondContact CB-OE2 3.19Å; T161-E183 WeakPolarHBondContact CB-OE1 3.41Å; T161-E183 HydrophobicContact CG2-CB 4.48Å; T161-E183 HydrophobicContact CG2-CG 4.04Å; T161-E183 WeakPolarHBondContact CG2-OE1 3.46Å; T161-E183 PolarHBondContact N-OE2 3.48Å; T161-E183 VanDerWaalsContact OG1-CD 3.27Å; T161-E183 PolarHBondContact OG1-OE1 2.68Å; T161-E183 PolarHBondContact OG1-OE2 3.15Å; E183-G185 PolarHBondContact O-N 2.61Å; E183-G185 VanDerWaalsContact O-N 3.17Å; E183-C186 HydrophobicContact CB-CB 4.24Å; E183-C186 VanDerWaalsContact O-CB 3.24Å; E183-C186 WeakPolarHBondContact O-CB 3.41Å; E183-C186 PolarHBondContact O-N 3.24Å; E183-C186 PolarHBondContact O-SG 3.23Å; E183-I211 WeakPolarHBondContact O-CD1 3.01Å
184	A	86.7	Confident	93.5	Very high	73 Å²	73	35.3 Å²	35.3	60%	0.603	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	120.1	179.1	0	0	0	0	0	110.7	T161	T161-A184 WeakPolarHBondContact CG2-O 3.43Å
185	G	86	Confident	93.4	Very high	13 Å²	13	38.1 Å²	38.1	13%	0.134	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	11	-175.5	0	0	0	0	0	115.4	E183 F187 D188	E183-G185 PolarHBondContact O-N 2.61Å; E183-G185 VanDerWaalsContact O-N 3.17Å; G185-F187 PolarHBondContact O-N 3.2Å; G185-D188 WeakPolarHBondContact CA-OD1 3.35Å; G185-D188 WeakPolarHBondContact O-CB 3.39Å; G185-D188 PolarHBondContact O-N 3.3Å
186	C	91.6	Very high	93.4	Very high	4 Å²	4	38.5 Å²	38.5	3%	0.027	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-7.1	178.3	63	0	0	0	0	116.1	I159 K160 F164 E183	I159-C186 HydrophobicContact CB-CB 4.3Å; I159-C186 HydrophobicContact CG2-CB 3.88Å; K160-C186 WeakPolarHBondContact O-CB 3.46Å; F164-C186 WeakPolarHBondContact CD2-O 3.1Å; E183-C186 HydrophobicContact CB-CB 4.24Å; E183-C186 VanDerWaalsContact O-CB 3.24Å; E183-C186 WeakPolarHBondContact O-CB 3.41Å; E183-C186 PolarHBondContact O-N 3.24Å; E183-C186 PolarHBondContact O-SG 3.23Å
187	F	92.8	Very high	93.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-0	173.3	-54	-71.9	0	0	0	114.1	I159 F164 L172 L182 G185 N189 L190 L199 F212 L214	I159-F187 HydrophobicContact CD1-CE1 3.93Å; I159-F187 HydrophobicContact CD1-CZ 3.69Å; F164-F187 HydrophobicContact CE2-CD1 4.28Å; F164-F187 HydrophobicContact CE2-CE1 4.33Å; L172-F187 HydrophobicContact CD2-CD1 4.34Å; L172-F187 HydrophobicContact CD2-CE1 4.06Å; L182-F187 HydrophobicContact CD2-CZ 4.42Å; G185-F187 PolarHBondContact O-N 3.2Å; F187-N189 PolarHBondContact O-N 2.86Å; F187-N189 VanDerWaalsContact O-N 3.12Å; F187-L190 PolarHBondContact O-N 3.34Å; F187-L199 HydrophobicContact CZ-CD1 4.16Å; F187-F212 AromaticContact CD2-CD1 3.89Å; F187-F212 HydrophobicContact CD2-CD1 3.89Å; F187-F212 AromaticContact CD2-CE1 3.9Å; F187-F212 HydrophobicContact CD2-CE1 3.9Å; F187-F212 HydrophobicContact CE2-CD1 4.19Å; F187-F212 AromaticContact CE2-CE1 3.7Å; F187-F212 HydrophobicContact CE2-CE1 3.7Å; F187-L214 HydrophobicContact CB-CD1 3.98Å; F187-L214 HydrophobicContact CB-CD2 3.92Å; F187-L214 HydrophobicContact CB-CG 4.27Å; F187-L214 HydrophobicContact CG-CD1 4.39Å; F187-L214 WeakPolarHBondContact O-CD2 3.37Å
188	D	90.3	Very high	93.4	Very high	40 Å²	40	37.2 Å²	37.2	21%	0.214	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-56.8	-34.5	-173.4	-78.3	9	0	0	0	112.5	G185 L190 S191 K213	G185-D188 WeakPolarHBondContact CA-OD1 3.35Å; G185-D188 WeakPolarHBondContact O-CB 3.39Å; G185-D188 PolarHBondContact O-N 3.3Å; D188-L190 PolarHBondContact O-N 3.35Å; D188-S191 WeakPolarHBondContact O-CB 3.31Å; D188-S191 PolarHBondContact O-N 2.9Å; D188-S191 PolarHBondContact O-OG 2.94Å; D188-K213 WeakPolarHBondContact OD1-CD 3.48Å; D188-K213 IonicContact OD1-NZ 2.72Å; D188-K213 WeakPolarHBondContact OD2-CE 2.97Å; D188-K213 IonicContact OD2-NZ 2.66Å; D188-K213 PolarHBondContact OD2-NZ 3.33Å
189	N	91.6	Very high	93.4	Very high	48 Å²	48	31.4 Å²	31.4	26%	0.257	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-69.5	-13.4	179.5	-67.5	-12.9	0	0	0	114.1	F164 H166 F187	F164-N189 PolarHBondContact O-ND2 2.98Å; H166-N189 WeakPolarHBondContact CA-O 3.42Å; H166-N189 PolarHBondContact CE1-OD1 3Å; H166-N189 PolarHBondContact ND1-O 3.22Å; F187-N189 PolarHBondContact O-N 2.86Å; F187-N189 VanDerWaalsContact O-N 3.12Å
190	L	93.5	Very high	93.4	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-103.7	0.2	178.1	-53.5	179.3	0	0	0	113.1	F164 M167 L169 L172 F187 D188 S192 S193 L194	F164-L190 HydrophobicContact CB-CD1 4.35Å; F164-L190 HydrophobicContact CB-CD2 4.05Å; F164-L190 HydrophobicContact CB-CG 4.16Å; F164-L190 HydrophobicContact CD1-CD1 3.98Å; F164-L190 HydrophobicContact CD1-CD2 4.39Å; F164-L190 HydrophobicContact CD2-CD1 4.02Å; F164-L190 HydrophobicContact CE1-CD1 4.25Å; F164-L190 HydrophobicContact CE2-CD1 4.29Å; F164-L190 HydrophobicContact CG-CD1 3.86Å; F164-L190 HydrophobicContact CG-CD2 4.32Å; F164-L190 HydrophobicContact CG-CG 4.22Å; F164-L190 HydrophobicContact CZ-CD1 4.4Å; M167-L190 HydrophobicContact CB-CD2 4.09Å; L169-L190 HydrophobicContact CB-CD2 4.18Å; L169-L190 HydrophobicContact CD2-CD1 4.23Å; L172-L190 HydrophobicContact CD2-CD1 4.13Å; F187-L190 PolarHBondContact O-N 3.34Å; D188-L190 PolarHBondContact O-N 3.35Å; L190-S192 PolarHBondContact O-N 3.28Å; L190-S192 VanDerWaalsContact O-N 3.08Å; L190-S193 PolarHBondContact O-N 2.04Å; L190-L194 HydrophobicContact CB-CB 4.27Å; L190-L194 HydrophobicContact CB-CD2 3.86Å; L190-L194 HydrophobicContact CD1-CD2 3.89Å; L190-L194 WeakPolarHBondContact O-CB 3.26Å; L190-L194 PolarHBondContact O-N 2.7Å
191	S	91.6	Very high	93.6	Very high	42 Å²	42	35.5 Å²	35.5	29%	0.294	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-28.1	-171.1	53.1	0	0	0	0	116.2	D188 S193 K213	D188-S191 WeakPolarHBondContact O-CB 3.31Å; D188-S191 PolarHBondContact O-N 2.9Å; D188-S191 PolarHBondContact O-OG 2.94Å; S191-S193 VanDerWaalsContact C-N 3.35Å; S191-S193 PolarHBondContact O-N 3.16Å; S191-K213 WeakPolarHBondContact CB-O 3.45Å
192	S	91.7	Very high	94	Very high	58 Å²	58	32.4 Å²	32.4	41%	0.406	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-14.1	-173.4	54.2	0	0	0	0	115.9	Q168 L190	Q168-S192 PolarHBondContact NE2-OG 2.8Å; Q168-S192 PolarHBondContact OE1-OG 3.33Å; L190-S192 PolarHBondContact O-N 3.28Å; L190-S192 VanDerWaalsContact O-N 3.08Å
193	S	93.6	Very high	94.2	Very high	16 Å²	16	37 Å²	37	11%	0.112	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-156.5	-4.9	-171.3	42.7	0	0	0	0	116.9	Q168 L169 L190 S191 L195	Q168-S193 VanDerWaalsContact C-OG 3.26Å; Q168-S193 VanDerWaalsContact CA-OG 3.22Å; Q168-S193 WeakPolarHBondContact CA-OG 3.05Å; Q168-S193 PolarHBondContact OE1-OG 3.16Å; L169-S193 CarbonylContact O-C 3.52Å; L190-S193 PolarHBondContact O-N 2.04Å; S191-S193 VanDerWaalsContact C-N 3.35Å; S191-S193 PolarHBondContact O-N 3.16Å; S193-L195 WeakPolarHBondContact O-CG 3.35Å; S193-L195 PolarHBondContact O-N 2.78Å
194	L	96.4	Very high	94.4	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	18%	0.18	C	C	.	.			trans	-70.6	114.9	-176.3	-167.5	60.7	0	0	0	111.7	L169 L172 L190 V197 L214 H216 L217	L169-L194 HydrophobicContact CD2-CD1 4.32Å; L169-L194 HydrophobicContact CG-CD1 4.38Å; L169-L194 WeakPolarHBondContact O-CA 3.44Å; L169-L194 WeakPolarHBondContact O-CD1 3.02Å; L169-L194 PolarHBondContact O-N 3.05Å; L172-L194 HydrophobicContact CB-CD1 3.99Å; L190-L194 HydrophobicContact CB-CB 4.27Å; L190-L194 HydrophobicContact CB-CD2 3.86Å; L190-L194 HydrophobicContact CD1-CD2 3.89Å; L190-L194 WeakPolarHBondContact O-CB 3.26Å; L190-L194 PolarHBondContact O-N 2.7Å; L194-V197 HydrophobicContact CD1-CG2 4.32Å; L194-V197 HydrophobicContact CD2-CG2 3.45Å; L194-V197 VanDerWaalsContact CD2-CG2 3.45Å; L194-V197 HydrophobicContact CG-CG2 3.82Å; L194-L214 HydrophobicContact CD2-CD1 4.08Å; L194-L214 HydrophobicContact CD2-CD2 4.26Å; L194-H216 CarbonylContact O-C 3.43Å; L194-L217 HydrophobicContact CG-CD1 4.19Å; L194-L217 WeakPolarHBondContact O-CA 3.47Å; L194-L217 PolarHBondContact O-N 2.99Å
195	L	97.7	Very high	94.7	Very high	58 Å²	58	32.6 Å²	32.6	30%	0.304	17%	0.171	S	C	.	.			trans	-100.8	-31.1	-176.6	-55.1	-177.3	0	0	0	112.8	K170 S193 H216 Q218 F219	K170-L195 HydrophobicContact CB-CG 4.45Å; K170-L195 PolarHBondContact O-N 3.25Å; S193-L195 WeakPolarHBondContact O-CG 3.35Å; S193-L195 PolarHBondContact O-N 2.78Å; L195-H216 HydrophobicContact CD2-CB 4.34Å; L195-H216 WeakPolarHBondContact CD2-O 3.36Å; L195-Q218 PolarHBondContact O-N 3.19Å; L195-F219 PolarHBondContact O-N 2.99Å; L195-F219 VanDerWaalsContact O-N 3.08Å
196	V	98.3	Very high	94.9	Very high	25 Å²	25	38 Å²	38	15%	0.152	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	125.6	-174.8	-176.5	0	0	0	0	111.2	K170 Y171 L172 K198 F219	K170-V196 PolarHBondContact O-N 3.43Å; K170-V196 VanDerWaalsContact O-N 3.07Å; Y171-V196 HydrophobicContact CD2-CB 3.74Å; Y171-V196 HydrophobicContact CD2-CG1 3.75Å; Y171-V196 HydrophobicContact CD2-CG2 4.23Å; Y171-V196 HydrophobicContact CE2-CB 4.35Å; Y171-V196 HydrophobicContact CE2-CG1 3.83Å; Y171-V196 HydrophobicContact CG-CB 4.5Å; L172-V196 PolarHBondContact N-O 3.08Å; V196-K198 HydrophobicContact CG1-CG 4.08Å; V196-F219 WeakPolarHBondContact CA-O 3.43Å; V196-F219 HydrophobicContact CG1-CB 4.28Å; V196-F219 HydrophobicContact CG2-CB 4.26Å; V196-F219 HydrophobicContact CG2-CD2 4.03Å; V196-F219 HydrophobicContact CG2-CG 4.5Å
197	V	97.7	Very high	94.8	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	127	171.9	170.4	0	0	0	0	110.1	L172 L194 L199 L217 F219 L220 E221	L172-V197 WeakPolarHBondContact O-CA 3.4Å; L194-V197 HydrophobicContact CD1-CG2 4.32Å; L194-V197 HydrophobicContact CD2-CG2 3.45Å; L194-V197 VanDerWaalsContact CD2-CG2 3.45Å; L194-V197 HydrophobicContact CG-CG2 3.82Å; V197-L199 HydrophobicContact CG1-CD1 3.87Å; V197-L199 HydrophobicContact CG1-CG 3.9Å; V197-L217 HydrophobicContact CB-CD1 4.17Å; V197-L217 HydrophobicContact CG2-CD1 3.7Å; V197-F219 PolarHBondContact N-O 2.96Å; V197-L220 HydrophobicContact CB-CD1 3.98Å; V197-L220 HydrophobicContact CG1-CD1 3.81Å; V197-E221 PolarHBondContact O-N 3.33Å
198	K	98.6	Very high	94.3	Very high	48 Å²	48	40.3 Å²	40.3	21%	0.209	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	110.2	176.8	-50.9	-167.9	-175.5	-139	0	111.2	L172 N173 L174 S175 V196 E221	L172-K198 PolarHBondContact O-N 3.29Å; N173-K198 HydrophobicContact CB-CB 4.41Å; L174-K198 CarbonylContact C-O 3.42Å; L174-K198 WeakPolarHBondContact CA-O 3.23Å; L174-K198 PolarHBondContact N-O 3.2Å; S175-K198 PolarHBondContact N-O 2.98Å; S175-K198 WeakPolarHBondContact OG-CB 3.23Å; V196-K198 HydrophobicContact CG1-CG 4.08Å; K198-E221 HydrophobicContact CB-CB 4.45Å; K198-E221 VanDerWaalsContact CD-OE1 3.3Å; K198-E221 WeakPolarHBondContact CD-OE1 3.4Å; K198-E221 WeakPolarHBondContact CE-OE1 3.4Å; K198-E221 HydrophobicContact CG-CB 4.42Å; K198-E221 HydrophobicContact CG-CG 4.24Å; K198-E221 IonicContact NZ-OE1 2.85Å; K198-E221 PolarHBondContact NZ-OE1 3.15Å
199	L	97.6	Very high	93.9	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.			trans	-113.4	17.1	-179.9	-71	164.3	0	0	0	112.2	I159 L174 I179 L182 F187 V197 N202 I204 E221 L222 N225	I159-L199 HydrophobicContact CD1-CD2 3.95Å; L174-L199 HydrophobicContact CB-CD2 4.03Å; L174-L199 HydrophobicContact CD1-CD2 4.2Å; I179-L199 HydrophobicContact CD1-CD2 4.14Å; L182-L199 HydrophobicContact CD1-CD1 4.43Å; F187-L199 HydrophobicContact CZ-CD1 4.16Å; V197-L199 HydrophobicContact CG1-CD1 3.87Å; V197-L199 HydrophobicContact CG1-CG 3.9Å; L199-N202 PolarHBondContact O-ND2 3.32Å; L199-I204 HydrophobicContact CB-CD1 4.15Å; L199-E221 WeakPolarHBondContact CA-O 3.32Å; L199-E221 PolarHBondContact N-O 2.9Å; L199-L222 HydrophobicContact CB-CD2 4Å; L199-L222 HydrophobicContact CD1-CD2 3.97Å; L199-N225 PolarHBondContact O-ND2 3.08Å
200	N	97.7	Very high	93.3	Very high	13 Å²	13	44.7 Å²	44.7	7%	0.07	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	154.9	-176.2	-60.6	-50.5	0	0	0	114	S175 N176 N202 E221 K223	S175-N200 CarbonylContact C-O 3.57Å; S175-N200 WeakPolarHBondContact CA-O 3.12Å; S175-N200 PolarHBondContact OG-ND2 2.95Å; N176-N200 PolarHBondContact N-O 3.29Å; N200-N202 PolarHBondContact O-N 2.6Å; N200-N202 VanDerWaalsContact O-N 3.14Å; N200-N202 PolarHBondContact O-ND2 2.76Å; N200-E221 WeakPolarHBondContact ND2-CB 3.25Å; N200-E221 PolarHBondContact ND2-OE2 2.92Å; N200-E221 WeakPolarHBondContact OD1-CB 3.3Å; N200-K223 CarbonylContact C-O 3.4Å; N200-K223 VanDerWaalsContact CA-O 3.23Å; N200-K223 WeakPolarHBondContact CA-O 3.44Å; N200-K223 HydrophobicContact CB-CG 4.36Å; N200-K223 WeakPolarHBondContact OD1-CD 3.45Å; N200-K223 WeakPolarHBondContact OD1-CG 3.18Å; N200-K223 PolarHBondContact OD1-N 3.28Å; N200-K223 VanDerWaalsContact OD1-N 3.09Å
201	R	97.9	Very high	92.9	Very high	135 Å²	135	44.9 Å²	44.9	51%	0.509	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	32.3	171.6	-56.8	-177.2	-171.3	-172.5	4.5	114.1	N176 K223 R224	N176-R201 HydrophobicContact CB-CB 4.25Å; R201-K223 PolarHBondContact N-O 2.8Å; R201-R224 VanDerWaalsContact CA-O 3.28Å; R201-R224 WeakPolarHBondContact CA-O 3.19Å; R201-R224 HydrophobicContact CG-CB 4.04Å
202	N	98.2	Very high	92.5	Very high	8 Å²	8	42.9 Å²	42.9	4%	0.043	22%	0.218	C	C	.	.	S	Bend	trans	-97.5	-158.6	173.9	-85	-72.4	0	0	0	110	L174 N177 R178 I179 L199 N200 I204 N225	L174-N202 PolarHBondContact O-ND2 2.87Å; N177-N202 VanDerWaalsContact CA-OD1 3.23Å; N177-N202 WeakPolarHBondContact CA-OD1 3.27Å; N177-N202 WeakPolarHBondContact CB-OD1 3.33Å; N177-N202 PolarHBondContact N-OD1 2.93Å; N177-N202 PolarHBondContact O-OD1 2.97Å; R178-N202 PolarHBondContact N-OD1 3.2Å; I179-N202 HydrophobicContact CB-CB 4.09Å; I179-N202 WeakPolarHBondContact CB-OD1 3.25Å; I179-N202 WeakPolarHBondContact CG1-OD1 3.37Å; I179-N202 PolarHBondContact N-OD1 3.35Å; L199-N202 PolarHBondContact O-ND2 3.32Å; N200-N202 PolarHBondContact O-N 2.6Å; N200-N202 VanDerWaalsContact O-N 3.14Å; N200-N202 PolarHBondContact O-ND2 2.76Å; N202-I204 HydrophobicContact CB-CD1 4.32Å; N202-I204 HydrophobicContact CB-CG1 4.25Å; N202-N225 VanDerWaalsContact CA-OD1 3.24Å; N202-N225 WeakPolarHBondContact CA-OD1 3.47Å; N202-N225 WeakPolarHBondContact CB-OD1 3.32Å; N202-N225 PolarHBondContact N-OD1 2.83Å; N202-N225 PolarHBondContact O-OD1 2.99Å
203	R	97.2	Very high	92.4	Very high	112 Å²	112	45.6 Å²	45.6	42%	0.423	22%	0.223	S	C	.	.			trans	-123.3	16.7	-176.6	-58.5	179.3	178.7	-171.2	-3.7	112.4	I179 T180 S205 N225	I179-R203 CarbonylContact O-C 3.58Å; I179-R203 VanDerWaalsContact O-CA 3.26Å; I179-R203 WeakPolarHBondContact O-CA 3.27Å; I179-R203 WeakPolarHBondContact O-CB 3.16Å; I179-R203 PolarHBondContact O-N 3.3Å; T180-R203 HydrophobicContact CG2-CB 3.7Å; R203-S205 PolarHBondContact O-N 3.09Å; R203-N225 PolarHBondContact N-OD1 2.6Å
204	I	96.4	Very high	92.4	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	22%	0.218	C	C	.	.			trans	-61.5	120.2	-175.2	-58.1	165.5	0	0	0	108.9	I179 L182 L199 N202 M206 L222 N225 R226 I227	I179-I204 HydrophobicContact CG2-CD1 4.45Å; I179-I204 HydrophobicContact CG2-CG1 4.13Å; I179-I204 WeakPolarHBondContact O-CG1 3.5Å; I179-I204 PolarHBondContact O-N 3.37Å; L182-I204 HydrophobicContact CD1-CD1 4.18Å; L182-I204 HydrophobicContact CD2-CD1 4.49Å; L182-I204 HydrophobicContact CG-CD1 4.43Å; L199-I204 HydrophobicContact CB-CD1 4.15Å; N202-I204 HydrophobicContact CB-CD1 4.32Å; N202-I204 HydrophobicContact CB-CG1 4.25Å; I204-M206 VanDerWaalsContact CG2-O 3.24Å; I204-M206 WeakPolarHBondContact CG2-O 3.05Å; I204-L222 HydrophobicContact CD1-CD2 4.36Å; I204-N225 HydrophobicContact CB-CB 4.26Å; I204-N225 WeakPolarHBondContact CB-OD1 3.13Å; I204-N225 WeakPolarHBondContact CG1-OD1 3.03Å; I204-N225 PolarHBondContact N-OD1 3.41Å; I204-R226 CarbonylContact O-C 3.55Å; I204-R226 VanDerWaalsContact O-C 3.32Å; I204-R226 WeakPolarHBondContact O-CA 3.28Å; I204-R226 WeakPolarHBondContact O-CB 3.32Å; I204-R226 PolarHBondContact O-N 3.05Å; I204-I227 HydrophobicContact CG2-CG1 4.36Å; I204-I227 PolarHBondContact O-N 3.1Å
205	S	92.9	Very high	92.3	Very high	61 Å²	61	47 Å²	47	43%	0.427	23%	0.231	S	C	.	.			trans	-101.7	-18.8	-177.2	55.7	0	0	0	0	114.4	R203	R203-S205 PolarHBondContact O-N 3.09Å
206	M	88.6	Confident	92.2	Very high	127 Å²	127	48.6 Å²	48.6	63%	0.626	24%	0.237	S	C	*	.			trans	-148.2	154	179.1	62	177.2	69.5	0	0	109.6	I204	I204-M206 VanDerWaalsContact CG2-O 3.24Å; I204-M206 WeakPolarHBondContact CG2-O 3.05Å
207	I	90.4	Very high	92.2	Very high	12 Å²	12	47.4 Å²	47.4	6%	0.062	23%	0.23	C	C	.	.			trans	-117.5	117.8	167.9	-56.8	179.6	0	0	0	106.3	I211 F212 L222 I227 T234 F235 M246	I207-I211 HydrophobicContact CG2-CG2 3.58Å; I207-F212 HydrophobicContact CG2-CE2 3.96Å; I207-L222 HydrophobicContact CD1-CD1 3.68Å; I207-L222 HydrophobicContact CD1-CD2 4.28Å; I207-I227 HydrophobicContact CD1-CD1 3.72Å; I207-I227 HydrophobicContact CG1-CD1 4Å; I207-I227 HydrophobicContact CG1-CG1 4.47Å; I207-T234 HydrophobicContact CB-CG2 3.77Å; I207-T234 HydrophobicContact CG2-CG2 3.5Å; I207-F235 HydrophobicContact CD1-CE1 4.04Å; I207-F235 HydrophobicContact CD1-CZ 3.95Å; I207-M246 HydrophobicContact CD1-CE 4.37Å
208	P	82.2	Confident	92.2	Very high	40 Å²	40	50.5 Å²	50.5	26%	0.26	24%	0.244	S	C	.	.			trans	-61.2	141.6	175.6	-24.7	35.1	0	0	0	111.7	K210 I211	P208-K210 PolarHBondContact O-N 3.4Å; P208-I211 HydrophobicContact CB-CB 4.38Å; P208-I211 HydrophobicContact CB-CD1 4.38Å; P208-I211 HydrophobicContact CG-CD1 3.96Å; P208-I211 WeakPolarHBondContact O-CB 3.14Å; P208-I211 VanDerWaalsContact O-CG2 3.3Å; P208-I211 WeakPolarHBondContact O-CG2 3.48Å; P208-I211 PolarHBondContact O-N 3.01Å
209	P	81	Confident	92.2	Very high	76 Å²	76	52.1 Å²	52.1	49%	0.494	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	138.2	177	-26.2	35	0	0	0	112.6	I211 E231	P209-I211 PolarHBondContact O-N 2.76Å; P209-E231 HydrophobicContact CG-CB 4.24Å
210	K	79.3	Confident	92.2	Very high	104 Å²	104	52.1 Å²	52.1	45%	0.452	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	25.8	176.7	-39	-171.2	-173.7	-151.3	0	115	P208 F212 L233 T234 Q236	P208-K210 PolarHBondContact O-N 3.4Å; K210-F212 PolarHBondContact O-N 3.16Å; K210-L233 PolarHBondContact N-O 3.03Å; K210-T234 PolarHBondContact N-O 2.96Å; K210-Q236 HydrophobicContact CG-CB 4.42Å
211	I	84.8	Confident	92.2	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.021	25%	0.253	C	S	.	.			trans	-66.3	-23.8	-179.6	-173.4	161.7	0	0	0	113.8	L182 E183 I207 P208 P209	L182-I211 HydrophobicContact CB-CD1 3.52Å; E183-I211 WeakPolarHBondContact O-CD1 3.01Å; I207-I211 HydrophobicContact CG2-CG2 3.58Å; P208-I211 HydrophobicContact CB-CB 4.38Å; P208-I211 HydrophobicContact CB-CD1 4.38Å; P208-I211 HydrophobicContact CG-CD1 3.96Å; P208-I211 WeakPolarHBondContact O-CB 3.14Å; P208-I211 VanDerWaalsContact O-CG2 3.3Å; P208-I211 WeakPolarHBondContact O-CG2 3.48Å; P208-I211 PolarHBondContact O-N 3.01Å; P209-I211 PolarHBondContact O-N 2.76Å
212	F	84.9	Confident	92.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.229	C	C	.	.			trans	-103.3	110.3	-175.9	-57.4	-74.3	0	0	0	112.2	F187 I207 K210 L214 L220 F235 G237 L238	F187-F212 AromaticContact CD2-CD1 3.89Å; F187-F212 HydrophobicContact CD2-CD1 3.89Å; F187-F212 AromaticContact CD2-CE1 3.9Å; F187-F212 HydrophobicContact CD2-CE1 3.9Å; F187-F212 HydrophobicContact CE2-CD1 4.19Å; F187-F212 AromaticContact CE2-CE1 3.7Å; F187-F212 HydrophobicContact CE2-CE1 3.7Å; I207-F212 HydrophobicContact CG2-CE2 3.96Å; K210-F212 PolarHBondContact O-N 3.16Å; F212-L214 HydrophobicContact CD1-CD1 4.07Å; F212-L220 HydrophobicContact CE1-CD2 4.41Å; F212-L220 HydrophobicContact CE2-CD2 3.98Å; F212-L220 HydrophobicContact CZ-CD1 4.47Å; F212-L220 HydrophobicContact CZ-CD2 3.93Å; F212-F235 HydrophobicContact CD2-CD1 4.13Å; F212-F235 AromaticContact CE2-CD1 3.98Å; F212-F235 HydrophobicContact CE2-CD1 3.98Å; F212-F235 HydrophobicContact CE2-CE1 4.02Å; F212-G237 CarbonylContact O-C 3.56Å; F212-G237 WeakPolarHBondContact O-CA 3.28Å; F212-L238 HydrophobicContact CB-CD1 4.11Å; F212-L238 HydrophobicContact CB-CD2 3.46Å; F212-L238 VanDerWaalsContact CB-CD2 3.46Å; F212-L238 HydrophobicContact CB-CG 3.71Å; F212-L238 HydrophobicContact CD2-CD1 3.93Å; F212-L238 HydrophobicContact CD2-CG 4.44Å; F212-L238 HydrophobicContact CG-CD1 4.1Å; F212-L238 HydrophobicContact CG-CD2 4.1Å; F212-L238 HydrophobicContact CG-CG 4.27Å
213	K	89.6	Confident	92.1	Very high	116 Å²	116	48.1 Å²	48.1	50%	0.504	24%	0.237	S	C	.	.			trans	-102.9	62	166.2	-57.5	177.8	-158.2	149.4	0	109.7	D188 S191 P215	D188-K213 WeakPolarHBondContact OD1-CD 3.48Å; D188-K213 IonicContact OD1-NZ 2.72Å; D188-K213 WeakPolarHBondContact OD2-CE 2.97Å; D188-K213 IonicContact OD2-NZ 2.66Å; D188-K213 PolarHBondContact OD2-NZ 3.33Å; S191-K213 WeakPolarHBondContact CB-O 3.45Å; K213-P215 VanDerWaalsContact C-CD 3.48Å; K213-P215 WeakPolarHBondContact O-CD 3.34Å
214	L	93.7	Very high	92.2	Very high	1 Å²	1	48 Å²	48	1%	0.005	24%	0.237	C	C	.	.			trans	-120.9	70.9	-174.1	-54.6	174	0	0	0	109.4	F187 L194 F212 H216 L217 G237 L238	F187-L214 HydrophobicContact CB-CD1 3.98Å; F187-L214 HydrophobicContact CB-CD2 3.92Å; F187-L214 HydrophobicContact CB-CG 4.27Å; F187-L214 HydrophobicContact CG-CD1 4.39Å; F187-L214 WeakPolarHBondContact O-CD2 3.37Å; L194-L214 HydrophobicContact CD2-CD1 4.08Å; L194-L214 HydrophobicContact CD2-CD2 4.26Å; F212-L214 HydrophobicContact CD1-CD1 4.07Å; L214-H216 PolarHBondContact O-N 2.9Å; L214-H216 VanDerWaalsContact O-N 3.07Å; L214-L217 HydrophobicContact CB-CB 3.83Å; L214-L217 HydrophobicContact CB-CD2 4.49Å; L214-L217 HydrophobicContact CD1-CD1 4.47Å; L214-L217 HydrophobicContact CD1-CD2 4.07Å; L214-L217 VanDerWaalsContact O-CB 3.31Å; L214-L217 WeakPolarHBondContact O-CB 3.39Å; L214-L217 PolarHBondContact O-N 2.97Å; L214-G237 CarbonylContact C-O 3.15Å; L214-G237 VanDerWaalsContact C-O 3.25Å; L214-G237 PolarHBondContact N-O 2.88Å; L214-L238 HydrophobicContact CB-CD2 3.71Å; L214-L238 HydrophobicContact CD1-CD2 4.48Å; L214-L238 HydrophobicContact CG-CD2 4.45Å
215	P	94.1	Very high	92.3	Very high	44 Å²	44	48.5 Å²	48.5	29%	0.286	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-20.6	-169.7	26.8	-36.3	0	0	0	113.3	K213 S240	K213-P215 VanDerWaalsContact C-CD 3.48Å; K213-P215 WeakPolarHBondContact O-CD 3.34Å; P215-S240 WeakPolarHBondContact O-CB 3.18Å; P215-S240 PolarHBondContact O-N 2.61Å; P215-S240 PolarHBondContact O-OG 2.86Å
216	H	95.8	Very high	92.4	Very high	92 Å²	92	52.5 Å²	52.5	43%	0.426	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-2.3	177.6	-59.7	-54.3	0	0	0	114.5	L194 L195 L214 Q218	L194-H216 CarbonylContact O-C 3.43Å; L195-H216 HydrophobicContact CD2-CB 4.34Å; L195-H216 WeakPolarHBondContact CD2-O 3.36Å; L214-H216 PolarHBondContact O-N 2.9Å; L214-H216 VanDerWaalsContact O-N 3.07Å; H216-Q218 PolarHBondContact O-N 2.71Å
217	L	97.1	Very high	92.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.215	C	C	.	.			trans	-66.4	129.9	-179.7	-167	74.8	0	0	0	110.2	L194 V197 L214 L220 L238 S240 L241	L194-L217 HydrophobicContact CG-CD1 4.19Å; L194-L217 WeakPolarHBondContact O-CA 3.47Å; L194-L217 PolarHBondContact O-N 2.99Å; V197-L217 HydrophobicContact CB-CD1 4.17Å; V197-L217 HydrophobicContact CG2-CD1 3.7Å; L214-L217 HydrophobicContact CB-CB 3.83Å; L214-L217 HydrophobicContact CB-CD2 4.49Å; L214-L217 HydrophobicContact CD1-CD1 4.47Å; L214-L217 HydrophobicContact CD1-CD2 4.07Å; L214-L217 VanDerWaalsContact O-CB 3.31Å; L214-L217 WeakPolarHBondContact O-CB 3.39Å; L214-L217 PolarHBondContact O-N 2.97Å; L217-L220 HydrophobicContact CD2-CB 4.02Å; L217-L220 HydrophobicContact CD2-CD1 4.48Å; L217-L220 HydrophobicContact CD2-CD2 4.48Å; L217-L238 HydrophobicContact CB-CD2 4.04Å; L217-L238 HydrophobicContact CD2-CD1 4.4Å; L217-L238 HydrophobicContact CD2-CD2 3.65Å; L217-L238 HydrophobicContact CG-CD2 4.48Å; L217-S240 CarbonylContact O-C 3.41Å; L217-L241 HydrophobicContact CB-CD1 4.45Å; L217-L241 HydrophobicContact CD2-CD1 3.97Å; L217-L241 HydrophobicContact CG-CD1 4.03Å; L217-L241 WeakPolarHBondContact O-CA 3.46Å; L217-L241 PolarHBondContact O-N 3.3Å
218	Q	97.8	Very high	93	Very high	66 Å²	66	52.6 Å²	52.6	31%	0.308	24%	0.242	S	C	.	.			trans	-108.4	-32.3	-179.3	-66.4	176.9	6.7	0	0	112.2	L195 H216 R242 S243	L195-Q218 PolarHBondContact O-N 3.19Å; H216-Q218 PolarHBondContact O-N 2.71Å; Q218-R242 PolarHBondContact O-N 3.02Å; Q218-S243 PolarHBondContact O-N 2.94Å
219	F	98.4	Very high	93.6	Very high	83 Å²	83	54.4 Å²	54.4	36%	0.364	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.8	-175.6	-58.2	-92.8	0	0	0	111.5	L195 V196 V197 S243	L195-F219 PolarHBondContact O-N 2.99Å; L195-F219 VanDerWaalsContact O-N 3.08Å; V196-F219 WeakPolarHBondContact CA-O 3.43Å; V196-F219 HydrophobicContact CG1-CB 4.28Å; V196-F219 HydrophobicContact CG2-CB 4.26Å; V196-F219 HydrophobicContact CG2-CD2 4.03Å; V196-F219 HydrophobicContact CG2-CG 4.5Å; V197-F219 PolarHBondContact N-O 2.96Å; F219-S243 VanDerWaalsContact CD1-CB 3.47Å
220	L	97.9	Very high	94.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	112.5	176	178.7	55.1	0	0	0	110.6	V197 F212 L217 L222 F235 L238 L241 S243 L244 K245	V197-L220 HydrophobicContact CB-CD1 3.98Å; V197-L220 HydrophobicContact CG1-CD1 3.81Å; F212-L220 HydrophobicContact CE1-CD2 4.41Å; F212-L220 HydrophobicContact CE2-CD2 3.98Å; F212-L220 HydrophobicContact CZ-CD1 4.47Å; F212-L220 HydrophobicContact CZ-CD2 3.93Å; L217-L220 HydrophobicContact CD2-CB 4.02Å; L217-L220 HydrophobicContact CD2-CD1 4.48Å; L217-L220 HydrophobicContact CD2-CD2 4.48Å; L220-L222 HydrophobicContact CD1-CD1 4.32Å; L220-L222 HydrophobicContact CD1-CG 4.21Å; L220-L222 HydrophobicContact CD2-CD1 3.9Å; L220-L222 HydrophobicContact CG-CD1 3.89Å; L220-L222 HydrophobicContact CG-CG 4.18Å; L220-F235 HydrophobicContact CD2-CD1 4.24Å; L220-F235 HydrophobicContact CD2-CE1 4.11Å; L220-L238 HydrophobicContact CD2-CD1 3.73Å; L220-L241 HydrophobicContact CB-CD1 3.85Å; L220-L241 HydrophobicContact CB-CD2 4.49Å; L220-S243 PolarHBondContact N-O 3.07Å; L220-L244 HydrophobicContact CB-CD1 4.08Å; L220-L244 HydrophobicContact CD2-CD1 3.98Å; L220-L244 HydrophobicContact CG-CD1 3.98Å; L220-L244 WeakPolarHBondContact O-CA 3.16Å; L220-K245 PolarHBondContact O-N 2.88Å
221	E	98.3	Very high	94.7	Very high	22 Å²	22	49.3 Å²	49.3	10%	0.103	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	118.5	176.7	-50.9	-170.5	-141.9	0	0	112.2	V197 K198 L199 N200 K223 K245	V197-E221 PolarHBondContact O-N 3.33Å; K198-E221 HydrophobicContact CB-CB 4.45Å; K198-E221 VanDerWaalsContact CD-OE1 3.3Å; K198-E221 WeakPolarHBondContact CD-OE1 3.4Å; K198-E221 WeakPolarHBondContact CE-OE1 3.4Å; K198-E221 HydrophobicContact CG-CB 4.42Å; K198-E221 HydrophobicContact CG-CG 4.24Å; K198-E221 IonicContact NZ-OE1 2.85Å; K198-E221 PolarHBondContact NZ-OE1 3.15Å; L199-E221 WeakPolarHBondContact CA-O 3.32Å; L199-E221 PolarHBondContact N-O 2.9Å; N200-E221 WeakPolarHBondContact ND2-CB 3.25Å; N200-E221 PolarHBondContact ND2-OE2 2.92Å; N200-E221 WeakPolarHBondContact OD1-CB 3.3Å; E221-K223 VanDerWaalsContact OE2-CE 3.29Å; E221-K223 WeakPolarHBondContact OE2-CE 3.45Å; E221-K223 IonicContact OE2-NZ 2.67Å; E221-K223 PolarHBondContact OE2-NZ 2.77Å; E221-K245 HydrophobicContact CB-CB 4.34Å; E221-K245 HydrophobicContact CG-CB 4.27Å; E221-K245 HydrophobicContact CG-CD 4.18Å; E221-K245 HydrophobicContact CG-CG 4.43Å
222	L	97.4	Very high	94.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.23	C	C	.	.			trans	-122	12.4	-176.9	-77.5	160	0	0	0	112.4	L199 I204 I207 L220 N225 F235 L244 K245 M246 N249	L199-L222 HydrophobicContact CB-CD2 4Å; L199-L222 HydrophobicContact CD1-CD2 3.97Å; I204-L222 HydrophobicContact CD1-CD2 4.36Å; I207-L222 HydrophobicContact CD1-CD1 3.68Å; I207-L222 HydrophobicContact CD1-CD2 4.28Å; L220-L222 HydrophobicContact CD1-CD1 4.32Å; L220-L222 HydrophobicContact CD1-CG 4.21Å; L220-L222 HydrophobicContact CD2-CD1 3.9Å; L220-L222 HydrophobicContact CG-CD1 3.89Å; L220-L222 HydrophobicContact CG-CG 4.18Å; L222-N225 WeakPolarHBondContact O-CB 3.32Å; L222-N225 PolarHBondContact O-ND2 2.87Å; L222-F235 HydrophobicContact CD1-CE1 4.01Å; L222-F235 HydrophobicContact CD1-CZ 4.35Å; L222-L244 HydrophobicContact CD1-CD1 4.2Å; L222-K245 CarbonylContact C-O 3.55Å; L222-K245 WeakPolarHBondContact CA-O 3.48Å; L222-K245 PolarHBondContact N-O 2.85Å; L222-M246 HydrophobicContact CB-CG 4.27Å; L222-M246 HydrophobicContact CD1-CG 4.47Å; L222-N249 PolarHBondContact O-ND2 3.24Å
223	K	97.3	Very high	95.1	Very high	50 Å²	50	53 Å²	53	22%	0.217	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	150.3	-166.8	80.7	-132.9	-175.5	-179.2	0	114.3	N200 R201 E221 N225 K245 Q247	N200-K223 CarbonylContact C-O 3.4Å; N200-K223 VanDerWaalsContact CA-O 3.23Å; N200-K223 WeakPolarHBondContact CA-O 3.44Å; N200-K223 HydrophobicContact CB-CG 4.36Å; N200-K223 WeakPolarHBondContact OD1-CD 3.45Å; N200-K223 WeakPolarHBondContact OD1-CG 3.18Å; N200-K223 PolarHBondContact OD1-N 3.28Å; N200-K223 VanDerWaalsContact OD1-N 3.09Å; R201-K223 PolarHBondContact N-O 2.8Å; E221-K223 VanDerWaalsContact OE2-CE 3.29Å; E221-K223 WeakPolarHBondContact OE2-CE 3.45Å; E221-K223 IonicContact OE2-NZ 2.67Å; E221-K223 PolarHBondContact OE2-NZ 2.77Å; K223-N225 VanDerWaalsContact C-N 3.32Å; K223-K245 HydrophobicContact CD-CB 4.23Å; K223-K245 PolarHBondContact N-O 3.41Å; K223-K245 VanDerWaalsContact N-O 3.16Å; K223-Q247 WeakPolarHBondContact CA-O 3.47Å; K223-Q247 HydrophobicContact CB-CG 4Å; K223-Q247 WeakPolarHBondContact CB-O 3.21Å
224	R	97.9	Very high	95.1	Very high	109 Å²	109	47.5 Å²	47.5	41%	0.411	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	40	-174.6	-54.5	178	-172.9	-160.7	1.4	113.1	R201 Q247 R248	R201-R224 VanDerWaalsContact CA-O 3.28Å; R201-R224 WeakPolarHBondContact CA-O 3.19Å; R201-R224 HydrophobicContact CG-CB 4.04Å; R224-Q247 PolarHBondContact N-O 2.94Å; R224-R248 VanDerWaalsContact CA-O 3.32Å; R224-R248 WeakPolarHBondContact CA-O 3.49Å; R224-R248 HydrophobicContact CG-CB 3.79Å; R224-R248 HydrophobicContact CG-CG 4.48Å
225	N	98	Very high	95.1	Very high	11 Å²	11	47.4 Å²	47.4	6%	0.059	22%	0.22	C	C	.	.	S	Bend	trans	-96.6	-150.6	166.5	-87.4	-76.1	0	0	0	109.7	L199 N202 R203 I204 L222 K223 I227 N249	L199-N225 PolarHBondContact O-ND2 3.08Å; N202-N225 VanDerWaalsContact CA-OD1 3.24Å; N202-N225 WeakPolarHBondContact CA-OD1 3.47Å; N202-N225 WeakPolarHBondContact CB-OD1 3.32Å; N202-N225 PolarHBondContact N-OD1 2.83Å; N202-N225 PolarHBondContact O-OD1 2.99Å; R203-N225 PolarHBondContact N-OD1 2.6Å; I204-N225 HydrophobicContact CB-CB 4.26Å; I204-N225 WeakPolarHBondContact CB-OD1 3.13Å; I204-N225 WeakPolarHBondContact CG1-OD1 3.03Å; I204-N225 PolarHBondContact N-OD1 3.41Å; L222-N225 WeakPolarHBondContact O-CB 3.32Å; L222-N225 PolarHBondContact O-ND2 2.87Å; K223-N225 VanDerWaalsContact C-N 3.32Å; N225-I227 HydrophobicContact CB-CD1 4.38Å; N225-I227 HydrophobicContact CB-CG1 4.36Å; N225-N249 VanDerWaalsContact CA-OD1 3.25Å; N225-N249 WeakPolarHBondContact CA-OD1 3.16Å; N225-N249 WeakPolarHBondContact CB-OD1 3.31Å; N225-N249 PolarHBondContact N-OD1 2.99Å
226	R	96.9	Very high	94.9	Very high	146 Å²	146	48.6 Å²	48.6	55%	0.551	22%	0.222	S	C	*	.			trans	-131.7	23.8	-176	-59.5	178.7	173.7	-168.7	-8.4	112.3	I204 K228 N249	I204-R226 CarbonylContact O-C 3.55Å; I204-R226 VanDerWaalsContact O-C 3.32Å; I204-R226 WeakPolarHBondContact O-CA 3.28Å; I204-R226 WeakPolarHBondContact O-CB 3.32Å; I204-R226 PolarHBondContact O-N 3.05Å; R226-K228 PolarHBondContact O-N 3.07Å; R226-N249 CarbonylContact C-O 3.35Å; R226-N249 PolarHBondContact N-OD1 2.99Å
227	I	96.3	Very high	94.6	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.209	C	C	.	.			trans	-71.3	114.1	-173.2	-57.8	162.3	0	0	0	108.9	I204 I207 N225 I229 V230 M246 N249 G250 I251	I204-I227 HydrophobicContact CG2-CG1 4.36Å; I204-I227 PolarHBondContact O-N 3.1Å; I207-I227 HydrophobicContact CD1-CD1 3.72Å; I207-I227 HydrophobicContact CG1-CD1 4Å; I207-I227 HydrophobicContact CG1-CG1 4.47Å; N225-I227 HydrophobicContact CB-CD1 4.38Å; N225-I227 HydrophobicContact CB-CG1 4.36Å; I227-I229 WeakPolarHBondContact CG2-O 3.47Å; I227-V230 HydrophobicContact CG2-CG2 4.23Å; I227-M246 HydrophobicContact CD1-CE 4.09Å; I227-N249 HydrophobicContact CB-CB 4.21Å; I227-N249 WeakPolarHBondContact CB-OD1 3.23Å; I227-N249 WeakPolarHBondContact CD1-OD1 3.21Å; I227-N249 WeakPolarHBondContact CG1-OD1 3.5Å; I227-N249 PolarHBondContact N-O 2.64Å; I227-N249 PolarHBondContact N-OD1 3.35Å; I227-N249 VanDerWaalsContact N-OD1 3.07Å; I227-G250 CarbonylContact O-C 3.44Å; I227-I251 HydrophobicContact CG2-CG1 4.48Å; I227-I251 WeakPolarHBondContact O-CA 3.23Å; I227-I251 WeakPolarHBondContact O-CG1 3.34Å; I227-I251 PolarHBondContact O-N 3.05Å
228	K	94.5	Very high	94.5	Very high	141 Å²	141	45 Å²	45	61%	0.613	21%	0.209	S	C	*	.			trans	-92.3	-31.7	178.7	-67.8	-169.7	174.9	-170.5	0	114	R226 I251 S252 K253	R226-K228 PolarHBondContact O-N 3.07Å; K228-I251 WeakPolarHBondContact O-CA 3.45Å; K228-S252 PolarHBondContact O-N 2.94Å; K228-K253 PolarHBondContact O-N 2.84Å
229	I	93.8	Very high	94.1	Very high	77 Å²	77	45 Å²	45	40%	0.395	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	139	-174.9	-54.3	-179.9	0	0	0	108.6	I227 E231 K253	I227-I229 WeakPolarHBondContact CG2-O 3.47Å; I229-E231 WeakPolarHBondContact CG2-OE1 3.41Å; I229-K253 VanDerWaalsContact CA-O 3.31Å; I229-K253 WeakPolarHBondContact CA-O 3.15Å; I229-K253 HydrophobicContact CG1-CB 4.4Å
230	V	94.7	Very high	94	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.018	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.8	166.5	-174.3	0	0	0	0	107.6	I227 T234 F235 M246 I251 K253 L254 K255 A258	I227-V230 HydrophobicContact CG2-CG2 4.23Å; V230-T234 HydrophobicContact CG1-CG2 4.06Å; V230-F235 HydrophobicContact CG1-CE2 3.8Å; V230-M246 HydrophobicContact CG2-CE 3.91Å; V230-I251 HydrophobicContact CG2-CD1 4.49Å; V230-I251 HydrophobicContact CG2-CG2 4.48Å; V230-K253 PolarHBondContact N-O 3.09Å; V230-K253 VanDerWaalsContact N-O 3.15Å; V230-L254 HydrophobicContact CB-CD2 3.75Å; V230-L254 HydrophobicContact CG2-CD2 3.65Å; V230-K255 WeakPolarHBondContact O-CB 3.49Å; V230-K255 WeakPolarHBondContact O-CG 3.27Å; V230-K255 PolarHBondContact O-N 3.16Å; V230-A258 HydrophobicContact CB-CB 4.26Å; V230-A258 HydrophobicContact CG1-CB 3.82Å
231	E	89.9	Confident	94	Very high	70 Å²	70	42.8 Å²	42.8	33%	0.327	21%	0.207	S	C	.	.			trans	-84	161.4	-179.1	-72.2	-63.4	145.5	0	0	111.9	P209 I229 T234 K255 A258	P209-E231 HydrophobicContact CG-CB 4.24Å; I229-E231 WeakPolarHBondContact CG2-OE1 3.41Å; E231-T234 PolarHBondContact N-OG1 3.2Å; E231-T234 WeakPolarHBondContact O-CB 3.38Å; E231-T234 PolarHBondContact O-N 3.02Å; E231-T234 PolarHBondContact O-OG1 3.41Å; E231-K255 WeakPolarHBondContact OE1-CE 3.42Å; E231-K255 IonicContact OE1-NZ 2.69Å; E231-K255 PolarHBondContact OE1-NZ 2.79Å; E231-K255 IonicContact OE2-NZ 2.74Å; E231-K255 PolarHBondContact OE2-NZ 2.97Å; E231-A258 WeakPolarHBondContact O-CA 3.49Å
232	G	88.9	Confident	94	Very high	23 Å²	23	46.6 Å²	46.6	24%	0.237	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	142.7	175.6	0	0	0	0	0	111.6	T234 D256	G232-T234 PolarHBondContact O-N 3.07Å; G232-D256 WeakPolarHBondContact CA-O 3.3Å
233	L	88.3	Confident	94.1	Very high	58 Å²	58	46.8 Å²	46.8	30%	0.304	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	20	-178.1	-44.1	177.7	0	0	0	114.9	K210 F235 Q236 G257 F260	K210-L233 PolarHBondContact N-O 3.03Å; L233-F235 PolarHBondContact O-N 2.99Å; L233-Q236 HydrophobicContact CB-CB 4.3Å; L233-Q236 PolarHBondContact O-N 3.07Å; L233-G257 PolarHBondContact N-O 2.99Å; L233-F260 HydrophobicContact CD2-CB 4.2Å; L233-F260 HydrophobicContact CD2-CD1 3.51Å; L233-F260 HydrophobicContact CD2-CE1 4.32Å; L233-F260 HydrophobicContact CD2-CG 4.23Å
234	T	90.2	Very high	94.1	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-41.6	-178.6	-69.9	0	0	0	0	112.4	I207 K210 V230 E231 G232	I207-T234 HydrophobicContact CB-CG2 3.77Å; I207-T234 HydrophobicContact CG2-CG2 3.5Å; K210-T234 PolarHBondContact N-O 2.96Å; V230-T234 HydrophobicContact CG1-CG2 4.06Å; E231-T234 PolarHBondContact N-OG1 3.2Å; E231-T234 WeakPolarHBondContact O-CB 3.38Å; E231-T234 PolarHBondContact O-N 3.02Å; E231-T234 PolarHBondContact O-OG1 3.41Å; G232-T234 PolarHBondContact O-N 3.07Å
235	F	93	Very high	94.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	15.2	-174.5	-57.9	-73.9	0	0	0	114.4	I207 F212 L220 L222 V230 L233 G237 L238 L244 M246 F259 L262	I207-F235 HydrophobicContact CD1-CE1 4.04Å; I207-F235 HydrophobicContact CD1-CZ 3.95Å; F212-F235 HydrophobicContact CD2-CD1 4.13Å; F212-F235 AromaticContact CE2-CD1 3.98Å; F212-F235 HydrophobicContact CE2-CD1 3.98Å; F212-F235 HydrophobicContact CE2-CE1 4.02Å; L220-F235 HydrophobicContact CD2-CD1 4.24Å; L220-F235 HydrophobicContact CD2-CE1 4.11Å; L222-F235 HydrophobicContact CD1-CE1 4.01Å; L222-F235 HydrophobicContact CD1-CZ 4.35Å; V230-F235 HydrophobicContact CG1-CE2 3.8Å; L233-F235 PolarHBondContact O-N 2.99Å; F235-G237 PolarHBondContact O-N 3.4Å; F235-L238 HydrophobicContact CB-CD1 4.19Å; F235-L238 HydrophobicContact CD1-CD1 3.97Å; F235-L238 WeakPolarHBondContact O-CB 3.34Å; F235-L238 PolarHBondContact O-N 3.38Å; F235-L244 HydrophobicContact CD2-CD2 4.21Å; F235-L244 HydrophobicContact CE1-CD1 4.24Å; F235-L244 HydrophobicContact CE1-CD2 4.4Å; F235-L244 HydrophobicContact CE2-CD2 4.05Å; F235-L244 HydrophobicContact CG-CD2 4.45Å; F235-L244 HydrophobicContact CZ-CD1 4.42Å; F235-L244 HydrophobicContact CZ-CD2 4.15Å; F235-M246 HydrophobicContact CE2-CE 4.47Å; F235-M246 HydrophobicContact CE2-SD 4.03Å; F235-M246 HydrophobicContact CZ-CE 3.89Å; F235-M246 HydrophobicContact CZ-SD 3.65Å; F235-F259 AromaticContact CD2-CD1 3.78Å; F235-F259 HydrophobicContact CD2-CD1 3.78Å; F235-F259 HydrophobicContact CD2-CE1 4.19Å; F235-F259 AromaticContact CE2-CD1 3.85Å; F235-F259 HydrophobicContact CE2-CD1 3.85Å; F235-F259 AromaticContact CE2-CE1 3.77Å; F235-F259 HydrophobicContact CE2-CE1 3.77Å; F235-L262 HydrophobicContact CB-CD1 3.95Å; F235-L262 HydrophobicContact CB-CD2 3.81Å; F235-L262 HydrophobicContact CB-CG 3.99Å; F235-L262 HydrophobicContact CD2-CD1 4.45Å; F235-L262 HydrophobicContact CG-CD1 4.34Å
236	Q	90.2	Very high	94.1	Very high	68 Å²	68	39.9 Å²	39.9	32%	0.318	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	128.2	174.4	178.9	170.6	51.6	0	0	110.6	K210 L233	K210-Q236 HydrophobicContact CG-CB 4.42Å; L233-Q236 HydrophobicContact CB-CB 4.3Å; L233-Q236 PolarHBondContact O-N 3.07Å
237	G	89.4	Confident	94.1	Very high	16 Å²	16	33.7 Å²	33.7	17%	0.165	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	103	9.1	-174.5	0	0	0	0	0	114.8	F212 L214 F235	F212-G237 CarbonylContact O-C 3.56Å; F212-G237 WeakPolarHBondContact O-CA 3.28Å; L214-G237 CarbonylContact C-O 3.15Å; L214-G237 VanDerWaalsContact C-O 3.25Å; L214-G237 PolarHBondContact N-O 2.88Å; F235-G237 PolarHBondContact O-N 3.4Å
238	L	94.4	Very high	94.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.			trans	-107.7	53.2	172.5	-66	-173.7	0	0	0	111.3	F212 L214 L217 L220 F235 S240 L241 L262	F212-L238 HydrophobicContact CB-CD1 4.11Å; F212-L238 HydrophobicContact CB-CD2 3.46Å; F212-L238 VanDerWaalsContact CB-CD2 3.46Å; F212-L238 HydrophobicContact CB-CG 3.71Å; F212-L238 HydrophobicContact CD2-CD1 3.93Å; F212-L238 HydrophobicContact CD2-CG 4.44Å; F212-L238 HydrophobicContact CG-CD1 4.1Å; F212-L238 HydrophobicContact CG-CD2 4.1Å; F212-L238 HydrophobicContact CG-CG 4.27Å; L214-L238 HydrophobicContact CB-CD2 3.71Å; L214-L238 HydrophobicContact CD1-CD2 4.48Å; L214-L238 HydrophobicContact CG-CD2 4.45Å; L217-L238 HydrophobicContact CB-CD2 4.04Å; L217-L238 HydrophobicContact CD2-CD1 4.4Å; L217-L238 HydrophobicContact CD2-CD2 3.65Å; L217-L238 HydrophobicContact CG-CD2 4.48Å; L220-L238 HydrophobicContact CD2-CD1 3.73Å; F235-L238 HydrophobicContact CB-CD1 4.19Å; F235-L238 HydrophobicContact CD1-CD1 3.97Å; F235-L238 WeakPolarHBondContact O-CB 3.34Å; F235-L238 PolarHBondContact O-N 3.38Å; L238-S240 VanDerWaalsContact C-N 3.3Å; L238-S240 PolarHBondContact O-N 3.27Å; L238-L241 HydrophobicContact CB-CB 4.06Å; L238-L241 HydrophobicContact CB-CD2 4.43Å; L238-L241 HydrophobicContact CD1-CD2 4.02Å; L238-L241 VanDerWaalsContact O-CB 3.27Å; L238-L241 WeakPolarHBondContact O-CB 3.46Å; L238-L241 PolarHBondContact O-N 3.18Å; L238-L262 HydrophobicContact CB-CD2 3.69Å
239	D	91.3	Very high	94.3	Very high	67 Å²	67	32.9 Å²	32.9	36%	0.358	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-29.1	-163.3	-52.9	-66	0	0	0	114.6	N264	D239-N264 PolarHBondContact O-ND2 3.07Å
240	S	96.1	Very high	94.5	Very high	37 Å²	37	30.9 Å²	30.9	26%	0.259	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	7.6	177.1	-56.3	0	0	0	0	114.8	P215 L217 L238 R242	P215-S240 WeakPolarHBondContact O-CB 3.18Å; P215-S240 PolarHBondContact O-N 2.61Å; P215-S240 PolarHBondContact O-OG 2.86Å; L217-S240 CarbonylContact O-C 3.41Å; L238-S240 VanDerWaalsContact C-N 3.3Å; L238-S240 PolarHBondContact O-N 3.27Å; S240-R242 PolarHBondContact O-N 2.89Å
241	L	97.8	Very high	94.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.163	C	C	.	.			trans	-69.3	125.9	-171.6	-164.1	78.1	0	0	0	111.6	L217 L220 L238 L244 L262 N264 M265	L217-L241 HydrophobicContact CB-CD1 4.45Å; L217-L241 HydrophobicContact CD2-CD1 3.97Å; L217-L241 HydrophobicContact CG-CD1 4.03Å; L217-L241 WeakPolarHBondContact O-CA 3.46Å; L217-L241 PolarHBondContact O-N 3.3Å; L220-L241 HydrophobicContact CB-CD1 3.85Å; L220-L241 HydrophobicContact CB-CD2 4.49Å; L238-L241 HydrophobicContact CB-CB 4.06Å; L238-L241 HydrophobicContact CB-CD2 4.43Å; L238-L241 HydrophobicContact CD1-CD2 4.02Å; L238-L241 VanDerWaalsContact O-CB 3.27Å; L238-L241 WeakPolarHBondContact O-CB 3.46Å; L238-L241 PolarHBondContact O-N 3.18Å; L241-L244 HydrophobicContact CD2-CB 4.08Å; L241-L244 HydrophobicContact CD2-CD2 4.45Å; L241-L262 HydrophobicContact CB-CD2 4.03Å; L241-L262 HydrophobicContact CD2-CD1 4.16Å; L241-L262 HydrophobicContact CD2-CD2 3.73Å; L241-N264 CarbonylContact O-C 3.59Å; L241-N264 VanDerWaalsContact O-O 3.04Å; L241-M265 HydrophobicContact CD2-SD 4.09Å; L241-M265 HydrophobicContact CG-SD 4.42Å; L241-M265 VanDerWaalsContact O-CA 3.29Å; L241-M265 WeakPolarHBondContact O-CA 3.34Å; L241-M265 PolarHBondContact O-N 2.99Å
242	R	98.1	Very high	94.8	Very high	102 Å²	102	30.3 Å²	30.3	39%	0.385	17%	0.167	S	C	.	.			trans	-103.4	-37.2	178.9	-69.1	174	170.2	-94.9	-10.3	112.4	Q218 S240 M265 E266 E267	Q218-R242 PolarHBondContact O-N 3.02Å; S240-R242 PolarHBondContact O-N 2.89Å; R242-M265 VanDerWaalsContact O-CE 3.3Å; R242-M265 WeakPolarHBondContact O-CE 3.49Å; R242-E266 HydrophobicContact CB-CG 4.43Å; R242-E266 WeakPolarHBondContact CB-OE2 3.1Å; R242-E266 VanDerWaalsContact CD-OE2 3.3Å; R242-E266 WeakPolarHBondContact CD-OE2 3.43Å; R242-E266 HydrophobicContact CG-CG 4.41Å; R242-E266 VanDerWaalsContact CG-OE2 3.27Å; R242-E266 WeakPolarHBondContact CG-OE2 3.16Å; R242-E266 IonicContact CZ-OE1 2.68Å; R242-E266 IonicContact CZ-OE2 2.69Å; R242-E266 IonicContact NE-OE2 2.76Å; R242-E266 IonicContact NH1-OE1 2.7Å; R242-E266 PolarHBondContact NH1-OE1 3.21Å; R242-E266 IonicContact NH1-OE2 3.14Å; R242-E266 PolarHBondContact NH1-OE2 3.39Å; R242-E266 WeakPolarHBondContact O-CA 3.36Å; R242-E266 PolarHBondContact O-N 3.25Å; R242-E267 PolarHBondContact O-N 3.07Å
243	S	98.6	Very high	95.1	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.021	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	126.6	-170.5	174.7	0	0	0	0	111.9	Q218 F219 L220 K245 E267	Q218-S243 PolarHBondContact O-N 2.94Å; F219-S243 VanDerWaalsContact CD1-CB 3.47Å; L220-S243 PolarHBondContact N-O 3.07Å; S243-K245 WeakPolarHBondContact OG-CE 3.29Å; S243-E267 WeakPolarHBondContact CA-O 3.12Å; S243-E267 VanDerWaalsContact CB-OE2 3.23Å; S243-E267 WeakPolarHBondContact CB-OE2 3.3Å; S243-E267 PolarHBondContact OG-OE2 2.84Å
244	L	98.4	Very high	95.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	108.8	-176.4	178.9	54.2	0	0	0	109.6	L220 L222 F235 L241 M246 F259 L262 M265 E267 L268 E269	L220-L244 HydrophobicContact CB-CD1 4.08Å; L220-L244 HydrophobicContact CD2-CD1 3.98Å; L220-L244 HydrophobicContact CG-CD1 3.98Å; L220-L244 WeakPolarHBondContact O-CA 3.16Å; L222-L244 HydrophobicContact CD1-CD1 4.2Å; F235-L244 HydrophobicContact CD2-CD2 4.21Å; F235-L244 HydrophobicContact CE1-CD1 4.24Å; F235-L244 HydrophobicContact CE1-CD2 4.4Å; F235-L244 HydrophobicContact CE2-CD2 4.05Å; F235-L244 HydrophobicContact CG-CD2 4.45Å; F235-L244 HydrophobicContact CZ-CD1 4.42Å; F235-L244 HydrophobicContact CZ-CD2 4.15Å; L241-L244 HydrophobicContact CD2-CB 4.08Å; L241-L244 HydrophobicContact CD2-CD2 4.45Å; L244-M246 HydrophobicContact CD1-CG 3.89Å; L244-M246 HydrophobicContact CD1-SD 4.07Å; L244-M246 HydrophobicContact CD2-SD 4.04Å; L244-M246 HydrophobicContact CG-CG 3.96Å; L244-M246 HydrophobicContact CG-SD 4Å; L244-F259 HydrophobicContact CD2-CD1 3.91Å; L244-F259 HydrophobicContact CD2-CE1 3.89Å; L244-L262 HydrophobicContact CD2-CD1 3.83Å; L244-M265 HydrophobicContact CB-CE 3.4Å; L244-M265 HydrophobicContact CB-SD 4.26Å; L244-M265 VanDerWaalsContact N-CE 3.29Å; L244-E267 PolarHBondContact N-O 3.05Å; L244-L268 HydrophobicContact CB-CD1 4.12Å; L244-L268 HydrophobicContact CD2-CD1 4.08Å; L244-L268 HydrophobicContact CG-CD1 4.07Å; L244-E269 PolarHBondContact O-N 3.48Å
245	K	98.4	Very high	95.5	Very high	25 Å²	25	35.4 Å²	35.4	11%	0.109	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	98.8	-169.2	-57.4	-165.9	171.6	-66.1	0	111.2	L220 E221 L222 K223 S243 E267 E269	L220-K245 PolarHBondContact O-N 2.88Å; E221-K245 HydrophobicContact CB-CB 4.34Å; E221-K245 HydrophobicContact CG-CB 4.27Å; E221-K245 HydrophobicContact CG-CD 4.18Å; E221-K245 HydrophobicContact CG-CG 4.43Å; L222-K245 CarbonylContact C-O 3.55Å; L222-K245 WeakPolarHBondContact CA-O 3.48Å; L222-K245 PolarHBondContact N-O 2.85Å; K223-K245 HydrophobicContact CD-CB 4.23Å; K223-K245 PolarHBondContact N-O 3.41Å; K223-K245 VanDerWaalsContact N-O 3.16Å; S243-K245 WeakPolarHBondContact OG-CE 3.29Å; K245-E267 WeakPolarHBondContact CE-OE2 3.4Å; K245-E267 IonicContact NZ-OE1 2.75Å; K245-E267 PolarHBondContact NZ-OE1 3.47Å; K245-E267 IonicContact NZ-OE2 2.86Å; K245-E267 PolarHBondContact NZ-OE2 3.24Å; K245-E269 WeakPolarHBondContact CB-OE2 3.35Å; K245-E269 WeakPolarHBondContact CD-OE2 3.45Å; K245-E269 HydrophobicContact CG-CG 4.42Å; K245-E269 WeakPolarHBondContact CG-OE2 3.48Å; K245-E269 IonicContact NZ-OE1 3.18Å; K245-E269 PolarHBondContact NZ-OE1 3.17Å; K245-E269 IonicContact NZ-OE2 2.94Å; K245-E269 PolarHBondContact NZ-OE2 2.86Å
246	M	97.6	Very high	95.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.21	C	C	.	.			trans	-119.7	11.4	-169.6	-66.5	-170	75.1	0	0	114.6	I207 L222 I227 V230 F235 L244 N249 I251 F259 E269 L270 N273	I207-M246 HydrophobicContact CD1-CE 4.37Å; L222-M246 HydrophobicContact CB-CG 4.27Å; L222-M246 HydrophobicContact CD1-CG 4.47Å; I227-M246 HydrophobicContact CD1-CE 4.09Å; V230-M246 HydrophobicContact CG2-CE 3.91Å; F235-M246 HydrophobicContact CE2-CE 4.47Å; F235-M246 HydrophobicContact CE2-SD 4.03Å; F235-M246 HydrophobicContact CZ-CE 3.89Å; F235-M246 HydrophobicContact CZ-SD 3.65Å; L244-M246 HydrophobicContact CD1-CG 3.89Å; L244-M246 HydrophobicContact CD1-SD 4.07Å; L244-M246 HydrophobicContact CD2-SD 4.04Å; L244-M246 HydrophobicContact CG-CG 3.96Å; L244-M246 HydrophobicContact CG-SD 4Å; M246-N249 PolarHBondContact O-ND2 2.88Å; M246-I251 HydrophobicContact CB-CD1 4.31Å; M246-I251 HydrophobicContact CE-CD1 4.04Å; M246-F259 HydrophobicContact SD-CE1 4.11Å; M246-E269 CarbonylContact C-O 3.51Å; M246-E269 WeakPolarHBondContact CA-O 3.47Å; M246-E269 PolarHBondContact N-O 3Å; M246-L270 HydrophobicContact CB-CD2 4.08Å; M246-N273 PolarHBondContact O-ND2 3.49Å
247	Q	97.1	Very high	95.4	Very high	17 Å²	17	38 Å²	38	8%	0.079	20%	0.199	C	C	.	.			trans	-62.5	157.8	-177.5	69.1	-86.8	70.4	0	0	114.4	K223 R224 N249 E269 E271	K223-Q247 WeakPolarHBondContact CA-O 3.47Å; K223-Q247 HydrophobicContact CB-CG 4Å; K223-Q247 WeakPolarHBondContact CB-O 3.21Å; R224-Q247 PolarHBondContact N-O 2.94Å; Q247-N249 VanDerWaalsContact C-N 3.35Å; Q247-N249 PolarHBondContact O-N 2.69Å; Q247-E269 PolarHBondContact N-O 3.05Å; Q247-E269 VanDerWaalsContact NE2-CD 3.27Å; Q247-E269 PolarHBondContact NE2-OE2 2.94Å; Q247-E269 PolarHBondContact OE1-OE2 2.92Å; Q247-E271 CarbonylContact C-O 3.58Å; Q247-E271 WeakPolarHBondContact CA-O 3.17Å; Q247-E271 HydrophobicContact CB-CB 3.73Å; Q247-E271 HydrophobicContact CB-CG 4.16Å; Q247-E271 WeakPolarHBondContact CB-O 3.29Å; Q247-E271 VanDerWaalsContact CB-OE2 3.27Å; Q247-E271 WeakPolarHBondContact CB-OE2 3.39Å; Q247-E271 WeakPolarHBondContact CG-OE2 3.12Å; Q247-E271 PolarHBondContact NE2-OE2 2.8Å
248	R	97.8	Very high	95.5	Very high	114 Å²	114	37.2 Å²	37.2	43%	0.43	19%	0.191	S	C	.	.	S	Bend	trans	57.4	39.7	178	-63	-177.4	-176.4	-148.4	4.7	113.8	R224 E271 H272	R224-R248 VanDerWaalsContact CA-O 3.32Å; R224-R248 WeakPolarHBondContact CA-O 3.49Å; R224-R248 HydrophobicContact CG-CB 3.79Å; R224-R248 HydrophobicContact CG-CG 4.48Å; R248-E271 PolarHBondContact N-O 2.83Å; R248-H272 VanDerWaalsContact CA-O 3.3Å; R248-H272 WeakPolarHBondContact CA-O 3.02Å; R248-H272 HydrophobicContact CB-CB 4.23Å; R248-H272 HydrophobicContact CG-CB 3.34Å; R248-H272 VanDerWaalsContact CZ-NE2 3.3Å; R248-H272 PolarHBondContact N-O 3.16Å; R248-H272 PolarHBondContact NE-CD2 3.26Å; R248-H272 PolarHBondContact NE-NE2 2.62Å; R248-H272 PolarHBondContact NH2-CE1 3.27Å; R248-H272 PolarHBondContact NH2-NE2 2.65Å
249	N	97.3	Very high	95.6	Very high	9 Å²	9	37.2 Å²	37.2	5%	0.048	19%	0.191	C	C	.	.	S	Bend	trans	-99.1	-25.1	178.1	-99.6	-75.2	0	0	0	114.1	L222 N225 R226 I227 M246 Q247 I251 N273	L222-N249 PolarHBondContact O-ND2 3.24Å; N225-N249 VanDerWaalsContact CA-OD1 3.25Å; N225-N249 WeakPolarHBondContact CA-OD1 3.16Å; N225-N249 WeakPolarHBondContact CB-OD1 3.31Å; N225-N249 PolarHBondContact N-OD1 2.99Å; R226-N249 CarbonylContact C-O 3.35Å; R226-N249 PolarHBondContact N-OD1 2.99Å; I227-N249 HydrophobicContact CB-CB 4.21Å; I227-N249 WeakPolarHBondContact CB-OD1 3.23Å; I227-N249 WeakPolarHBondContact CD1-OD1 3.21Å; I227-N249 WeakPolarHBondContact CG1-OD1 3.5Å; I227-N249 PolarHBondContact N-O 2.64Å; I227-N249 PolarHBondContact N-OD1 3.35Å; I227-N249 VanDerWaalsContact N-OD1 3.07Å; M246-N249 PolarHBondContact O-ND2 2.88Å; Q247-N249 VanDerWaalsContact C-N 3.35Å; Q247-N249 PolarHBondContact O-N 2.69Å; N249-I251 HydrophobicContact CB-CD1 4.17Å; N249-I251 HydrophobicContact CB-CG1 3.74Å; N249-N273 WeakPolarHBondContact CA-OD1 3.14Å; N249-N273 WeakPolarHBondContact CB-OD1 3.36Å; N249-N273 PolarHBondContact N-OD1 3.06Å
250	G	96.2	Very high	95.5	Very high	36 Å²	36	37.3 Å²	37.3	37%	0.371	19%	0.189	S	C	.	.			trans	80.1	29.7	-168.6	0	0	0	0	0	113	I227 S252 N273	I227-G250 CarbonylContact O-C 3.44Å; G250-S252 PolarHBondContact O-N 2.7Å; G250-N273 PolarHBondContact N-OD1 3.23Å
251	I	97.7	Very high	95.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.18	C	C	.	.			trans	-64.1	116.9	176.9	-54.2	167.7	0	0	0	108.4	I227 K228 V230 M246 N249 L254 L270 N273 N274 L275	I227-I251 HydrophobicContact CG2-CG1 4.48Å; I227-I251 WeakPolarHBondContact O-CA 3.23Å; I227-I251 WeakPolarHBondContact O-CG1 3.34Å; I227-I251 PolarHBondContact O-N 3.05Å; K228-I251 WeakPolarHBondContact O-CA 3.45Å; V230-I251 HydrophobicContact CG2-CD1 4.49Å; V230-I251 HydrophobicContact CG2-CG2 4.48Å; M246-I251 HydrophobicContact CB-CD1 4.31Å; M246-I251 HydrophobicContact CE-CD1 4.04Å; N249-I251 HydrophobicContact CB-CD1 4.17Å; N249-I251 HydrophobicContact CB-CG1 3.74Å; I251-L254 HydrophobicContact CG2-CD2 3.85Å; I251-L254 HydrophobicContact CG2-CG 4.21Å; I251-L270 HydrophobicContact CD1-CD2 3.91Å; I251-N273 HydrophobicContact CB-CB 4.14Å; I251-N273 PolarHBondContact N-OD1 3.15Å; I251-N274 CarbonylContact O-C 3.25Å; I251-N274 VanDerWaalsContact O-C 3.24Å; I251-N274 WeakPolarHBondContact O-CA 3.29Å; I251-N274 PolarHBondContact O-N 2.71Å; I251-L275 HydrophobicContact CB-CD2 4.39Å; I251-L275 HydrophobicContact CG2-CD2 3.89Å; I251-L275 PolarHBondContact O-N 3.06Å
252	S	95.2	Very high	95	Very high	61 Å²	61	35.9 Å²	35.9	43%	0.427	18%	0.18	S	C	.	.			trans	-106.9	-13.6	177.4	66.8	0	0	0	0	113.2	K228 G250 N274	K228-S252 PolarHBondContact O-N 2.94Å; G250-S252 PolarHBondContact O-N 2.7Å; S252-N274 WeakPolarHBondContact CA-O 3.34Å
253	K	93.6	Very high	94.6	Very high	105 Å²	105	35.1 Å²	35.1	46%	0.457	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	119.3	176.6	-167.1	166.8	-174.7	171.2	0	111.6	K228 I229 V230	K228-K253 PolarHBondContact O-N 2.84Å; I229-K253 VanDerWaalsContact CA-O 3.31Å; I229-K253 WeakPolarHBondContact CA-O 3.15Å; I229-K253 HydrophobicContact CG1-CB 4.4Å; V230-K253 PolarHBondContact N-O 3.09Å; V230-K253 VanDerWaalsContact N-O 3.15Å
254	L	96	Very high	94.4	Very high	15 Å²	15	38.7 Å²	38.7	8%	0.079	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	136.7	159	-60.1	169.4	0	0	0	107.3	V230 I251 F259 L270 L275 W282	V230-L254 HydrophobicContact CB-CD2 3.75Å; V230-L254 HydrophobicContact CG2-CD2 3.65Å; I251-L254 HydrophobicContact CG2-CD2 3.85Å; I251-L254 HydrophobicContact CG2-CG 4.21Å; L254-F259 HydrophobicContact CD1-CE2 3.97Å; L254-F259 HydrophobicContact CD1-CZ 4.31Å; L254-F259 HydrophobicContact CD2-CE2 4.18Å; L254-F259 HydrophobicContact CD2-CZ 3.88Å; L254-L270 HydrophobicContact CD1-CD1 4.09Å; L254-L275 HydrophobicContact CD1-CD1 3.94Å; L254-L275 HydrophobicContact CD1-CD2 3.96Å; L254-L275 HydrophobicContact CG-CD2 3.85Å; L254-W282 HydrophobicContact CB-CB 3.58Å; L254-W282 HydrophobicContact CB-CD2 4.27Å; L254-W282 HydrophobicContact CB-CG 3.71Å; L254-W282 HydrophobicContact CD1-CB 4.36Å; L254-W282 HydrophobicContact CD1-CD2 3.47Å; L254-W282 VanDerWaalsContact CD1-CD2 3.47Å; L254-W282 HydrophobicContact CD1-CE3 3.6Å; L254-W282 HydrophobicContact CD1-CG 3.86Å; L254-W282 HydrophobicContact CD1-CH2 4.26Å; L254-W282 HydrophobicContact CD1-CZ2 4.16Å; L254-W282 HydrophobicContact CD1-CZ3 3.99Å; L254-W282 HydrophobicContact CG-CG 4.44Å
255	K	91.4	Very high	94.4	Very high	68 Å²	68	38.8 Å²	38.8	30%	0.296	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-89	163.8	172.6	-70.3	-74.8	-166	72.5	0	110.9	V230 E231 G257 A258 W282	V230-K255 WeakPolarHBondContact O-CB 3.49Å; V230-K255 WeakPolarHBondContact O-CG 3.27Å; V230-K255 PolarHBondContact O-N 3.16Å; E231-K255 WeakPolarHBondContact OE1-CE 3.42Å; E231-K255 IonicContact OE1-NZ 2.69Å; E231-K255 PolarHBondContact OE1-NZ 2.79Å; E231-K255 IonicContact OE2-NZ 2.74Å; E231-K255 PolarHBondContact OE2-NZ 2.97Å; K255-G257 PolarHBondContact O-N 2.52Å; K255-A258 WeakPolarHBondContact O-CB 3.27Å; K255-A258 PolarHBondContact O-N 2.8Å; K255-W282 WeakPolarHBondContact O-CB 3.18Å
256	D	90.6	Very high	94.3	Very high	113 Å²	113	40 Å²	40	60%	0.604	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	136.1	176.9	-54.8	-21.6	0	0	0	110	G232 A258 G281	G232-D256 WeakPolarHBondContact CA-O 3.3Å; D256-A258 VanDerWaalsContact C-N 3.25Å; D256-A258 PolarHBondContact O-N 3.21Å; D256-G281 CarbonylContact C-O 3.38Å; D256-G281 VanDerWaalsContact CA-O 3.29Å; D256-G281 WeakPolarHBondContact CA-O 3.35Å; D256-G281 WeakPolarHBondContact OD1-CA 3.12Å
257	G	90.4	Very high	94.4	Very high	9 Å²	9	41.8 Å²	41.8	9%	0.093	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	21.2	-170.3	0	0	0	0	0	115	L233 K255 F259 F260 G281	L233-G257 PolarHBondContact N-O 2.99Å; K255-G257 PolarHBondContact O-N 2.52Å; G257-F259 PolarHBondContact O-N 3.04Å; G257-F260 WeakPolarHBondContact O-CB 3.12Å; G257-F260 PolarHBondContact O-N 3.23Å; G257-F260 VanDerWaalsContact O-N 3.07Å; G257-G281 PolarHBondContact N-O 3.21Å
258	A	92.6	Very high	94.5	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-40.4	177.5	0	0	0	0	0	113.3	V230 E231 K255 D256	V230-A258 HydrophobicContact CB-CB 4.26Å; V230-A258 HydrophobicContact CG1-CB 3.82Å; E231-A258 WeakPolarHBondContact O-CA 3.49Å; K255-A258 WeakPolarHBondContact O-CB 3.27Å; K255-A258 PolarHBondContact O-N 2.8Å; D256-A258 VanDerWaalsContact C-N 3.25Å; D256-A258 PolarHBondContact O-N 3.21Å
259	F	94.7	Very high	94.5	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	10.9	178.6	-55.9	-61.9	0	0	0	113.7	F235 L244 M246 L254 G257 L262 L268 L270 W282 L286	F235-F259 AromaticContact CD2-CD1 3.78Å; F235-F259 HydrophobicContact CD2-CD1 3.78Å; F235-F259 HydrophobicContact CD2-CE1 4.19Å; F235-F259 AromaticContact CE2-CD1 3.85Å; F235-F259 HydrophobicContact CE2-CD1 3.85Å; F235-F259 AromaticContact CE2-CE1 3.77Å; F235-F259 HydrophobicContact CE2-CE1 3.77Å; L244-F259 HydrophobicContact CD2-CD1 3.91Å; L244-F259 HydrophobicContact CD2-CE1 3.89Å; M246-F259 HydrophobicContact SD-CE1 4.11Å; L254-F259 HydrophobicContact CD1-CE2 3.97Å; L254-F259 HydrophobicContact CD1-CZ 4.31Å; L254-F259 HydrophobicContact CD2-CE2 4.18Å; L254-F259 HydrophobicContact CD2-CZ 3.88Å; G257-F259 PolarHBondContact O-N 3.04Å; F259-L262 HydrophobicContact CB-CD1 4.09Å; F259-L262 HydrophobicContact CD1-CD1 4.2Å; F259-L262 WeakPolarHBondContact O-CB 3.38Å; F259-L262 WeakPolarHBondContact O-CG 2.93Å; F259-L262 PolarHBondContact O-N 2.98Å; F259-L268 HydrophobicContact CD2-CD2 4.06Å; F259-L268 HydrophobicContact CE1-CD1 4.18Å; F259-L268 HydrophobicContact CE2-CD2 3.87Å; F259-L268 HydrophobicContact CZ-CD1 4.22Å; F259-L268 HydrophobicContact CZ-CD2 4.15Å; F259-L270 HydrophobicContact CE2-CD1 4.16Å; F259-L270 HydrophobicContact CZ-CD1 4.11Å; F259-L270 HydrophobicContact CZ-CD2 4.18Å; F259-W282 HydrophobicContact CD2-CE3 4.06Å; F259-W282 WeakPolarHBondContact CD2-O 3.13Å; F259-W282 AromaticContact CE2-CE3 3.73Å; F259-W282 HydrophobicContact CE2-CE3 3.73Å; F259-W282 HydrophobicContact CE2-CZ3 4.09Å; F259-L286 HydrophobicContact CB-CD1 4.11Å; F259-L286 HydrophobicContact CB-CD2 3.88Å; F259-L286 HydrophobicContact CB-CG 4.19Å; F259-L286 HydrophobicContact CD2-CD1 4.15Å; F259-L286 HydrophobicContact CG-CD1 4.43Å
260	F	91.2	Very high	94.6	Very high	68 Å²	68	36.5 Å²	36.5	30%	0.298	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	137.4	-178.6	-179.6	-93.8	0	0	0	111.8	L233 G257 Y284	L233-F260 HydrophobicContact CD2-CB 4.2Å; L233-F260 HydrophobicContact CD2-CD1 3.51Å; L233-F260 HydrophobicContact CD2-CE1 4.32Å; L233-F260 HydrophobicContact CD2-CG 4.23Å; G257-F260 WeakPolarHBondContact O-CB 3.12Å; G257-F260 PolarHBondContact O-N 3.23Å; G257-F260 VanDerWaalsContact O-N 3.07Å; F260-Y284 HydrophobicContact CB-CD1 4.46Å; F260-Y284 AromaticContact CD2-CD1 3.47Å; F260-Y284 HydrophobicContact CD2-CD1 3.47Å; F260-Y284 VanDerWaalsContact CD2-CD1 3.47Å; F260-Y284 AromaticContact CD2-CE1 3.38Å; F260-Y284 HydrophobicContact CD2-CE1 3.38Å; F260-Y284 HydrophobicContact CE2-CD1 4.07Å; F260-Y284 AromaticContact CE2-CE1 3.48Å; F260-Y284 HydrophobicContact CE2-CE1 3.48Å; F260-Y284 VanDerWaalsContact CE2-CE1 3.48Å; F260-Y284 HydrophobicContact CG-CD1 4.26Å; F260-Y284 HydrophobicContact CG-CE1 4.36Å
261	G	88.2	Confident	94.6	Very high	7 Å²	7	36.7 Å²	36.7	7%	0.072	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.7	-12.2	-172.5	0	0	0	0	0	114	N263	G261-N263 PolarHBondContact O-N 3.47Å; G261-N263 PolarHBondContact O-ND2 2.77Å
262	L	94.3	Very high	94.7	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.2	C	C	.	.			trans	-78.2	66.9	173.2	-59.4	-176.1	0	0	0	110.8	F235 L238 L241 L244 F259 N264 M265 L286	F235-L262 HydrophobicContact CB-CD1 3.95Å; F235-L262 HydrophobicContact CB-CD2 3.81Å; F235-L262 HydrophobicContact CB-CG 3.99Å; F235-L262 HydrophobicContact CD2-CD1 4.45Å; F235-L262 HydrophobicContact CG-CD1 4.34Å; L238-L262 HydrophobicContact CB-CD2 3.69Å; L241-L262 HydrophobicContact CB-CD2 4.03Å; L241-L262 HydrophobicContact CD2-CD1 4.16Å; L241-L262 HydrophobicContact CD2-CD2 3.73Å; L244-L262 HydrophobicContact CD2-CD1 3.83Å; F259-L262 HydrophobicContact CB-CD1 4.09Å; F259-L262 HydrophobicContact CD1-CD1 4.2Å; F259-L262 WeakPolarHBondContact O-CB 3.38Å; F259-L262 WeakPolarHBondContact O-CG 2.93Å; F259-L262 PolarHBondContact O-N 2.98Å; L262-N264 VanDerWaalsContact C-N 3.31Å; L262-N264 PolarHBondContact O-N 3.37Å; L262-M265 HydrophobicContact CB-CB 4.03Å; L262-M265 HydrophobicContact CB-CG 4.34Å; L262-M265 HydrophobicContact CB-SD 4.01Å; L262-M265 HydrophobicContact CD1-SD 3.75Å; L262-M265 HydrophobicContact CG-SD 4.38Å; L262-M265 VanDerWaalsContact O-CB 3.31Å; L262-M265 WeakPolarHBondContact O-CB 3.36Å; L262-M265 PolarHBondContact O-N 3.34Å; L262-L286 HydrophobicContact CB-CD2 4.21Å
263	N	88.7	Confident	94.8	Very high	86 Å²	86	36.9 Å²	36.9	46%	0.46	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-26.6	-169.5	-62.3	-54.2	0	0	0	113.8	G261 M288	G261-N263 PolarHBondContact O-N 3.47Å; G261-N263 PolarHBondContact O-ND2 2.77Å; N263-M288 WeakPolarHBondContact O-CG 3.31Å
264	N	95.4	Very high	95	Very high	78 Å²	78	36.2 Å²	36.2	42%	0.417	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	20.1	180	-68.7	-70.7	0	0	0	113	D239 L241 L262 E266	D239-N264 PolarHBondContact O-ND2 3.07Å; L241-N264 CarbonylContact O-C 3.59Å; L241-N264 VanDerWaalsContact O-O 3.04Å; L262-N264 VanDerWaalsContact C-N 3.31Å; L262-N264 PolarHBondContact O-N 3.37Å; N264-E266 PolarHBondContact O-N 2.86Å
265	M	97.3	Very high	95.1	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.182	C	C	.	.			trans	-62.7	128.2	-177.1	-159.5	69.1	-139.6	0	0	111.7	L241 R242 L244 L262 E267 L286 M288 L289	L241-M265 HydrophobicContact CD2-SD 4.09Å; L241-M265 HydrophobicContact CG-SD 4.42Å; L241-M265 VanDerWaalsContact O-CA 3.29Å; L241-M265 WeakPolarHBondContact O-CA 3.34Å; L241-M265 PolarHBondContact O-N 2.99Å; R242-M265 VanDerWaalsContact O-CE 3.3Å; R242-M265 WeakPolarHBondContact O-CE 3.49Å; L244-M265 HydrophobicContact CB-CE 3.4Å; L244-M265 HydrophobicContact CB-SD 4.26Å; L244-M265 VanDerWaalsContact N-CE 3.29Å; L262-M265 HydrophobicContact CB-CB 4.03Å; L262-M265 HydrophobicContact CB-CG 4.34Å; L262-M265 HydrophobicContact CB-SD 4.01Å; L262-M265 HydrophobicContact CD1-SD 3.75Å; L262-M265 HydrophobicContact CG-SD 4.38Å; L262-M265 VanDerWaalsContact O-CB 3.31Å; L262-M265 WeakPolarHBondContact O-CB 3.36Å; L262-M265 PolarHBondContact O-N 3.34Å; M265-E267 WeakPolarHBondContact CE-O 3.29Å; M265-L286 HydrophobicContact CB-CD2 3.87Å; M265-L286 HydrophobicContact CG-CD2 3.87Å; M265-M288 CarbonylContact O-C 3.55Å; M265-M288 VanDerWaalsContact O-CB 3.27Å; M265-M288 WeakPolarHBondContact O-CB 3.13Å; M265-M288 VanDerWaalsContact O-O 3.05Å; M265-L289 HydrophobicContact CG-CD1 3.95Å; M265-L289 VanDerWaalsContact O-CA 3.27Å; M265-L289 WeakPolarHBondContact O-CA 3.47Å; M265-L289 PolarHBondContact O-N 3.42Å
266	E	98.1	Very high	95.3	Very high	50 Å²	50	35.2 Å²	35.2	23%	0.234	18%	0.184	C	C	.	.			trans	-116.1	-39	-180	-62.6	177	143	0	0	111.8	R242 N264 Q290 Q291	R242-E266 HydrophobicContact CB-CG 4.43Å; R242-E266 WeakPolarHBondContact CB-OE2 3.1Å; R242-E266 VanDerWaalsContact CD-OE2 3.3Å; R242-E266 WeakPolarHBondContact CD-OE2 3.43Å; R242-E266 HydrophobicContact CG-CG 4.41Å; R242-E266 VanDerWaalsContact CG-OE2 3.27Å; R242-E266 WeakPolarHBondContact CG-OE2 3.16Å; R242-E266 IonicContact CZ-OE1 2.68Å; R242-E266 IonicContact CZ-OE2 2.69Å; R242-E266 IonicContact NE-OE2 2.76Å; R242-E266 IonicContact NH1-OE1 2.7Å; R242-E266 PolarHBondContact NH1-OE1 3.21Å; R242-E266 IonicContact NH1-OE2 3.14Å; R242-E266 PolarHBondContact NH1-OE2 3.39Å; R242-E266 WeakPolarHBondContact O-CA 3.36Å; R242-E266 PolarHBondContact O-N 3.25Å; N264-E266 PolarHBondContact O-N 2.86Å; E266-Q290 PolarHBondContact O-N 3.35Å; E266-Q291 PolarHBondContact O-N 3.45Å
267	E	98.6	Very high	95.6	Very high	38 Å²	38	36.3 Å²	36.3	18%	0.178	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	117.6	-170.8	-179.1	-157.9	-152.7	0	0	112.6	R242 S243 L244 K245 M265 Q291 Y293	R242-E267 PolarHBondContact O-N 3.07Å; S243-E267 WeakPolarHBondContact CA-O 3.12Å; S243-E267 VanDerWaalsContact CB-OE2 3.23Å; S243-E267 WeakPolarHBondContact CB-OE2 3.3Å; S243-E267 PolarHBondContact OG-OE2 2.84Å; L244-E267 PolarHBondContact N-O 3.05Å; K245-E267 WeakPolarHBondContact CE-OE2 3.4Å; K245-E267 IonicContact NZ-OE1 2.75Å; K245-E267 PolarHBondContact NZ-OE1 3.47Å; K245-E267 IonicContact NZ-OE2 2.86Å; K245-E267 PolarHBondContact NZ-OE2 3.24Å; M265-E267 WeakPolarHBondContact CE-O 3.29Å; E267-Q291 HydrophobicContact CB-CB 4.47Å; E267-Q291 HydrophobicContact CG-CB 4.32Å; E267-Y293 HydrophobicContact CG-CE2 4.41Å
268	L	98.6	Very high	95.9	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	112.7	179.5	179.5	56.2	0	0	0	111.9	L244 F259 L270 L286 L289 Q291 L292 Y293	L244-L268 HydrophobicContact CB-CD1 4.12Å; L244-L268 HydrophobicContact CD2-CD1 4.08Å; L244-L268 HydrophobicContact CG-CD1 4.07Å; F259-L268 HydrophobicContact CD2-CD2 4.06Å; F259-L268 HydrophobicContact CE1-CD1 4.18Å; F259-L268 HydrophobicContact CE2-CD2 3.87Å; F259-L268 HydrophobicContact CZ-CD1 4.22Å; F259-L268 HydrophobicContact CZ-CD2 4.15Å; L268-L270 HydrophobicContact CD1-CD1 4.32Å; L268-L270 HydrophobicContact CD1-CG 4.12Å; L268-L270 HydrophobicContact CD2-CD1 3.91Å; L268-L270 HydrophobicContact CG-CD1 3.96Å; L268-L270 HydrophobicContact CG-CG 4.09Å; L268-L286 HydrophobicContact CD2-CD1 4.05Å; L268-L289 HydrophobicContact CB-CD1 3.85Å; L268-Q291 PolarHBondContact N-O 2.85Å; L268-L292 HydrophobicContact CB-CD1 4.04Å; L268-L292 HydrophobicContact CD2-CD1 3.93Å; L268-L292 HydrophobicContact CG-CD1 3.99Å; L268-Y293 PolarHBondContact O-N 3.29Å
269	E	98.6	Very high	95.9	Very high	28 Å²	28	37.2 Å²	37.2	13%	0.131	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	113.8	175	-62.9	173.3	163.8	0	0	111.5	L244 K245 M246 Q247 Y293	L244-E269 PolarHBondContact O-N 3.48Å; K245-E269 WeakPolarHBondContact CB-OE2 3.35Å; K245-E269 WeakPolarHBondContact CD-OE2 3.45Å; K245-E269 HydrophobicContact CG-CG 4.42Å; K245-E269 WeakPolarHBondContact CG-OE2 3.48Å; K245-E269 IonicContact NZ-OE1 3.18Å; K245-E269 PolarHBondContact NZ-OE1 3.17Å; K245-E269 IonicContact NZ-OE2 2.94Å; K245-E269 PolarHBondContact NZ-OE2 2.86Å; M246-E269 CarbonylContact C-O 3.51Å; M246-E269 WeakPolarHBondContact CA-O 3.47Å; M246-E269 PolarHBondContact N-O 3Å; Q247-E269 PolarHBondContact N-O 3.05Å; Q247-E269 VanDerWaalsContact NE2-CD 3.27Å; Q247-E269 PolarHBondContact NE2-OE2 2.94Å; Q247-E269 PolarHBondContact OE1-OE2 2.92Å; E269-Y293 HydrophobicContact CG-CD2 4.02Å
270	L	98.4	Very high	95.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.2	C	C	.	.			trans	-122.2	16.6	177.7	-73	168.5	0	0	0	112.6	M246 I251 L254 F259 L268 N273 L275 W282 Y293 V294 N297	M246-L270 HydrophobicContact CB-CD2 4.08Å; I251-L270 HydrophobicContact CD1-CD2 3.91Å; L254-L270 HydrophobicContact CD1-CD1 4.09Å; F259-L270 HydrophobicContact CE2-CD1 4.16Å; F259-L270 HydrophobicContact CZ-CD1 4.11Å; F259-L270 HydrophobicContact CZ-CD2 4.18Å; L268-L270 HydrophobicContact CD1-CD1 4.32Å; L268-L270 HydrophobicContact CD1-CG 4.12Å; L268-L270 HydrophobicContact CD2-CD1 3.91Å; L268-L270 HydrophobicContact CG-CD1 3.96Å; L268-L270 HydrophobicContact CG-CG 4.09Å; L270-N273 PolarHBondContact O-ND2 3.15Å; L270-L275 HydrophobicContact CB-CD1 4.39Å; L270-L275 HydrophobicContact CD1-CD1 4.41Å; L270-W282 HydrophobicContact CD1-CH2 4.11Å; L270-W282 HydrophobicContact CD1-CZ3 3.91Å; L270-Y293 CarbonylContact C-O 3.47Å; L270-Y293 WeakPolarHBondContact CA-O 3.4Å; L270-Y293 PolarHBondContact N-O 3.02Å; L270-V294 HydrophobicContact CB-CG1 4.01Å; L270-V294 HydrophobicContact CD1-CG1 4.22Å; L270-N297 PolarHBondContact O-ND2 3.24Å
271	E	98.2	Very high	95.8	Very high	41 Å²	41	38.6 Å²	38.6	19%	0.192	19%	0.192	C	C	.	.			trans	-55.2	158.2	-178	-35.4	149.2	77.5	0	0	112.8	Q247 R248 N273 Y293 S295	Q247-E271 CarbonylContact C-O 3.58Å; Q247-E271 WeakPolarHBondContact CA-O 3.17Å; Q247-E271 HydrophobicContact CB-CB 3.73Å; Q247-E271 HydrophobicContact CB-CG 4.16Å; Q247-E271 WeakPolarHBondContact CB-O 3.29Å; Q247-E271 VanDerWaalsContact CB-OE2 3.27Å; Q247-E271 WeakPolarHBondContact CB-OE2 3.39Å; Q247-E271 WeakPolarHBondContact CG-OE2 3.12Å; Q247-E271 PolarHBondContact NE2-OE2 2.8Å; R248-E271 PolarHBondContact N-O 2.83Å; E271-N273 VanDerWaalsContact C-N 3.3Å; E271-N273 PolarHBondContact O-N 3.43Å; E271-N273 PolarHBondContact O-ND2 2.99Å; E271-Y293 PolarHBondContact N-O 2.82Å; E271-S295 CarbonylContact C-O 3.56Å; E271-S295 WeakPolarHBondContact CA-O 3.42Å
272	H	98.2	Very high	96.1	Very high	51 Å²	51	38.6 Å²	38.6	24%	0.236	19%	0.19	C	C	.	.	S	Bend	trans	52.6	43.6	172.4	-60.9	-87.9	0	0	0	113.6	R248 S295 Q296	R248-H272 VanDerWaalsContact CA-O 3.3Å; R248-H272 WeakPolarHBondContact CA-O 3.02Å; R248-H272 HydrophobicContact CB-CB 4.23Å; R248-H272 HydrophobicContact CG-CB 3.34Å; R248-H272 VanDerWaalsContact CZ-NE2 3.3Å; R248-H272 PolarHBondContact N-O 3.16Å; R248-H272 PolarHBondContact NE-CD2 3.26Å; R248-H272 PolarHBondContact NE-NE2 2.62Å; R248-H272 PolarHBondContact NH2-CE1 3.27Å; R248-H272 PolarHBondContact NH2-NE2 2.65Å; H272-S295 PolarHBondContact N-O 3.38Å; H272-Q296 WeakPolarHBondContact CA-O 3.37Å; H272-Q296 PolarHBondContact CE1-NE2 3.36Å; H272-Q296 VanDerWaalsContact CE1-NE2 3.33Å; H272-Q296 PolarHBondContact CE1-OE1 3Å; H272-Q296 PolarHBondContact N-O 2.94Å; H272-Q296 PolarHBondContact ND1-OE1 3Å; H272-Q296 VanDerWaalsContact ND1-OE1 3.16Å; H272-Q296 PolarHBondContact NE2-NE2 3.34Å
273	N	98.4	Very high	96.2	Very high	14 Å²	14	38.6 Å²	38.6	8%	0.075	19%	0.19	C	C	.	.	S	Bend	trans	-115.2	-162.6	174.9	-78.5	-60.1	0	0	0	109.6	M246 N249 G250 I251 L270 E271 L275 Q296 N297	M246-N273 PolarHBondContact O-ND2 3.49Å; N249-N273 WeakPolarHBondContact CA-OD1 3.14Å; N249-N273 WeakPolarHBondContact CB-OD1 3.36Å; N249-N273 PolarHBondContact N-OD1 3.06Å; G250-N273 PolarHBondContact N-OD1 3.23Å; I251-N273 HydrophobicContact CB-CB 4.14Å; I251-N273 PolarHBondContact N-OD1 3.15Å; L270-N273 PolarHBondContact O-ND2 3.15Å; E271-N273 VanDerWaalsContact C-N 3.3Å; E271-N273 PolarHBondContact O-N 3.43Å; E271-N273 PolarHBondContact O-ND2 2.99Å; N273-L275 HydrophobicContact CB-CG 4.44Å; N273-Q296 PolarHBondContact N-O 3.48Å; N273-N297 VanDerWaalsContact CA-OD1 3.29Å; N273-N297 WeakPolarHBondContact CA-OD1 3.36Å; N273-N297 WeakPolarHBondContact CB-OD1 3.38Å; N273-N297 PolarHBondContact N-OD1 3.26Å; N273-N297 PolarHBondContact O-OD1 2.99Å
274	N	97.8	Very high	96.4	Very high	90 Å²	90	39.5 Å²	39.5	48%	0.481	19%	0.188	S	C	.	.			trans	-126.2	35.8	-177	-158.5	107.9	0	0	0	110.5	I251 S252 N297	I251-N274 CarbonylContact O-C 3.25Å; I251-N274 VanDerWaalsContact O-C 3.24Å; I251-N274 WeakPolarHBondContact O-CA 3.29Å; I251-N274 PolarHBondContact O-N 2.71Å; S252-N274 WeakPolarHBondContact CA-O 3.34Å; N274-N297 PolarHBondContact N-OD1 3.26Å
275	L	97.6	Very high	96	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.026	17%	0.173	C	C	.	.			trans	-72.6	135.1	176.2	-56.7	177.1	0	0	0	109.6	I251 L254 L270 N273 N297 A298 I299	I251-L275 HydrophobicContact CB-CD2 4.39Å; I251-L275 HydrophobicContact CG2-CD2 3.89Å; I251-L275 PolarHBondContact O-N 3.06Å; L254-L275 HydrophobicContact CD1-CD1 3.94Å; L254-L275 HydrophobicContact CD1-CD2 3.96Å; L254-L275 HydrophobicContact CG-CD2 3.85Å; L270-L275 HydrophobicContact CB-CD1 4.39Å; L270-L275 HydrophobicContact CD1-CD1 4.41Å; N273-L275 HydrophobicContact CB-CG 4.44Å; L275-N297 HydrophobicContact CB-CB 4.41Å; L275-N297 WeakPolarHBondContact CB-OD1 3.27Å; L275-N297 WeakPolarHBondContact CG-OD1 3.42Å; L275-N297 PolarHBondContact N-OD1 3.02Å; L275-A298 CarbonylContact O-C 3.44Å; L275-A298 WeakPolarHBondContact O-CA 3.33Å; L275-A298 PolarHBondContact O-N 3.14Å; L275-I299 HydrophobicContact CB-CG1 4.35Å; L275-I299 WeakPolarHBondContact O-CG1 3.27Å; L275-I299 PolarHBondContact O-N 3.23Å; L275-I299 VanDerWaalsContact O-N 3.15Å
276	T	96.4	Very high	95.9	Very high	57 Å²	57	36.3 Å²	36.3	35%	0.35	17%	0.173	S	C	.	.			trans	-107	-8.8	-179.1	56.3	0	0	0	0	114.6	A298 E300	T276-A298 WeakPolarHBondContact CA-O 3.36Å; T276-A298 HydrophobicContact CG2-CB 4.19Å; T276-E300 PolarHBondContact O-N 2.68Å
277	R	96	Very high	95.6	Very high	137 Å²	137	42 Å²	42	52%	0.517	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	145.7	-178.6	60.6	-172.1	-178.4	-173.8	3.6	113.2	W282 R301	R277-W282 PolarHBondContact O-NE1 3.32Å; R277-R301 WeakPolarHBondContact CA-O 3.22Å; R277-R301 HydrophobicContact CB-CG 4.07Å
278	V	96.7	Very high	95.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	132.1	165.7	-171.5	0	0	0	0	108.4	W282 L283 I299 R301 I302 S303 A306 W307 L318	V278-W282 HydrophobicContact CB-CZ2 4.23Å; V278-W282 HydrophobicContact CG1-CH2 4.31Å; V278-W282 HydrophobicContact CG1-CZ2 3.82Å; V278-W282 HydrophobicContact CG2-CZ2 4.23Å; V278-L283 HydrophobicContact CG1-CD1 3.67Å; V278-I299 HydrophobicContact CG2-CD1 3.92Å; V278-I299 HydrophobicContact CG2-CG2 4.14Å; V278-R301 PolarHBondContact N-O 2.93Å; V278-I302 HydrophobicContact CB-CG1 4.23Å; V278-I302 HydrophobicContact CB-CG2 4.37Å; V278-I302 HydrophobicContact CG2-CG1 4.28Å; V278-S303 PolarHBondContact O-N 2.7Å; V278-S303 PolarHBondContact O-OG 2.76Å; V278-A306 HydrophobicContact CG1-CB 4.14Å; V278-W307 HydrophobicContact CG1-CH2 3.76Å; V278-W307 HydrophobicContact CG1-CZ2 4.32Å; V278-W307 HydrophobicContact CG1-CZ3 4.05Å; V278-L318 HydrophobicContact CG2-CD2 4.27Å
279	N	93.3	Very high	95.5	Very high	27 Å²	27	43 Å²	43	14%	0.144	20%	0.198	C	C	.	.			trans	-147.2	164.4	177.8	75.7	3.3	0	0	0	112	G281 W282 S303	N279-G281 PolarHBondContact O-N 3.47Å; N279-G281 PolarHBondContact OD1-N 3.45Å; N279-W282 PolarHBondContact OD1-N 2.85Å; N279-S303 WeakPolarHBondContact CB-OG 3.47Å
280	K	92.6	Very high	95.5	Very high	86 Å²	86	45 Å²	45	37%	0.374	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-26.7	179.9	71.2	172.4	169.9	-147.5	0	113.7	L283 Y284 D305 F309	K280-L283 PolarHBondContact O-N 2.79Å; K280-Y284 PolarHBondContact O-N 2.7Å; K280-D305 WeakPolarHBondContact CB-O 3.02Å; K280-D305 HydrophobicContact CD-CB 4.09Å; K280-D305 WeakPolarHBondContact CD-OD2 3.45Å; K280-D305 WeakPolarHBondContact CE-OD2 3.49Å; K280-D305 IonicContact NZ-OD2 3.16Å; K280-D305 PolarHBondContact NZ-OD2 2.87Å; K280-F309 HydrophobicContact CB-CE2 4.35Å
281	G	91.5	Very high	95.5	Very high	13 Å²	13	47.7 Å²	47.7	13%	0.134	22%	0.22	C	C	.	.	H	α-helix	trans	-59.9	-55	-173.4	0	0	0	0	0	112.2	D256 G257 N279 Y284	D256-G281 CarbonylContact C-O 3.38Å; D256-G281 VanDerWaalsContact CA-O 3.29Å; D256-G281 WeakPolarHBondContact CA-O 3.35Å; D256-G281 WeakPolarHBondContact OD1-CA 3.12Å; G257-G281 PolarHBondContact N-O 3.21Å; N279-G281 PolarHBondContact O-N 3.47Å; N279-G281 PolarHBondContact OD1-N 3.45Å; G281-Y284 VanDerWaalsContact O-CB 3.3Å; G281-Y284 WeakPolarHBondContact O-CB 3.47Å; G281-Y284 PolarHBondContact O-N 3.07Å
282	W	94.6	Very high	95.5	Very high	7 Å²	7	45.8 Å²	45.8	3%	0.027	21%	0.211	C	C	.	.	H	α-helix	trans	-79.6	-22.7	179.5	64.8	-104.6	0	0	0	113.9	L254 K255 F259 L270 R277 V278 N279 Y284 V294	L254-W282 HydrophobicContact CB-CB 3.58Å; L254-W282 HydrophobicContact CB-CD2 4.27Å; L254-W282 HydrophobicContact CB-CG 3.71Å; L254-W282 HydrophobicContact CD1-CB 4.36Å; L254-W282 HydrophobicContact CD1-CD2 3.47Å; L254-W282 VanDerWaalsContact CD1-CD2 3.47Å; L254-W282 HydrophobicContact CD1-CE3 3.6Å; L254-W282 HydrophobicContact CD1-CG 3.86Å; L254-W282 HydrophobicContact CD1-CH2 4.26Å; L254-W282 HydrophobicContact CD1-CZ2 4.16Å; L254-W282 HydrophobicContact CD1-CZ3 3.99Å; L254-W282 HydrophobicContact CG-CG 4.44Å; K255-W282 WeakPolarHBondContact O-CB 3.18Å; F259-W282 HydrophobicContact CD2-CE3 4.06Å; F259-W282 WeakPolarHBondContact CD2-O 3.13Å; F259-W282 AromaticContact CE2-CE3 3.73Å; F259-W282 HydrophobicContact CE2-CE3 3.73Å; F259-W282 HydrophobicContact CE2-CZ3 4.09Å; L270-W282 HydrophobicContact CD1-CH2 4.11Å; L270-W282 HydrophobicContact CD1-CZ3 3.91Å; R277-W282 PolarHBondContact O-NE1 3.32Å; V278-W282 HydrophobicContact CB-CZ2 4.23Å; V278-W282 HydrophobicContact CG1-CH2 4.31Å; V278-W282 HydrophobicContact CG1-CZ2 3.82Å; V278-W282 HydrophobicContact CG2-CZ2 4.23Å; N279-W282 PolarHBondContact OD1-N 2.85Å; W282-Y284 VanDerWaalsContact C-N 3.26Å; W282-Y284 PolarHBondContact O-N 2.94Å; W282-V294 HydrophobicContact CH2-CG1 4.25Å
283	L	95.3	Very high	95.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-77.7	-6.4	172.8	-70.7	172.1	0	0	0	113.8	V278 K280 G285 L286 L292 A306 W307	V278-L283 HydrophobicContact CG1-CD1 3.67Å; K280-L283 PolarHBondContact O-N 2.79Å; L283-G285 PolarHBondContact O-N 2.75Å; L283-G285 VanDerWaalsContact O-N 3.15Å; L283-L286 HydrophobicContact CD2-CD1 3.99Å; L283-L286 PolarHBondContact O-N 2.84Å; L283-L292 HydrophobicContact CD2-CD2 4.21Å; L283-A306 HydrophobicContact CD1-CB 4.35Å; L283-A306 WeakPolarHBondContact CD1-O 3.26Å; L283-W307 HydrophobicContact CD1-CE3 3.93Å; L283-W307 HydrophobicContact CD1-CZ3 3.86Å
284	Y	92.6	Very high	95.5	Very high	106 Å²	106	44.5 Å²	44.5	42%	0.416	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	116.9	-173.7	-177.8	-106.1	0	0	0	113.4	F260 K280 G281 W282 F309	F260-Y284 HydrophobicContact CB-CD1 4.46Å; F260-Y284 AromaticContact CD2-CD1 3.47Å; F260-Y284 HydrophobicContact CD2-CD1 3.47Å; F260-Y284 VanDerWaalsContact CD2-CD1 3.47Å; F260-Y284 AromaticContact CD2-CE1 3.38Å; F260-Y284 HydrophobicContact CD2-CE1 3.38Å; F260-Y284 HydrophobicContact CE2-CD1 4.07Å; F260-Y284 AromaticContact CE2-CE1 3.48Å; F260-Y284 HydrophobicContact CE2-CE1 3.48Å; F260-Y284 VanDerWaalsContact CE2-CE1 3.48Å; F260-Y284 HydrophobicContact CG-CD1 4.26Å; F260-Y284 HydrophobicContact CG-CE1 4.36Å; K280-Y284 PolarHBondContact O-N 2.7Å; G281-Y284 VanDerWaalsContact O-CB 3.3Å; G281-Y284 WeakPolarHBondContact O-CB 3.47Å; G281-Y284 PolarHBondContact O-N 3.07Å; W282-Y284 VanDerWaalsContact C-N 3.26Å; W282-Y284 PolarHBondContact O-N 2.94Å; Y284-F309 HydrophobicContact CD2-CD1 4.37Å; Y284-F309 HydrophobicContact CD2-CD2 4.05Å; Y284-F309 AromaticContact CD2-CE1 3.98Å; Y284-F309 HydrophobicContact CD2-CE1 3.98Å; Y284-F309 AromaticContact CD2-CE2 3.64Å; Y284-F309 HydrophobicContact CD2-CE2 3.64Å; Y284-F309 HydrophobicContact CD2-CG 4.42Å; Y284-F309 AromaticContact CD2-CZ 3.6Å; Y284-F309 HydrophobicContact CD2-CZ 3.6Å; Y284-F309 AromaticContact CE2-CE1 3.91Å; Y284-F309 HydrophobicContact CE2-CE1 3.91Å; Y284-F309 HydrophobicContact CE2-CE2 4.28Å; Y284-F309 AromaticContact CE2-CZ 3.76Å; Y284-F309 HydrophobicContact CE2-CZ 3.76Å
285	G	87.1	Confident	95.5	Very high	11 Å²	11	40.3 Å²	40.3	11%	0.113	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.7	-5.7	175.7	0	0	0	0	0	116.2	L283 R287	L283-G285 PolarHBondContact O-N 2.75Å; L283-G285 VanDerWaalsContact O-N 3.15Å; G285-R287 PolarHBondContact O-N 2.95Å
286	L	94.8	Very high	95.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.197	C	C	.	.			trans	-76.1	47.7	-175.1	-67.7	-179.9	0	0	0	115.1	F259 L262 M265 L268 L283 M288 L289 F309	F259-L286 HydrophobicContact CB-CD1 4.11Å; F259-L286 HydrophobicContact CB-CD2 3.88Å; F259-L286 HydrophobicContact CB-CG 4.19Å; F259-L286 HydrophobicContact CD2-CD1 4.15Å; F259-L286 HydrophobicContact CG-CD1 4.43Å; L262-L286 HydrophobicContact CB-CD2 4.21Å; M265-L286 HydrophobicContact CB-CD2 3.87Å; M265-L286 HydrophobicContact CG-CD2 3.87Å; L268-L286 HydrophobicContact CD2-CD1 4.05Å; L283-L286 HydrophobicContact CD2-CD1 3.99Å; L283-L286 PolarHBondContact O-N 2.84Å; L286-M288 PolarHBondContact O-N 3.2Å; L286-M288 VanDerWaalsContact O-N 3.1Å; L286-L289 HydrophobicContact CB-CB 4.2Å; L286-L289 HydrophobicContact CB-CD2 4.4Å; L286-L289 HydrophobicContact CD1-CD2 4.2Å; L286-L289 VanDerWaalsContact O-CB 3.28Å; L286-L289 WeakPolarHBondContact O-CB 3.4Å; L286-L289 PolarHBondContact O-N 2.92Å; L286-L289 VanDerWaalsContact O-N 3.14Å; L286-F309 CarbonylContact C-O 3.47Å
287	R	92.8	Very high	95.7	Very high	169 Å²	169	41.6 Å²	41.6	64%	0.638	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-16.6	-169.8	-64.9	-178.6	179	-170.8	-1.5	116.3	G285 F309 R312	G285-R287 PolarHBondContact O-N 2.95Å; R287-F309 VanDerWaalsContact CA-O 3.26Å; R287-F309 WeakPolarHBondContact CA-O 3.28Å; R287-F309 PolarHBondContact N-O 3.29Å; R287-R312 WeakPolarHBondContact O-CD 3.26Å; R287-R312 WeakPolarHBondContact O-CG 3.39Å
288	M	96.6	Very high	95.8	Very high	62 Å²	62	36.3 Å²	36.3	31%	0.305	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-3.1	-179.6	-67.4	-59.2	-67.7	0	0	113.8	N263 M265 L286 Q290	N263-M288 WeakPolarHBondContact O-CG 3.31Å; M265-M288 CarbonylContact O-C 3.55Å; M265-M288 VanDerWaalsContact O-CB 3.27Å; M265-M288 WeakPolarHBondContact O-CB 3.13Å; M265-M288 VanDerWaalsContact O-O 3.05Å; L286-M288 PolarHBondContact O-N 3.2Å; L286-M288 VanDerWaalsContact O-N 3.1Å; M288-Q290 PolarHBondContact O-N 2.78Å; M288-Q290 PolarHBondContact O-NE2 2.68Å
289	L	98.1	Very high	95.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.169	C	C	.	.			trans	-64.3	127	-170.5	-169.2	73	0	0	0	111	M265 L268 L286 L292 R312 L313	M265-L289 HydrophobicContact CG-CD1 3.95Å; M265-L289 VanDerWaalsContact O-CA 3.27Å; M265-L289 WeakPolarHBondContact O-CA 3.47Å; M265-L289 PolarHBondContact O-N 3.42Å; L268-L289 HydrophobicContact CB-CD1 3.85Å; L286-L289 HydrophobicContact CB-CB 4.2Å; L286-L289 HydrophobicContact CB-CD2 4.4Å; L286-L289 HydrophobicContact CD1-CD2 4.2Å; L286-L289 VanDerWaalsContact O-CB 3.28Å; L286-L289 WeakPolarHBondContact O-CB 3.4Å; L286-L289 PolarHBondContact O-N 2.92Å; L286-L289 VanDerWaalsContact O-N 3.14Å; L289-L292 HydrophobicContact CD2-CB 4.17Å; L289-L292 HydrophobicContact CD2-CD1 4.43Å; L289-L292 HydrophobicContact CD2-CD2 4.49Å; L289-R312 CarbonylContact O-C 3.49Å; L289-L313 HydrophobicContact CD2-CD1 4.04Å; L289-L313 HydrophobicContact CG-CD1 4Å; L289-L313 WeakPolarHBondContact O-CA 3.39Å; L289-L313 PolarHBondContact O-N 3.15Å; L289-L313 VanDerWaalsContact O-N 3.12Å
290	Q	98.3	Very high	96	Very high	70 Å²	70	39.4 Å²	39.4	33%	0.327	18%	0.183	S	C	.	.			trans	-110.7	-35.1	-179.6	-75.6	159.7	73.8	0	0	111.3	E266 M288 L313 S314 E315	E266-Q290 PolarHBondContact O-N 3.35Å; M288-Q290 PolarHBondContact O-N 2.78Å; M288-Q290 PolarHBondContact O-NE2 2.68Å; Q290-L313 WeakPolarHBondContact O-CD1 3.38Å; Q290-S314 PolarHBondContact O-N 2.67Å; Q290-S314 PolarHBondContact O-OG 2.71Å; Q290-E315 PolarHBondContact O-N 3.33Å
291	Q	98.8	Very high	96	Very high	56 Å²	56	42.6 Å²	42.6	26%	0.262	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.8	-176.4	-54.6	-177.8	-60.8	0	0	111.4	E266 E267 L268 Y293 E315	E266-Q291 PolarHBondContact O-N 3.45Å; E267-Q291 HydrophobicContact CB-CB 4.47Å; E267-Q291 HydrophobicContact CG-CB 4.32Å; L268-Q291 PolarHBondContact N-O 2.85Å; Q291-Y293 HydrophobicContact CB-CE2 3.76Å; Q291-Y293 PolarHBondContact NE2-OH 2.64Å; Q291-E315 WeakPolarHBondContact CA-O 3.11Å; Q291-E315 HydrophobicContact CG-CB 4.2Å
292	L	98.7	Very high	96.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	111.3	177.8	-179.6	59.9	0	0	0	111	L268 L283 L289 V294 W307 L313 E315 L316 D317	L268-L292 HydrophobicContact CB-CD1 4.04Å; L268-L292 HydrophobicContact CD2-CD1 3.93Å; L268-L292 HydrophobicContact CG-CD1 3.99Å; L283-L292 HydrophobicContact CD2-CD2 4.21Å; L289-L292 HydrophobicContact CD2-CB 4.17Å; L289-L292 HydrophobicContact CD2-CD1 4.43Å; L289-L292 HydrophobicContact CD2-CD2 4.49Å; L292-V294 HydrophobicContact CD1-CG1 3.82Å; L292-V294 HydrophobicContact CD2-CG1 4.48Å; L292-V294 HydrophobicContact CG-CG1 3.99Å; L292-W307 HydrophobicContact CD2-CH2 4.37Å; L292-W307 HydrophobicContact CD2-CZ3 3.83Å; L292-L313 HydrophobicContact CB-CD1 3.74Å; L292-L313 HydrophobicContact CB-CD2 4.42Å; L292-E315 PolarHBondContact N-O 2.88Å; L292-L316 HydrophobicContact CB-CD1 4.16Å; L292-L316 HydrophobicContact CD2-CD1 4.04Å; L292-L316 HydrophobicContact CG-CD1 4.16Å; L292-D317 PolarHBondContact O-N 3.19Å
293	Y	98.8	Very high	96.2	Very high	38 Å²	38	44.5 Å²	44.5	15%	0.149	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	103	179.1	-56.9	-80	0	0	0	110	E267 L268 E269 L270 E271 Q291 E315 D317	E267-Y293 HydrophobicContact CG-CE2 4.41Å; L268-Y293 PolarHBondContact O-N 3.29Å; E269-Y293 HydrophobicContact CG-CD2 4.02Å; L270-Y293 CarbonylContact C-O 3.47Å; L270-Y293 WeakPolarHBondContact CA-O 3.4Å; L270-Y293 PolarHBondContact N-O 3.02Å; E271-Y293 PolarHBondContact N-O 2.82Å; Q291-Y293 HydrophobicContact CB-CE2 3.76Å; Q291-Y293 PolarHBondContact NE2-OH 2.64Å; Y293-E315 HydrophobicContact CE1-CG 4.33Å; Y293-E315 VanDerWaalsContact CE1-OE1 3.26Å; Y293-E315 WeakPolarHBondContact CE1-OE1 3.28Å; Y293-E315 PolarHBondContact OH-OE1 2.86Å; Y293-D317 HydrophobicContact CD1-CB 3.72Å; Y293-D317 HydrophobicContact CE1-CB 4.38Å
294	V	97.9	Very high	95.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.23	C	C	.	.			trans	-119.8	17.8	-178.4	-72.9	0	0	0	0	112.4	L270 W282 L292 N297 I299 L316 D317 L318 N321	L270-V294 HydrophobicContact CB-CG1 4.01Å; L270-V294 HydrophobicContact CD1-CG1 4.22Å; W282-V294 HydrophobicContact CH2-CG1 4.25Å; L292-V294 HydrophobicContact CD1-CG1 3.82Å; L292-V294 HydrophobicContact CD2-CG1 4.48Å; L292-V294 HydrophobicContact CG-CG1 3.99Å; V294-N297 PolarHBondContact O-ND2 2.86Å; V294-I299 HydrophobicContact CB-CD1 4.06Å; V294-I299 HydrophobicContact CG2-CD1 4.23Å; V294-L316 HydrophobicContact CG2-CD1 4.37Å; V294-D317 CarbonylContact C-O 3.4Å; V294-D317 WeakPolarHBondContact CG2-O 3.27Å; V294-D317 PolarHBondContact N-O 3.44Å; V294-L318 HydrophobicContact CG2-CD2 3.53Å; V294-L318 HydrophobicContact CG2-CG 3.91Å; V294-N321 PolarHBondContact O-ND2 2.95Å; V294-N321 VanDerWaalsContact O-ND2 3.13Å
295	S	98.3	Very high	95.9	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.021	23%	0.225	C	C	.	.			trans	-68.1	163.2	-179.8	52.2	0	0	0	0	114.3	E271 H272 N297 D317 S319	E271-S295 CarbonylContact C-O 3.56Å; E271-S295 WeakPolarHBondContact CA-O 3.42Å; H272-S295 PolarHBondContact N-O 3.38Å; S295-N297 VanDerWaalsContact C-N 3.32Å; S295-N297 PolarHBondContact O-N 2.83Å; S295-N297 PolarHBondContact O-ND2 3.33Å; S295-N297 VanDerWaalsContact O-ND2 3.09Å; S295-D317 WeakPolarHBondContact CB-OD2 3.45Å; S295-D317 PolarHBondContact N-O 3.19Å; S295-D317 PolarHBondContact OG-OD2 2.89Å; S295-S319 CarbonylContact C-O 3.26Å; S295-S319 WeakPolarHBondContact CA-O 3.41Å; S295-S319 WeakPolarHBondContact CB-O 3.3Å; S295-S319 VanDerWaalsContact CB-OG 3.32Å; S295-S319 WeakPolarHBondContact CB-OG 3.08Å
296	Q	98.3	Very high	96.2	Very high	76 Å²	76	45.9 Å²	45.9	36%	0.355	22%	0.219	S	C	.	.	S	Bend	trans	54.9	47.1	-178	-64.5	173	84.7	0	0	112.1	H272 N273 S319 Y320	H272-Q296 WeakPolarHBondContact CA-O 3.37Å; H272-Q296 PolarHBondContact CE1-NE2 3.36Å; H272-Q296 VanDerWaalsContact CE1-NE2 3.33Å; H272-Q296 PolarHBondContact CE1-OE1 3Å; H272-Q296 PolarHBondContact N-O 2.94Å; H272-Q296 PolarHBondContact ND1-OE1 3Å; H272-Q296 VanDerWaalsContact ND1-OE1 3.16Å; H272-Q296 PolarHBondContact NE2-NE2 3.34Å; N273-Q296 PolarHBondContact N-O 3.48Å; Q296-S319 PolarHBondContact N-O 2.84Å; Q296-Y320 WeakPolarHBondContact CA-O 3.3Å; Q296-Y320 VanDerWaalsContact CG-CB 3.41Å; Q296-Y320 HydrophobicContact CG-CD2 4Å; Q296-Y320 HydrophobicContact CG-CG 3.77Å; Q296-Y320 PolarHBondContact N-O 3.47Å
297	N	98.4	Very high	96.2	Very high	12 Å²	12	46 Å²	46	6%	0.064	22%	0.22	C	C	.	.	S	Bend	trans	-117.1	-161.7	174.7	-88.4	-90.7	0	0	0	109.2	L270 N273 N274 L275 V294 S295 I299 Y320 N321	L270-N297 PolarHBondContact O-ND2 3.24Å; N273-N297 VanDerWaalsContact CA-OD1 3.29Å; N273-N297 WeakPolarHBondContact CA-OD1 3.36Å; N273-N297 WeakPolarHBondContact CB-OD1 3.38Å; N273-N297 PolarHBondContact N-OD1 3.26Å; N273-N297 PolarHBondContact O-OD1 2.99Å; N274-N297 PolarHBondContact N-OD1 3.26Å; L275-N297 HydrophobicContact CB-CB 4.41Å; L275-N297 WeakPolarHBondContact CB-OD1 3.27Å; L275-N297 WeakPolarHBondContact CG-OD1 3.42Å; L275-N297 PolarHBondContact N-OD1 3.02Å; V294-N297 PolarHBondContact O-ND2 2.86Å; S295-N297 VanDerWaalsContact C-N 3.32Å; S295-N297 PolarHBondContact O-N 2.83Å; S295-N297 PolarHBondContact O-ND2 3.33Å; S295-N297 VanDerWaalsContact O-ND2 3.09Å; N297-I299 HydrophobicContact CB-CD1 4.15Å; N297-I299 HydrophobicContact CB-CG1 4.02Å; N297-Y320 PolarHBondContact N-O 3.49Å; N297-N321 VanDerWaalsContact CA-OD1 3.28Å; N297-N321 WeakPolarHBondContact CA-OD1 3.46Å; N297-N321 WeakPolarHBondContact CB-OD1 3.23Å; N297-N321 PolarHBondContact N-OD1 2.96Å; N297-N321 PolarHBondContact O-OD1 2.92Å
298	A	97.8	Very high	96.2	Very high	27 Å²	27	42.6 Å²	42.6	22%	0.223	21%	0.211	C	C	.	.			trans	-117.8	30.4	176.8	0	0	0	0	0	111.4	L275 T276 E300 N321	L275-A298 CarbonylContact O-C 3.44Å; L275-A298 WeakPolarHBondContact O-CA 3.33Å; L275-A298 PolarHBondContact O-N 3.14Å; T276-A298 WeakPolarHBondContact CA-O 3.36Å; T276-A298 HydrophobicContact CG2-CB 4.19Å; A298-E300 PolarHBondContact O-N 3.1Å; A298-E300 VanDerWaalsContact O-N 3.15Å; A298-N321 PolarHBondContact N-OD1 3.38Å
299	I	98.3	Very high	96	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.			trans	-68.7	113.6	-170.5	-61	167.2	0	0	0	109.6	L275 V278 V294 N297 L318 N321 Q322 L323	L275-I299 HydrophobicContact CB-CG1 4.35Å; L275-I299 WeakPolarHBondContact O-CG1 3.27Å; L275-I299 PolarHBondContact O-N 3.23Å; L275-I299 VanDerWaalsContact O-N 3.15Å; V278-I299 HydrophobicContact CG2-CD1 3.92Å; V278-I299 HydrophobicContact CG2-CG2 4.14Å; V294-I299 HydrophobicContact CB-CD1 4.06Å; V294-I299 HydrophobicContact CG2-CD1 4.23Å; N297-I299 HydrophobicContact CB-CD1 4.15Å; N297-I299 HydrophobicContact CB-CG1 4.02Å; I299-L318 HydrophobicContact CD1-CD2 4.08Å; I299-N321 HydrophobicContact CB-CB 4.13Å; I299-N321 VanDerWaalsContact CB-OD1 3.27Å; I299-N321 WeakPolarHBondContact CB-OD1 3.45Å; I299-N321 WeakPolarHBondContact CG1-OD1 3.15Å; I299-N321 PolarHBondContact N-OD1 3.26Å; I299-Q322 CarbonylContact O-C 3.52Å; I299-Q322 WeakPolarHBondContact O-CA 3.27Å; I299-Q322 PolarHBondContact O-N 3.29Å; I299-L323 HydrophobicContact CG2-CD2 3.96Å; I299-L323 PolarHBondContact O-N 3.16Å; I299-L323 VanDerWaalsContact O-N 3.15Å
300	E	96.3	Very high	95.8	Very high	91 Å²	91	41 Å²	41	43%	0.425	20%	0.202	S	C	.	.			trans	-88.4	-29.7	177.1	-62.4	166.7	-169.9	0	0	112	T276 A298	T276-E300 PolarHBondContact O-N 2.68Å; A298-E300 PolarHBondContact O-N 3.1Å; A298-E300 VanDerWaalsContact O-N 3.15Å
301	R	93.2	Very high	95.6	Very high	154 Å²	154	43.2 Å²	43.2	58%	0.581	21%	0.213	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-155.9	152.7	-167	67.7	-166.2	88.6	-179.8	4	113.5	R277 V278	R277-R301 WeakPolarHBondContact CA-O 3.22Å; R277-R301 HydrophobicContact CB-CG 4.07Å; V278-R301 PolarHBondContact N-O 2.93Å
302	I	96.4	Very high	95.4	Very high	24 Å²	24	46.9 Å²	46.9	12%	0.123	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135.2	174.9	-61.6	163.5	0	0	0	107	V278 A306 W307 L318 L323 T330 F331	V278-I302 HydrophobicContact CB-CG1 4.23Å; V278-I302 HydrophobicContact CB-CG2 4.37Å; V278-I302 HydrophobicContact CG2-CG1 4.28Å; I302-A306 HydrophobicContact CG2-CB 3.96Å; I302-W307 HydrophobicContact CD1-CZ2 4.41Å; I302-W307 HydrophobicContact CG2-CZ2 3.86Å; I302-L318 HydrophobicContact CD1-CD1 3.81Å; I302-L318 HydrophobicContact CD1-CD2 4.44Å; I302-L323 HydrophobicContact CD1-CD1 4.29Å; I302-L323 HydrophobicContact CD1-CD2 4.23Å; I302-L323 HydrophobicContact CG1-CD2 4.19Å; I302-T330 HydrophobicContact CB-CG2 4.26Å; I302-T330 HydrophobicContact CD1-CG2 3.85Å; I302-T330 HydrophobicContact CG2-CG2 4.42Å; I302-F331 HydrophobicContact CD1-CE1 4.39Å
303	S	92.7	Very high	95.4	Very high	35 Å²	35	46.9 Å²	46.9	25%	0.245	22%	0.224	C	C	.	.			trans	-73.3	140.6	174.3	-62.6	0	0	0	0	111.1	V278 N279 D305 A306	V278-S303 PolarHBondContact O-N 2.7Å; V278-S303 PolarHBondContact O-OG 2.76Å; N279-S303 WeakPolarHBondContact CB-OG 3.47Å; S303-D305 VanDerWaalsContact CB-OD1 3.23Å; S303-D305 WeakPolarHBondContact CB-OD1 3.15Å; S303-D305 PolarHBondContact O-N 3.23Å; S303-A306 WeakPolarHBondContact O-CB 3.01Å; S303-A306 PolarHBondContact O-N 3.38Å
304	P	90.3	Very high	95.4	Very high	89 Å²	89	46.1 Å²	46.1	58%	0.578	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-23.5	178.3	-30.7	37.5	0	0	0	115.5
305	D	91.5	Very high	95.4	Very high	58 Å²	58	48 Å²	48	31%	0.31	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	2.3	-179.1	59.6	9.3	0	0	0	113.8	K280 S303 W307 E308	K280-D305 WeakPolarHBondContact CB-O 3.02Å; K280-D305 HydrophobicContact CD-CB 4.09Å; K280-D305 WeakPolarHBondContact CD-OD2 3.45Å; K280-D305 WeakPolarHBondContact CE-OD2 3.49Å; K280-D305 IonicContact NZ-OD2 3.16Å; K280-D305 PolarHBondContact NZ-OD2 2.87Å; S303-D305 VanDerWaalsContact CB-OD1 3.23Å; S303-D305 WeakPolarHBondContact CB-OD1 3.15Å; S303-D305 PolarHBondContact O-N 3.23Å; D305-W307 PolarHBondContact O-N 3.09Å; D305-E308 WeakPolarHBondContact O-CB 3.2Å; D305-E308 PolarHBondContact O-N 3.03Å
306	A	94.1	Very high	95.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-36.5	-168.7	0	0	0	0	0	113.9	V278 L283 I302 S303	V278-A306 HydrophobicContact CG1-CB 4.14Å; L283-A306 HydrophobicContact CD1-CB 4.35Å; L283-A306 WeakPolarHBondContact CD1-O 3.26Å; I302-A306 HydrophobicContact CG2-CB 3.96Å; S303-A306 WeakPolarHBondContact O-CB 3.01Å; S303-A306 PolarHBondContact O-N 3.38Å
307	W	95	Very high	95.5	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.008	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	2	-170.9	-46.8	119.3	0	0	0	114.8	V278 L283 L292 I302 D305 F309 C310 L316 T330 L334	V278-W307 HydrophobicContact CG1-CH2 3.76Å; V278-W307 HydrophobicContact CG1-CZ2 4.32Å; V278-W307 HydrophobicContact CG1-CZ3 4.05Å; L283-W307 HydrophobicContact CD1-CE3 3.93Å; L283-W307 HydrophobicContact CD1-CZ3 3.86Å; L292-W307 HydrophobicContact CD2-CH2 4.37Å; L292-W307 HydrophobicContact CD2-CZ3 3.83Å; I302-W307 HydrophobicContact CD1-CZ2 4.41Å; I302-W307 HydrophobicContact CG2-CZ2 3.86Å; D305-W307 PolarHBondContact O-N 3.09Å; W307-F309 PolarHBondContact O-N 2.86Å; W307-C310 HydrophobicContact CE3-CB 4.49Å; W307-C310 PolarHBondContact O-N 3.42Å; W307-L316 HydrophobicContact CH2-CD1 4.03Å; W307-L316 HydrophobicContact CH2-CD2 3.77Å; W307-L316 HydrophobicContact CZ2-CD2 3.86Å; W307-L316 HydrophobicContact CZ3-CD1 4.49Å; W307-L316 HydrophobicContact CZ3-CD2 4.42Å; W307-T330 PolarHBondContact NE1-O 2.88Å; W307-L334 HydrophobicContact CB-CD1 4.45Å; W307-L334 HydrophobicContact CB-CD2 3.73Å; W307-L334 HydrophobicContact CB-CG 3.92Å; W307-L334 HydrophobicContact CD2-CD1 3.86Å; W307-L334 HydrophobicContact CD2-CD2 4.24Å; W307-L334 HydrophobicContact CD2-CG 4.29Å; W307-L334 HydrophobicContact CE3-CD1 4.48Å; W307-L334 HydrophobicContact CE3-CD2 4.47Å; W307-L334 HydrophobicContact CG-CD1 3.8Å; W307-L334 HydrophobicContact CG-CD2 3.93Å; W307-L334 HydrophobicContact CG-CG 3.8Å
308	E	92.8	Very high	95.5	Very high	98 Å²	98	44.8 Å²	44.8	46%	0.458	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.6	-40.8	-177.7	-172.7	-169	155.4	0	0	112.7	D305 Q311	D305-E308 WeakPolarHBondContact O-CB 3.2Å; D305-E308 PolarHBondContact O-N 3.03Å; E308-Q311 PolarHBondContact O-NE2 3.19Å
309	F	91.5	Very high	95.5	Very high	28 Å²	28	43.8 Å²	43.8	12%	0.123	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-4.6	-177.8	-55.3	-71	0	0	0	115	K280 Y284 L286 R287 W307	K280-F309 HydrophobicContact CB-CE2 4.35Å; Y284-F309 HydrophobicContact CD2-CD1 4.37Å; Y284-F309 HydrophobicContact CD2-CD2 4.05Å; Y284-F309 AromaticContact CD2-CE1 3.98Å; Y284-F309 HydrophobicContact CD2-CE1 3.98Å; Y284-F309 AromaticContact CD2-CE2 3.64Å; Y284-F309 HydrophobicContact CD2-CE2 3.64Å; Y284-F309 HydrophobicContact CD2-CG 4.42Å; Y284-F309 AromaticContact CD2-CZ 3.6Å; Y284-F309 HydrophobicContact CD2-CZ 3.6Å; Y284-F309 AromaticContact CE2-CE1 3.91Å; Y284-F309 HydrophobicContact CE2-CE1 3.91Å; Y284-F309 HydrophobicContact CE2-CE2 4.28Å; Y284-F309 AromaticContact CE2-CZ 3.76Å; Y284-F309 HydrophobicContact CE2-CZ 3.76Å; L286-F309 CarbonylContact C-O 3.47Å; R287-F309 VanDerWaalsContact CA-O 3.26Å; R287-F309 WeakPolarHBondContact CA-O 3.28Å; R287-F309 PolarHBondContact N-O 3.29Å; W307-F309 PolarHBondContact O-N 2.86Å
310	C	94.4	Very high	95.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.229	C	C	.	.			trans	-113.8	27.9	-169.3	-61.9	0	0	0	0	113.5	W307 R312 L313	W307-C310 HydrophobicContact CE3-CB 4.49Å; W307-C310 PolarHBondContact O-N 3.42Å; C310-R312 PolarHBondContact O-N 3.26Å; C310-L313 WeakPolarHBondContact O-CB 3.39Å; C310-L313 PolarHBondContact O-N 3.38Å; C310-L313 VanDerWaalsContact O-N 3.08Å
311	Q	93.3	Very high	95.6	Very high	117 Å²	117	44.5 Å²	44.5	55%	0.547	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-2.8	-172.5	-58.3	173.5	17.3	0	0	115.6	E308	E308-Q311 PolarHBondContact O-NE2 3.19Å
312	R	96.6	Very high	95.9	Very high	132 Å²	132	40.5 Å²	40.5	50%	0.498	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	3.5	177	-57	-167.5	78.6	99.5	3.2	113.9	R287 L289 C310 S314	R287-R312 WeakPolarHBondContact O-CD 3.26Å; R287-R312 WeakPolarHBondContact O-CG 3.39Å; L289-R312 CarbonylContact O-C 3.49Å; C310-R312 PolarHBondContact O-N 3.26Å; R312-S314 PolarHBondContact O-N 3.37Å
313	L	98	Very high	95.9	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	19%	0.192	C	C	.	.			trans	-64.8	120.7	-176.9	-159.9	74.2	0	0	0	110.5	L289 Q290 L292 C310 L316 L334 L336 L337	L289-L313 HydrophobicContact CD2-CD1 4.04Å; L289-L313 HydrophobicContact CG-CD1 4Å; L289-L313 WeakPolarHBondContact O-CA 3.39Å; L289-L313 PolarHBondContact O-N 3.15Å; L289-L313 VanDerWaalsContact O-N 3.12Å; Q290-L313 WeakPolarHBondContact O-CD1 3.38Å; L292-L313 HydrophobicContact CB-CD1 3.74Å; L292-L313 HydrophobicContact CB-CD2 4.42Å; C310-L313 WeakPolarHBondContact O-CB 3.39Å; C310-L313 PolarHBondContact O-N 3.38Å; C310-L313 VanDerWaalsContact O-N 3.08Å; L313-L316 HydrophobicContact CD2-CB 3.84Å; L313-L316 HydrophobicContact CD2-CD1 4.2Å; L313-L316 HydrophobicContact CD2-CD2 4.14Å; L313-L316 HydrophobicContact CD2-CG 4.28Å; L313-L334 HydrophobicContact CB-CD2 4.03Å; L313-L334 HydrophobicContact CD2-CD2 4.15Å; L313-L336 CarbonylContact O-C 3.16Å; L313-L337 HydrophobicContact CB-CD1 4.38Å; L313-L337 HydrophobicContact CD2-CD1 4.13Å; L313-L337 HydrophobicContact CG-CD1 4.08Å; L313-L337 VanDerWaalsContact O-CA 3.25Å; L313-L337 WeakPolarHBondContact O-CA 3.48Å; L313-L337 PolarHBondContact O-N 2.84Å
314	S	98.2	Very high	96	Very high	21 Å²	21	40.9 Å²	40.9	15%	0.147	20%	0.199	C	C	.	.			trans	-102.8	-20.8	174.5	57.5	0	0	0	0	112.6	Q290 R312 E338 R339	Q290-S314 PolarHBondContact O-N 2.67Å; Q290-S314 PolarHBondContact O-OG 2.71Å; R312-S314 PolarHBondContact O-N 3.37Å; S314-E338 WeakPolarHBondContact O-CA 3.28Å; S314-E338 WeakPolarHBondContact O-CB 3.32Å; S314-E338 PolarHBondContact O-N 2.9Å; S314-R339 PolarHBondContact O-N 3.13Å
315	E	98.7	Very high	96	Very high	39 Å²	39	41.1 Å²	41.1	18%	0.182	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	126.2	179.2	-169.3	166.9	148	0	0	112.6	Q290 Q291 L292 Y293 R339	Q290-E315 PolarHBondContact O-N 3.33Å; Q291-E315 WeakPolarHBondContact CA-O 3.11Å; Q291-E315 HydrophobicContact CG-CB 4.2Å; L292-E315 PolarHBondContact N-O 2.88Å; Y293-E315 HydrophobicContact CE1-CG 4.33Å; Y293-E315 VanDerWaalsContact CE1-OE1 3.26Å; Y293-E315 WeakPolarHBondContact CE1-OE1 3.28Å; Y293-E315 PolarHBondContact OH-OE1 2.86Å; E315-R339 WeakPolarHBondContact CA-O 3.09Å; E315-R339 HydrophobicContact CB-CB 4.47Å; E315-R339 HydrophobicContact CG-CB 4.03Å; E315-R339 IonicContact OE2-CZ 2.68Å; E315-R339 IonicContact OE2-NE 3.59Å; E315-R339 PolarHBondContact OE2-NE 3.1Å; E315-R339 IonicContact OE2-NH2 2.8Å; E315-R339 PolarHBondContact OE2-NH2 2.9Å
316	L	98.7	Very high	96.1	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	117.5	179.6	178.6	53.3	0	0	0	110.6	L292 V294 W307 L313 L318 F331 L334 L337 R339 L340 N341	L292-L316 HydrophobicContact CB-CD1 4.16Å; L292-L316 HydrophobicContact CD2-CD1 4.04Å; L292-L316 HydrophobicContact CG-CD1 4.16Å; V294-L316 HydrophobicContact CG2-CD1 4.37Å; W307-L316 HydrophobicContact CH2-CD1 4.03Å; W307-L316 HydrophobicContact CH2-CD2 3.77Å; W307-L316 HydrophobicContact CZ2-CD2 3.86Å; W307-L316 HydrophobicContact CZ3-CD1 4.49Å; W307-L316 HydrophobicContact CZ3-CD2 4.42Å; L313-L316 HydrophobicContact CD2-CB 3.84Å; L313-L316 HydrophobicContact CD2-CD1 4.2Å; L313-L316 HydrophobicContact CD2-CD2 4.14Å; L313-L316 HydrophobicContact CD2-CG 4.28Å; L316-L318 HydrophobicContact CD1-CD1 4.14Å; L316-L318 HydrophobicContact CD1-CG 4.08Å; L316-L318 HydrophobicContact CD2-CD1 3.81Å; L316-L318 HydrophobicContact CG-CD1 3.89Å; L316-L318 HydrophobicContact CG-CG 4.21Å; L316-F331 HydrophobicContact CD2-CE1 4.35Å; L316-L334 HydrophobicContact CD2-CD1 4.1Å; L316-L337 HydrophobicContact CB-CD1 3.87Å; L316-L337 HydrophobicContact CB-CD2 4.46Å; L316-R339 PolarHBondContact N-O 2.03Å; L316-L340 HydrophobicContact CB-CD1 4.1Å; L316-L340 HydrophobicContact CD2-CD1 3.96Å; L316-L340 HydrophobicContact CG-CD1 4Å; L316-N341 PolarHBondContact O-N 2.78Å
317	D	98.8	Very high	95.9	Very high	23 Å²	23	40.9 Å²	40.9	12%	0.123	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	106.8	174.7	-179.9	27.2	0	0	0	111.4	L292 Y293 V294 S295 S319 N341	L292-D317 PolarHBondContact O-N 3.19Å; Y293-D317 HydrophobicContact CD1-CB 3.72Å; Y293-D317 HydrophobicContact CE1-CB 4.38Å; V294-D317 CarbonylContact C-O 3.4Å; V294-D317 WeakPolarHBondContact CG2-O 3.27Å; V294-D317 PolarHBondContact N-O 3.44Å; S295-D317 WeakPolarHBondContact CB-OD2 3.45Å; S295-D317 PolarHBondContact N-O 3.19Å; S295-D317 PolarHBondContact OG-OD2 2.89Å; D317-S319 WeakPolarHBondContact OD1-CB 3.19Å; D317-S319 PolarHBondContact OD1-N 2.87Å; D317-S319 VanDerWaalsContact OD1-N 3.09Å; D317-S319 PolarHBondContact OD1-OG 3.15Å; D317-N341 HydrophobicContact CB-CB 4.49Å; D317-N341 PolarHBondContact OD1-ND2 2.99Å
318	L	98.6	Very high	95.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.209	C	C	.	.			trans	-108.7	10.8	176.6	-81.9	158.9	0	0	0	112	V278 V294 I299 I302 L316 N321 L323 F331 N341 L342 N345	V278-L318 HydrophobicContact CG2-CD2 4.27Å; V294-L318 HydrophobicContact CG2-CD2 3.53Å; V294-L318 HydrophobicContact CG2-CG 3.91Å; I299-L318 HydrophobicContact CD1-CD2 4.08Å; I302-L318 HydrophobicContact CD1-CD1 3.81Å; I302-L318 HydrophobicContact CD1-CD2 4.44Å; L316-L318 HydrophobicContact CD1-CD1 4.14Å; L316-L318 HydrophobicContact CD1-CG 4.08Å; L316-L318 HydrophobicContact CD2-CD1 3.81Å; L316-L318 HydrophobicContact CG-CD1 3.89Å; L316-L318 HydrophobicContact CG-CG 4.21Å; L318-N321 WeakPolarHBondContact O-CB 3.26Å; L318-N321 PolarHBondContact O-ND2 3.2Å; L318-L323 HydrophobicContact CB-CD1 4.38Å; L318-F331 HydrophobicContact CD1-CE1 4.27Å; L318-N341 CarbonylContact C-O 3.55Å; L318-N341 WeakPolarHBondContact CA-O 3.18Å; L318-N341 PolarHBondContact N-O 3.3Å; L318-L342 HydrophobicContact CB-CD2 3.82Å; L318-L342 HydrophobicContact CD1-CD2 3.89Å; L318-N345 PolarHBondContact O-ND2 2.8Å
319	S	98.7	Very high	95.6	Very high	6 Å²	6	42.9 Å²	42.9	4%	0.042	20%	0.202	C	C	.	.			trans	-64.4	161	-175.5	60.6	0	0	0	0	114.6	S295 Q296 D317 N321 N341 G343	S295-S319 CarbonylContact C-O 3.26Å; S295-S319 WeakPolarHBondContact CA-O 3.41Å; S295-S319 WeakPolarHBondContact CB-O 3.3Å; S295-S319 VanDerWaalsContact CB-OG 3.32Å; S295-S319 WeakPolarHBondContact CB-OG 3.08Å; Q296-S319 PolarHBondContact N-O 2.84Å; D317-S319 WeakPolarHBondContact OD1-CB 3.19Å; D317-S319 PolarHBondContact OD1-N 2.87Å; D317-S319 VanDerWaalsContact OD1-N 3.09Å; D317-S319 PolarHBondContact OD1-OG 3.15Å; S319-N321 PolarHBondContact O-N 3.01Å; S319-N321 PolarHBondContact O-ND2 3.07Å; S319-N341 VanDerWaalsContact CB-ND2 3.3Å; S319-N341 WeakPolarHBondContact CB-ND2 3.43Å; S319-N341 PolarHBondContact N-O 2.9Å; S319-N341 PolarHBondContact OG-ND2 3.15Å; S319-N341 VanDerWaalsContact OG-ND2 3.12Å; S319-G343 CarbonylContact C-O 3.55Å; S319-G343 WeakPolarHBondContact CA-O 3.34Å; S319-G343 WeakPolarHBondContact CB-O 3.23Å
320	Y	98.6	Very high	95.7	Very high	105 Å²	105	42 Å²	42	41%	0.412	20%	0.198	S	C	.	.	S	Bend	trans	53.7	52.7	-178.3	-61.7	-83.9	0	0	0	112.4	Q296 N297 G343 D344	Q296-Y320 WeakPolarHBondContact CA-O 3.3Å; Q296-Y320 VanDerWaalsContact CG-CB 3.41Å; Q296-Y320 HydrophobicContact CG-CD2 4Å; Q296-Y320 HydrophobicContact CG-CG 3.77Å; Q296-Y320 PolarHBondContact N-O 3.47Å; N297-Y320 PolarHBondContact N-O 3.49Å; Y320-G343 PolarHBondContact N-O 3.21Å; Y320-D344 WeakPolarHBondContact CA-O 3.43Å; Y320-D344 HydrophobicContact CD1-CB 3.48Å; Y320-D344 VanDerWaalsContact CD1-CB 3.48Å; Y320-D344 HydrophobicContact CD2-CB 4.14Å; Y320-D344 HydrophobicContact CE1-CB 3.4Å; Y320-D344 VanDerWaalsContact CE1-CB 3.4Å; Y320-D344 WeakPolarHBondContact CE1-OD1 3.32Å; Y320-D344 HydrophobicContact CE2-CB 4.09Å; Y320-D344 HydrophobicContact CG-CB 3.83Å; Y320-D344 PolarHBondContact N-O 2.97Å; Y320-D344 VanDerWaalsContact OH-CG 3.27Å; Y320-D344 PolarHBondContact OH-OD1 2.93Å; Y320-D344 PolarHBondContact OH-OD2 3.42Å
321	N	98.6	Very high	95.7	Very high	2 Å²	2	42 Å²	42	1%	0.011	20%	0.199	C	C	.	.	S	Bend	trans	-126.8	-163	177.3	-87.1	-69.6	0	0	0	110.1	V294 N297 A298 I299 L318 S319 D344 N345	V294-N321 PolarHBondContact O-ND2 2.95Å; V294-N321 VanDerWaalsContact O-ND2 3.13Å; N297-N321 VanDerWaalsContact CA-OD1 3.28Å; N297-N321 WeakPolarHBondContact CA-OD1 3.46Å; N297-N321 WeakPolarHBondContact CB-OD1 3.23Å; N297-N321 PolarHBondContact N-OD1 2.96Å; N297-N321 PolarHBondContact O-OD1 2.92Å; A298-N321 PolarHBondContact N-OD1 3.38Å; I299-N321 HydrophobicContact CB-CB 4.13Å; I299-N321 VanDerWaalsContact CB-OD1 3.27Å; I299-N321 WeakPolarHBondContact CB-OD1 3.45Å; I299-N321 WeakPolarHBondContact CG1-OD1 3.15Å; I299-N321 PolarHBondContact N-OD1 3.26Å; L318-N321 WeakPolarHBondContact O-CB 3.26Å; L318-N321 PolarHBondContact O-ND2 3.2Å; S319-N321 PolarHBondContact O-N 3.01Å; S319-N321 PolarHBondContact O-ND2 3.07Å; N321-D344 PolarHBondContact N-O 2.89Å; N321-N345 VanDerWaalsContact CA-OD1 3.31Å; N321-N345 WeakPolarHBondContact CA-OD1 3.28Å; N321-N345 WeakPolarHBondContact CB-OD1 3.46Å; N321-N345 PolarHBondContact O-OD1 2.99Å
322	Q	97.9	Very high	95.6	Very high	70 Å²	70	39.6 Å²	39.6	33%	0.327	19%	0.192	S	C	.	.			trans	-123.7	27.1	-175.2	-50.5	-58.9	-51.6	0	0	111.8	I299 T324 N345 R346	I299-Q322 CarbonylContact O-C 3.52Å; I299-Q322 WeakPolarHBondContact O-CA 3.27Å; I299-Q322 PolarHBondContact O-N 3.29Å; Q322-T324 PolarHBondContact O-N 3.35Å; Q322-N345 PolarHBondContact N-OD1 2.68Å; Q322-R346 VanDerWaalsContact OE1-CZ 3.27Å
323	L	97.6	Very high	95.3	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.183	C	C	.	.			trans	-65.7	130.2	177.8	-63	172.5	0	0	0	110	I299 I302 L318 L342 N345 R346 V347	I299-L323 HydrophobicContact CG2-CD2 3.96Å; I299-L323 PolarHBondContact O-N 3.16Å; I299-L323 VanDerWaalsContact O-N 3.15Å; I302-L323 HydrophobicContact CD1-CD1 4.29Å; I302-L323 HydrophobicContact CD1-CD2 4.23Å; I302-L323 HydrophobicContact CG1-CD2 4.19Å; L318-L323 HydrophobicContact CB-CD1 4.38Å; L323-L342 HydrophobicContact CD1-CD2 3.78Å; L323-N345 HydrophobicContact CB-CB 4.34Å; L323-N345 WeakPolarHBondContact CB-OD1 3.26Å; L323-N345 WeakPolarHBondContact CG-OD1 3.34Å; L323-N345 PolarHBondContact N-OD1 3Å; L323-R346 CarbonylContact O-C 3.24Å; L323-R346 WeakPolarHBondContact O-CA 3.28Å; L323-R346 PolarHBondContact O-N 3.26Å; L323-V347 HydrophobicContact CB-CG2 4.1Å; L323-V347 PolarHBondContact O-N 3.47Å; L323-V347 VanDerWaalsContact O-N 3.14Å
324	T	93.8	Very high	95.1	Very high	66 Å²	66	34.8 Å²	34.8	41%	0.405	18%	0.183	S	C	.	.			trans	-110.8	-25.4	179.1	53.7	0	0	0	0	114.1	Q322 R346 V347 T348 H349	Q322-T324 PolarHBondContact O-N 3.35Å; T324-R346 WeakPolarHBondContact CA-O 3.04Å; T324-R346 HydrophobicContact CG2-CB 4.19Å; T324-V347 WeakPolarHBondContact O-CA 3.49Å; T324-T348 PolarHBondContact O-N 2.62Å; T324-T348 PolarHBondContact O-OG1 3.12Å; T324-H349 PolarHBondContact O-N 3.25Å
325	R	91.4	Very high	94.9	Very high	94 Å²	94	36.5 Å²	36.5	36%	0.355	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	149.6	-178	67	-171.2	-66.7	141.9	4.4	111.5	D327 H349 E538	R325-D327 IonicContact CZ-OD1 3.52Å; R325-D327 IonicContact CZ-OD2 2.67Å; R325-D327 VanDerWaalsContact NE-CG 3.32Å; R325-D327 IonicContact NE-OD1 2.67Å; R325-D327 PolarHBondContact NE-OD1 2.85Å; R325-D327 IonicContact NE-OD2 2.82Å; R325-D327 PolarHBondContact NE-OD2 3.3Å; R325-D327 IonicContact NH2-OD1 3.51Å; R325-D327 PolarHBondContact NH2-OD1 3.24Å; R325-H349 CarbonylContact C-O 3.47Å; R325-H349 WeakPolarHBondContact CA-O 3.34Å; R325-H349 HydrophobicContact CB-CB 4.02Å; R325-E538 IonicContact CZ-OE1 3.61Å; R325-E538 VanDerWaalsContact NH1-CD 3.29Å; R325-E538 IonicContact NH1-OE1 2.7Å; R325-E538 PolarHBondContact NH1-OE1 2.9Å; R325-E538 IonicContact NH1-OE2 2.75Å; R325-E538 IonicContact NH2-OE1 2.97Å; R325-E538 PolarHBondContact NH2-OE1 3.07Å
326	L	93.2	Very high	94.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	100.2	170.5	-57	175.2	0	0	0	108.2	T330 F331 L342 V347 H349 I350 A351 V354 F355	L326-T330 HydrophobicContact CD2-CG2 4.14Å; L326-F331 HydrophobicContact CD1-CE2 4.38Å; L326-F331 HydrophobicContact CD2-CE2 4.06Å; L326-F331 HydrophobicContact CD2-CZ 3.99Å; L326-L342 HydrophobicContact CD1-CD1 3.91Å; L326-L342 HydrophobicContact CD2-CD2 4.49Å; L326-V347 HydrophobicContact CD1-CG1 4.05Å; L326-V347 HydrophobicContact CD1-CG2 4.44Å; L326-V347 HydrophobicContact CG-CG1 4.03Å; L326-V347 HydrophobicContact CG-CG2 4.33Å; L326-H349 PolarHBondContact N-O 2.8Å; L326-I350 HydrophobicContact CD1-CG1 4.29Å; L326-A351 WeakPolarHBondContact O-CB 3.37Å; L326-A351 PolarHBondContact O-N 2.94Å; L326-V354 HydrophobicContact CB-CG2 4.08Å; L326-F355 HydrophobicContact CD1-CZ 4.13Å
327	D	90.4	Very high	94.8	Very high	52 Å²	52	38.3 Å²	38.3	28%	0.278	21%	0.206	S	C	.	.			trans	-82.3	157.3	179.7	-58.7	-64	0	0	0	111.6	R325 S329 T330 V354	R325-D327 IonicContact CZ-OD1 3.52Å; R325-D327 IonicContact CZ-OD2 2.67Å; R325-D327 VanDerWaalsContact NE-CG 3.32Å; R325-D327 IonicContact NE-OD1 2.67Å; R325-D327 PolarHBondContact NE-OD1 2.85Å; R325-D327 IonicContact NE-OD2 2.82Å; R325-D327 PolarHBondContact NE-OD2 3.3Å; R325-D327 IonicContact NH2-OD1 3.51Å; R325-D327 PolarHBondContact NH2-OD1 3.24Å; D327-S329 PolarHBondContact O-N 2.88Å; D327-T330 PolarHBondContact N-OG1 2.93Å; D327-T330 VanDerWaalsContact O-CB 3.22Å; D327-T330 WeakPolarHBondContact O-CB 3.26Å; D327-T330 PolarHBondContact O-N 3.35Å; D327-T330 PolarHBondContact O-OG1 2.8Å; D327-V354 WeakPolarHBondContact O-CG2 3.29Å
328	E	89.1	Confident	94.8	Very high	99 Å²	99	40.4 Å²	40.4	46%	0.463	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-33	-174.4	-171.8	179.4	-176.3	0	0	113.9	T330	E328-T330 PolarHBondContact O-N 2.83Å
329	S	90.5	Very high	94.8	Very high	44 Å²	44	44.2 Å²	44.2	31%	0.308	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-12.2	179	57.8	0	0	0	0	115.4	D327 F331 V332	D327-S329 PolarHBondContact O-N 2.88Å; S329-F331 VanDerWaalsContact C-N 3.28Å; S329-F331 PolarHBondContact O-N 2.8Å; S329-F331 VanDerWaalsContact O-N 3.08Å; S329-V332 PolarHBondContact O-N 2.8Å
330	T	94.1	Very high	94.8	Very high	8 Å²	8	44 Å²	44	5%	0.049	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.9	-163.5	-56.2	0	0	0	0	114.7	I302 W307 L326 D327 E328	I302-T330 HydrophobicContact CB-CG2 4.26Å; I302-T330 HydrophobicContact CD1-CG2 3.85Å; I302-T330 HydrophobicContact CG2-CG2 4.42Å; W307-T330 PolarHBondContact NE1-O 2.88Å; L326-T330 HydrophobicContact CD2-CG2 4.14Å; D327-T330 PolarHBondContact N-OG1 2.93Å; D327-T330 VanDerWaalsContact O-CB 3.22Å; D327-T330 WeakPolarHBondContact O-CB 3.26Å; D327-T330 PolarHBondContact O-N 3.35Å; D327-T330 PolarHBondContact O-OG1 2.8Å; E328-T330 PolarHBondContact O-N 2.83Å
331	F	94.8	Very high	94.8	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.009	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.4	19.7	-178.3	-54.9	-69.5	0	0	0	113.6	I302 L316 L318 L326 S329 G333 L334 L340 L342 V354 F355 L358	I302-F331 HydrophobicContact CD1-CE1 4.39Å; L316-F331 HydrophobicContact CD2-CE1 4.35Å; L318-F331 HydrophobicContact CD1-CE1 4.27Å; L326-F331 HydrophobicContact CD1-CE2 4.38Å; L326-F331 HydrophobicContact CD2-CE2 4.06Å; L326-F331 HydrophobicContact CD2-CZ 3.99Å; S329-F331 VanDerWaalsContact C-N 3.28Å; S329-F331 PolarHBondContact O-N 2.8Å; S329-F331 VanDerWaalsContact O-N 3.08Å; F331-G333 PolarHBondContact O-N 3.33Å; F331-L334 HydrophobicContact CB-CD1 4.32Å; F331-L334 HydrophobicContact CD1-CD1 4.11Å; F331-L334 PolarHBondContact O-N 2.93Å; F331-L340 HydrophobicContact CD1-CD2 4.47Å; F331-L340 HydrophobicContact CE1-CD1 4.19Å; F331-L340 HydrophobicContact CE1-CD2 4.24Å; F331-L340 HydrophobicContact CE2-CD2 4.3Å; F331-L340 HydrophobicContact CZ-CD2 4.16Å; F331-L342 HydrophobicContact CE2-CD1 4.31Å; F331-L342 HydrophobicContact CZ-CD1 3.9Å; F331-L342 HydrophobicContact CZ-CD2 4.13Å; F331-V354 HydrophobicContact CD2-CG2 3.98Å; F331-V354 HydrophobicContact CE2-CG2 4.28Å; F331-F355 HydrophobicContact CD2-CD1 4.07Å; F331-F355 AromaticContact CD2-CE1 3.97Å; F331-F355 HydrophobicContact CD2-CE1 3.97Å; F331-F355 HydrophobicContact CE2-CD1 4.32Å; F331-F355 AromaticContact CE2-CE1 3.74Å; F331-F355 HydrophobicContact CE2-CE1 3.74Å; F331-L358 HydrophobicContact CB-CD1 4.14Å; F331-L358 HydrophobicContact CB-CD2 4.09Å; F331-L358 HydrophobicContact CB-CG 4.46Å; F331-L358 HydrophobicContact CG-CD1 4.45Å
332	V	91.5	Very high	94.8	Very high	66 Å²	66	40.5 Å²	40.5	40%	0.4	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	133.9	177.7	172.1	0	0	0	0	110.5	S329 F357	S329-V332 PolarHBondContact O-N 2.8Å; V332-F357 HydrophobicContact CG2-CD2 3.99Å; V332-F357 HydrophobicContact CG2-CE2 4.02Å
333	G	89.2	Confident	94.8	Very high	31 Å²	31	37.1 Å²	37.1	32%	0.32	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	91	-7.3	-179	0	0	0	0	0	115.8	F331 S335	F331-G333 PolarHBondContact O-N 3.33Å; G333-S335 VanDerWaalsContact C-N 3.33Å; G333-S335 PolarHBondContact O-N 2.87Å
334	L	95.2	Very high	94.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.208	C	C	.	.			trans	-90.9	41.1	-179.9	-62.8	-176.9	0	0	0	113.8	W307 L313 L316 F331 L336 L337 L358	W307-L334 HydrophobicContact CB-CD1 4.45Å; W307-L334 HydrophobicContact CB-CD2 3.73Å; W307-L334 HydrophobicContact CB-CG 3.92Å; W307-L334 HydrophobicContact CD2-CD1 3.86Å; W307-L334 HydrophobicContact CD2-CD2 4.24Å; W307-L334 HydrophobicContact CD2-CG 4.29Å; W307-L334 HydrophobicContact CE3-CD1 4.48Å; W307-L334 HydrophobicContact CE3-CD2 4.47Å; W307-L334 HydrophobicContact CG-CD1 3.8Å; W307-L334 HydrophobicContact CG-CD2 3.93Å; W307-L334 HydrophobicContact CG-CG 3.8Å; L313-L334 HydrophobicContact CB-CD2 4.03Å; L313-L334 HydrophobicContact CD2-CD2 4.15Å; L316-L334 HydrophobicContact CD2-CD1 4.1Å; F331-L334 HydrophobicContact CB-CD1 4.32Å; F331-L334 HydrophobicContact CD1-CD1 4.11Å; F331-L334 PolarHBondContact O-N 2.93Å; L334-L336 PolarHBondContact O-N 3.1Å; L334-L336 VanDerWaalsContact O-N 3.12Å; L334-L337 HydrophobicContact CB-CB 4.28Å; L334-L337 HydrophobicContact CD1-CD2 4.3Å; L334-L337 VanDerWaalsContact O-CB 3.22Å; L334-L337 WeakPolarHBondContact O-CB 3.42Å; L334-L337 PolarHBondContact O-N 2.81Å; L334-L337 VanDerWaalsContact O-N 3.08Å; L334-L358 HydrophobicContact CB-CD2 3.78Å; L334-L358 VanDerWaalsContact O-CD2 3.28Å; L334-L358 WeakPolarHBondContact O-CD2 3.45Å
335	S	94	Very high	95.1	Very high	58 Å²	58	36 Å²	36	41%	0.406	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-12	-173.4	57	0	0	0	0	115.6	G333 F357 N360	G333-S335 VanDerWaalsContact C-N 3.33Å; G333-S335 PolarHBondContact O-N 2.87Å; S335-F357 WeakPolarHBondContact CA-O 3.39Å; S335-F357 WeakPolarHBondContact CB-O 3.25Å; S335-N360 PolarHBondContact O-ND2 3Å
336	L	96.7	Very high	95.3	Very high	78 Å²	78	37.7 Å²	37.7	41%	0.408	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	4.4	174.6	-62.4	-177.9	0	0	0	113.8	L313 L334 E338	L313-L336 CarbonylContact O-C 3.16Å; L334-L336 PolarHBondContact O-N 3.1Å; L334-L336 VanDerWaalsContact O-N 3.12Å; L336-E338 PolarHBondContact O-N 3.35Å
337	L	98.2	Very high	95.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.198	C	C	.	.			trans	-69.8	123.7	-177.8	-163	70.7	0	0	0	111.1	L313 L316 L334 L340 L358 N360 L361	L313-L337 HydrophobicContact CB-CD1 4.38Å; L313-L337 HydrophobicContact CD2-CD1 4.13Å; L313-L337 HydrophobicContact CG-CD1 4.08Å; L313-L337 VanDerWaalsContact O-CA 3.25Å; L313-L337 WeakPolarHBondContact O-CA 3.48Å; L313-L337 PolarHBondContact O-N 2.84Å; L316-L337 HydrophobicContact CB-CD1 3.87Å; L316-L337 HydrophobicContact CB-CD2 4.46Å; L334-L337 HydrophobicContact CB-CB 4.28Å; L334-L337 HydrophobicContact CD1-CD2 4.3Å; L334-L337 VanDerWaalsContact O-CB 3.22Å; L334-L337 WeakPolarHBondContact O-CB 3.42Å; L334-L337 PolarHBondContact O-N 2.81Å; L334-L337 VanDerWaalsContact O-N 3.08Å; L337-L340 HydrophobicContact CD2-CB 3.92Å; L337-L340 HydrophobicContact CD2-CD1 4.29Å; L337-L340 HydrophobicContact CD2-CD2 4.21Å; L337-L340 HydrophobicContact CD2-CG 4.37Å; L337-L358 HydrophobicContact CB-CD2 4.48Å; L337-L358 HydrophobicContact CD2-CD1 4.43Å; L337-L358 HydrophobicContact CD2-CD2 4.46Å; L337-N360 CarbonylContact O-C 3.59Å; L337-N360 VanDerWaalsContact O-C 3.26Å; L337-L361 HydrophobicContact CB-CD1 4.3Å; L337-L361 HydrophobicContact CD2-CD1 4.04Å; L337-L361 HydrophobicContact CG-CD1 3.92Å; L337-L361 WeakPolarHBondContact O-CA 3.37Å; L337-L361 PolarHBondContact O-N 3.43Å; L337-L361 VanDerWaalsContact O-N 3.11Å
338	E	98.4	Very high	95.4	Very high	66 Å²	66	38.1 Å²	38.1	31%	0.308	20%	0.203	S	C	.	.			trans	-99.3	-33.9	177.7	-58.1	-178.8	149.5	0	0	112.1	S314 L336 Q362 T363	S314-E338 WeakPolarHBondContact O-CA 3.28Å; S314-E338 WeakPolarHBondContact O-CB 3.32Å; S314-E338 PolarHBondContact O-N 2.9Å; L336-E338 PolarHBondContact O-N 3.35Å; E338-Q362 PolarHBondContact O-N 2.91Å; E338-T363 PolarHBondContact O-N 3.45Å
339	R	98.8	Very high	95.2	Very high	81 Å²	81	34 Å²	34	31%	0.306	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	122.4	-174.2	-71	178.7	-66.9	-63.3	-7.1	110.9	S314 E315 L316	S314-R339 PolarHBondContact O-N 3.13Å; E315-R339 WeakPolarHBondContact CA-O 3.09Å; E315-R339 HydrophobicContact CB-CB 4.47Å; E315-R339 HydrophobicContact CG-CB 4.03Å; E315-R339 IonicContact OE2-CZ 2.68Å; E315-R339 IonicContact OE2-NE 3.59Å; E315-R339 PolarHBondContact OE2-NE 3.1Å; E315-R339 IonicContact OE2-NH2 2.8Å; E315-R339 PolarHBondContact OE2-NH2 2.9Å; L316-R339 PolarHBondContact N-O 2.03Å
340	L	98.8	Very high	95.2	Very high	2 Å²	2	32 Å²	32	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	115.9	177.6	178.3	53.1	0	0	0	109.6	L316 F331 L337 L342 F355 L358 L361 T363 L364 D365	L316-L340 HydrophobicContact CB-CD1 4.1Å; L316-L340 HydrophobicContact CD2-CD1 3.96Å; L316-L340 HydrophobicContact CG-CD1 4Å; F331-L340 HydrophobicContact CD1-CD2 4.47Å; F331-L340 HydrophobicContact CE1-CD1 4.19Å; F331-L340 HydrophobicContact CE1-CD2 4.24Å; F331-L340 HydrophobicContact CE2-CD2 4.3Å; F331-L340 HydrophobicContact CZ-CD2 4.16Å; L337-L340 HydrophobicContact CD2-CB 3.92Å; L337-L340 HydrophobicContact CD2-CD1 4.29Å; L337-L340 HydrophobicContact CD2-CD2 4.21Å; L337-L340 HydrophobicContact CD2-CG 4.37Å; L340-L342 HydrophobicContact CD1-CD1 4.16Å; L340-L342 HydrophobicContact CD1-CD2 4.49Å; L340-L342 HydrophobicContact CD1-CG 4.01Å; L340-L342 HydrophobicContact CD2-CD1 3.91Å; L340-L342 HydrophobicContact CG-CD1 3.88Å; L340-L342 HydrophobicContact CG-CG 4.11Å; L340-F355 HydrophobicContact CD2-CD1 4.45Å; L340-F355 HydrophobicContact CD2-CE1 4.08Å; L340-L358 HydrophobicContact CD2-CD1 4.01Å; L340-L361 HydrophobicContact CB-CD1 3.72Å; L340-L361 HydrophobicContact CB-CD2 4.22Å; L340-T363 PolarHBondContact N-O 2.89Å; L340-L364 HydrophobicContact CB-CD1 4.16Å; L340-L364 HydrophobicContact CD2-CD1 4Å; L340-L364 HydrophobicContact CG-CD1 4Å; L340-D365 PolarHBondContact O-N 2.96Å
341	N	98.8	Very high	94.9	Very high	32 Å²	32	32.3 Å²	32.3	17%	0.171	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	116.3	175.2	-177.1	17.2	0	0	0	110.6	L316 D317 L318 S319 G343 D365	L316-N341 PolarHBondContact O-N 2.78Å; D317-N341 HydrophobicContact CB-CB 4.49Å; D317-N341 PolarHBondContact OD1-ND2 2.99Å; L318-N341 CarbonylContact C-O 3.55Å; L318-N341 WeakPolarHBondContact CA-O 3.18Å; L318-N341 PolarHBondContact N-O 3.3Å; S319-N341 VanDerWaalsContact CB-ND2 3.3Å; S319-N341 WeakPolarHBondContact CB-ND2 3.43Å; S319-N341 PolarHBondContact N-O 2.9Å; S319-N341 PolarHBondContact OG-ND2 3.15Å; S319-N341 VanDerWaalsContact OG-ND2 3.12Å; N341-G343 PolarHBondContact OD1-N 2.84Å; N341-D365 HydrophobicContact CB-CB 4.41Å
342	L	98.6	Very high	94.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.181	C	C	.	.			trans	-120.4	10.3	177.7	-70.5	161.3	0	0	0	111.2	L318 L323 L326 F331 L340 N345 F355 L364 D365 L366 N369	L318-L342 HydrophobicContact CB-CD2 3.82Å; L318-L342 HydrophobicContact CD1-CD2 3.89Å; L323-L342 HydrophobicContact CD1-CD2 3.78Å; L326-L342 HydrophobicContact CD1-CD1 3.91Å; L326-L342 HydrophobicContact CD2-CD2 4.49Å; F331-L342 HydrophobicContact CE2-CD1 4.31Å; F331-L342 HydrophobicContact CZ-CD1 3.9Å; F331-L342 HydrophobicContact CZ-CD2 4.13Å; L340-L342 HydrophobicContact CD1-CD1 4.16Å; L340-L342 HydrophobicContact CD1-CD2 4.49Å; L340-L342 HydrophobicContact CD1-CG 4.01Å; L340-L342 HydrophobicContact CD2-CD1 3.91Å; L340-L342 HydrophobicContact CG-CD1 3.88Å; L340-L342 HydrophobicContact CG-CG 4.11Å; L342-N345 PolarHBondContact O-ND2 3.49Å; L342-F355 HydrophobicContact CD1-CE1 4.43Å; L342-L364 HydrophobicContact CD1-CD1 4.4Å; L342-D365 CarbonylContact C-O 3.49Å; L342-D365 WeakPolarHBondContact CA-O 3.34Å; L342-D365 PolarHBondContact N-O 2.81Å; L342-L366 HydrophobicContact CB-CD2 3.8Å; L342-L366 HydrophobicContact CD1-CD2 3.88Å; L342-N369 PolarHBondContact O-ND2 2.88Å
343	G	98.4	Very high	94	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.165	C	C	.	.			trans	-59	155.9	-177.8	0	0	0	0	0	114.1	S319 Y320 N341 N345 D365 R367	S319-G343 CarbonylContact C-O 3.55Å; S319-G343 WeakPolarHBondContact CA-O 3.34Å; S319-G343 WeakPolarHBondContact CB-O 3.23Å; Y320-G343 PolarHBondContact N-O 3.21Å; N341-G343 PolarHBondContact OD1-N 2.84Å; G343-N345 VanDerWaalsContact C-N 3.34Å; G343-N345 PolarHBondContact O-N 3.2Å; G343-N345 PolarHBondContact O-ND2 3.13Å; G343-D365 PolarHBondContact N-O 2.83Å; G343-R367 CarbonylContact C-O 3.5Å; G343-R367 VanDerWaalsContact CA-O 3.22Å; G343-R367 WeakPolarHBondContact CA-O 3.26Å
344	D	98.4	Very high	94.1	Very high	33 Å²	33	29.7 Å²	29.7	18%	0.176	15%	0.151	C	C	.	.	S	Bend	trans	56.1	46	176.9	-59.5	-92.9	0	0	0	112.4	Y320 N321 R367 N368	Y320-D344 WeakPolarHBondContact CA-O 3.43Å; Y320-D344 HydrophobicContact CD1-CB 3.48Å; Y320-D344 VanDerWaalsContact CD1-CB 3.48Å; Y320-D344 HydrophobicContact CD2-CB 4.14Å; Y320-D344 HydrophobicContact CE1-CB 3.4Å; Y320-D344 VanDerWaalsContact CE1-CB 3.4Å; Y320-D344 WeakPolarHBondContact CE1-OD1 3.32Å; Y320-D344 HydrophobicContact CE2-CB 4.09Å; Y320-D344 HydrophobicContact CG-CB 3.83Å; Y320-D344 PolarHBondContact N-O 2.97Å; Y320-D344 VanDerWaalsContact OH-CG 3.27Å; Y320-D344 PolarHBondContact OH-OD1 2.93Å; Y320-D344 PolarHBondContact OH-OD2 3.42Å; N321-D344 PolarHBondContact N-O 2.89Å; D344-R367 PolarHBondContact N-O 3.14Å; D344-N368 VanDerWaalsContact CA-O 3.31Å; D344-N368 WeakPolarHBondContact CA-O 3.5Å; D344-N368 HydrophobicContact CB-CB 4.43Å; D344-N368 PolarHBondContact N-O 2.82Å; D344-N368 WeakPolarHBondContact OD1-CB 3.47Å; D344-N368 PolarHBondContact OD1-ND2 2.87Å
345	N	98.5	Very high	94	Very high	11 Å²	11	29.7 Å²	29.7	6%	0.059	15%	0.151	C	C	.	.	S	Bend	trans	-114	-155.5	173	-88.9	-88.3	0	0	0	109.4	L318 N321 Q322 L323 L342 G343 V347 N368 N369	L318-N345 PolarHBondContact O-ND2 2.8Å; N321-N345 VanDerWaalsContact CA-OD1 3.31Å; N321-N345 WeakPolarHBondContact CA-OD1 3.28Å; N321-N345 WeakPolarHBondContact CB-OD1 3.46Å; N321-N345 PolarHBondContact O-OD1 2.99Å; Q322-N345 PolarHBondContact N-OD1 2.68Å; L323-N345 HydrophobicContact CB-CB 4.34Å; L323-N345 WeakPolarHBondContact CB-OD1 3.26Å; L323-N345 WeakPolarHBondContact CG-OD1 3.34Å; L323-N345 PolarHBondContact N-OD1 3Å; L342-N345 PolarHBondContact O-ND2 3.49Å; G343-N345 VanDerWaalsContact C-N 3.34Å; G343-N345 PolarHBondContact O-N 3.2Å; G343-N345 PolarHBondContact O-ND2 3.13Å; N345-V347 HydrophobicContact CB-CG2 4.24Å; N345-N368 PolarHBondContact N-O 3.13Å; N345-N369 WeakPolarHBondContact CA-OD1 3.26Å; N345-N369 WeakPolarHBondContact CB-OD1 3.5Å
346	R	96.6	Very high	93.9	Very high	128 Å²	128	34.2 Å²	34.2	48%	0.483	16%	0.159	S	C	.	.			trans	-129.9	31.3	176.1	-54.5	-168.6	-160.1	-146.5	6.6	112.1	Q322 L323 T324 T348 N369	Q322-R346 VanDerWaalsContact OE1-CZ 3.27Å; L323-R346 CarbonylContact O-C 3.24Å; L323-R346 WeakPolarHBondContact O-CA 3.28Å; L323-R346 PolarHBondContact O-N 3.26Å; T324-R346 WeakPolarHBondContact CA-O 3.04Å; T324-R346 HydrophobicContact CG2-CB 4.19Å; R346-T348 PolarHBondContact O-N 2.98Å; R346-N369 PolarHBondContact N-OD1 3.24Å
347	V	95.1	Very high	93.5	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.159	C	C	.	.			trans	-66.9	107.8	-171.6	178.6	0	0	0	0	109.4	L323 T324 L326 N345 H349 I350 N369 E370 I371	L323-V347 HydrophobicContact CB-CG2 4.1Å; L323-V347 PolarHBondContact O-N 3.47Å; L323-V347 VanDerWaalsContact O-N 3.14Å; T324-V347 WeakPolarHBondContact O-CA 3.49Å; L326-V347 HydrophobicContact CD1-CG1 4.05Å; L326-V347 HydrophobicContact CD1-CG2 4.44Å; L326-V347 HydrophobicContact CG-CG1 4.03Å; L326-V347 HydrophobicContact CG-CG2 4.33Å; N345-V347 HydrophobicContact CB-CG2 4.24Å; V347-H349 WeakPolarHBondContact CG1-O 3.25Å; V347-I350 HydrophobicContact CG1-CD1 4.18Å; V347-I350 HydrophobicContact CG1-CG1 3.69Å; V347-N369 HydrophobicContact CB-CB 4.38Å; V347-N369 VanDerWaalsContact CB-OD1 3.32Å; V347-N369 WeakPolarHBondContact CB-OD1 3.42Å; V347-N369 WeakPolarHBondContact CG2-OD1 3.32Å; V347-N369 PolarHBondContact N-OD1 3.43Å; V347-E370 CarbonylContact O-C 3.53Å; V347-E370 WeakPolarHBondContact O-CA 3.4Å; V347-E370 PolarHBondContact O-N 3.26Å; V347-I371 HydrophobicContact CG1-CG1 4.43Å; V347-I371 WeakPolarHBondContact O-CG1 3.13Å; V347-I371 PolarHBondContact O-N 3.45Å; V347-I371 VanDerWaalsContact O-N 3.15Å
348	T	89.1	Confident	93.3	Very high	62 Å²	62	35 Å²	35	38%	0.38	16%	0.159	S	C	.	.			trans	-94.9	-20.5	171.2	54.6	0	0	0	0	111.8	T324 R346 E370 W373	T324-T348 PolarHBondContact O-N 2.62Å; T324-T348 PolarHBondContact O-OG1 3.12Å; R346-T348 PolarHBondContact O-N 2.98Å; T348-E370 HydrophobicContact CG2-CB 3.49Å; T348-E370 VanDerWaalsContact CG2-CB 3.49Å; T348-E370 HydrophobicContact CG2-CG 4.39Å; T348-W373 PolarHBondContact O-NE1 2.97Å
349	H	85.9	Confident	93.1	Very high	13 Å²	13	34 Å²	34	6%	0.06	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	129.1	-171.6	177.1	112.3	0	0	0	112.9	T324 R325 L326 V347 W373 S537	T324-H349 PolarHBondContact O-N 3.25Å; R325-H349 CarbonylContact C-O 3.47Å; R325-H349 WeakPolarHBondContact CA-O 3.34Å; R325-H349 HydrophobicContact CB-CB 4.02Å; L326-H349 PolarHBondContact N-O 2.8Å; V347-H349 WeakPolarHBondContact CG1-O 3.25Å; H349-W373 HydrophobicContact CB-CZ2 4.02Å; H349-W373 AromaticContact CG-CZ2 3.8Å; H349-W373 AromaticContact ND1-CZ2 3.66Å; H349-S537 PolarHBondContact ND1-O 3.3Å
350	I	90.4	Very high	92.9	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	104.3	177.2	-56.5	-173.4	0	0	0	108.1	L326 V347 V354 F355 L366 I371 W373 A374 A381	L326-I350 HydrophobicContact CD1-CG1 4.29Å; V347-I350 HydrophobicContact CG1-CD1 4.18Å; V347-I350 HydrophobicContact CG1-CG1 3.69Å; I350-V354 HydrophobicContact CG2-CG1 3.47Å; I350-V354 VanDerWaalsContact CG2-CG1 3.47Å; I350-F355 HydrophobicContact CG2-CE2 3.97Å; I350-F355 HydrophobicContact CG2-CZ 4.41Å; I350-L366 HydrophobicContact CD1-CD1 4.37Å; I350-L366 HydrophobicContact CD1-CD2 4.49Å; I350-I371 HydrophobicContact CD1-CD1 3.68Å; I350-I371 HydrophobicContact CD1-CG1 3.91Å; I350-I371 HydrophobicContact CD1-CG2 4.17Å; I350-W373 WeakPolarHBondContact O-CH2 3.34Å; I350-W373 VanDerWaalsContact O-CZ3 3.27Å; I350-W373 WeakPolarHBondContact O-CZ3 3.02Å; I350-A374 HydrophobicContact CB-CB 4.2Å; I350-A374 HydrophobicContact CD1-CB 4.44Å; I350-A381 HydrophobicContact CG2-CB 3.97Å
351	A	86.8	Confident	92.9	Very high	14 Å²	14	33.1 Å²	33.1	12%	0.116	16%	0.161	C	C	.	.			trans	-61.8	148.4	-175.7	0	0	0	0	0	112.7	L326 G353 V354	L326-A351 WeakPolarHBondContact O-CB 3.37Å; L326-A351 PolarHBondContact O-N 2.94Å; A351-G353 PolarHBondContact O-N 3.12Å; A351-V354 WeakPolarHBondContact O-CG1 3.32Å; A351-V354 PolarHBondContact O-N 3.12Å
352	D	84.1	Confident	92.9	Very high	36 Å²	36	35.3 Å²	35.3	19%	0.193	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	125	170.7	-69.2	-46.1	0	0	0	108.9	V354 S379 E380 K577 K593	D352-V354 PolarHBondContact O-N 2.63Å; D352-S379 WeakPolarHBondContact OD1-CA 3Å; D352-S379 WeakPolarHBondContact OD1-CB 3.05Å; D352-E380 PolarHBondContact OD1-N 3.02Å; D352-E380 VanDerWaalsContact OD1-N 3.15Å; D352-K577 IonicContact OD2-NZ 3.56Å; D352-K593 IonicContact OD1-NZ 2.71Å; D352-K593 PolarHBondContact OD1-NZ 2.91Å; D352-K593 IonicContact OD2-NZ 2.92Å; D352-K593 PolarHBondContact OD2-NZ 2.92Å
353	G	84.9	Confident	92.9	Very high	7 Å²	7	37.2 Å²	37.2	7%	0.072	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	9.1	176.5	0	0	0	0	0	117.3	A351 F355 R356 E380	A351-G353 PolarHBondContact O-N 3.12Å; G353-F355 PolarHBondContact O-N 2.81Å; G353-F355 VanDerWaalsContact O-N 3.1Å; G353-R356 WeakPolarHBondContact O-CB 3.38Å; G353-R356 PolarHBondContact O-N 2.85Å; G353-E380 PolarHBondContact N-O 2.88Å
354	V	91.1	Very high	92.9	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.012	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.5	178.5	63.6	0	0	0	0	114.6	L326 D327 F331 I350 A351 D352	L326-V354 HydrophobicContact CB-CG2 4.08Å; D327-V354 WeakPolarHBondContact O-CG2 3.29Å; F331-V354 HydrophobicContact CD2-CG2 3.98Å; F331-V354 HydrophobicContact CE2-CG2 4.28Å; I350-V354 HydrophobicContact CG2-CG1 3.47Å; I350-V354 VanDerWaalsContact CG2-CG1 3.47Å; A351-V354 WeakPolarHBondContact O-CG1 3.32Å; A351-V354 PolarHBondContact O-N 3.12Å; D352-V354 PolarHBondContact O-N 2.63Å
355	F	92.8	Very high	92.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	5	176.1	-55.3	-53.1	0	0	0	114.1	L326 F331 L340 L342 I350 G353 F357 L358 L364 L366 A381 F382 L385	L326-F355 HydrophobicContact CD1-CZ 4.13Å; F331-F355 HydrophobicContact CD2-CD1 4.07Å; F331-F355 AromaticContact CD2-CE1 3.97Å; F331-F355 HydrophobicContact CD2-CE1 3.97Å; F331-F355 HydrophobicContact CE2-CD1 4.32Å; F331-F355 AromaticContact CE2-CE1 3.74Å; F331-F355 HydrophobicContact CE2-CE1 3.74Å; L340-F355 HydrophobicContact CD2-CD1 4.45Å; L340-F355 HydrophobicContact CD2-CE1 4.08Å; L342-F355 HydrophobicContact CD1-CE1 4.43Å; I350-F355 HydrophobicContact CG2-CE2 3.97Å; I350-F355 HydrophobicContact CG2-CZ 4.41Å; G353-F355 PolarHBondContact O-N 2.81Å; G353-F355 VanDerWaalsContact O-N 3.1Å; F355-F357 PolarHBondContact O-N 2.62Å; F355-L358 HydrophobicContact CB-CD1 4.32Å; F355-L358 HydrophobicContact CD1-CD1 3.8Å; F355-L358 WeakPolarHBondContact O-CB 3.19Å; F355-L358 PolarHBondContact O-N 3Å; F355-L364 HydrophobicContact CD2-CD2 4.12Å; F355-L364 HydrophobicContact CE1-CD1 4.42Å; F355-L364 HydrophobicContact CE2-CD2 3.85Å; F355-L364 HydrophobicContact CZ-CD1 4.33Å; F355-L364 HydrophobicContact CZ-CD2 4.07Å; F355-L366 HydrophobicContact CE2-CD1 4.5Å; F355-L366 HydrophobicContact CZ-CD1 4.47Å; F355-A381 VanDerWaalsContact CD2-O 3.28Å; F355-A381 WeakPolarHBondContact CD2-O 3.43Å; F355-F382 HydrophobicContact CD2-CD1 4.08Å; F355-F382 HydrophobicContact CD2-CE1 4.44Å; F355-F382 HydrophobicContact CE2-CD1 4.14Å; F355-F382 HydrophobicContact CE2-CE1 4.02Å; F355-L385 HydrophobicContact CB-CD1 3.76Å; F355-L385 HydrophobicContact CB-CD2 3.84Å; F355-L385 HydrophobicContact CB-CG 3.72Å; F355-L385 HydrophobicContact CD2-CD1 3.96Å; F355-L385 HydrophobicContact CG-CD1 4.07Å
356	R	90.5	Very high	92.9	Very high	153 Å²	153	35.9 Å²	35.9	58%	0.577	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-27.8	-170.2	-176.4	178.5	-172.8	177.5	5.2	115.7	G353 A383	G353-R356 WeakPolarHBondContact O-CB 3.38Å; G353-R356 PolarHBondContact O-N 2.85Å; R356-A383 VanDerWaalsContact CA-O 3.26Å; R356-A383 WeakPolarHBondContact CA-O 3.41Å; R356-A383 PolarHBondContact N-O 3.09Å
357	F	89.1	Confident	93	Very high	94 Å²	94	33.5 Å²	33.5	41%	0.412	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-2.3	-178.9	-57.6	-71.1	0	0	0	113.6	V332 S335 F355 S359	V332-F357 HydrophobicContact CG2-CD2 3.99Å; V332-F357 HydrophobicContact CG2-CE2 4.02Å; S335-F357 WeakPolarHBondContact CA-O 3.39Å; S335-F357 WeakPolarHBondContact CB-O 3.25Å; F355-F357 PolarHBondContact O-N 2.62Å; F357-S359 VanDerWaalsContact C-N 3.31Å; F357-S359 PolarHBondContact O-N 3.08Å
358	L	94.7	Very high	93.1	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.181	C	C	.	.			trans	-93.4	47.6	-175.7	-50.9	-175.4	0	0	0	111.9	F331 L334 L337 L340 F355 N360 L361 L385	F331-L358 HydrophobicContact CB-CD1 4.14Å; F331-L358 HydrophobicContact CB-CD2 4.09Å; F331-L358 HydrophobicContact CB-CG 4.46Å; F331-L358 HydrophobicContact CG-CD1 4.45Å; L334-L358 HydrophobicContact CB-CD2 3.78Å; L334-L358 VanDerWaalsContact O-CD2 3.28Å; L334-L358 WeakPolarHBondContact O-CD2 3.45Å; L337-L358 HydrophobicContact CB-CD2 4.48Å; L337-L358 HydrophobicContact CD2-CD1 4.43Å; L337-L358 HydrophobicContact CD2-CD2 4.46Å; L340-L358 HydrophobicContact CD2-CD1 4.01Å; F355-L358 HydrophobicContact CB-CD1 4.32Å; F355-L358 HydrophobicContact CD1-CD1 3.8Å; F355-L358 WeakPolarHBondContact O-CB 3.19Å; F355-L358 PolarHBondContact O-N 3Å; L358-N360 PolarHBondContact O-N 3.24Å; L358-L361 HydrophobicContact CB-CB 4.06Å; L358-L361 HydrophobicContact CD1-CD2 4.26Å; L358-L361 VanDerWaalsContact O-CB 3.23Å; L358-L361 WeakPolarHBondContact O-CB 3.44Å; L358-L361 PolarHBondContact O-N 3.26Å; L358-L385 HydrophobicContact CB-CD2 3.96Å
359	S	92.9	Very high	93.5	Very high	45 Å²	45	33.9 Å²	33.9	32%	0.315	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.7	-173.2	58.2	0	0	0	0	114.7	F357 T386 S387	F357-S359 VanDerWaalsContact C-N 3.31Å; F357-S359 PolarHBondContact O-N 3.08Å; S359-T386 PolarHBondContact O-OG1 2.89Å; S359-S387 WeakPolarHBondContact O-CB 3.44Å; S359-S387 PolarHBondContact O-N 3.15Å; S359-S387 PolarHBondContact O-OG 3.34Å
360	N	96.3	Very high	94	Very high	64 Å²	64	36.7 Å²	36.7	34%	0.342	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-1.4	-178.6	-65	10	0	0	0	113.3	S335 L337 L358 Q362	S335-N360 PolarHBondContact O-ND2 3Å; L337-N360 CarbonylContact O-C 3.59Å; L337-N360 VanDerWaalsContact O-C 3.26Å; L358-N360 PolarHBondContact O-N 3.24Å; N360-Q362 PolarHBondContact O-N 3.02Å
361	L	98.1	Very high	94.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.179	C	C	.	.			trans	-69.1	122.5	-175.1	-166	76.6	0	0	0	110.2	L337 L340 L358 L364 L385 S387 L388	L337-L361 HydrophobicContact CB-CD1 4.3Å; L337-L361 HydrophobicContact CD2-CD1 4.04Å; L337-L361 HydrophobicContact CG-CD1 3.92Å; L337-L361 WeakPolarHBondContact O-CA 3.37Å; L337-L361 PolarHBondContact O-N 3.43Å; L337-L361 VanDerWaalsContact O-N 3.11Å; L340-L361 HydrophobicContact CB-CD1 3.72Å; L340-L361 HydrophobicContact CB-CD2 4.22Å; L358-L361 HydrophobicContact CB-CB 4.06Å; L358-L361 HydrophobicContact CD1-CD2 4.26Å; L358-L361 VanDerWaalsContact O-CB 3.23Å; L358-L361 WeakPolarHBondContact O-CB 3.44Å; L358-L361 PolarHBondContact O-N 3.26Å; L361-L364 HydrophobicContact CD2-CB 3.96Å; L361-L364 HydrophobicContact CD2-CD1 4.34Å; L361-L364 HydrophobicContact CD2-CD2 4.48Å; L361-L364 HydrophobicContact CD2-CG 4.5Å; L361-L385 HydrophobicContact CB-CD2 3.84Å; L361-L385 HydrophobicContact CD2-CD2 3.59Å; L361-L385 HydrophobicContact CG-CD2 4.32Å; L361-S387 CarbonylContact O-C 3.58Å; L361-L388 HydrophobicContact CD2-CD1 4.12Å; L361-L388 HydrophobicContact CG-CD1 4.19Å; L361-L388 WeakPolarHBondContact O-CA 3.31Å; L361-L388 PolarHBondContact O-N 2.71Å; L361-L388 VanDerWaalsContact O-N 3.08Å
362	Q	98	Very high	94.2	Very high	77 Å²	77	37.3 Å²	37.3	36%	0.36	18%	0.182	S	C	.	.			trans	-101.7	-34.7	-178.8	-66.4	163.3	38.8	0	0	111.5	E338 N360 T389 K390	E338-Q362 PolarHBondContact O-N 2.91Å; N360-Q362 PolarHBondContact O-N 3.02Å; Q362-T389 PolarHBondContact O-N 2.75Å; Q362-T389 PolarHBondContact O-OG1 3.26Å; Q362-T389 VanDerWaalsContact O-OG1 3.13Å; Q362-K390 PolarHBondContact O-N 2.86Å
363	T	98.6	Very high	94.1	Very high	41 Å²	41	36.7 Å²	36.7	25%	0.252	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	125	178.4	-56.9	0	0	0	0	111.5	E338 L340 K390	E338-T363 PolarHBondContact O-N 3.45Å; L340-T363 PolarHBondContact N-O 2.89Å; T363-K390 WeakPolarHBondContact CA-O 3.22Å; T363-K390 HydrophobicContact CG2-CB 4.25Å; T363-K390 HydrophobicContact CG2-CD 4.38Å; T363-K390 HydrophobicContact CG2-CG 4.24Å
364	L	98.6	Very high	94.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	118.2	171.9	179.4	54.3	0	0	0	109.2	L340 L342 F355 L361 L366 F382 L385 L388 K390 L391 V392	L340-L364 HydrophobicContact CB-CD1 4.16Å; L340-L364 HydrophobicContact CD2-CD1 4Å; L340-L364 HydrophobicContact CG-CD1 4Å; L342-L364 HydrophobicContact CD1-CD1 4.4Å; F355-L364 HydrophobicContact CD2-CD2 4.12Å; F355-L364 HydrophobicContact CE1-CD1 4.42Å; F355-L364 HydrophobicContact CE2-CD2 3.85Å; F355-L364 HydrophobicContact CZ-CD1 4.33Å; F355-L364 HydrophobicContact CZ-CD2 4.07Å; L361-L364 HydrophobicContact CD2-CB 3.96Å; L361-L364 HydrophobicContact CD2-CD1 4.34Å; L361-L364 HydrophobicContact CD2-CD2 4.48Å; L361-L364 HydrophobicContact CD2-CG 4.5Å; L364-L366 HydrophobicContact CD1-CD1 4.2Å; L364-L366 HydrophobicContact CD1-CG 4.07Å; L364-L366 HydrophobicContact CD2-CD1 3.88Å; L364-L366 HydrophobicContact CG-CD1 3.88Å; L364-L366 HydrophobicContact CG-CG 4.1Å; L364-F382 HydrophobicContact CD2-CD1 4.02Å; L364-F382 HydrophobicContact CD2-CE1 3.91Å; L364-L385 HydrophobicContact CD2-CD1 3.83Å; L364-L388 HydrophobicContact CB-CD1 3.73Å; L364-L388 HydrophobicContact CB-CD2 4.48Å; L364-K390 PolarHBondContact N-O 2.99Å; L364-L391 HydrophobicContact CB-CD1 4.11Å; L364-L391 HydrophobicContact CD2-CD1 4.02Å; L364-L391 HydrophobicContact CG-CD1 4.02Å; L364-L391 WeakPolarHBondContact O-CA 3.21Å; L364-V392 PolarHBondContact O-N 3.39Å
365	D	98.8	Very high	94.1	Very high	16 Å²	16	36.3 Å²	36.3	9%	0.086	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115.8	177.2	-169	-21.9	0	0	0	110.2	L340 N341 L342 G343 R367 V392	L340-D365 PolarHBondContact O-N 2.96Å; N341-D365 HydrophobicContact CB-CB 4.41Å; L342-D365 CarbonylContact C-O 3.49Å; L342-D365 WeakPolarHBondContact CA-O 3.34Å; L342-D365 PolarHBondContact N-O 2.81Å; G343-D365 PolarHBondContact N-O 2.83Å; D365-R367 WeakPolarHBondContact OD1-CB 3.05Å; D365-R367 WeakPolarHBondContact OD1-CG 3.29Å; D365-R367 PolarHBondContact OD1-N 3.28Å; D365-R367 VanDerWaalsContact OD1-N 3.09Å; D365-R367 IonicContact OD1-NE 3.6Å; D365-R367 PolarHBondContact OD1-NE 2.72Å; D365-R367 VanDerWaalsContact OD1-NE 3.13Å; D365-R367 IonicContact OD2-CZ 2.72Å; D365-R367 IonicContact OD2-NE 2.71Å; D365-R367 PolarHBondContact OD2-NE 2.97Å; D365-R367 IonicContact OD2-NH2 3.89Å; D365-R367 PolarHBondContact OD2-NH2 2.9Å; D365-V392 HydrophobicContact CB-CB 4.46Å
366	L	98.3	Very high	93.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.175	C	C	.	.			trans	-125.2	22.2	-178.4	-74	164.7	0	0	0	110.7	L342 I350 F355 L364 N369 I371 F382 V392 L393 N396	L342-L366 HydrophobicContact CB-CD2 3.8Å; L342-L366 HydrophobicContact CD1-CD2 3.88Å; I350-L366 HydrophobicContact CD1-CD1 4.37Å; I350-L366 HydrophobicContact CD1-CD2 4.49Å; F355-L366 HydrophobicContact CE2-CD1 4.5Å; F355-L366 HydrophobicContact CZ-CD1 4.47Å; L364-L366 HydrophobicContact CD1-CD1 4.2Å; L364-L366 HydrophobicContact CD1-CG 4.07Å; L364-L366 HydrophobicContact CD2-CD1 3.88Å; L364-L366 HydrophobicContact CG-CD1 3.88Å; L364-L366 HydrophobicContact CG-CG 4.1Å; L366-N369 PolarHBondContact O-ND2 3.04Å; L366-I371 HydrophobicContact CB-CD1 3.79Å; L366-I371 HydrophobicContact CD1-CD1 4.26Å; L366-I371 HydrophobicContact CD2-CD1 4.08Å; L366-I371 HydrophobicContact CG-CD1 4.28Å; L366-F382 HydrophobicContact CD1-CE1 3.77Å; L366-F382 HydrophobicContact CD1-CZ 4.14Å; L366-V392 CarbonylContact C-O 3.17Å; L366-V392 WeakPolarHBondContact CA-O 3.37Å; L366-V392 PolarHBondContact N-O 2.76Å; L366-L393 HydrophobicContact CB-CD2 3.98Å; L366-L393 HydrophobicContact CD1-CD2 4.12Å; L366-N396 PolarHBondContact O-ND2 3.45Å
367	R	98.4	Very high	93.3	Very high	77 Å²	77	29.4 Å²	29.4	29%	0.291	15%	0.148	S	C	.	.			trans	-59.4	158.8	-178.4	78.5	-178.2	102.5	141.8	3.7	112.5	G343 D344 D365 N369 V392 Q394	G343-R367 CarbonylContact C-O 3.5Å; G343-R367 VanDerWaalsContact CA-O 3.22Å; G343-R367 WeakPolarHBondContact CA-O 3.26Å; D344-R367 PolarHBondContact N-O 3.14Å; D365-R367 WeakPolarHBondContact OD1-CB 3.05Å; D365-R367 WeakPolarHBondContact OD1-CG 3.29Å; D365-R367 PolarHBondContact OD1-N 3.28Å; D365-R367 VanDerWaalsContact OD1-N 3.09Å; D365-R367 IonicContact OD1-NE 3.6Å; D365-R367 PolarHBondContact OD1-NE 2.72Å; D365-R367 VanDerWaalsContact OD1-NE 3.13Å; D365-R367 IonicContact OD2-CZ 2.72Å; D365-R367 IonicContact OD2-NE 2.71Å; D365-R367 PolarHBondContact OD2-NE 2.97Å; D365-R367 IonicContact OD2-NH2 3.89Å; D365-R367 PolarHBondContact OD2-NH2 2.9Å; R367-N369 VanDerWaalsContact C-N 3.33Å; R367-N369 PolarHBondContact O-N 2.74Å; R367-N369 PolarHBondContact O-ND2 3.47Å; R367-V392 HydrophobicContact CB-CG1 3.93Å; R367-V392 PolarHBondContact N-O 3.46Å; R367-Q394 CarbonylContact C-O 3.36Å; R367-Q394 WeakPolarHBondContact CA-O 3.08Å; R367-Q394 HydrophobicContact CB-CB 4.16Å
368	N	98.2	Very high	92.4	Very high	62 Å²	62	27.4 Å²	27.4	33%	0.332	15%	0.149	S	C	.	.	S	Bend	trans	48.1	54.1	171	-58.8	-17.1	0	0	0	112.2	D344 N345 Q394 G395	D344-N368 VanDerWaalsContact CA-O 3.31Å; D344-N368 WeakPolarHBondContact CA-O 3.5Å; D344-N368 HydrophobicContact CB-CB 4.43Å; D344-N368 PolarHBondContact N-O 2.82Å; D344-N368 WeakPolarHBondContact OD1-CB 3.47Å; D344-N368 PolarHBondContact OD1-ND2 2.87Å; N345-N368 PolarHBondContact N-O 3.13Å; N368-Q394 PolarHBondContact N-O 3.49Å; N368-G395 WeakPolarHBondContact CA-O 3.46Å
369	N	98	Very high	91.2	Very high	8 Å²	8	27.9 Å²	27.9	4%	0.043	15%	0.152	C	C	.	.	S	Bend	trans	-125.8	-171.1	176.6	-88.8	-82.6	0	0	0	108.9	L342 N345 R346 V347 L366 R367 I371 N396	L342-N369 PolarHBondContact O-ND2 2.88Å; N345-N369 WeakPolarHBondContact CA-OD1 3.26Å; N345-N369 WeakPolarHBondContact CB-OD1 3.5Å; R346-N369 PolarHBondContact N-OD1 3.24Å; V347-N369 HydrophobicContact CB-CB 4.38Å; V347-N369 VanDerWaalsContact CB-OD1 3.32Å; V347-N369 WeakPolarHBondContact CB-OD1 3.42Å; V347-N369 WeakPolarHBondContact CG2-OD1 3.32Å; V347-N369 PolarHBondContact N-OD1 3.43Å; L366-N369 PolarHBondContact O-ND2 3.04Å; R367-N369 VanDerWaalsContact C-N 3.33Å; R367-N369 PolarHBondContact O-N 2.74Å; R367-N369 PolarHBondContact O-ND2 3.47Å; N369-I371 HydrophobicContact CB-CD1 4.05Å; N369-I371 HydrophobicContact CB-CG1 4.02Å; N369-N396 WeakPolarHBondContact CA-OD1 3.38Å; N369-N396 WeakPolarHBondContact CB-OD1 3.15Å; N369-N396 PolarHBondContact N-OD1 3.19Å; N369-N396 PolarHBondContact O-OD1 3.07Å
370	E	95.1	Very high	90.7	Very high	73 Å²	73	31.9 Å²	31.9	34%	0.341	17%	0.166	S	C	.	.			trans	-110.5	26.5	-177.2	-61.5	-169.3	-133.1	0	0	111.9	V347 T348 Q397	V347-E370 CarbonylContact O-C 3.53Å; V347-E370 WeakPolarHBondContact O-CA 3.4Å; V347-E370 PolarHBondContact O-N 3.26Å; T348-E370 HydrophobicContact CG2-CB 3.49Å; T348-E370 VanDerWaalsContact CG2-CB 3.49Å; T348-E370 HydrophobicContact CG2-CG 4.39Å; E370-Q397 PolarHBondContact OE2-NE2 2.81Å
371	I	93.1	Very high	90.1	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	15%	0.15	C	C	.	.			trans	-72.8	136.8	-173.7	-54.1	163.5	0	0	0	109.8	V347 I350 L366 N369 A374 L393 N396 Q397 I398	V347-I371 HydrophobicContact CG1-CG1 4.43Å; V347-I371 WeakPolarHBondContact O-CG1 3.13Å; V347-I371 PolarHBondContact O-N 3.45Å; V347-I371 VanDerWaalsContact O-N 3.15Å; I350-I371 HydrophobicContact CD1-CD1 3.68Å; I350-I371 HydrophobicContact CD1-CG1 3.91Å; I350-I371 HydrophobicContact CD1-CG2 4.17Å; L366-I371 HydrophobicContact CB-CD1 3.79Å; L366-I371 HydrophobicContact CD1-CD1 4.26Å; L366-I371 HydrophobicContact CD2-CD1 4.08Å; L366-I371 HydrophobicContact CG-CD1 4.28Å; N369-I371 HydrophobicContact CB-CD1 4.05Å; N369-I371 HydrophobicContact CB-CG1 4.02Å; I371-A374 HydrophobicContact CG2-CB 3.96Å; I371-L393 HydrophobicContact CD1-CD2 4.23Å; I371-N396 HydrophobicContact CB-CB 4.26Å; I371-N396 VanDerWaalsContact CB-OD1 3.24Å; I371-N396 WeakPolarHBondContact CB-OD1 3.43Å; I371-N396 WeakPolarHBondContact CD1-OD1 3.08Å; I371-N396 VanDerWaalsContact CG1-OD1 3.3Å; I371-N396 WeakPolarHBondContact CG1-OD1 3.4Å; I371-N396 PolarHBondContact N-OD1 3.37Å; I371-Q397 CarbonylContact O-C 3.52Å; I371-Q397 WeakPolarHBondContact O-CA 3.25Å; I371-Q397 PolarHBondContact O-N 2.78Å; I371-I398 PolarHBondContact O-N 2.86Å
372	S	88.7	Confident	89.8	Confident	25 Å²	25	29.2 Å²	29.2	18%	0.175	15%	0.151	C	C	.	.			trans	-139.9	-77	171.7	46.8	0	0	0	0	109.9	A374 I375 E376 Q397	S372-A374 PolarHBondContact O-N 3.09Å; S372-I375 PolarHBondContact O-N 2.71Å; S372-E376 WeakPolarHBondContact O-CG 3.3Å; S372-E376 PolarHBondContact O-N 2.81Å; S372-Q397 WeakPolarHBondContact CB-O 3.31Å
373	W	81.8	Confident	89.3	Confident	23 Å²	23	26.9 Å²	26.9	9%	0.087	15%	0.145	C	C	.	.	H	α-helix	trans	-57.4	-25.2	-169.8	58.5	-94.1	0	0	0	115.4	T348 H349 I350 I375 E376 D377 S537 Y590	T348-W373 PolarHBondContact O-NE1 2.97Å; H349-W373 HydrophobicContact CB-CZ2 4.02Å; H349-W373 AromaticContact CG-CZ2 3.8Å; H349-W373 AromaticContact ND1-CZ2 3.66Å; I350-W373 WeakPolarHBondContact O-CH2 3.34Å; I350-W373 VanDerWaalsContact O-CZ3 3.27Å; I350-W373 WeakPolarHBondContact O-CZ3 3.02Å; W373-I375 PolarHBondContact O-N 2.94Å; W373-E376 PolarHBondContact O-N 3.26Å; W373-D377 WeakPolarHBondContact O-CB 3.32Å; W373-D377 PolarHBondContact O-N 3.1Å; W373-S537 VanDerWaalsContact CZ2-CB 3.47Å; W373-Y590 HydrophobicContact CB-CE1 3.92Å
374	A	86.8	Confident	88.7	Confident	2 Å²	2	26.2 Å²	26.2	2%	0.017	15%	0.147	C	C	.	.	H	α-helix	trans	-64	-6.6	174.7	0	0	0	0	0	114.4	I350 I371 S372 A381	I350-A374 HydrophobicContact CB-CB 4.2Å; I350-A374 HydrophobicContact CD1-CB 4.44Å; I371-A374 HydrophobicContact CG2-CB 3.96Å; S372-A374 PolarHBondContact O-N 3.09Å; A374-A381 HydrophobicContact CB-CB 4.1Å
375	I	90.4	Very high	88.5	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-122.2	-28.5	172.5	-60.1	-67.1	0	0	0	111.5	S372 W373 F382 L393 I398 I401 T402 A405 F406	S372-I375 PolarHBondContact O-N 2.71Å; W373-I375 PolarHBondContact O-N 2.94Å; I375-F382 HydrophobicContact CD1-CD2 4.23Å; I375-F382 HydrophobicContact CD1-CE2 3.49Å; I375-F382 VanDerWaalsContact CD1-CE2 3.49Å; I375-F382 HydrophobicContact CD1-CZ 4.17Å; I375-F382 HydrophobicContact CG1-CE2 4.35Å; I375-L393 HydrophobicContact CD1-CD1 3.75Å; I375-L393 HydrophobicContact CG1-CD1 4.1Å; I375-I398 HydrophobicContact CB-CD1 4.2Å; I375-I398 HydrophobicContact CB-CG1 4.3Å; I375-I398 HydrophobicContact CB-CG2 4.02Å; I375-I398 HydrophobicContact CG1-CD1 3.86Å; I375-I398 HydrophobicContact CG1-CG1 4.35Å; I375-I398 HydrophobicContact CG2-CD1 4.38Å; I375-I398 HydrophobicContact CG2-CG2 3.71Å; I375-I401 HydrophobicContact CG2-CB 4.31Å; I375-I401 HydrophobicContact CG2-CG1 3.93Å; I375-I401 HydrophobicContact CG2-CG2 4.24Å; I375-T402 PolarHBondContact O-N 2.85Å; I375-A405 HydrophobicContact CB-CB 4.48Å; I375-A405 HydrophobicContact CD1-CB 4.16Å; I375-A405 HydrophobicContact CG2-CB 3.98Å; I375-F406 HydrophobicContact CD1-CD1 4.48Å; I375-F406 HydrophobicContact CD1-CE1 3.69Å; I375-F406 HydrophobicContact CD1-CZ 4.16Å; I375-F406 HydrophobicContact CG2-CZ 4.49Å
376	E	88.1	Confident	88.1	Confident	5 Å²	5	29.2 Å²	29.2	2%	0.023	17%	0.166	C	C	.	.	H	α-helix	trans	-85.4	-20.8	-179.4	-49.9	-153.7	-136.2	0	0	114.9	S372 W373 I398 K399 S400 T402 Y590	S372-E376 WeakPolarHBondContact O-CG 3.3Å; S372-E376 PolarHBondContact O-N 2.81Å; W373-E376 PolarHBondContact O-N 3.26Å; E376-I398 HydrophobicContact CG-CG2 4.32Å; E376-K399 VanDerWaalsContact CD-N 3.31Å; E376-K399 WeakPolarHBondContact OE1-CB 3.09Å; E376-K399 PolarHBondContact OE1-N 2.71Å; E376-K399 WeakPolarHBondContact OE2-CB 3.5Å; E376-S400 VanDerWaalsContact CD-N 3.34Å; E376-S400 WeakPolarHBondContact CG-O 3Å; E376-S400 WeakPolarHBondContact OE2-CB 3.07Å; E376-S400 PolarHBondContact OE2-N 3.22Å; E376-S400 PolarHBondContact OE2-OG 2.91Å; E376-T402 VanDerWaalsContact C-CG2 3.47Å; E376-T402 WeakPolarHBondContact O-CG2 3.33Å; E376-Y590 HydrophobicContact CB-CD2 4.37Å; E376-Y590 HydrophobicContact CB-CE2 3.47Å; E376-Y590 VanDerWaalsContact CB-CE2 3.47Å; E376-Y590 VanDerWaalsContact O-CD2 3.26Å; E376-Y590 WeakPolarHBondContact O-CD2 3.48Å; E376-Y590 WeakPolarHBondContact O-CE2 3.37Å
377	D	78.4	Confident	88	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.011	18%	0.181	C	C	.	.	S	Bend	trans	-96.7	-176	171.7	84.9	-3.1	0	0	0	111.4	W373 S379 T402 R534 Y590	W373-D377 WeakPolarHBondContact O-CB 3.32Å; W373-D377 PolarHBondContact O-N 3.1Å; D377-S379 WeakPolarHBondContact OD1-CA 3.21Å; D377-S379 WeakPolarHBondContact OD1-CB 3.34Å; D377-S379 PolarHBondContact OD1-N 3.4Å; D377-S379 PolarHBondContact OD1-OG 2.86Å; D377-T402 VanDerWaalsContact O-CG2 3.27Å; D377-T402 WeakPolarHBondContact O-CG2 3.4Å; D377-T402 PolarHBondContact O-OG1 2.82Å; D377-R534 IonicContact OD2-CZ 3.8Å; D377-R534 VanDerWaalsContact OD2-CZ 3.26Å; D377-R534 IonicContact OD2-NH1 3.24Å; D377-R534 PolarHBondContact OD2-NH1 3.27Å; D377-R534 IonicContact OD2-NH2 3.72Å; D377-R534 PolarHBondContact OD2-NH2 2.95Å; D377-Y590 HydrophobicContact CB-CD1 3.78Å; D377-Y590 HydrophobicContact CB-CE1 4.24Å; D377-Y590 HydrophobicContact CB-CG 3.95Å
378	A	68.4	Low	87.9	Confident	53 Å²	53	27.7 Å²	27.7	44%	0.438	17%	0.167	S	C	.	.			trans	-100.1	39.6	176.2	0	0	0	0	0	111.7	K404	A378-K404 HydrophobicContact CB-CB 4.28Å; A378-K404 HydrophobicContact CB-CD 3.97Å; A378-K404 HydrophobicContact CB-CG 4.21Å
379	S	71.1	Confident	87.9	Confident	10 Å²	10	26.8 Å²	26.8	7%	0.07	16%	0.164	C	C	.	.			trans	-69.8	163.1	178.3	52.4	0	0	0	0	113.3	D352 D377	D352-S379 WeakPolarHBondContact OD1-CA 3Å; D352-S379 WeakPolarHBondContact OD1-CB 3.05Å; D377-S379 WeakPolarHBondContact OD1-CA 3.21Å; D377-S379 WeakPolarHBondContact OD1-CB 3.34Å; D377-S379 PolarHBondContact OD1-N 3.4Å; D377-S379 PolarHBondContact OD1-OG 2.86Å
380	E	81.7	Confident	87.9	Confident	130 Å²	130	30.3 Å²	30.3	61%	0.607	18%	0.179	S	C	*	.			trans	-105.8	33.3	173.2	-70.3	174	-165.6	0	0	109.8	D352 G353 F382 A383	D352-E380 PolarHBondContact OD1-N 3.02Å; D352-E380 VanDerWaalsContact OD1-N 3.15Å; G353-E380 PolarHBondContact N-O 2.88Å; E380-F382 VanDerWaalsContact C-N 3.31Å; E380-F382 PolarHBondContact O-N 2.02Å; E380-A383 HydrophobicContact CB-CB 3.91Å; E380-A383 VanDerWaalsContact O-CB 3.28Å; E380-A383 WeakPolarHBondContact O-CB 3.14Å; E380-A383 PolarHBondContact O-N 2.87Å; E380-A383 VanDerWaalsContact O-N 3.15Å
381	A	84.6	Confident	88.1	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.008	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-42.6	-176.3	0	0	0	0	0	112.5	I350 F355 A374	I350-A381 HydrophobicContact CG2-CB 3.97Å; F355-A381 VanDerWaalsContact CD2-O 3.28Å; F355-A381 WeakPolarHBondContact CD2-O 3.43Å; A374-A381 HydrophobicContact CB-CB 4.1Å
382	F	90.1	Very high	88.3	Confident	6 Å²	6	27.2 Å²	27.2	3%	0.026	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	7.5	179.6	-59.4	-79.1	0	0	0	114.1	F355 L364 L366 I375 E380 L385 L391 L393 L409	F355-F382 HydrophobicContact CD2-CD1 4.08Å; F355-F382 HydrophobicContact CD2-CE1 4.44Å; F355-F382 HydrophobicContact CE2-CD1 4.14Å; F355-F382 HydrophobicContact CE2-CE1 4.02Å; L364-F382 HydrophobicContact CD2-CD1 4.02Å; L364-F382 HydrophobicContact CD2-CE1 3.91Å; L366-F382 HydrophobicContact CD1-CE1 3.77Å; L366-F382 HydrophobicContact CD1-CZ 4.14Å; I375-F382 HydrophobicContact CD1-CD2 4.23Å; I375-F382 HydrophobicContact CD1-CE2 3.49Å; I375-F382 VanDerWaalsContact CD1-CE2 3.49Å; I375-F382 HydrophobicContact CD1-CZ 4.17Å; I375-F382 HydrophobicContact CG1-CE2 4.35Å; E380-F382 VanDerWaalsContact C-N 3.31Å; E380-F382 PolarHBondContact O-N 2.02Å; F382-L385 HydrophobicContact CB-CD1 4.16Å; F382-L385 HydrophobicContact CD1-CD1 3.98Å; F382-L385 WeakPolarHBondContact O-CB 3.08Å; F382-L385 PolarHBondContact O-N 2.85Å; F382-L391 HydrophobicContact CE1-CD1 4.06Å; F382-L391 HydrophobicContact CE1-CD2 4.45Å; F382-L393 HydrophobicContact CZ-CD2 4.36Å; F382-L409 HydrophobicContact CB-CD1 4.23Å; F382-L409 HydrophobicContact CB-CD2 4.25Å; F382-L409 HydrophobicContact CB-CG 4.49Å
383	A	87.8	Confident	88.8	Confident	28 Å²	28	26 Å²	26	23%	0.231	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	143.1	-178.8	0	0	0	0	0	111.9	R356 E380	R356-A383 VanDerWaalsContact CA-O 3.26Å; R356-A383 WeakPolarHBondContact CA-O 3.41Å; R356-A383 PolarHBondContact N-O 3.09Å; E380-A383 HydrophobicContact CB-CB 3.91Å; E380-A383 VanDerWaalsContact O-CB 3.28Å; E380-A383 WeakPolarHBondContact O-CB 3.14Å; E380-A383 PolarHBondContact O-N 2.87Å; E380-A383 VanDerWaalsContact O-N 3.15Å
384	G	87	Confident	89.5	Confident	28 Å²	28	27.4 Å²	27.4	29%	0.289	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.5	-8.6	-178.6	0	0	0	0	0	115.4	T386	G384-T386 PolarHBondContact O-N 2.89Å
385	L	93.3	Very high	89.9	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.173	C	C	.	.			trans	-78.3	50.8	178.3	-70.8	178.4	0	0	0	113.3	F355 L358 L361 L364 F382 S387 L388 L409	F355-L385 HydrophobicContact CB-CD1 3.76Å; F355-L385 HydrophobicContact CB-CD2 3.84Å; F355-L385 HydrophobicContact CB-CG 3.72Å; F355-L385 HydrophobicContact CD2-CD1 3.96Å; F355-L385 HydrophobicContact CG-CD1 4.07Å; L358-L385 HydrophobicContact CB-CD2 3.96Å; L361-L385 HydrophobicContact CB-CD2 3.84Å; L361-L385 HydrophobicContact CD2-CD2 3.59Å; L361-L385 HydrophobicContact CG-CD2 4.32Å; L364-L385 HydrophobicContact CD2-CD1 3.83Å; F382-L385 HydrophobicContact CB-CD1 4.16Å; F382-L385 HydrophobicContact CD1-CD1 3.98Å; F382-L385 WeakPolarHBondContact O-CB 3.08Å; F382-L385 PolarHBondContact O-N 2.85Å; L385-S387 VanDerWaalsContact C-N 3.3Å; L385-S387 PolarHBondContact O-N 3.26Å; L385-L388 HydrophobicContact CB-CB 4.09Å; L385-L388 HydrophobicContact CB-CD2 4.45Å; L385-L388 HydrophobicContact CD1-CD2 4.18Å; L385-L388 VanDerWaalsContact O-CB 3.27Å; L385-L388 WeakPolarHBondContact O-CB 3.03Å; L385-L388 PolarHBondContact O-N 2.82Å; L385-L388 VanDerWaalsContact O-N 3.16Å; L385-L409 HydrophobicContact CB-CD2 3.58Å; L385-L409 HydrophobicContact CD1-CD2 4.46Å
386	T	91.7	Very high	90.3	Very high	78 Å²	78	28.7 Å²	28.7	48%	0.479	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-27	-169.9	52.4	0	0	0	0	114.7	S359 G384 S411	S359-T386 PolarHBondContact O-OG1 2.89Å; G384-T386 PolarHBondContact O-N 2.89Å; T386-S411 WeakPolarHBondContact O-CB 3.46Å; T386-S411 PolarHBondContact O-OG 2.8Å
387	S	95.5	Very high	90.5	Very high	45 Å²	45	33 Å²	33	32%	0.315	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	7.7	178.7	-52.1	0	0	0	0	114.1	S359 L361 L385 T389	S359-S387 WeakPolarHBondContact O-CB 3.44Å; S359-S387 PolarHBondContact O-N 3.15Å; S359-S387 PolarHBondContact O-OG 3.34Å; L361-S387 CarbonylContact O-C 3.58Å; L385-S387 VanDerWaalsContact C-N 3.3Å; L385-S387 PolarHBondContact O-N 3.26Å; S387-T389 PolarHBondContact O-N 2.92Å
388	L	97.3	Very high	91.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.195	C	C	.	.			trans	-72.4	112.9	-172.5	-168.3	78.9	0	0	0	111.3	L361 L364 L385 L391 L409 S411 L412	L361-L388 HydrophobicContact CD2-CD1 4.12Å; L361-L388 HydrophobicContact CG-CD1 4.19Å; L361-L388 WeakPolarHBondContact O-CA 3.31Å; L361-L388 PolarHBondContact O-N 2.71Å; L361-L388 VanDerWaalsContact O-N 3.08Å; L364-L388 HydrophobicContact CB-CD1 3.73Å; L364-L388 HydrophobicContact CB-CD2 4.48Å; L385-L388 HydrophobicContact CB-CB 4.09Å; L385-L388 HydrophobicContact CB-CD2 4.45Å; L385-L388 HydrophobicContact CD1-CD2 4.18Å; L385-L388 VanDerWaalsContact O-CB 3.27Å; L385-L388 WeakPolarHBondContact O-CB 3.03Å; L385-L388 PolarHBondContact O-N 2.82Å; L385-L388 VanDerWaalsContact O-N 3.16Å; L388-L391 HydrophobicContact CD2-CB 4.06Å; L388-L391 HydrophobicContact CD2-CD1 4.46Å; L388-L409 HydrophobicContact CB-CD2 4.36Å; L388-L409 HydrophobicContact CD2-CD1 4.31Å; L388-L409 HydrophobicContact CD2-CD2 3.93Å; L388-S411 CarbonylContact O-C 3.44Å; L388-L412 HydrophobicContact CD2-CD1 4.33Å; L388-L412 HydrophobicContact CG-CD1 4.48Å; L388-L412 WeakPolarHBondContact O-CA 3.39Å; L388-L412 PolarHBondContact O-N 3.1Å; L388-L412 VanDerWaalsContact O-N 3.17Å
389	T	97.8	Very high	92.2	Very high	44 Å²	44	34.3 Å²	34.3	27%	0.27	19%	0.191	S	C	.	.			trans	-97.6	-22.1	178	59	0	0	0	0	113	Q362 S387 S411 E413 H414	Q362-T389 PolarHBondContact O-N 2.75Å; Q362-T389 PolarHBondContact O-OG1 3.26Å; Q362-T389 VanDerWaalsContact O-OG1 3.13Å; S387-T389 PolarHBondContact O-N 2.92Å; T389-S411 WeakPolarHBondContact CA-O 3.47Å; T389-E413 HydrophobicContact CG2-CG 4.45Å; T389-E413 PolarHBondContact O-N 3.01Å; T389-H414 PolarHBondContact O-N 2.82Å
390	K	98.4	Very high	93.1	Very high	82 Å²	82	34.1 Å²	34.1	36%	0.357	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	127.1	179.1	-179.5	162.9	-177.6	158.8	0	113.5	Q362 T363 L364 V392 H414	Q362-K390 PolarHBondContact O-N 2.86Å; T363-K390 WeakPolarHBondContact CA-O 3.22Å; T363-K390 HydrophobicContact CG2-CB 4.25Å; T363-K390 HydrophobicContact CG2-CD 4.38Å; T363-K390 HydrophobicContact CG2-CG 4.24Å; L364-K390 PolarHBondContact N-O 2.99Å; K390-V392 HydrophobicContact CD-CG2 4.48Å; K390-V392 HydrophobicContact CG-CG2 4.23Å; K390-H414 WeakPolarHBondContact CA-O 3.44Å; K390-H414 HydrophobicContact CB-CB 4.09Å; K390-H414 HydrophobicContact CD-CB 4.25Å; K390-H414 HydrophobicContact CG-CB 3.96Å
391	L	97.9	Very high	93.6	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	123.6	173.9	-179.1	55.8	0	0	0	110.2	L364 F382 L388 L393 F406 L409 L412 H414 L415 D416	L364-L391 HydrophobicContact CB-CD1 4.11Å; L364-L391 HydrophobicContact CD2-CD1 4.02Å; L364-L391 HydrophobicContact CG-CD1 4.02Å; L364-L391 WeakPolarHBondContact O-CA 3.21Å; F382-L391 HydrophobicContact CE1-CD1 4.06Å; F382-L391 HydrophobicContact CE1-CD2 4.45Å; L388-L391 HydrophobicContact CD2-CB 4.06Å; L388-L391 HydrophobicContact CD2-CD1 4.46Å; L391-L393 HydrophobicContact CD1-CD1 4.44Å; L391-L393 HydrophobicContact CD1-CG 4.2Å; L391-L393 HydrophobicContact CD2-CD1 3.88Å; L391-L393 HydrophobicContact CG-CD1 3.99Å; L391-L393 HydrophobicContact CG-CG 4.1Å; L391-F406 HydrophobicContact CD2-CD1 4.18Å; L391-F406 HydrophobicContact CD2-CE1 4.02Å; L391-L409 HydrophobicContact CD2-CD1 3.97Å; L391-L412 HydrophobicContact CB-CD1 3.76Å; L391-L412 HydrophobicContact CB-CD2 4.48Å; L391-H414 PolarHBondContact N-O 3.23Å; L391-L415 HydrophobicContact CB-CD1 4.16Å; L391-L415 HydrophobicContact CD2-CD1 4.15Å; L391-L415 HydrophobicContact CG-CD1 4.15Å; L391-L415 WeakPolarHBondContact O-CA 3.47Å; L391-D416 PolarHBondContact O-N 2.62Å; L391-D416 VanDerWaalsContact O-N 3.1Å
392	V	98.4	Very high	93.9	Very high	9 Å²	9	29 Å²	29	6%	0.055	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	115	176.7	-173.6	0	0	0	0	109.5	L364 D365 L366 R367 K390 Q394 D416	L364-V392 PolarHBondContact O-N 3.39Å; D365-V392 HydrophobicContact CB-CB 4.46Å; L366-V392 CarbonylContact C-O 3.17Å; L366-V392 WeakPolarHBondContact CA-O 3.37Å; L366-V392 PolarHBondContact N-O 2.76Å; R367-V392 HydrophobicContact CB-CG1 3.93Å; R367-V392 PolarHBondContact N-O 3.46Å; K390-V392 HydrophobicContact CD-CG2 4.48Å; K390-V392 HydrophobicContact CG-CG2 4.23Å; V392-Q394 HydrophobicContact CG1-CB 4.17Å; V392-D416 HydrophobicContact CG1-CB 4.18Å
393	L	97.5	Very high	93.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.192	C	C	.	.			trans	-120.6	15.5	178.4	-71.6	165.2	0	0	0	111.9	L366 I371 I375 F382 L391 G395 N396 I398 F406 D416 L417 N420	L366-L393 HydrophobicContact CB-CD2 3.98Å; L366-L393 HydrophobicContact CD1-CD2 4.12Å; I371-L393 HydrophobicContact CD1-CD2 4.23Å; I375-L393 HydrophobicContact CD1-CD1 3.75Å; I375-L393 HydrophobicContact CG1-CD1 4.1Å; F382-L393 HydrophobicContact CZ-CD2 4.36Å; L391-L393 HydrophobicContact CD1-CD1 4.44Å; L391-L393 HydrophobicContact CD1-CG 4.2Å; L391-L393 HydrophobicContact CD2-CD1 3.88Å; L391-L393 HydrophobicContact CG-CD1 3.99Å; L391-L393 HydrophobicContact CG-CG 4.1Å; L393-G395 PolarHBondContact O-N 3.35Å; L393-N396 PolarHBondContact O-ND2 3.33Å; L393-I398 HydrophobicContact CB-CD1 4.16Å; L393-I398 HydrophobicContact CD1-CD1 4.4Å; L393-F406 HydrophobicContact CD1-CE1 4.24Å; L393-D416 CarbonylContact C-O 3.57Å; L393-D416 WeakPolarHBondContact CA-O 3.32Å; L393-D416 PolarHBondContact N-O 2.97Å; L393-L417 HydrophobicContact CB-CD2 4.06Å; L393-L417 HydrophobicContact CD1-CD2 4.13Å; L393-N420 PolarHBondContact O-ND2 2.82Å
394	Q	97	Very high	93.8	Very high	52 Å²	52	38.1 Å²	38.1	24%	0.243	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	137.4	178.2	178.1	-178.1	43.6	0	0	112.3	R367 N368 V392 N396 D416 N418	R367-Q394 CarbonylContact C-O 3.36Å; R367-Q394 WeakPolarHBondContact CA-O 3.08Å; R367-Q394 HydrophobicContact CB-CB 4.16Å; N368-Q394 PolarHBondContact N-O 3.49Å; V392-Q394 HydrophobicContact CG1-CB 4.17Å; Q394-N396 PolarHBondContact O-ND2 2.89Å; Q394-D416 PolarHBondContact N-O 3.39Å; Q394-N418 CarbonylContact C-O 3.56Å; Q394-N418 VanDerWaalsContact CA-O 3.24Å; Q394-N418 WeakPolarHBondContact CA-O 3.38Å; Q394-N418 HydrophobicContact CG-CB 3.94Å
395	G	96.6	Very high	93.9	Very high	20 Å²	20	37 Å²	37	21%	0.206	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	37.9	168.5	0	0	0	0	0	114.1	N368 L393 N418	N368-G395 WeakPolarHBondContact CA-O 3.46Å; L393-G395 PolarHBondContact O-N 3.35Å; G395-N418 PolarHBondContact N-O 2.93Å
396	N	96.9	Very high	93.7	Very high	10 Å²	10	37.2 Å²	37.2	5%	0.053	19%	0.191	C	C	.	.	S	Bend	trans	-106	-174.3	173.9	-82.9	-80	0	0	0	110.7	L366 N369 I371 L393 Q394 I398 N420	L366-N396 PolarHBondContact O-ND2 3.45Å; N369-N396 WeakPolarHBondContact CA-OD1 3.38Å; N369-N396 WeakPolarHBondContact CB-OD1 3.15Å; N369-N396 PolarHBondContact N-OD1 3.19Å; N369-N396 PolarHBondContact O-OD1 3.07Å; I371-N396 HydrophobicContact CB-CB 4.26Å; I371-N396 VanDerWaalsContact CB-OD1 3.24Å; I371-N396 WeakPolarHBondContact CB-OD1 3.43Å; I371-N396 WeakPolarHBondContact CD1-OD1 3.08Å; I371-N396 VanDerWaalsContact CG1-OD1 3.3Å; I371-N396 WeakPolarHBondContact CG1-OD1 3.4Å; I371-N396 PolarHBondContact N-OD1 3.37Å; L393-N396 PolarHBondContact O-ND2 3.33Å; Q394-N396 PolarHBondContact O-ND2 2.89Å; N396-I398 HydrophobicContact CB-CD1 4.26Å; N396-I398 HydrophobicContact CB-CG1 4.19Å; N396-N420 VanDerWaalsContact CA-OD1 3.28Å; N396-N420 WeakPolarHBondContact CA-OD1 3.39Å; N396-N420 WeakPolarHBondContact CB-OD1 3.35Å; N396-N420 PolarHBondContact N-OD1 3.49Å; N396-N420 PolarHBondContact O-OD1 3.08Å; N396-N420 VanDerWaalsContact O-OD1 3.06Å
397	Q	93.1	Very high	93.4	Very high	95 Å²	95	37.2 Å²	37.2	44%	0.444	19%	0.187	S	C	.	.			trans	-99.4	22.3	-177.4	-59.6	-174	27.5	0	0	113	E370 I371 S372 K399	E370-Q397 PolarHBondContact OE2-NE2 2.81Å; I371-Q397 CarbonylContact O-C 3.52Å; I371-Q397 WeakPolarHBondContact O-CA 3.25Å; I371-Q397 PolarHBondContact O-N 2.78Å; S372-Q397 WeakPolarHBondContact CB-O 3.31Å; Q397-K399 PolarHBondContact O-N 2.92Å
398	I	92.8	Very high	92.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.			trans	-70.4	118.2	-174.9	-55.1	164.3	0	0	0	110.4	I371 I375 E376 L393 N396 S400 I401 L417 N420 A421 I422	I371-I398 PolarHBondContact O-N 2.86Å; I375-I398 HydrophobicContact CB-CD1 4.2Å; I375-I398 HydrophobicContact CB-CG1 4.3Å; I375-I398 HydrophobicContact CB-CG2 4.02Å; I375-I398 HydrophobicContact CG1-CD1 3.86Å; I375-I398 HydrophobicContact CG1-CG1 4.35Å; I375-I398 HydrophobicContact CG2-CD1 4.38Å; I375-I398 HydrophobicContact CG2-CG2 3.71Å; E376-I398 HydrophobicContact CG-CG2 4.32Å; L393-I398 HydrophobicContact CB-CD1 4.16Å; L393-I398 HydrophobicContact CD1-CD1 4.4Å; N396-I398 HydrophobicContact CB-CD1 4.26Å; N396-I398 HydrophobicContact CB-CG1 4.19Å; I398-S400 WeakPolarHBondContact CG2-O 2.98Å; I398-I401 HydrophobicContact CG2-CG1 4.47Å; I398-L417 HydrophobicContact CD1-CD2 4.21Å; I398-N420 HydrophobicContact CB-CB 4.21Å; I398-N420 WeakPolarHBondContact CB-OD1 3.4Å; I398-N420 WeakPolarHBondContact CD1-OD1 3.4Å; I398-N420 WeakPolarHBondContact CG1-OD1 3.41Å; I398-N420 PolarHBondContact N-OD1 3.41Å; I398-A421 CarbonylContact O-C 3.56Å; I398-A421 PolarHBondContact O-N 3.12Å; I398-I422 HydrophobicContact CG2-CG1 4.23Å; I398-I422 WeakPolarHBondContact O-CG1 3.47Å; I398-I422 PolarHBondContact O-N 2.86Å
399	K	89.6	Confident	92.5	Very high	83 Å²	83	36.1 Å²	36.1	36%	0.361	18%	0.182	S	C	.	.			trans	-101.9	-15.3	175.8	-51	170.1	-169	167.2	0	113.6	E376 Q397 M423	E376-K399 VanDerWaalsContact CD-N 3.31Å; E376-K399 WeakPolarHBondContact OE1-CB 3.09Å; E376-K399 PolarHBondContact OE1-N 2.71Å; E376-K399 WeakPolarHBondContact OE2-CB 3.5Å; Q397-K399 PolarHBondContact O-N 2.92Å; K399-M423 HydrophobicContact CB-CG 4.35Å; K399-M423 WeakPolarHBondContact O-CB 3.34Å; K399-M423 PolarHBondContact O-N 3.27Å
400	S	90.6	Very high	92.2	Very high	5 Å²	5	40 Å²	40	4%	0.035	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	162.6	177.8	62.3	0	0	0	0	112.9	E376 I398 S424	E376-S400 VanDerWaalsContact CD-N 3.34Å; E376-S400 WeakPolarHBondContact CG-O 3Å; E376-S400 WeakPolarHBondContact OE2-CB 3.07Å; E376-S400 PolarHBondContact OE2-N 3.22Å; E376-S400 PolarHBondContact OE2-OG 2.91Å; I398-S400 WeakPolarHBondContact CG2-O 2.98Å; S400-S424 CarbonylContact C-O 3.59Å; S400-S424 WeakPolarHBondContact CA-O 3.23Å; S400-S424 WeakPolarHBondContact CB-O 3.24Å; S400-S424 VanDerWaalsContact CB-OG 3.23Å; S400-S424 WeakPolarHBondContact CB-OG 3.36Å
401	I	92.8	Very high	92	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.015	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	118.6	178.8	-55.8	-178	0	0	0	107.8	I375 I398 A405 F406 L417 I422 S424 I425 Q426 A429 F430	I375-I401 HydrophobicContact CG2-CB 4.31Å; I375-I401 HydrophobicContact CG2-CG1 3.93Å; I375-I401 HydrophobicContact CG2-CG2 4.24Å; I398-I401 HydrophobicContact CG2-CG1 4.47Å; I401-A405 HydrophobicContact CG2-CB 4.18Å; I401-F406 HydrophobicContact CG2-CD2 4.46Å; I401-F406 HydrophobicContact CG2-CE2 3.69Å; I401-F406 HydrophobicContact CG2-CZ 4.33Å; I401-L417 HydrophobicContact CD1-CD1 3.7Å; I401-L417 HydrophobicContact CD1-CD2 4.47Å; I401-I422 HydrophobicContact CD1-CD1 4.1Å; I401-I422 HydrophobicContact CG1-CG2 4.44Å; I401-S424 PolarHBondContact N-O 3.37Å; I401-I425 HydrophobicContact CB-CG1 4.46Å; I401-I425 HydrophobicContact CB-CG2 4.04Å; I401-I425 HydrophobicContact CD1-CD1 4.16Å; I401-I425 HydrophobicContact CD1-CG1 4.18Å; I401-I425 HydrophobicContact CD1-CG2 4.42Å; I401-I425 HydrophobicContact CG1-CG1 4.4Å; I401-I425 HydrophobicContact CG2-CG2 4.39Å; I401-Q426 WeakPolarHBondContact O-CB 3.41Å; I401-Q426 PolarHBondContact O-N 2.99Å; I401-A429 HydrophobicContact CG2-CB 3.95Å; I401-F430 HydrophobicContact CD1-CZ 4.35Å
402	T	90.1	Very high	91.9	Very high	21 Å²	21	38.5 Å²	38.5	13%	0.129	20%	0.197	C	C	.	.			trans	-81.9	160.2	175.5	73.8	0	0	0	0	111.4	I375 E376 D377 K404 A405	I375-T402 PolarHBondContact O-N 2.85Å; E376-T402 VanDerWaalsContact C-CG2 3.47Å; E376-T402 WeakPolarHBondContact O-CG2 3.33Å; D377-T402 VanDerWaalsContact O-CG2 3.27Å; D377-T402 WeakPolarHBondContact O-CG2 3.4Å; D377-T402 PolarHBondContact O-OG1 2.82Å; T402-K404 PolarHBondContact O-N 3.43Å; T402-K404 PolarHBondContact OG1-N 2.96Å; T402-K404 VanDerWaalsContact OG1-N 3.15Å; T402-A405 PolarHBondContact O-N 2.95Å; T402-A405 PolarHBondContact OG1-N 3.27Å
403	K	88	Confident	91.8	Very high	126 Å²	126	40.8 Å²	40.8	55%	0.548	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	3.1	169.6	77.4	179.3	-176.9	176.1	0	114.4	Q426	K403-Q426 HydrophobicContact CB-CB 4.48Å; K403-Q426 HydrophobicContact CB-CG 4.13Å
404	K	87.2	Confident	91.8	Very high	100 Å²	100	43.6 Å²	43.6	44%	0.435	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-19.5	176.2	-67.2	-136	-166.3	176.8	0	114.2	A378 T402 F406 I407	A378-K404 HydrophobicContact CB-CB 4.28Å; A378-K404 HydrophobicContact CB-CD 3.97Å; A378-K404 HydrophobicContact CB-CG 4.21Å; T402-K404 PolarHBondContact O-N 3.43Å; T402-K404 PolarHBondContact OG1-N 2.96Å; T402-K404 VanDerWaalsContact OG1-N 3.15Å; K404-F406 PolarHBondContact O-N 3.28Å; K404-I407 HydrophobicContact CB-CD1 3.88Å; K404-I407 HydrophobicContact CD-CD1 3.88Å; K404-I407 HydrophobicContact CG-CD1 3.74Å; K404-I407 PolarHBondContact O-N 2.9Å
405	A	88.8	Confident	91.8	Very high	5 Å²	5	41.2 Å²	41.2	4%	0.041	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-30.4	-169.7	0	0	0	0	0	115.1	I375 I401 T402	I375-A405 HydrophobicContact CB-CB 4.48Å; I375-A405 HydrophobicContact CD1-CB 4.16Å; I375-A405 HydrophobicContact CG2-CB 3.98Å; I401-A405 HydrophobicContact CG2-CB 4.18Å; T402-A405 PolarHBondContact O-N 2.95Å; T402-A405 PolarHBondContact OG1-N 3.27Å
406	F	89.9	Confident	91.8	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.018	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	20.8	-177.2	-50.1	-57.9	0	0	0	113.4	I375 L391 L393 I401 K404 G408 L409 L415 F430 T433	I375-F406 HydrophobicContact CD1-CD1 4.48Å; I375-F406 HydrophobicContact CD1-CE1 3.69Å; I375-F406 HydrophobicContact CD1-CZ 4.16Å; I375-F406 HydrophobicContact CG2-CZ 4.49Å; L391-F406 HydrophobicContact CD2-CD1 4.18Å; L391-F406 HydrophobicContact CD2-CE1 4.02Å; L393-F406 HydrophobicContact CD1-CE1 4.24Å; I401-F406 HydrophobicContact CG2-CD2 4.46Å; I401-F406 HydrophobicContact CG2-CE2 3.69Å; I401-F406 HydrophobicContact CG2-CZ 4.33Å; K404-F406 PolarHBondContact O-N 3.28Å; F406-G408 PolarHBondContact O-N 2.98Å; F406-L409 HydrophobicContact CB-CD1 4.09Å; F406-L409 HydrophobicContact CD1-CD1 3.94Å; F406-L409 HydrophobicContact CG-CD1 4.5Å; F406-L409 WeakPolarHBondContact O-CB 3.43Å; F406-L409 PolarHBondContact O-N 2.71Å; F406-L415 HydrophobicContact CE1-CD1 4.26Å; F406-L415 HydrophobicContact CE1-CD2 4.37Å; F406-L415 HydrophobicContact CE2-CD2 3.99Å; F406-L415 HydrophobicContact CZ-CD1 4.34Å; F406-L415 HydrophobicContact CZ-CD2 3.91Å; F406-F430 HydrophobicContact CD2-CD1 4.19Å; F406-F430 HydrophobicContact CD2-CE1 4.37Å; F406-F430 HydrophobicContact CE2-CD1 4.13Å; F406-F430 AromaticContact CE2-CE1 3.84Å; F406-F430 HydrophobicContact CE2-CE1 3.84Å; F406-T433 HydrophobicContact CB-CG2 3.92Å
407	I	84.4	Confident	91.8	Very high	77 Å²	77	40.8 Å²	40.8	40%	0.395	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	133.6	176.2	-72.9	176.7	0	0	0	110.4	K404 L409	K404-I407 HydrophobicContact CB-CD1 3.88Å; K404-I407 HydrophobicContact CD-CD1 3.88Å; K404-I407 HydrophobicContact CG-CD1 3.74Å; K404-I407 PolarHBondContact O-N 2.9Å; I407-L409 VanDerWaalsContact C-N 3.28Å
408	G	83.5	Confident	91.8	Very high	22 Å²	22	37.8 Å²	37.8	23%	0.227	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	-0.1	-177.8	0	0	0	0	0	114.8	F406 E410	F406-G408 PolarHBondContact O-N 2.98Å; G408-E410 PolarHBondContact O-N 2.92Å
409	L	91.5	Very high	91.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.215	C	C	.	.			trans	-90.6	46.9	173.1	-55.7	-173.6	0	0	0	111.5	F382 L385 L388 L391 F406 I407 S411 L412	F382-L409 HydrophobicContact CB-CD1 4.23Å; F382-L409 HydrophobicContact CB-CD2 4.25Å; F382-L409 HydrophobicContact CB-CG 4.49Å; L385-L409 HydrophobicContact CB-CD2 3.58Å; L385-L409 HydrophobicContact CD1-CD2 4.46Å; L388-L409 HydrophobicContact CB-CD2 4.36Å; L388-L409 HydrophobicContact CD2-CD1 4.31Å; L388-L409 HydrophobicContact CD2-CD2 3.93Å; L391-L409 HydrophobicContact CD2-CD1 3.97Å; F406-L409 HydrophobicContact CB-CD1 4.09Å; F406-L409 HydrophobicContact CD1-CD1 3.94Å; F406-L409 HydrophobicContact CG-CD1 4.5Å; F406-L409 WeakPolarHBondContact O-CB 3.43Å; F406-L409 PolarHBondContact O-N 2.71Å; I407-L409 VanDerWaalsContact C-N 3.28Å; L409-S411 PolarHBondContact O-N 2.84Å; L409-L412 HydrophobicContact CB-CB 4.07Å; L409-L412 HydrophobicContact CB-CD2 4.34Å; L409-L412 HydrophobicContact CD1-CD2 4.2Å; L409-L412 WeakPolarHBondContact O-CB 3.29Å; L409-L412 PolarHBondContact O-N 2.98Å
410	E	90.4	Very high	92	Very high	126 Å²	126	38.9 Å²	38.9	59%	0.589	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-33.7	-174.5	-64.1	175.1	-162.8	0	0	112.4	G408 L412 Q432 H434	G408-E410 PolarHBondContact O-N 2.92Å; E410-L412 VanDerWaalsContact C-N 3.27Å; E410-L412 PolarHBondContact O-N 3.19Å; E410-Q432 WeakPolarHBondContact CA-O 3.18Å; E410-H434 PolarHBondContact O-CD2 2.83Å
411	S	95	Very high	92.1	Very high	50 Å²	50	41.1 Å²	41.1	35%	0.35	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-0.2	177.6	-59.3	0	0	0	0	114.7	T386 L388 T389 L409 E413	T386-S411 WeakPolarHBondContact O-CB 3.46Å; T386-S411 PolarHBondContact O-OG 2.8Å; L388-S411 CarbonylContact O-C 3.44Å; T389-S411 WeakPolarHBondContact CA-O 3.47Å; L409-S411 PolarHBondContact O-N 2.84Å; S411-E413 WeakPolarHBondContact O-CG 3.28Å; S411-E413 PolarHBondContact O-N 3.4Å
412	L	96.5	Very high	92.1	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.217	C	C	.	.			trans	-73.1	114.9	-168.8	-173.2	67.1	0	0	0	112.3	L388 L391 L409 E410 L415 T433 H434 L435	L388-L412 HydrophobicContact CD2-CD1 4.33Å; L388-L412 HydrophobicContact CG-CD1 4.48Å; L388-L412 WeakPolarHBondContact O-CA 3.39Å; L388-L412 PolarHBondContact O-N 3.1Å; L388-L412 VanDerWaalsContact O-N 3.17Å; L391-L412 HydrophobicContact CB-CD1 3.76Å; L391-L412 HydrophobicContact CB-CD2 4.48Å; L409-L412 HydrophobicContact CB-CB 4.07Å; L409-L412 HydrophobicContact CB-CD2 4.34Å; L409-L412 HydrophobicContact CD1-CD2 4.2Å; L409-L412 WeakPolarHBondContact O-CB 3.29Å; L409-L412 PolarHBondContact O-N 2.98Å; E410-L412 VanDerWaalsContact C-N 3.27Å; E410-L412 PolarHBondContact O-N 3.19Å; L412-L415 HydrophobicContact CD2-CB 4.36Å; L412-T433 HydrophobicContact CB-CG2 4.34Å; L412-T433 HydrophobicContact CD2-CG2 4.14Å; L412-H434 CarbonylContact O-C 3.55Å; L412-H434 PolarHBondContact O-N 3.22Å; L412-L435 HydrophobicContact CD2-CD2 4.18Å; L412-L435 HydrophobicContact CG-CD2 3.97Å; L412-L435 PolarHBondContact O-N 3.34Å
413	E	96.3	Very high	92.2	Very high	58 Å²	58	41.3 Å²	41.3	27%	0.271	22%	0.218	S	C	.	.			trans	-104.8	-30.6	-178.2	-46.5	-162.8	150.5	0	0	112.7	T389 S411 K436 E437	T389-E413 HydrophobicContact CG2-CG 4.45Å; T389-E413 PolarHBondContact O-N 3.01Å; S411-E413 WeakPolarHBondContact O-CG 3.28Å; S411-E413 PolarHBondContact O-N 3.4Å; E413-K436 HydrophobicContact CB-CD 4.19Å; E413-K436 HydrophobicContact CB-CG 4.28Å; E413-K436 HydrophobicContact CG-CD 4.49Å; E413-K436 PolarHBondContact O-N 2.81Å; E413-K436 VanDerWaalsContact OE1-CE 3.31Å; E413-K436 WeakPolarHBondContact OE1-CE 3.49Å; E413-K436 IonicContact OE1-NZ 2.8Å; E413-K436 PolarHBondContact OE1-NZ 2.93Å; E413-K436 WeakPolarHBondContact OE2-CE 3.35Å; E413-K436 IonicContact OE2-NZ 4Å; E413-K436 PolarHBondContact OE2-NZ 3.01Å; E413-E437 PolarHBondContact O-N 2.76Å
414	H	97.2	Very high	92.2	Very high	59 Å²	59	36.4 Å²	36.4	27%	0.273	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	118.9	-175.7	-59.9	-92.9	0	0	0	111.3	T389 K390 L391 E437	T389-H414 PolarHBondContact O-N 2.82Å; K390-H414 WeakPolarHBondContact CA-O 3.44Å; K390-H414 HydrophobicContact CB-CB 4.09Å; K390-H414 HydrophobicContact CD-CB 4.25Å; K390-H414 HydrophobicContact CG-CB 3.96Å; L391-H414 PolarHBondContact N-O 3.23Å; H414-E437 WeakPolarHBondContact CA-O 3.46Å; H414-E437 IonicContact CE1-OE2 2.64Å; H414-E437 IonicContact CG-OE2 2.65Å; H414-E437 WeakPolarHBondContact ND1-CB 3.38Å; H414-E437 IonicContact ND1-OE2 3.63Å; H414-E437 PolarHBondContact ND1-OE2 2.88Å
415	L	96.9	Very high	92.5	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	119.8	177.8	178	58.1	0	0	0	110.9	L391 F406 L412 L417 F430 L435 E437 L438 I439	L391-L415 HydrophobicContact CB-CD1 4.16Å; L391-L415 HydrophobicContact CD2-CD1 4.15Å; L391-L415 HydrophobicContact CG-CD1 4.15Å; L391-L415 WeakPolarHBondContact O-CA 3.47Å; F406-L415 HydrophobicContact CE1-CD1 4.26Å; F406-L415 HydrophobicContact CE1-CD2 4.37Å; F406-L415 HydrophobicContact CE2-CD2 3.99Å; F406-L415 HydrophobicContact CZ-CD1 4.34Å; F406-L415 HydrophobicContact CZ-CD2 3.91Å; L412-L415 HydrophobicContact CD2-CB 4.36Å; L415-L417 HydrophobicContact CD1-CD1 4.41Å; L415-L417 HydrophobicContact CD1-CG 4.12Å; L415-L417 HydrophobicContact CD2-CD1 3.86Å; L415-L417 HydrophobicContact CD2-CG 4.45Å; L415-L417 HydrophobicContact CG-CD1 3.98Å; L415-L417 HydrophobicContact CG-CG 4.06Å; L415-F430 HydrophobicContact CD2-CD1 4.26Å; L415-F430 HydrophobicContact CD2-CE1 4.01Å; L415-L435 HydrophobicContact CB-CD1 4.43Å; L415-L435 HydrophobicContact CB-CD2 3.58Å; L415-L435 HydrophobicContact CD2-CD1 4.26Å; L415-E437 PolarHBondContact N-O 3.15Å; L415-L438 HydrophobicContact CB-CD1 4.29Å; L415-L438 HydrophobicContact CD2-CD1 4.13Å; L415-L438 HydrophobicContact CG-CD1 4.16Å; L415-I439 PolarHBondContact O-N 3.35Å
416	D	96.9	Very high	92.6	Very high	21 Å²	21	35.9 Å²	35.9	11%	0.112	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	117.6	174	-173.7	-4.5	0	0	0	111	L391 V392 L393 Q394 N418 I439	L391-D416 PolarHBondContact O-N 2.62Å; L391-D416 VanDerWaalsContact O-N 3.1Å; V392-D416 HydrophobicContact CG1-CB 4.18Å; L393-D416 CarbonylContact C-O 3.57Å; L393-D416 WeakPolarHBondContact CA-O 3.32Å; L393-D416 PolarHBondContact N-O 2.97Å; Q394-D416 PolarHBondContact N-O 3.39Å; D416-N418 VanDerWaalsContact OD1-CB 3.28Å; D416-N418 WeakPolarHBondContact OD1-CB 3.35Å; D416-N418 PolarHBondContact OD1-N 2.66Å; D416-I439 HydrophobicContact CB-CB 4.3Å; D416-I439 HydrophobicContact CB-CD1 4.31Å
417	L	95.7	Very high	92.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.223	C	C	.	.			trans	-119.5	12.1	179.7	-72.5	164.1	0	0	0	112.2	L393 I398 I401 L415 N420 I422 F430 L438 I439 L440	L393-L417 HydrophobicContact CB-CD2 4.06Å; L393-L417 HydrophobicContact CD1-CD2 4.13Å; I398-L417 HydrophobicContact CD1-CD2 4.21Å; I401-L417 HydrophobicContact CD1-CD1 3.7Å; I401-L417 HydrophobicContact CD1-CD2 4.47Å; L415-L417 HydrophobicContact CD1-CD1 4.41Å; L415-L417 HydrophobicContact CD1-CG 4.12Å; L415-L417 HydrophobicContact CD2-CD1 3.86Å; L415-L417 HydrophobicContact CD2-CG 4.45Å; L415-L417 HydrophobicContact CG-CD1 3.98Å; L415-L417 HydrophobicContact CG-CG 4.06Å; L417-N420 PolarHBondContact O-ND2 3.05Å; L417-I422 HydrophobicContact CB-CD1 4.14Å; L417-F430 HydrophobicContact CD1-CE1 4.41Å; L417-L438 HydrophobicContact CD1-CD1 4.3Å; L417-I439 PolarHBondContact N-O 3.26Å; L417-L440 HydrophobicContact CB-CD1 3.89Å
418	N	94.1	Very high	92.8	Very high	31 Å²	31	41.4 Å²	41.4	17%	0.166	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	154.9	-179.3	-90.6	-23.3	0	0	0	113.4	Q394 G395 D416 N420 I439 N441	Q394-N418 CarbonylContact C-O 3.56Å; Q394-N418 VanDerWaalsContact CA-O 3.24Å; Q394-N418 WeakPolarHBondContact CA-O 3.38Å; Q394-N418 HydrophobicContact CG-CB 3.94Å; G395-N418 PolarHBondContact N-O 2.93Å; D416-N418 VanDerWaalsContact OD1-CB 3.28Å; D416-N418 WeakPolarHBondContact OD1-CB 3.35Å; D416-N418 PolarHBondContact OD1-N 2.66Å; N418-N420 PolarHBondContact O-N 2.98Å; N418-N420 VanDerWaalsContact O-N 3.11Å; N418-N420 PolarHBondContact O-ND2 2.97Å; N418-N420 VanDerWaalsContact O-ND2 3.14Å; N418-I439 WeakPolarHBondContact ND2-CG2 3.41Å; N418-N441 WeakPolarHBondContact OD1-CB 3.45Å; N418-N441 PolarHBondContact OD1-N 3.23Å
419	N	92.9	Very high	93.2	Very high	101 Å²	101	40.7 Å²	40.7	54%	0.54	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	22.4	173.7	-51.9	-17.9	0	0	0	114.2
420	N	94.4	Very high	93.2	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.027	22%	0.216	C	C	.	.			trans	-101.5	141.3	168.2	-73.3	-89	0	0	0	109.5	L393 N396 I398 L417 N418 I422	L393-N420 PolarHBondContact O-ND2 2.82Å; N396-N420 VanDerWaalsContact CA-OD1 3.28Å; N396-N420 WeakPolarHBondContact CA-OD1 3.39Å; N396-N420 WeakPolarHBondContact CB-OD1 3.35Å; N396-N420 PolarHBondContact N-OD1 3.49Å; N396-N420 PolarHBondContact O-OD1 3.08Å; N396-N420 VanDerWaalsContact O-OD1 3.06Å; I398-N420 HydrophobicContact CB-CB 4.21Å; I398-N420 WeakPolarHBondContact CB-OD1 3.4Å; I398-N420 WeakPolarHBondContact CD1-OD1 3.4Å; I398-N420 WeakPolarHBondContact CG1-OD1 3.41Å; I398-N420 PolarHBondContact N-OD1 3.41Å; L417-N420 PolarHBondContact O-ND2 3.05Å; N418-N420 PolarHBondContact O-N 2.98Å; N418-N420 VanDerWaalsContact O-N 3.11Å; N418-N420 PolarHBondContact O-ND2 2.97Å; N418-N420 VanDerWaalsContact O-ND2 3.14Å; N420-I422 HydrophobicContact CB-CD1 3.81Å; N420-I422 HydrophobicContact CB-CG1 3.79Å; N420-I422 PolarHBondContact O-N 2.9Å
421	A	92	Very high	93	Very high	52 Å²	52	38.1 Å²	38.1	43%	0.43	21%	0.212	S	C	.	.			trans	-80.8	49.5	-179.4	0	0	0	0	0	112.5	I398 M423	I398-A421 CarbonylContact O-C 3.56Å; I398-A421 PolarHBondContact O-N 3.12Å; A421-M423 VanDerWaalsContact O-CG 3.29Å; A421-M423 WeakPolarHBondContact O-CG 3.49Å; A421-M423 PolarHBondContact O-N 2.8Å
422	I	93.4	Very high	92.4	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.			trans	-67.6	122.4	-172.3	-63.8	158	0	0	0	110.1	I398 I401 L417 N420 I425 L440 T442 L445	I398-I422 HydrophobicContact CG2-CG1 4.23Å; I398-I422 WeakPolarHBondContact O-CG1 3.47Å; I398-I422 PolarHBondContact O-N 2.86Å; I401-I422 HydrophobicContact CD1-CD1 4.1Å; I401-I422 HydrophobicContact CG1-CG2 4.44Å; L417-I422 HydrophobicContact CB-CD1 4.14Å; N420-I422 HydrophobicContact CB-CD1 3.81Å; N420-I422 HydrophobicContact CB-CG1 3.79Å; N420-I422 PolarHBondContact O-N 2.9Å; I422-I425 HydrophobicContact CG2-CD1 4.03Å; I422-I425 HydrophobicContact CG2-CG1 3.66Å; I422-L440 HydrophobicContact CD1-CD1 3.59Å; I422-T442 HydrophobicContact CB-CG2 4.2Å; I422-T442 PolarHBondContact O-OG1 2.9Å; I422-L445 HydrophobicContact CG2-CD2 4.27Å; I422-L445 WeakPolarHBondContact O-CD2 3.44Å
423	M	90.3	Very high	92	Very high	28 Å²	28	40.7 Å²	40.7	14%	0.138	22%	0.22	C	C	.	.			trans	-104.2	-35.4	-176.7	-48.4	-172.4	68.5	0	0	112.9	K399 A421 S444 L445 L446 H585	K399-M423 HydrophobicContact CB-CG 4.35Å; K399-M423 WeakPolarHBondContact O-CB 3.34Å; K399-M423 PolarHBondContact O-N 3.27Å; A421-M423 VanDerWaalsContact O-CG 3.29Å; A421-M423 WeakPolarHBondContact O-CG 3.49Å; A421-M423 PolarHBondContact O-N 2.8Å; M423-S444 WeakPolarHBondContact CA-O 3.38Å; M423-L445 WeakPolarHBondContact O-CA 3.4Å; M423-L446 PolarHBondContact O-N 3.28Å; M423-H585 VanDerWaalsContact CE-O 3.32Å; M423-H585 WeakPolarHBondContact CE-O 3.42Å
424	S	89.7	Confident	91.6	Very high	24 Å²	24	44.3 Å²	44.3	17%	0.168	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	128.6	-176.9	67.2	0	0	0	0	112.1	S400 I401 K497	S400-S424 CarbonylContact C-O 3.59Å; S400-S424 WeakPolarHBondContact CA-O 3.23Å; S400-S424 WeakPolarHBondContact CB-O 3.24Å; S400-S424 VanDerWaalsContact CB-OG 3.23Å; S400-S424 WeakPolarHBondContact CB-OG 3.36Å; I401-S424 PolarHBondContact N-O 3.37Å; S424-K497 PolarHBondContact OG-NZ 3.38Å
425	I	92.8	Very high	91.5	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117.2	176	-52	-177.6	0	0	0	108	I401 I422 A429 F430 L440 L451 W453 L454	I401-I425 HydrophobicContact CB-CG1 4.46Å; I401-I425 HydrophobicContact CB-CG2 4.04Å; I401-I425 HydrophobicContact CD1-CD1 4.16Å; I401-I425 HydrophobicContact CD1-CG1 4.18Å; I401-I425 HydrophobicContact CD1-CG2 4.42Å; I401-I425 HydrophobicContact CG1-CG1 4.4Å; I401-I425 HydrophobicContact CG2-CG2 4.39Å; I422-I425 HydrophobicContact CG2-CD1 4.03Å; I422-I425 HydrophobicContact CG2-CG1 3.66Å; I425-A429 HydrophobicContact CG2-CB 4Å; I425-F430 HydrophobicContact CD1-CZ 4.41Å; I425-F430 HydrophobicContact CG2-CE2 4.03Å; I425-F430 HydrophobicContact CG2-CZ 4.01Å; I425-L440 HydrophobicContact CD1-CD2 3.95Å; I425-L451 HydrophobicContact CB-CD1 4.36Å; I425-W453 HydrophobicContact CB-CZ2 4.34Å; I425-W453 HydrophobicContact CG2-CH2 4.23Å; I425-W453 HydrophobicContact CG2-CZ2 3.72Å; I425-W453 PolarHBondContact O-NE1 2.91Å; I425-L454 HydrophobicContact CD1-CD2 4Å
426	Q	91.1	Very high	91.3	Very high	89 Å²	89	48.9 Å²	48.9	42%	0.416	26%	0.256	S	S	.	.			trans	-66.2	145.6	-175.9	-172.9	171.1	22.1	0	0	111.8	I401 K403 N428 A429 W453	I401-Q426 WeakPolarHBondContact O-CB 3.41Å; I401-Q426 PolarHBondContact O-N 2.99Å; K403-Q426 HydrophobicContact CB-CB 4.48Å; K403-Q426 HydrophobicContact CB-CG 4.13Å; Q426-N428 PolarHBondContact O-N 3.49Å; Q426-A429 VanDerWaalsContact O-CB 3.23Å; Q426-A429 WeakPolarHBondContact O-CB 3.41Å; Q426-A429 PolarHBondContact O-N 3.29Å; Q426-W453 WeakPolarHBondContact O-CZ2 3.42Å
427	E	90.6	Very high	91.2	Very high	118 Å²	118	51.4 Å²	51.4	55%	0.551	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	131.1	175.5	-159	-167.9	168.8	0	0	112.6	A429 W453	E427-A429 VanDerWaalsContact C-N 3.28Å; E427-A429 PolarHBondContact O-N 2.79Å; E427-W453 HydrophobicContact CB-CG 4.31Å; E427-W453 HydrophobicContact CG-CB 4.03Å; E427-W453 HydrophobicContact CG-CD2 4.29Å; E427-W453 HydrophobicContact CG-CG 3.77Å
428	N	88.6	Confident	91.1	Very high	79 Å²	79	51.4 Å²	51.4	42%	0.422	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	21.5	-179.7	-64.5	-60.2	0	0	0	115.4	Q426 F430 S431	Q426-N428 PolarHBondContact O-N 3.49Å; N428-F430 PolarHBondContact O-N 3.3Å; N428-F430 VanDerWaalsContact O-N 3.07Å; N428-S431 WeakPolarHBondContact O-CB 3.35Å; N428-S431 PolarHBondContact O-N 2.87Å; N428-S431 PolarHBondContact O-OG 2.99Å
429	A	91.9	Very high	91.2	Very high	7 Å²	7	52 Å²	52	6%	0.058	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.1	179.4	0	0	0	0	0	115.6	I401 I425 Q426 E427	I401-A429 HydrophobicContact CG2-CB 3.95Å; I425-A429 HydrophobicContact CG2-CB 4Å; Q426-A429 VanDerWaalsContact O-CB 3.23Å; Q426-A429 WeakPolarHBondContact O-CB 3.41Å; Q426-A429 PolarHBondContact O-N 3.29Å; E427-A429 VanDerWaalsContact C-N 3.28Å; E427-A429 PolarHBondContact O-N 2.79Å
430	F	91.4	Very high	91.2	Very high	1 Å²	1	47.2 Å²	47.2	0%	0.004	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	1.1	176.6	-50.2	-58.7	0	0	0	113.7	I401 F406 L415 L417 I425 N428 Q432 T433 L435 L438 W453 L454 W457	I401-F430 HydrophobicContact CD1-CZ 4.35Å; F406-F430 HydrophobicContact CD2-CD1 4.19Å; F406-F430 HydrophobicContact CD2-CE1 4.37Å; F406-F430 HydrophobicContact CE2-CD1 4.13Å; F406-F430 AromaticContact CE2-CE1 3.84Å; F406-F430 HydrophobicContact CE2-CE1 3.84Å; L415-F430 HydrophobicContact CD2-CD1 4.26Å; L415-F430 HydrophobicContact CD2-CE1 4.01Å; L417-F430 HydrophobicContact CD1-CE1 4.41Å; I425-F430 HydrophobicContact CD1-CZ 4.41Å; I425-F430 HydrophobicContact CG2-CE2 4.03Å; I425-F430 HydrophobicContact CG2-CZ 4.01Å; N428-F430 PolarHBondContact O-N 3.3Å; N428-F430 VanDerWaalsContact O-N 3.07Å; F430-Q432 VanDerWaalsContact C-N 3.28Å; F430-Q432 PolarHBondContact O-N 3.29Å; F430-T433 PolarHBondContact O-N 3.08Å; F430-T433 PolarHBondContact O-OG1 3.42Å; F430-L435 HydrophobicContact CB-CD1 4.34Å; F430-L435 HydrophobicContact CD1-CD1 4.26Å; F430-L435 HydrophobicContact CG-CD1 4.42Å; F430-L438 HydrophobicContact CE2-CD2 4.36Å; F430-L438 HydrophobicContact CZ-CD2 4.5Å; F430-W453 AromaticContact CD2-CH2 3.74Å; F430-W453 HydrophobicContact CD2-CH2 3.74Å; F430-W453 HydrophobicContact CD2-CZ3 4.29Å; F430-W453 HydrophobicContact CE2-CH2 4.02Å; F430-L454 HydrophobicContact CE2-CD1 3.93Å; F430-W457 HydrophobicContact CB-CH2 3.79Å; F430-W457 HydrophobicContact CB-CZ2 3.48Å; F430-W457 VanDerWaalsContact CB-CZ2 3.48Å; F430-W457 HydrophobicContact CD2-CD2 4.4Å; F430-W457 HydrophobicContact CD2-CE3 4.02Å; F430-W457 AromaticContact CD2-CH2 3.65Å; F430-W457 HydrophobicContact CD2-CH2 3.65Å; F430-W457 HydrophobicContact CD2-CZ2 4.05Å; F430-W457 AromaticContact CD2-CZ3 3.63Å; F430-W457 HydrophobicContact CD2-CZ3 3.63Å; F430-W457 HydrophobicContact CE2-CZ3 4.18Å; F430-W457 AromaticContact CG-CH2 3.9Å; F430-W457 HydrophobicContact CG-CH2 3.9Å; F430-W457 HydrophobicContact CG-CZ2 4.1Å; F430-W457 HydrophobicContact CG-CZ3 4.35Å
431	S	84.4	Confident	91	Very high	72 Å²	72	50.1 Å²	50.1	50%	0.503	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-21.1	-167.6	70.2	0	0	0	0	115.2	N428 T433	N428-S431 WeakPolarHBondContact O-CB 3.35Å; N428-S431 PolarHBondContact O-N 2.87Å; N428-S431 PolarHBondContact O-OG 2.99Å; S431-T433 VanDerWaalsContact C-N 3.35Å
432	Q	83.3	Confident	91	Very high	90 Å²	90	48 Å²	48	42%	0.421	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	0.7	174.7	-63.2	-165.4	-5.5	0	0	113.6	E410 F430	E410-Q432 WeakPolarHBondContact CA-O 3.18Å; F430-Q432 VanDerWaalsContact C-N 3.28Å; F430-Q432 PolarHBondContact O-N 3.29Å
433	T	87.3	Confident	91	Very high	13 Å²	13	51.8 Å²	51.8	8%	0.08	27%	0.268	C	S	.	.			trans	-109.5	152.1	-175.8	64.7	0	0	0	0	111.2	F406 L412 F430 S431 L435	F406-T433 HydrophobicContact CB-CG2 3.92Å; L412-T433 HydrophobicContact CB-CG2 4.34Å; L412-T433 HydrophobicContact CD2-CG2 4.14Å; F430-T433 PolarHBondContact O-N 3.08Å; F430-T433 PolarHBondContact O-OG1 3.42Å; S431-T433 VanDerWaalsContact C-N 3.35Å; T433-L435 WeakPolarHBondContact OG1-CG 3.39Å
434	H	89.3	Confident	91.1	Very high	135 Å²	135	52.1 Å²	52.1	63%	0.625	27%	0.273	S	S	*	.			trans	-108.2	48.7	-179.5	-69.2	-24.4	0	0	0	111.6	E410 L412 K436	E410-H434 PolarHBondContact O-CD2 2.83Å; L412-H434 CarbonylContact O-C 3.55Å; L412-H434 PolarHBondContact O-N 3.22Å; H434-K436 PolarHBondContact O-N 3Å
435	L	93.8	Very high	91.2	Very high	21 Å²	21	51 Å²	51	11%	0.11	27%	0.265	C	S	.	.			trans	-58.6	131.9	-174.6	-66.3	172.5	0	0	0	112.2	L412 L415 F430 T433 W457 F463	L412-L435 HydrophobicContact CD2-CD2 4.18Å; L412-L435 HydrophobicContact CG-CD2 3.97Å; L412-L435 PolarHBondContact O-N 3.34Å; L415-L435 HydrophobicContact CB-CD1 4.43Å; L415-L435 HydrophobicContact CB-CD2 3.58Å; L415-L435 HydrophobicContact CD2-CD1 4.26Å; F430-L435 HydrophobicContact CB-CD1 4.34Å; F430-L435 HydrophobicContact CD1-CD1 4.26Å; F430-L435 HydrophobicContact CG-CD1 4.42Å; T433-L435 WeakPolarHBondContact OG1-CG 3.39Å; L435-W457 HydrophobicContact CD1-CH2 4.21Å; L435-F463 HydrophobicContact CB-CE2 4.37Å; L435-F463 HydrophobicContact CB-CZ 3.83Å
436	K	93.3	Very high	91.1	Very high	135 Å²	135	51.3 Å²	51.3	59%	0.587	27%	0.267	S	S	*	.	S	Bend	trans	-109	-23.4	168.6	-57.8	177.4	-169.1	165.8	0	111.2	E413 H434	E413-K436 HydrophobicContact CB-CD 4.19Å; E413-K436 HydrophobicContact CB-CG 4.28Å; E413-K436 HydrophobicContact CG-CD 4.49Å; E413-K436 PolarHBondContact O-N 2.81Å; E413-K436 VanDerWaalsContact OE1-CE 3.31Å; E413-K436 WeakPolarHBondContact OE1-CE 3.49Å; E413-K436 IonicContact OE1-NZ 2.8Å; E413-K436 PolarHBondContact OE1-NZ 2.93Å; E413-K436 WeakPolarHBondContact OE2-CE 3.35Å; E413-K436 IonicContact OE2-NZ 4Å; E413-K436 PolarHBondContact OE2-NZ 3.01Å; H434-K436 PolarHBondContact O-N 3Å
437	E	94	Very high	91.2	Very high	75 Å²	75	47.1 Å²	47.1	35%	0.35	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	115.6	176.1	-173.9	176.5	-145.3	0	0	109.8	E413 H414 L415 I439	E413-E437 PolarHBondContact O-N 2.76Å; H414-E437 WeakPolarHBondContact CA-O 3.46Å; H414-E437 IonicContact CE1-OE2 2.64Å; H414-E437 IonicContact CG-OE2 2.65Å; H414-E437 WeakPolarHBondContact ND1-CB 3.38Å; H414-E437 IonicContact ND1-OE2 3.63Å; H414-E437 PolarHBondContact ND1-OE2 2.88Å; L415-E437 PolarHBondContact N-O 3.15Å; E437-I439 HydrophobicContact CG-CD1 4.35Å; E437-I439 HydrophobicContact CG-CG1 3.91Å
438	L	95.1	Very high	91.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	117.4	167.1	174.6	62.4	0	0	0	108.4	L415 L417 F430 L440 W457 L458 F463 S466 V467	L415-L438 HydrophobicContact CB-CD1 4.29Å; L415-L438 HydrophobicContact CD2-CD1 4.13Å; L415-L438 HydrophobicContact CG-CD1 4.16Å; L417-L438 HydrophobicContact CD1-CD1 4.3Å; F430-L438 HydrophobicContact CE2-CD2 4.36Å; F430-L438 HydrophobicContact CZ-CD2 4.5Å; L438-L440 HydrophobicContact CD1-CB 4.41Å; L438-L440 HydrophobicContact CG-CB 4.33Å; L438-W457 HydrophobicContact CD2-CH2 4.07Å; L438-W457 HydrophobicContact CD2-CZ3 3.7Å; L438-L458 HydrophobicContact CD2-CD2 4.14Å; L438-F463 HydrophobicContact CB-CD1 3.96Å; L438-F463 HydrophobicContact CB-CD2 4.4Å; L438-F463 HydrophobicContact CB-CE1 4.02Å; L438-F463 HydrophobicContact CB-CE2 4.43Å; L438-F463 HydrophobicContact CB-CG 4.18Å; L438-F463 HydrophobicContact CB-CZ 4.26Å; L438-S466 VanDerWaalsContact O-CB 3.25Å; L438-S466 WeakPolarHBondContact O-CB 3.1Å; L438-S466 PolarHBondContact O-OG 2.9Å; L438-V467 HydrophobicContact CB-CG2 4.5Å; L438-V467 HydrophobicContact CD2-CG2 4.12Å; L438-V467 HydrophobicContact CG-CG2 4.07Å
439	I	94.6	Very high	91.1	Very high	43 Å²	43	41.3 Å²	41.3	22%	0.221	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	112.3	173.8	-40.4	-178.5	0	0	0	108	L415 D416 L417 N418 E437	L415-I439 PolarHBondContact O-N 3.35Å; D416-I439 HydrophobicContact CB-CB 4.3Å; D416-I439 HydrophobicContact CB-CD1 4.31Å; L417-I439 PolarHBondContact N-O 3.26Å; N418-I439 WeakPolarHBondContact ND2-CG2 3.41Å; E437-I439 HydrophobicContact CG-CD1 4.35Å; E437-I439 HydrophobicContact CG-CG1 3.91Å
440	L	93	Very high	91	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	119.1	-176.3	174	66.7	0	0	0	110.1	L417 I422 I425 L438 T442 V467 N468 V469	L417-L440 HydrophobicContact CB-CD1 3.89Å; I422-L440 HydrophobicContact CD1-CD1 3.59Å; I425-L440 HydrophobicContact CD1-CD2 3.95Å; L438-L440 HydrophobicContact CD1-CB 4.41Å; L438-L440 HydrophobicContact CG-CB 4.33Å; L440-T442 HydrophobicContact CD1-CG2 4.15Å; L440-T442 HydrophobicContact CG-CG2 4.46Å; L440-V467 HydrophobicContact CB-CG1 4.12Å; L440-V467 HydrophobicContact CB-CG2 4.22Å; L440-V467 HydrophobicContact CD2-CG1 4.28Å; L440-V467 HydrophobicContact CG-CG1 4.36Å; L440-V467 CarbonylContact O-C 3.55Å; L440-V467 WeakPolarHBondContact O-CA 3.46Å; L440-N468 PolarHBondContact O-N 3.35Å; L440-V469 HydrophobicContact CD2-CG1 3.93Å; L440-V469 HydrophobicContact CG-CG1 3.79Å
441	N	91.2	Very high	91	Very high	66 Å²	66	46.5 Å²	46.5	35%	0.353	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	109.9	176.2	-173.1	10.1	0	0	0	109.3	N418 N468	N418-N441 WeakPolarHBondContact OD1-CB 3.45Å; N418-N441 PolarHBondContact OD1-N 3.23Å; N441-N468 VanDerWaalsContact CA-O 3.31Å; N441-N468 WeakPolarHBondContact CA-O 3.3Å; N441-N468 PolarHBondContact OD1-ND2 2.94Å; N441-N468 PolarHBondContact OD1-O 2.93Å; N441-N468 VanDerWaalsContact OD1-O 3.05Å
442	T	91.9	Very high	91.3	Very high	6 Å²	6	47.2 Å²	47.2	4%	0.037	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	138.8	176.9	170.9	0	0	0	0	110.1	I422 L440 S444 L445 N468 V469 S470	I422-T442 HydrophobicContact CB-CG2 4.2Å; I422-T442 PolarHBondContact O-OG1 2.9Å; L440-T442 HydrophobicContact CD1-CG2 4.15Å; L440-T442 HydrophobicContact CG-CG2 4.46Å; T442-S444 PolarHBondContact OG1-N 3.48Å; T442-S444 VanDerWaalsContact OG1-N 3.09Å; T442-L445 HydrophobicContact CG2-CD1 3.91Å; T442-L445 HydrophobicContact CG2-CD2 4.15Å; T442-L445 HydrophobicContact CG2-CG 3.84Å; T442-N468 PolarHBondContact N-O 2.66Å; T442-V469 HydrophobicContact CG2-CG1 3.81Å; T442-V469 WeakPolarHBondContact O-CA 3.22Å; T442-S470 PolarHBondContact O-N 3.18Å; T442-S470 VanDerWaalsContact O-N 3.08Å
443	S	92.9	Very high	91.8	Very high	81 Å²	81	44.5 Å²	44.5	57%	0.566	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	17	172.2	67.3	0	0	0	0	112.6	S470	S443-S470 CarbonylContact C-O 3.52Å; S443-S470 WeakPolarHBondContact CA-OG 3.25Å; S443-S470 VanDerWaalsContact CB-OG 3.31Å; S443-S470 WeakPolarHBondContact CB-OG 3.3Å
444	S	92.5	Very high	92.1	Very high	35 Å²	35	43.9 Å²	43.9	25%	0.245	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	7.3	-170.4	-59.1	0	0	0	0	114	M423 T442	M423-S444 WeakPolarHBondContact CA-O 3.38Å; T442-S444 PolarHBondContact OG1-N 3.48Å; T442-S444 VanDerWaalsContact OG1-N 3.09Å
445	L	92.4	Very high	92.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	139.7	-167.3	-69.8	166.6	0	0	0	113.8	I422 M423 T442 L451 V469 C471 A472 H473 I482	I422-L445 HydrophobicContact CG2-CD2 4.27Å; I422-L445 WeakPolarHBondContact O-CD2 3.44Å; M423-L445 WeakPolarHBondContact O-CA 3.4Å; T442-L445 HydrophobicContact CG2-CD1 3.91Å; T442-L445 HydrophobicContact CG2-CD2 4.15Å; T442-L445 HydrophobicContact CG2-CG 3.84Å; L445-L451 HydrophobicContact CB-CD2 4.05Å; L445-L451 HydrophobicContact CD1-CD2 4.22Å; L445-L451 HydrophobicContact CD2-CD1 4.27Å; L445-L451 HydrophobicContact CD2-CD2 4.36Å; L445-L451 HydrophobicContact CG-CD2 4.45Å; L445-V469 HydrophobicContact CD1-CB 3.71Å; L445-V469 HydrophobicContact CD1-CG1 4.17Å; L445-V469 HydrophobicContact CD1-CG2 4.45Å; L445-C471 CarbonylContact O-C 3.57Å; L445-C471 WeakPolarHBondContact O-CA 3.24Å; L445-A472 PolarHBondContact O-N 2.86Å; L445-H473 PolarHBondContact O-N 2.67Å; L445-I482 HydrophobicContact CD1-CG2 4.24Å
446	L	90.9	Very high	92	Very high	10 Å²	10	40.4 Å²	40.4	5%	0.052	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	103.7	163.2	178	61.7	0	0	0	108.2	M423 D448 H473 L496	M423-L446 PolarHBondContact O-N 3.28Å; L446-D448 HydrophobicContact CG-CB 4.16Å; L446-D448 PolarHBondContact O-N 2.85Å; L446-H473 HydrophobicContact CD1-CB 3.68Å; L446-L496 HydrophobicContact CD1-CD1 4.29Å
447	C	91.9	Very high	92	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	19%	0.185	C	C	.	.			trans	-85.2	57	-179.8	-68.9	0	0	0	0	111.7	L451 C471 H473 L477 F490	C447-L451 HydrophobicContact CB-CD2 4.38Å; C447-C471 HydrophobicContact CB-CB 3.82Å; C447-C471 WeakPolarHBondContact CB-SG 3.34Å; C447-C471 VanDerWaalsContact SG-CA 3.55Å; C447-C471 WeakPolarHBondContact SG-CB 3.47Å; C447-C471 CovalentContact SG-SG 2.03Å; C447-C471 PolarHBondContact SG-SG 2.75Å; C447-H473 PolarHBondContact N-O 2.9Å; C447-L477 HydrophobicContact CB-CD1 3.9Å; C447-F490 HydrophobicContact CB-CD1 4.14Å; C447-F490 HydrophobicContact CB-CE1 3.94Å
448	D	89.8	Confident	91.9	Very high	28 Å²	28	32.3 Å²	32.3	15%	0.15	17%	0.169	C	C	.	.	S	Bend	trans	-84.7	-178.7	171.8	68	13.6	0	0	0	111.5	L446 H450 L451 F490 V491	L446-D448 HydrophobicContact CG-CB 4.16Å; L446-D448 PolarHBondContact O-N 2.85Å; D448-H450 PolarHBondContact O-N 2.96Å; D448-H450 VanDerWaalsContact OD1-CA 3.3Å; D448-H450 WeakPolarHBondContact OD1-CA 3.45Å; D448-H450 VanDerWaalsContact OD1-CB 3.24Å; D448-H450 WeakPolarHBondContact OD1-CB 3.22Å; D448-H450 IonicContact OD1-CG 3.54Å; D448-H450 PolarHBondContact OD1-N 3.29Å; D448-H450 IonicContact OD2-CD2 3.48Å; D448-L451 PolarHBondContact O-N 2.87Å; D448-L451 VanDerWaalsContact O-N 3.09Å; D448-L451 PolarHBondContact OD1-N 2.67Å; D448-L451 VanDerWaalsContact OD1-N 3.14Å; D448-F490 WeakPolarHBondContact O-CD1 3.27Å; D448-V491 VanDerWaalsContact CA-O 3.32Å; D448-V491 WeakPolarHBondContact CA-O 3.43Å; D448-V491 WeakPolarHBondContact CB-O 3.47Å
449	C	88.8	Confident	91.6	Very high	47 Å²	47	35.4 Å²	35.4	32%	0.318	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-21.8	175.4	81.8	0	0	0	0	114.2	L451 K452 F490 V491 C492	C449-L451 VanDerWaalsContact C-N 3.3Å; C449-K452 VanDerWaalsContact O-CB 3.25Å; C449-K452 WeakPolarHBondContact O-CB 3.31Å; C449-K452 PolarHBondContact O-N 3.31Å; C449-F490 WeakPolarHBondContact CA-O 3.48Å; C449-F490 WeakPolarHBondContact CB-O 3.21Å; C449-V491 PolarHBondContact N-O 2.69Å; C449-V491 VanDerWaalsContact N-O 3.11Å; C449-C492 WeakPolarHBondContact CA-SG 3.22Å; C449-C492 HydrophobicContact CB-CB 3.94Å; C449-C492 WeakPolarHBondContact CB-SG 3.25Å; C449-C492 PolarHBondContact N-SG 2.74Å; C449-C492 WeakPolarHBondContact SG-CB 3.47Å; C449-C492 CovalentContact SG-SG 2.03Å; C449-C492 PolarHBondContact SG-SG 2.84Å
450	H	88.3	Confident	91.5	Very high	116 Å²	116	38.2 Å²	38.2	54%	0.537	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-16.3	176.3	-60	-56	0	0	0	112.7	D448 W453	D448-H450 PolarHBondContact O-N 2.96Å; D448-H450 VanDerWaalsContact OD1-CA 3.3Å; D448-H450 WeakPolarHBondContact OD1-CA 3.45Å; D448-H450 VanDerWaalsContact OD1-CB 3.24Å; D448-H450 WeakPolarHBondContact OD1-CB 3.22Å; D448-H450 IonicContact OD1-CG 3.54Å; D448-H450 PolarHBondContact OD1-N 3.29Å; D448-H450 IonicContact OD2-CD2 3.48Å; H450-W453 PolarHBondContact O-NE1 3.25Å; H450-W453 VanDerWaalsContact O-NE1 3.15Å
451	L	91.3	Very high	91.4	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-15.3	171.1	-157.1	72	0	0	0	113.3	I425 L445 C447 D448 C449 W453 L454 F490	I425-L451 HydrophobicContact CB-CD1 4.36Å; L445-L451 HydrophobicContact CB-CD2 4.05Å; L445-L451 HydrophobicContact CD1-CD2 4.22Å; L445-L451 HydrophobicContact CD2-CD1 4.27Å; L445-L451 HydrophobicContact CD2-CD2 4.36Å; L445-L451 HydrophobicContact CG-CD2 4.45Å; C447-L451 HydrophobicContact CB-CD2 4.38Å; D448-L451 PolarHBondContact O-N 2.87Å; D448-L451 VanDerWaalsContact O-N 3.09Å; D448-L451 PolarHBondContact OD1-N 2.67Å; D448-L451 VanDerWaalsContact OD1-N 3.14Å; C449-L451 VanDerWaalsContact C-N 3.3Å; L451-W453 VanDerWaalsContact C-N 3.27Å; L451-W453 PolarHBondContact O-N 3.25Å; L451-W453 VanDerWaalsContact O-N 3.1Å; L451-L454 HydrophobicContact CD1-CB 4.43Å; L451-L454 HydrophobicContact CD1-CD2 3.76Å; L451-L454 HydrophobicContact CG-CB 4.4Å; L451-L454 HydrophobicContact CG-CD2 4.16Å; L451-L454 VanDerWaalsContact O-CB 3.22Å; L451-L454 WeakPolarHBondContact O-CB 3.28Å; L451-L454 PolarHBondContact O-N 3.15Å; L451-F490 HydrophobicContact CB-CD1 4.43Å
452	K	91.3	Very high	91.4	Very high	87 Å²	87	44.7 Å²	44.7	38%	0.378	24%	0.235	S	C	.	.	H	α-helix	trans	-50.4	-38.8	-174.3	-177.5	169.5	171.5	156.1	0	115.1	C449 L454 L487 F490	C449-K452 VanDerWaalsContact O-CB 3.25Å; C449-K452 WeakPolarHBondContact O-CB 3.31Å; C449-K452 PolarHBondContact O-N 3.31Å; K452-L454 VanDerWaalsContact C-N 3.25Å; K452-L454 PolarHBondContact O-N 3.06Å; K452-L487 WeakPolarHBondContact CE-O 3.34Å; K452-L487 HydrophobicContact CG-CD2 4.01Å; K452-L487 PolarHBondContact NZ-O 2.99Å; K452-F490 HydrophobicContact CB-CB 3.78Å; K452-F490 HydrophobicContact CB-CG 4.13Å; K452-F490 HydrophobicContact CD-CB 4.24Å; K452-F490 HydrophobicContact CG-CB 4.14Å; K452-F490 HydrophobicContact CG-CG 4.47Å
453	W	93.3	Very high	91.4	Very high	33 Å²	33	44.9 Å²	44.9	13%	0.125	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-31.7	178.7	73.1	-81.3	0	0	0	112.7	I425 Q426 E427 F430 H450 L451 L455 Q456 W457	I425-W453 HydrophobicContact CB-CZ2 4.34Å; I425-W453 HydrophobicContact CG2-CH2 4.23Å; I425-W453 HydrophobicContact CG2-CZ2 3.72Å; I425-W453 PolarHBondContact O-NE1 2.91Å; Q426-W453 WeakPolarHBondContact O-CZ2 3.42Å; E427-W453 HydrophobicContact CB-CG 4.31Å; E427-W453 HydrophobicContact CG-CB 4.03Å; E427-W453 HydrophobicContact CG-CD2 4.29Å; E427-W453 HydrophobicContact CG-CG 3.77Å; F430-W453 AromaticContact CD2-CH2 3.74Å; F430-W453 HydrophobicContact CD2-CH2 3.74Å; F430-W453 HydrophobicContact CD2-CZ3 4.29Å; F430-W453 HydrophobicContact CE2-CH2 4.02Å; H450-W453 PolarHBondContact O-NE1 3.25Å; H450-W453 VanDerWaalsContact O-NE1 3.15Å; L451-W453 VanDerWaalsContact C-N 3.27Å; L451-W453 PolarHBondContact O-N 3.25Å; L451-W453 VanDerWaalsContact O-N 3.1Å; W453-L455 PolarHBondContact O-N 2.79Å; W453-Q456 PolarHBondContact O-N 3.33Å; W453-W457 HydrophobicContact CE3-CB 3.93Å; W453-W457 HydrophobicContact CE3-CG 4.25Å; W453-W457 HydrophobicContact CZ3-CB 4.04Å; W453-W457 HydrophobicContact CZ3-CD2 4.22Å; W453-W457 AromaticContact CZ3-CG 3.92Å; W453-W457 HydrophobicContact CZ3-CG 3.92Å; W453-W457 WeakPolarHBondContact O-CB 3.32Å; W453-W457 PolarHBondContact O-N 2.85Å
454	L	93.6	Very high	91.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-40.2	-173.4	-177.8	65.6	0	0	0	111	I425 F430 L451 K452 W457 L458 I482	I425-L454 HydrophobicContact CD1-CD2 4Å; F430-L454 HydrophobicContact CE2-CD1 3.93Å; L451-L454 HydrophobicContact CD1-CB 4.43Å; L451-L454 HydrophobicContact CD1-CD2 3.76Å; L451-L454 HydrophobicContact CG-CB 4.4Å; L451-L454 HydrophobicContact CG-CD2 4.16Å; L451-L454 VanDerWaalsContact O-CB 3.22Å; L451-L454 WeakPolarHBondContact O-CB 3.28Å; L451-L454 PolarHBondContact O-N 3.15Å; K452-L454 VanDerWaalsContact C-N 3.25Å; K452-L454 PolarHBondContact O-N 3.06Å; L454-W457 HydrophobicContact CD1-CE3 4.28Å; L454-W457 PolarHBondContact O-N 3.38Å; L454-L458 HydrophobicContact CD1-CD1 4.33Å; L454-L458 HydrophobicContact CD1-CG 4.2Å; L454-L458 HydrophobicContact CG-CD1 3.99Å; L454-L458 HydrophobicContact CG-CG 4.3Å; L454-L458 WeakPolarHBondContact O-CB 3.14Å; L454-L458 WeakPolarHBondContact O-CG 3.35Å; L454-L458 PolarHBondContact O-N 2.81Å; L454-I482 HydrophobicContact CD2-CD1 3.92Å; L454-I482 HydrophobicContact CG-CD1 4.22Å
455	L	91.5	Very high	90.5	Very high	7 Å²	7	51.6 Å²	51.6	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-58.5	-50.3	175.5	173.4	55.8	0	0	0	110.9	W453 L458 I459 I482 L483 V485 L487 F490	W453-L455 PolarHBondContact O-N 2.79Å; L455-L458 PolarHBondContact O-N 2.85Å; L455-I459 HydrophobicContact CD1-CD1 3.84Å; L455-I459 HydrophobicContact CD1-CG1 4.43Å; L455-I459 HydrophobicContact CG-CD1 4.15Å; L455-I459 WeakPolarHBondContact O-CD1 3.38Å; L455-I459 VanDerWaalsContact O-CG1 3.29Å; L455-I459 WeakPolarHBondContact O-CG1 3.42Å; L455-I459 PolarHBondContact O-N 2.87Å; L455-I459 VanDerWaalsContact O-N 3.15Å; L455-I482 WeakPolarHBondContact CD1-O 3.2Å; L455-L483 HydrophobicContact CD1-CD2 3.97Å; L455-V485 WeakPolarHBondContact CD2-O 3.37Å; L455-L487 HydrophobicContact CB-CD2 4.45Å; L455-L487 HydrophobicContact CD2-CD2 3.88Å; L455-L487 HydrophobicContact CD2-CG 4.19Å; L455-L487 HydrophobicContact CG-CD2 4.31Å; L455-F490 HydrophobicContact CB-CZ 4.45Å; L455-F490 HydrophobicContact CD2-CE2 3.72Å; L455-F490 HydrophobicContact CD2-CZ 4.08Å
456	Q	90	Very high	89.9	Confident	76 Å²	76	53.8 Å²	53.8	36%	0.355	27%	0.268	S	S	.	.	H	α-helix	trans	-63	-45.5	178.3	-171	62.2	57.4	0	0	111.3	W453 L458 I459 D460	W453-Q456 PolarHBondContact O-N 3.33Å; Q456-L458 PolarHBondContact O-N 3.04Å; Q456-I459 WeakPolarHBondContact O-CB 3.4Å; Q456-I459 PolarHBondContact O-N 2.82Å; Q456-I459 VanDerWaalsContact O-N 3.12Å; Q456-D460 PolarHBondContact NE2-OD1 3.23Å; Q456-D460 PolarHBondContact NE2-OD2 3.02Å; Q456-D460 PolarHBondContact O-N 3.1Å
457	W	92.8	Very high	89.9	Confident	39 Å²	39	53.8 Å²	53.8	15%	0.148	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-38.9	180	-178	90	0	0	0	113.1	F430 L435 L438 W453 L454 I459 D460 N461 F463	F430-W457 HydrophobicContact CB-CH2 3.79Å; F430-W457 HydrophobicContact CB-CZ2 3.48Å; F430-W457 VanDerWaalsContact CB-CZ2 3.48Å; F430-W457 HydrophobicContact CD2-CD2 4.4Å; F430-W457 HydrophobicContact CD2-CE3 4.02Å; F430-W457 AromaticContact CD2-CH2 3.65Å; F430-W457 HydrophobicContact CD2-CH2 3.65Å; F430-W457 HydrophobicContact CD2-CZ2 4.05Å; F430-W457 AromaticContact CD2-CZ3 3.63Å; F430-W457 HydrophobicContact CD2-CZ3 3.63Å; F430-W457 HydrophobicContact CE2-CZ3 4.18Å; F430-W457 AromaticContact CG-CH2 3.9Å; F430-W457 HydrophobicContact CG-CH2 3.9Å; F430-W457 HydrophobicContact CG-CZ2 4.1Å; F430-W457 HydrophobicContact CG-CZ3 4.35Å; L435-W457 HydrophobicContact CD1-CH2 4.21Å; L438-W457 HydrophobicContact CD2-CH2 4.07Å; L438-W457 HydrophobicContact CD2-CZ3 3.7Å; W453-W457 HydrophobicContact CE3-CB 3.93Å; W453-W457 HydrophobicContact CE3-CG 4.25Å; W453-W457 HydrophobicContact CZ3-CB 4.04Å; W453-W457 HydrophobicContact CZ3-CD2 4.22Å; W453-W457 AromaticContact CZ3-CG 3.92Å; W453-W457 HydrophobicContact CZ3-CG 3.92Å; W453-W457 WeakPolarHBondContact O-CB 3.32Å; W453-W457 PolarHBondContact O-N 2.85Å; L454-W457 HydrophobicContact CD1-CE3 4.28Å; L454-W457 PolarHBondContact O-N 3.38Å; W457-I459 VanDerWaalsContact C-N 3.3Å; W457-I459 PolarHBondContact O-N 3.44Å; W457-D460 PolarHBondContact O-N 2.79Å; W457-N461 PolarHBondContact NE1-ND2 2.95Å; W457-N461 WeakPolarHBondContact O-CB 3.43Å; W457-N461 PolarHBondContact O-N 3.16Å; W457-N461 VanDerWaalsContact O-N 3.09Å; W457-N461 PolarHBondContact O-ND2 2.8Å; W457-F463 HydrophobicContact CE3-CD2 4.41Å; W457-F463 AromaticContact CH2-CD2 3.69Å; W457-F463 HydrophobicContact CH2-CD2 3.69Å; W457-F463 AromaticContact CH2-CE2 3.46Å; W457-F463 HydrophobicContact CH2-CE2 3.46Å; W457-F463 VanDerWaalsContact CH2-CE2 3.46Å; W457-F463 HydrophobicContact CZ2-CD2 4.49Å; W457-F463 HydrophobicContact CZ2-CE2 4.03Å; W457-F463 AromaticContact CZ3-CD2 3.64Å; W457-F463 HydrophobicContact CZ3-CD2 3.64Å; W457-F463 AromaticContact CZ3-CE2 3.94Å; W457-F463 HydrophobicContact CZ3-CE2 3.94Å
458	L	92.3	Very high	89.8	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-65.7	-32.8	174.1	-72.5	171.2	0	0	0	112.3	L438 L454 L455 Q456 N462 F463 V467 I482	L438-L458 HydrophobicContact CD2-CD2 4.14Å; L454-L458 HydrophobicContact CD1-CD1 4.33Å; L454-L458 HydrophobicContact CD1-CG 4.2Å; L454-L458 HydrophobicContact CG-CD1 3.99Å; L454-L458 HydrophobicContact CG-CG 4.3Å; L454-L458 WeakPolarHBondContact O-CB 3.14Å; L454-L458 WeakPolarHBondContact O-CG 3.35Å; L454-L458 PolarHBondContact O-N 2.81Å; L455-L458 PolarHBondContact O-N 2.85Å; Q456-L458 PolarHBondContact O-N 3.04Å; L458-N462 PolarHBondContact O-N 3.38Å; L458-F463 HydrophobicContact CD2-CB 3.58Å; L458-F463 HydrophobicContact CD2-CD2 4.41Å; L458-F463 HydrophobicContact CD2-CG 4.41Å; L458-F463 PolarHBondContact O-N 2.9Å; L458-V467 HydrophobicContact CD1-CG1 4.21Å; L458-V467 HydrophobicContact CD2-CB 4.35Å; L458-V467 HydrophobicContact CD2-CG1 4.32Å; L458-V467 HydrophobicContact CD2-CG2 3.9Å; L458-I482 HydrophobicContact CD1-CD1 4.08Å
459	I	89.8	Confident	90	Very high	65 Å²	65	57.3 Å²	57.3	33%	0.333	29%	0.288	S	S	.	.	H	α-helix	trans	-70.1	-53.5	174.6	-69.2	163.9	0	0	0	110	L455 Q456 W457 N461 N462 Q464	L455-I459 HydrophobicContact CD1-CD1 3.84Å; L455-I459 HydrophobicContact CD1-CG1 4.43Å; L455-I459 HydrophobicContact CG-CD1 4.15Å; L455-I459 WeakPolarHBondContact O-CD1 3.38Å; L455-I459 VanDerWaalsContact O-CG1 3.29Å; L455-I459 WeakPolarHBondContact O-CG1 3.42Å; L455-I459 PolarHBondContact O-N 2.87Å; L455-I459 VanDerWaalsContact O-N 3.15Å; Q456-I459 WeakPolarHBondContact O-CB 3.4Å; Q456-I459 PolarHBondContact O-N 2.82Å; Q456-I459 VanDerWaalsContact O-N 3.12Å; W457-I459 VanDerWaalsContact C-N 3.3Å; W457-I459 PolarHBondContact O-N 3.44Å; I459-N461 PolarHBondContact O-N 2.82Å; I459-N462 PolarHBondContact O-N 3.35Å; I459-Q464 HydrophobicContact CG1-CG 4.46Å
460	D	91.6	Very high	90.2	Very high	102 Å²	102	56.2 Å²	56.2	55%	0.545	28%	0.28	S	S	.	.	H	α-helix	trans	-62.1	-31.5	-174.8	-64.2	-18.2	0	0	0	112.6	Q456 W457	Q456-D460 PolarHBondContact NE2-OD1 3.23Å; Q456-D460 PolarHBondContact NE2-OD2 3.02Å; Q456-D460 PolarHBondContact O-N 3.1Å; W457-D460 PolarHBondContact O-N 2.79Å
461	N	91.4	Very high	90.5	Very high	72 Å²	72	50.7 Å²	50.7	39%	0.385	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	7.7	178.7	-62.7	-88.4	0	0	0	113.8	W457 I459 F463	W457-N461 PolarHBondContact NE1-ND2 2.95Å; W457-N461 WeakPolarHBondContact O-CB 3.43Å; W457-N461 PolarHBondContact O-N 3.16Å; W457-N461 VanDerWaalsContact O-N 3.09Å; W457-N461 PolarHBondContact O-ND2 2.8Å; I459-N461 PolarHBondContact O-N 2.82Å; N461-F463 VanDerWaalsContact C-N 3.3Å; N461-F463 HydrophobicContact CB-CD2 3.6Å; N461-F463 HydrophobicContact CB-CE2 3.52Å; N461-F463 HydrophobicContact CB-CZ 4.46Å; N461-F463 PolarHBondContact O-N 2.89Å
462	N	91.8	Very high	90.6	Very high	130 Å²	130	52 Å²	52	70%	0.695	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	23.2	177.8	-57.6	-83.7	0	0	0	116.3	L458 I459 Q464	L458-N462 PolarHBondContact O-N 3.38Å; I459-N462 PolarHBondContact O-N 3.35Å; N462-Q464 PolarHBondContact O-N 3.44Å
463	F	92.2	Very high	90.4	Very high	10 Å²	10	49.4 Å²	49.4	4%	0.044	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-78.2	4.3	179.4	-69.2	-54.2	0	0	0	114.9	L435 L438 W457 L458 N461 H465 S466 V467	L435-F463 HydrophobicContact CB-CE2 4.37Å; L435-F463 HydrophobicContact CB-CZ 3.83Å; L438-F463 HydrophobicContact CB-CD1 3.96Å; L438-F463 HydrophobicContact CB-CD2 4.4Å; L438-F463 HydrophobicContact CB-CE1 4.02Å; L438-F463 HydrophobicContact CB-CE2 4.43Å; L438-F463 HydrophobicContact CB-CG 4.18Å; L438-F463 HydrophobicContact CB-CZ 4.26Å; W457-F463 HydrophobicContact CE3-CD2 4.41Å; W457-F463 AromaticContact CH2-CD2 3.69Å; W457-F463 HydrophobicContact CH2-CD2 3.69Å; W457-F463 AromaticContact CH2-CE2 3.46Å; W457-F463 HydrophobicContact CH2-CE2 3.46Å; W457-F463 VanDerWaalsContact CH2-CE2 3.46Å; W457-F463 HydrophobicContact CZ2-CD2 4.49Å; W457-F463 HydrophobicContact CZ2-CE2 4.03Å; W457-F463 AromaticContact CZ3-CD2 3.64Å; W457-F463 HydrophobicContact CZ3-CD2 3.64Å; W457-F463 AromaticContact CZ3-CE2 3.94Å; W457-F463 HydrophobicContact CZ3-CE2 3.94Å; L458-F463 HydrophobicContact CD2-CB 3.58Å; L458-F463 HydrophobicContact CD2-CD2 4.41Å; L458-F463 HydrophobicContact CD2-CG 4.41Å; L458-F463 PolarHBondContact O-N 2.9Å; N461-F463 VanDerWaalsContact C-N 3.3Å; N461-F463 HydrophobicContact CB-CD2 3.6Å; N461-F463 HydrophobicContact CB-CE2 3.52Å; N461-F463 HydrophobicContact CB-CZ 4.46Å; N461-F463 PolarHBondContact O-N 2.89Å; F463-H465 PolarHBondContact O-N 2.88Å; F463-S466 PolarHBondContact O-N 2.82Å; F463-S466 VanDerWaalsContact O-N 3.14Å; F463-S466 PolarHBondContact O-OG 3.26Å; F463-V467 HydrophobicContact CB-CG2 4.17Å; F463-V467 PolarHBondContact O-N 3.29Å
464	Q	85.3	Confident	90.2	Very high	77 Å²	77	49.4 Å²	49.4	36%	0.36	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-53.7	-16.7	-178.7	-56	176.1	16.3	0	0	115.3	I459 N462 L483	I459-Q464 HydrophobicContact CG1-CG 4.46Å; N462-Q464 PolarHBondContact O-N 3.44Å; Q464-L483 HydrophobicContact CB-CD1 4.44Å
465	H	81.2	Confident	90	Very high	181 Å²	181	57.5 Å²	57.5	84%	0.838	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-113.1	-12.3	-177.2	-59.5	-29.5	0	0	0	114.5	F463	F463-H465 PolarHBondContact O-N 2.88Å
466	S	80	Confident	89.9	Confident	45 Å²	45	64.3 Å²	64.3	32%	0.315	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-7.8	177.3	65	0	0	0	0	113.3	L438 F463	L438-S466 VanDerWaalsContact O-CB 3.25Å; L438-S466 WeakPolarHBondContact O-CB 3.1Å; L438-S466 PolarHBondContact O-OG 2.9Å; F463-S466 PolarHBondContact O-N 2.82Å; F463-S466 VanDerWaalsContact O-N 3.14Å; F463-S466 PolarHBondContact O-OG 3.26Å
467	V	89.4	Confident	90	Very high	11 Å²	11	60.8 Å²	60.8	7%	0.067	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	130.2	-174.3	176.5	0	0	0	0	109.8	L438 L440 L458 F463 V469	L438-V467 HydrophobicContact CB-CG2 4.5Å; L438-V467 HydrophobicContact CD2-CG2 4.12Å; L438-V467 HydrophobicContact CG-CG2 4.07Å; L440-V467 HydrophobicContact CB-CG1 4.12Å; L440-V467 HydrophobicContact CB-CG2 4.22Å; L440-V467 HydrophobicContact CD2-CG1 4.28Å; L440-V467 HydrophobicContact CG-CG1 4.36Å; L440-V467 CarbonylContact O-C 3.55Å; L440-V467 WeakPolarHBondContact O-CA 3.46Å; L458-V467 HydrophobicContact CD1-CG1 4.21Å; L458-V467 HydrophobicContact CD2-CB 4.35Å; L458-V467 HydrophobicContact CD2-CG1 4.32Å; L458-V467 HydrophobicContact CD2-CG2 3.9Å; F463-V467 HydrophobicContact CB-CG2 4.17Å; F463-V467 PolarHBondContact O-N 3.29Å; V467-V469 HydrophobicContact CG1-CB 4.21Å; V467-V469 HydrophobicContact CG1-CG1 3.54Å; V467-V469 HydrophobicContact CG1-CG2 3.71Å
468	N	91.1	Very high	90	Very high	102 Å²	102	61.5 Å²	61.5	55%	0.545	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	92	175.9	177.4	65.1	0	0	0	109.5	L440 N441 T442	L440-N468 PolarHBondContact O-N 3.35Å; N441-N468 VanDerWaalsContact CA-O 3.31Å; N441-N468 WeakPolarHBondContact CA-O 3.3Å; N441-N468 PolarHBondContact OD1-ND2 2.94Å; N441-N468 PolarHBondContact OD1-O 2.93Å; N441-N468 VanDerWaalsContact OD1-O 3.05Å; T442-N468 PolarHBondContact N-O 2.66Å
469	V	93	Very high	90	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.006	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133.7	-171.3	-69.4	0	0	0	0	112.2	L440 T442 L445 V467 S481 I482	L440-V469 HydrophobicContact CD2-CG1 3.93Å; L440-V469 HydrophobicContact CG-CG1 3.79Å; T442-V469 HydrophobicContact CG2-CG1 3.81Å; T442-V469 WeakPolarHBondContact O-CA 3.22Å; L445-V469 HydrophobicContact CD1-CB 3.71Å; L445-V469 HydrophobicContact CD1-CG1 4.17Å; L445-V469 HydrophobicContact CD1-CG2 4.45Å; V467-V469 HydrophobicContact CG1-CB 4.21Å; V467-V469 HydrophobicContact CG1-CG1 3.54Å; V467-V469 HydrophobicContact CG1-CG2 3.71Å; V469-S481 VanDerWaalsContact O-CA 3.24Å; V469-S481 WeakPolarHBondContact O-CA 3.27Å; V469-S481 PolarHBondContact O-OG 2.76Å; V469-S481 VanDerWaalsContact O-OG 3.09Å; V469-I482 HydrophobicContact CG2-CD1 3.6Å; V469-I482 HydrophobicContact CG2-CG1 3.73Å; V469-I482 HydrophobicContact CG2-CG2 4.18Å; V469-I482 PolarHBondContact O-N 3.14Å; V469-I482 VanDerWaalsContact O-N 3.07Å
470	S	94.2	Very high	90.3	Very high	23 Å²	23	65.4 Å²	65.4	16%	0.161	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	150.7	178.3	69.7	0	0	0	0	112.6	T442 S443 Q480	T442-S470 PolarHBondContact O-N 3.18Å; T442-S470 VanDerWaalsContact O-N 3.08Å; S443-S470 CarbonylContact C-O 3.52Å; S443-S470 WeakPolarHBondContact CA-OG 3.25Å; S443-S470 VanDerWaalsContact CB-OG 3.31Å; S443-S470 WeakPolarHBondContact CB-OG 3.3Å; S470-Q480 CarbonylContact C-O 3.45Å; S470-Q480 WeakPolarHBondContact CA-O 3.49Å; S470-Q480 WeakPolarHBondContact CB-O 3.33Å
471	C	94.3	Very high	90.4	Very high	1 Å²	1	62 Å²	62	1%	0.007	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	140	175.2	-49.3	0	0	0	0	110.8	L445 C447 L477 A478 G479 Q480	L445-C471 CarbonylContact O-C 3.57Å; L445-C471 WeakPolarHBondContact O-CA 3.24Å; C447-C471 HydrophobicContact CB-CB 3.82Å; C447-C471 WeakPolarHBondContact CB-SG 3.34Å; C447-C471 VanDerWaalsContact SG-CA 3.55Å; C447-C471 WeakPolarHBondContact SG-CB 3.47Å; C447-C471 CovalentContact SG-SG 2.03Å; C447-C471 PolarHBondContact SG-SG 2.75Å; C471-L477 HydrophobicContact CB-CB 3.88Å; C471-L477 WeakPolarHBondContact CB-O 3.43Å; C471-A478 WeakPolarHBondContact O-CA 3.29Å; C471-G479 PolarHBondContact O-N 2.86Å; C471-Q480 PolarHBondContact N-O 2.76Å
472	A	92.8	Very high	90.5	Very high	29 Å²	29	58.6 Å²	58.6	24%	0.24	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-36	158.1	0	0	0	0	0	111	L445 A478	L445-A472 PolarHBondContact O-N 2.86Å; A472-A478 WeakPolarHBondContact O-CB 3.45Å
473	H	88.1	Confident	90.5	Very high	32 Å²	32	55.1 Å²	55.1	15%	0.148	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	154.5	-178.7	-61.8	-68.1	0	0	0	111	L445 L446 C447 H585 F586	L445-H473 PolarHBondContact O-N 2.67Å; L446-H473 HydrophobicContact CD1-CB 3.68Å; C447-H473 PolarHBondContact N-O 2.9Å; H473-H585 AromaticContact NE2-CD2 3.92Å; H473-H585 AromaticContact NE2-NE2 3.9Å; H473-F586 HydrophobicContact CB-CE1 4.34Å; H473-F586 AromaticContact CD2-CD1 3.88Å; H473-F586 AromaticContact CD2-CE1 3.79Å; H473-F586 AromaticContact CE1-CE1 3.9Å; H473-F586 AromaticContact CG-CE1 3.74Å; H473-F586 AromaticContact ND1-CE1 3.81Å; H473-F586 AromaticContact NE2-CE1 3.91Å
474	P	88.9	Confident	90.4	Very high	34 Å²	34	61 Å²	61	22%	0.221	33%	0.333	C	S	.	.	S	Bend	cis	-64.1	161.7	-9	30.2	-37.9	0	0	0	112.5	W476 L477 A478	P474-W476 HydrophobicContact CG-CD2 4.28Å; P474-W476 HydrophobicContact CG-CZ2 3.82Å; P474-W476 PolarHBondContact O-N 2.84Å; P474-W476 VanDerWaalsContact O-N 3.08Å; P474-L477 HydrophobicContact CG-CB 4.49Å; P474-L477 HydrophobicContact CG-CD1 4.27Å; P474-L477 HydrophobicContact CG-CG 4.31Å; P474-L477 PolarHBondContact O-N 2.85Å; P474-A478 PolarHBondContact O-N 3.09Å
475	E	87.6	Confident	90.8	Very high	169 Å²	169	57.7 Å²	57.7	79%	0.79	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-56.6	-31.3	-169	-62.4	-169.6	150.5	0	0	114.3	L477 A478	E475-L477 VanDerWaalsContact C-N 3.29Å; E475-L477 PolarHBondContact O-N 2.91Å; E475-A478 WeakPolarHBondContact O-CB 3.46Å; E475-A478 PolarHBondContact O-N 3.28Å; E475-A478 VanDerWaalsContact O-N 3.14Å
476	W	89.8	Confident	91.2	Very high	151 Å²	151	53.3 Å²	53.3	57%	0.572	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-74.5	-15.6	178.5	56.4	-89.2	0	0	0	113.9	P474 Q480 D489	P474-W476 HydrophobicContact CG-CD2 4.28Å; P474-W476 HydrophobicContact CG-CZ2 3.82Å; P474-W476 PolarHBondContact O-N 2.84Å; P474-W476 VanDerWaalsContact O-N 3.08Å; W476-Q480 PolarHBondContact O-NE2 2.79Å; W476-D489 HydrophobicContact CH2-CB 3.75Å; W476-D489 WeakPolarHBondContact CH2-O 3.33Å; W476-D489 HydrophobicContact CZ3-CB 3.99Å
477	L	92.5	Very high	91.7	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.01	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-96.4	-4.1	167.7	-67.2	-175.8	0	0	0	113	C447 C471 P474 E475 G479 Q480 V485	C447-L477 HydrophobicContact CB-CD1 3.9Å; C471-L477 HydrophobicContact CB-CB 3.88Å; C471-L477 WeakPolarHBondContact CB-O 3.43Å; P474-L477 HydrophobicContact CG-CB 4.49Å; P474-L477 HydrophobicContact CG-CD1 4.27Å; P474-L477 HydrophobicContact CG-CG 4.31Å; P474-L477 PolarHBondContact O-N 2.85Å; E475-L477 VanDerWaalsContact C-N 3.29Å; E475-L477 PolarHBondContact O-N 2.91Å; L477-G479 PolarHBondContact O-N 3.01Å; L477-Q480 VanDerWaalsContact O-CB 3.26Å; L477-Q480 WeakPolarHBondContact O-CB 3.36Å; L477-Q480 WeakPolarHBondContact O-CG 3.36Å; L477-Q480 PolarHBondContact O-N 2.82Å; L477-V485 HydrophobicContact CD1-CG1 3.89Å; L477-V485 HydrophobicContact CD2-CG1 3.98Å; L477-V485 HydrophobicContact CD2-CG2 4.08Å
478	A	93.2	Very high	91.7	Very high	54 Å²	54	60.4 Å²	60.4	45%	0.446	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	129.6	-173.1	0	0	0	0	0	112.7	C471 A472 P474 E475 Q480	C471-A478 WeakPolarHBondContact O-CA 3.29Å; A472-A478 WeakPolarHBondContact O-CB 3.45Å; P474-A478 PolarHBondContact O-N 3.09Å; E475-A478 WeakPolarHBondContact O-CB 3.46Å; E475-A478 PolarHBondContact O-N 3.28Å; E475-A478 VanDerWaalsContact O-N 3.14Å; A478-Q480 PolarHBondContact O-N 2.65Å
479	G	93.1	Very high	91.7	Very high	64 Å²	64	57.6 Å²	57.6	66%	0.66	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	-7.1	-176.7	0	0	0	0	0	115.3	C471 L477	C471-G479 PolarHBondContact O-N 2.86Å; L477-G479 PolarHBondContact O-N 3.01Å
480	Q	94.3	Very high	91.6	Very high	84 Å²	84	57.8 Å²	57.8	39%	0.393	31%	0.314	S	S	.	.			trans	-76.9	134.4	175.4	-56.3	-165.9	47.3	0	0	110.7	S470 C471 W476 L477 A478 V485	S470-Q480 CarbonylContact C-O 3.45Å; S470-Q480 WeakPolarHBondContact CA-O 3.49Å; S470-Q480 WeakPolarHBondContact CB-O 3.33Å; C471-Q480 PolarHBondContact N-O 2.76Å; W476-Q480 PolarHBondContact O-NE2 2.79Å; L477-Q480 VanDerWaalsContact O-CB 3.26Å; L477-Q480 WeakPolarHBondContact O-CB 3.36Å; L477-Q480 WeakPolarHBondContact O-CG 3.36Å; L477-Q480 PolarHBondContact O-N 2.82Å; A478-Q480 PolarHBondContact O-N 2.65Å; Q480-V485 HydrophobicContact CB-CG2 4.33Å
481	S	93.8	Very high	91.4	Very high	30 Å²	30	59.7 Å²	59.7	21%	0.21	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-68.9	135.2	171.8	-179.3	0	0	0	0	110.3	V469 L483 N484	V469-S481 VanDerWaalsContact O-CA 3.24Å; V469-S481 WeakPolarHBondContact O-CA 3.27Å; V469-S481 PolarHBondContact O-OG 2.76Å; V469-S481 VanDerWaalsContact O-OG 3.09Å; S481-L483 PolarHBondContact O-N 2.79Å; S481-L483 VanDerWaalsContact O-N 3.09Å; S481-N484 PolarHBondContact O-N 3.47Å
482	I	93.9	Very high	90.8	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-62.6	-24.3	-175.3	90	-177.2	0	0	0	112.1	L445 L454 L455 L458 V469 N484 V485 F490	L445-I482 HydrophobicContact CD1-CG2 4.24Å; L454-I482 HydrophobicContact CD2-CD1 3.92Å; L454-I482 HydrophobicContact CG-CD1 4.22Å; L455-I482 WeakPolarHBondContact CD1-O 3.2Å; L458-I482 HydrophobicContact CD1-CD1 4.08Å; V469-I482 HydrophobicContact CG2-CD1 3.6Å; V469-I482 HydrophobicContact CG2-CG1 3.73Å; V469-I482 HydrophobicContact CG2-CG2 4.18Å; V469-I482 PolarHBondContact O-N 3.14Å; V469-I482 VanDerWaalsContact O-N 3.07Å; I482-N484 PolarHBondContact O-N 3.33Å; I482-V485 PolarHBondContact O-N 3.04Å; I482-F490 HydrophobicContact CB-CZ 4.35Å
483	L	91.2	Very high	89.8	Confident	58 Å²	58	67.3 Å²	67.3	30%	0.304	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-64.6	-15.3	175.2	-59.6	178.7	0	0	0	113.5	L455 Q464 S481	L455-L483 HydrophobicContact CD1-CD2 3.97Å; Q464-L483 HydrophobicContact CB-CD1 4.44Å; S481-L483 PolarHBondContact O-N 2.79Å; S481-L483 VanDerWaalsContact O-N 3.09Å
484	N	91.9	Very high	89.2	Confident	132 Å²	132	70.1 Å²	70.1	71%	0.706	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-108.3	1.1	179.4	-60.8	-21.8	0	0	0	113.1	S481 I482	S481-N484 PolarHBondContact O-N 3.47Å; I482-N484 PolarHBondContact O-N 3.33Å
485	V	92.2	Very high	88.8	Confident	8 Å²	8	71.3 Å²	71.3	5%	0.048	38%	0.382	C	S	.	.	S	Bend	trans	-93.8	133.4	-177.2	179.2	0	0	0	0	110	L455 L477 Q480 I482 D489 F490	L455-V485 WeakPolarHBondContact CD2-O 3.37Å; L477-V485 HydrophobicContact CD1-CG1 3.89Å; L477-V485 HydrophobicContact CD2-CG1 3.98Å; L477-V485 HydrophobicContact CD2-CG2 4.08Å; Q480-V485 HydrophobicContact CB-CG2 4.33Å; I482-V485 PolarHBondContact O-N 3.04Å; V485-D489 HydrophobicContact CG1-CB 3.94Å; V485-F490 HydrophobicContact CB-CE2 3.87Å; V485-F490 HydrophobicContact CB-CZ 3.92Å; V485-F490 HydrophobicContact CG1-CD2 4.08Å; V485-F490 HydrophobicContact CG1-CE2 3.54Å; V485-F490 HydrophobicContact CG1-CZ 3.84Å
486	D	91	Very high	88.7	Confident	89 Å²	89	65.2 Å²	65.2	48%	0.476	36%	0.355	S	S	.	.			trans	-67.4	139.8	178.8	-93.4	-28.4	0	0	0	111.3	K488 D489 F490	D486-K488 HydrophobicContact CB-CD 3.94Å; D486-K488 HydrophobicContact CB-CG 3.99Å; D486-K488 PolarHBondContact O-N 2.85Å; D486-K488 WeakPolarHBondContact OD2-CE 3.36Å; D486-K488 IonicContact OD2-NZ 2.65Å; D486-K488 PolarHBondContact OD2-NZ 2.81Å; D486-D489 WeakPolarHBondContact O-CB 3.46Å; D486-D489 PolarHBondContact O-N 2.79Å; D486-F490 WeakPolarHBondContact O-CD2 3.41Å
487	L	89.3	Confident	88.5	Confident	67 Å²	67	60 Å²	60	35%	0.351	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-8.2	177.7	-76.4	169.5	0	0	0	114.9	K452 L455	K452-L487 WeakPolarHBondContact CE-O 3.34Å; K452-L487 HydrophobicContact CG-CD2 4.01Å; K452-L487 PolarHBondContact NZ-O 2.99Å; L455-L487 HydrophobicContact CB-CD2 4.45Å; L455-L487 HydrophobicContact CD2-CD2 3.88Å; L455-L487 HydrophobicContact CD2-CG 4.19Å; L455-L487 HydrophobicContact CG-CD2 4.31Å
488	K	89.9	Confident	88.4	Confident	138 Å²	138	60 Å²	60	60%	0.6	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-22.3	174.7	81.3	-155.1	179.2	-157.6	0	112.9	D486	D486-K488 HydrophobicContact CB-CD 3.94Å; D486-K488 HydrophobicContact CB-CG 3.99Å; D486-K488 PolarHBondContact O-N 2.85Å; D486-K488 WeakPolarHBondContact OD2-CE 3.36Å; D486-K488 IonicContact OD2-NZ 2.65Å; D486-K488 PolarHBondContact OD2-NZ 2.81Å
489	D	91.6	Very high	88.3	Confident	43 Å²	43	60.3 Å²	60.3	23%	0.23	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-14.6	-168.9	-69.1	-15.3	0	0	0	112.1	W476 V485 D486 V491	W476-D489 HydrophobicContact CH2-CB 3.75Å; W476-D489 WeakPolarHBondContact CH2-O 3.33Å; W476-D489 HydrophobicContact CZ3-CB 3.99Å; V485-D489 HydrophobicContact CG1-CB 3.94Å; D486-D489 WeakPolarHBondContact O-CB 3.46Å; D486-D489 PolarHBondContact O-N 2.79Å; D489-V491 PolarHBondContact O-N 3.48Å
490	F	90.6	Very high	88.3	Confident	6 Å²	6	58.3 Å²	58.3	3%	0.026	30%	0.302	C	S	.	.			trans	-76.9	92	168.6	-63.5	-90.9	0	0	0	110.5	C447 D448 C449 L451 K452 L455 I482 V485 D486	C447-F490 HydrophobicContact CB-CD1 4.14Å; C447-F490 HydrophobicContact CB-CE1 3.94Å; D448-F490 WeakPolarHBondContact O-CD1 3.27Å; C449-F490 WeakPolarHBondContact CA-O 3.48Å; C449-F490 WeakPolarHBondContact CB-O 3.21Å; L451-F490 HydrophobicContact CB-CD1 4.43Å; K452-F490 HydrophobicContact CB-CB 3.78Å; K452-F490 HydrophobicContact CB-CG 4.13Å; K452-F490 HydrophobicContact CD-CB 4.24Å; K452-F490 HydrophobicContact CG-CB 4.14Å; K452-F490 HydrophobicContact CG-CG 4.47Å; L455-F490 HydrophobicContact CB-CZ 4.45Å; L455-F490 HydrophobicContact CD2-CE2 3.72Å; L455-F490 HydrophobicContact CD2-CZ 4.08Å; I482-F490 HydrophobicContact CB-CZ 4.35Å; V485-F490 HydrophobicContact CB-CE2 3.87Å; V485-F490 HydrophobicContact CB-CZ 3.92Å; V485-F490 HydrophobicContact CG1-CD2 4.08Å; V485-F490 HydrophobicContact CG1-CE2 3.54Å; V485-F490 HydrophobicContact CG1-CZ 3.84Å; D486-F490 WeakPolarHBondContact O-CD2 3.41Å
491	V	88.9	Confident	88.2	Confident	63 Å²	63	61.4 Å²	61.4	38%	0.382	31%	0.31	S	S	.	.			trans	-118.4	155	-176.4	-162.9	0	0	0	0	111	D448 C449 D489 D493	D448-V491 VanDerWaalsContact CA-O 3.32Å; D448-V491 WeakPolarHBondContact CA-O 3.43Å; D448-V491 WeakPolarHBondContact CB-O 3.47Å; C449-V491 PolarHBondContact N-O 2.69Å; C449-V491 VanDerWaalsContact N-O 3.11Å; D489-V491 PolarHBondContact O-N 3.48Å; V491-D493 WeakPolarHBondContact CG1-OD1 3.49Å; V491-D493 WeakPolarHBondContact CG1-OD2 3.43Å
492	C	82.5	Confident	88.3	Confident	44 Å²	44	63 Å²	63	30%	0.297	32%	0.319	S	S	.	.			trans	-124.4	54.6	174	-62.9	0	0	0	0	111.1	C449 D494	C449-C492 WeakPolarHBondContact CA-SG 3.22Å; C449-C492 HydrophobicContact CB-CB 3.94Å; C449-C492 WeakPolarHBondContact CB-SG 3.25Å; C449-C492 PolarHBondContact N-SG 2.74Å; C449-C492 WeakPolarHBondContact SG-CB 3.47Å; C449-C492 CovalentContact SG-SG 2.03Å; C449-C492 PolarHBondContact SG-SG 2.84Å; C492-D494 PolarHBondContact O-N 2.96Å
493	D	70.9	Confident	88.3	Confident	146 Å²	146	66 Å²	66	78%	0.781	33%	0.332	S	S	*	.	S	Bend	trans	-66.5	-24.3	173.5	-62.1	-41.2	0	0	0	111.5	V491	V491-D493 WeakPolarHBondContact CG1-OD1 3.49Å; V491-D493 WeakPolarHBondContact CG1-OD2 3.43Å
494	D	76.6	Confident	88.6	Confident	90 Å²	90	63.6 Å²	63.6	48%	0.481	32%	0.321	S	S	.	.	S	Bend	trans	-122.9	150.5	178.2	-89	-61.2	0	0	0	112.8	C492 L496 S524	C492-D494 PolarHBondContact O-N 2.96Å; D494-L496 HydrophobicContact CB-CD2 3.78Å; D494-L496 HydrophobicContact CB-CG 3.92Å; D494-S524 WeakPolarHBondContact CB-OG 3.32Å; D494-S524 WeakPolarHBondContact OD1-CB 3.48Å; D494-S524 PolarHBondContact OD1-OG 2.82Å
495	F	80.5	Confident	88.8	Confident	59 Å²	59	64.6 Å²	64.6	26%	0.259	32%	0.321	S	S	.	.			trans	-109.4	70.5	171.2	55.1	-77.4	0	0	0	110.3	K497 Q499 V522 S523 S524 A558	F495-K497 VanDerWaalsContact C-N 3.31Å; F495-K497 PolarHBondContact O-N 2.99Å; F495-Q499 HydrophobicContact CB-CG 4.44Å; F495-Q499 HydrophobicContact CD2-CG 4.34Å; F495-V522 HydrophobicContact CD2-CG2 4.32Å; F495-V522 HydrophobicContact CE2-CB 4.04Å; F495-V522 HydrophobicContact CE2-CG2 3.7Å; F495-S523 VanDerWaalsContact CE2-C 3.42Å; F495-S523 VanDerWaalsContact CE2-CA 3.47Å; F495-S523 WeakPolarHBondContact O-CA 3.48Å; F495-S523 PolarHBondContact O-OG 2.86Å; F495-S524 PolarHBondContact N-OG 3.06Å; F495-S524 PolarHBondContact O-N 2.83Å; F495-A558 HydrophobicContact CE2-CB 4.41Å; F495-A558 HydrophobicContact CZ-CB 3.86Å
496	L	85.4	Confident	89	Confident	41 Å²	41	68.7 Å²	68.7	22%	0.215	35%	0.346	C	S	.	.			trans	-64.8	-30.4	-176	-56.7	177.5	0	0	0	113.3	L446 D494 S523 N584 F586	L446-L496 HydrophobicContact CD1-CD1 4.29Å; D494-L496 HydrophobicContact CB-CD2 3.78Å; D494-L496 HydrophobicContact CB-CG 3.92Å; L496-S523 PolarHBondContact O-OG 2.93Å; L496-S523 VanDerWaalsContact O-OG 3.04Å; L496-N584 PolarHBondContact O-ND2 3.16Å; L496-F586 HydrophobicContact CB-CB 4.19Å; L496-F586 HydrophobicContact CB-CD1 3.93Å; L496-F586 HydrophobicContact CB-CD2 3.85Å; L496-F586 HydrophobicContact CB-CE1 4.28Å; L496-F586 HydrophobicContact CB-CE2 4.23Å; L496-F586 HydrophobicContact CB-CG 3.7Å; L496-F586 HydrophobicContact CB-CZ 4.42Å; L496-F586 HydrophobicContact CD1-CD1 4.13Å; L496-F586 HydrophobicContact CD1-CE1 3.85Å; L496-F586 HydrophobicContact CD1-CZ 4.21Å; L496-F586 WeakPolarHBondContact O-CD2 3.3Å
497	K	86.3	Confident	89.1	Confident	43 Å²	43	66.6 Å²	66.6	19%	0.187	34%	0.335	C	S	.	.	S	Bend	trans	-83.8	139.8	173.5	-171.8	176.3	-176.8	-177.3	0	110.5	S424 F495 Q499 F586 S588	S424-K497 PolarHBondContact OG-NZ 3.38Å; F495-K497 VanDerWaalsContact C-N 3.31Å; F495-K497 PolarHBondContact O-N 2.99Å; K497-Q499 PolarHBondContact O-N 3.23Å; K497-F586 HydrophobicContact CB-CB 4.47Å; K497-S588 WeakPolarHBondContact CE-O 3.33Å; K497-S588 PolarHBondContact NZ-O 2.81Å
498	P	90.3	Very high	89.3	Confident	0 Å²	0	69 Å²	69	0%	0	35%	0.346	C	S	.	.			trans	-61.4	128	-176.7	-23.4	35	0	0	0	112.3	A521 M529 V582 N584 G587 N589	P498-A521 HydrophobicContact CB-CB 4.42Å; P498-M529 HydrophobicContact CB-SD 4Å; P498-M529 HydrophobicContact CG-CG 4.11Å; P498-M529 HydrophobicContact CG-SD 4.21Å; P498-V582 HydrophobicContact CB-CB 4.38Å; P498-V582 HydrophobicContact CB-CG1 4.12Å; P498-V582 HydrophobicContact CG-CG1 4.47Å; P498-N584 WeakPolarHBondContact CD-OD1 3.27Å; P498-N584 HydrophobicContact CG-CB 4.11Å; P498-G587 WeakPolarHBondContact CD-O 3.44Å; P498-N589 WeakPolarHBondContact O-CB 3.09Å; P498-N589 PolarHBondContact O-ND2 3.05Å
499	Q	90.9	Very high	89.5	Confident	62 Å²	62	62.8 Å²	62.8	29%	0.29	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	114.7	173.8	-66	-174.7	-6.8	0	0	110.1	F495 K497 R501 A521 V522	F495-Q499 HydrophobicContact CB-CG 4.44Å; F495-Q499 HydrophobicContact CD2-CG 4.34Å; K497-Q499 PolarHBondContact O-N 3.23Å; Q499-R501 PolarHBondContact O-N 2.89Å; Q499-A521 CarbonylContact O-C 3.54Å; Q499-A521 VanDerWaalsContact O-CA 3.23Å; Q499-A521 WeakPolarHBondContact O-CA 3.01Å; Q499-V522 HydrophobicContact CB-CG2 4.14Å; Q499-V522 PolarHBondContact N-O 2.86Å; Q499-V522 PolarHBondContact O-N 3.31Å
500	I	92.2	Very high	89.6	Confident	22 Å²	22	63.6 Å²	63.6	11%	0.113	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	128.4	177	-62.4	170.9	0	0	0	109.6	T502 H503 T520 A521 V582 N589	I500-T502 VanDerWaalsContact CG2-O 3.3Å; I500-T502 WeakPolarHBondContact CG2-O 3.16Å; I500-H503 VanDerWaalsContact CG2-ND1 3.3Å; I500-H503 WeakPolarHBondContact CG2-ND1 3.49Å; I500-T520 CarbonylContact C-O 3.6Å; I500-A521 HydrophobicContact CG1-CB 4.06Å; I500-V582 HydrophobicContact CD1-CG2 4.37Å; I500-V582 HydrophobicContact CG1-CG2 4.29Å; I500-N589 HydrophobicContact CD1-CB 4.31Å; I500-N589 HydrophobicContact CG1-CB 4.46Å
501	R	92.9	Very high	89.8	Confident	148 Å²	148	69.7 Å²	69.7	56%	0.558	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.7	-30.7	-178.7	-63.3	-66	177.2	148.2	-5.5	112.8	Q499 T520 V522	Q499-R501 PolarHBondContact O-N 2.89Å; R501-T520 PolarHBondContact N-O 3.32Å; R501-V522 HydrophobicContact CG-CG1 4.06Å; R501-V522 HydrophobicContact CG-CG2 3.74Å
502	T	94.6	Very high	90	Very high	63 Å²	63	68.3 Å²	68.3	39%	0.387	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	124	174.4	-50.3	0	0	0	0	108.4	I500 C519 T520	I500-T502 VanDerWaalsContact CG2-O 3.3Å; I500-T502 WeakPolarHBondContact CG2-O 3.16Å; T502-C519 WeakPolarHBondContact O-CA 3.41Å; T502-T520 PolarHBondContact N-O 3.11Å; T502-T520 PolarHBondContact O-N 3.06Å
503	H	95	Very high	90.5	Very high	63 Å²	63	71.4 Å²	71.4	29%	0.292	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-96	155.1	172.4	-58.4	-52.6	0	0	0	109.9	I500 T518 Q592	I500-H503 VanDerWaalsContact CG2-ND1 3.3Å; I500-H503 WeakPolarHBondContact CG2-ND1 3.49Å; H503-T518 CarbonylContact C-O 3.1Å; H503-Q592 HydrophobicContact CB-CB 4.14Å; H503-Q592 HydrophobicContact CB-CG 4.46Å; H503-Q592 VanDerWaalsContact CD2-CD 3.48Å; H503-Q592 PolarHBondContact CD2-NE2 2.94Å; H503-Q592 PolarHBondContact ND1-N 2.95Å; H503-Q592 PolarHBondContact NE2-NE2 3.13Å
504	P	96.4	Very high	91.7	Very high	9 Å²	9	69.2 Å²	69.2	6%	0.058	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-65.4	146.6	169.9	28.7	-33.6	0	0	0	110.6	L517 T518 W533 S591 A594	P504-L517 HydrophobicContact CB-CB 4.17Å; P504-L517 HydrophobicContact CB-CD2 4.24Å; P504-T518 VanDerWaalsContact CA-O 3.27Å; P504-T518 WeakPolarHBondContact CA-O 3.42Å; P504-W533 HydrophobicContact CB-CH2 4.07Å; P504-W533 HydrophobicContact CB-CZ3 4.02Å; P504-W533 HydrophobicContact CG-CH2 4.34Å; P504-W533 HydrophobicContact CG-CZ3 4.05Å; P504-S591 WeakPolarHBondContact CD-OG 3.29Å; P504-A594 HydrophobicContact CB-CB 3.81Å; P504-A594 HydrophobicContact CG-CB 3.87Å
505	E	95.9	Very high	92.6	Very high	152 Å²	152	65.4 Å²	65.4	71%	0.71	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-94	153.4	-179.7	-63.1	-173.5	168.2	0	0	111.8	A594	E505-A594 WeakPolarHBondContact O-CB 3.26Å
506	T	96.4	Very high	93.3	Very high	95 Å²	95	66 Å²	66	58%	0.583	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-78.2	126.3	175.4	-75.6	0	0	0	0	109.8	K595	T506-K595 CarbonylContact C-O 3.12Å; T506-K595 WeakPolarHBondContact CA-O 3.34Å; T506-K595 HydrophobicContact CG2-CB 4.02Å; T506-K595 WeakPolarHBondContact CG2-O 3.48Å; T506-K595 PolarHBondContact OG1-N 3.46Å
507	I	95	Very high	93.9	Very high	45 Å²	45	64.3 Å²	64.3	23%	0.231	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.1	-170.4	-65.4	176.3	0	0	0	110.5	A509 V515 L517 K595 L596 T597	I507-A509 HydrophobicContact CG2-CB 4.4Å; I507-V515 HydrophobicContact CB-CG1 4.48Å; I507-V515 HydrophobicContact CD1-CG1 3.68Å; I507-V515 HydrophobicContact CG2-CG1 4.07Å; I507-V515 HydrophobicContact CG2-CG2 4.38Å; I507-L517 HydrophobicContact CD1-CD2 3.76Å; I507-L517 HydrophobicContact CG1-CD2 4.47Å; I507-K595 PolarHBondContact N-O 3.06Å; I507-L596 HydrophobicContact CB-CD1 4.17Å; I507-L596 HydrophobicContact CG2-CD1 4.04Å; I507-L596 WeakPolarHBondContact O-CA 3.39Å; I507-T597 PolarHBondContact O-N 3.34Å
508	I	93.1	Very high	94.4	Very high	116 Å²	116	64.5 Å²	64.5	60%	0.595	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.3	165.4	-57.6	177.7	0	0	0	106.6	T597 N599	I508-T597 WeakPolarHBondContact CA-O 3.47Å; I508-N599 WeakPolarHBondContact CG2-ND2 3.38Å
509	A	94.1	Very high	94.7	Very high	9 Å²	9	64.6 Å²	64.6	7%	0.074	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	155.6	-177.1	0	0	0	0	0	111.3	I507 V515 V570 L596 T597 N599	I507-A509 HydrophobicContact CG2-CB 4.4Å; A509-V515 HydrophobicContact CB-CG2 3.6Å; A509-V570 HydrophobicContact CB-CG1 4.41Å; A509-L596 HydrophobicContact CB-CD1 4.01Å; A509-T597 PolarHBondContact N-O 3.15Å; A509-N599 PolarHBondContact O-N 2.84Å
510	L	93.3	Very high	94.9	Very high	60 Å²	60	62.2 Å²	62.2	31%	0.314	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	143	164.1	-60.3	-178	0	0	0	109.7	G512 M513 N599 M601 A681	L510-G512 PolarHBondContact O-N 2.97Å; L510-M513 HydrophobicContact CB-CG 3.85Å; L510-M513 VanDerWaalsContact O-CB 3.26Å; L510-M513 WeakPolarHBondContact O-CB 3.43Å; L510-M513 WeakPolarHBondContact O-CG 3.21Å; L510-M513 PolarHBondContact O-N 2.98Å; L510-N599 CarbonylContact C-O 3.51Å; L510-N599 WeakPolarHBondContact CA-O 3.37Å; L510-N599 HydrophobicContact CD2-CB 4.43Å; L510-M601 HydrophobicContact CD1-CE 4.34Å; L510-M601 HydrophobicContact CD1-CG 4.25Å; L510-M601 HydrophobicContact CD1-SD 4.3Å; L510-M601 HydrophobicContact CD2-CG 4.13Å; L510-A681 HydrophobicContact CD2-CB 3.47Å; L510-A681 VanDerWaalsContact CD2-CB 3.47Å
511	R	94.1	Very high	95	Very high	134 Å²	134	61.2 Å²	61.2	51%	0.506	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	129.7	172.8	-171.3	-171.1	179.6	-178.3	0.8	110.6	V570 V598 N599 E600	R511-V570 CarbonylContact C-O 3.11Å; R511-V570 WeakPolarHBondContact CA-O 3.3Å; R511-V598 HydrophobicContact CB-CG1 4.25Å; R511-N599 PolarHBondContact N-O 3.3Å; R511-E600 WeakPolarHBondContact CD-OE1 3.49Å; R511-E600 IonicContact CZ-OE1 2.71Å; R511-E600 IonicContact NE-OE1 3.33Å; R511-E600 VanDerWaalsContact NH1-CD 3.3Å; R511-E600 IonicContact NH1-OE1 3.8Å; R511-E600 PolarHBondContact NH1-OE1 3.09Å; R511-E600 IonicContact NH1-OE2 2.94Å; R511-E600 PolarHBondContact NH1-OE2 3.03Å; R511-E600 VanDerWaalsContact NH1-OE2 3.09Å
512	G	92.6	Very high	94.9	Very high	34 Å²	34	54.4 Å²	54.4	35%	0.351	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	-5.6	-177.3	0	0	0	0	0	115.5	L510 V570	L510-G512 PolarHBondContact O-N 2.97Å; G512-V570 PolarHBondContact N-O 3.43Å
513	M	93.4	Very high	94.8	Very high	108 Å²	108	51.4 Å²	51.4	53%	0.532	27%	0.273	S	S	.	.			trans	-75.9	159.9	173.5	-67.1	-64.2	-68	0	0	112.2	L510 N569 V570	L510-M513 HydrophobicContact CB-CG 3.85Å; L510-M513 VanDerWaalsContact O-CB 3.26Å; L510-M513 WeakPolarHBondContact O-CB 3.43Å; L510-M513 WeakPolarHBondContact O-CG 3.21Å; L510-M513 PolarHBondContact O-N 2.98Å; M513-N569 PolarHBondContact O-N 2.83Å; M513-V570 WeakPolarHBondContact O-CB 3.48Å; M513-V570 WeakPolarHBondContact O-CG2 3.24Å; M513-V570 PolarHBondContact O-N 2.88Å
514	N	96.2	Very high	94.5	Very high	101 Å²	101	49.7 Å²	49.7	54%	0.54	27%	0.268	S	S	.	.			trans	-93.1	139.4	167.2	-61	-17.4	0	0	0	109.5	L567 F568 N569	N514-L567 CarbonylContact C-O 3.44Å; N514-L567 WeakPolarHBondContact CA-O 3.18Å; N514-F568 HydrophobicContact CB-CD1 4.4Å; N514-F568 WeakPolarHBondContact OD1-CA 3.28Å; N514-N569 PolarHBondContact OD1-N 2.88Å
515	V	95.9	Very high	93.9	Very high	10 Å²	10	49.6 Å²	49.6	6%	0.061	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	143.7	-178.7	174.5	0	0	0	0	108.9	I507 A509 L567 V570 L596	I507-V515 HydrophobicContact CB-CG1 4.48Å; I507-V515 HydrophobicContact CD1-CG1 3.68Å; I507-V515 HydrophobicContact CG2-CG1 4.07Å; I507-V515 HydrophobicContact CG2-CG2 4.38Å; A509-V515 HydrophobicContact CB-CG2 3.6Å; V515-L567 HydrophobicContact CB-CB 4.38Å; V515-L567 PolarHBondContact N-O 2.84Å; V515-L567 PolarHBondContact O-N 2.94Å; V515-V570 HydrophobicContact CB-CG2 4.02Å; V515-V570 HydrophobicContact CG2-CB 4.49Å; V515-V570 HydrophobicContact CG2-CG2 3.85Å; V515-L596 HydrophobicContact CG1-CD1 4.28Å; V515-L596 HydrophobicContact CG2-CD1 4.36Å
516	T	95.9	Very high	93.4	Very high	70 Å²	70	49.3 Å²	49.3	43%	0.429	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.5	175.3	67	0	0	0	0	110.3	L565 H566	T516-L565 WeakPolarHBondContact CA-O 3.34Å; T516-H566 WeakPolarHBondContact CG2-ND1 3.47Å
517	L	96.8	Very high	92.9	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	118.6	177.7	-65.9	174.9	0	0	0	108.8	P504 I507 W533 I564 L565 L567 Y578	P504-L517 HydrophobicContact CB-CB 4.17Å; P504-L517 HydrophobicContact CB-CD2 4.24Å; I507-L517 HydrophobicContact CD1-CD2 3.76Å; I507-L517 HydrophobicContact CG1-CD2 4.47Å; L517-W533 HydrophobicContact CB-CH2 3.78Å; L517-W533 HydrophobicContact CB-CZ3 3.84Å; L517-W533 VanDerWaalsContact O-CH2 3.24Å; L517-W533 WeakPolarHBondContact O-CH2 3.35Å; L517-W533 VanDerWaalsContact O-CZ2 3.26Å; L517-W533 WeakPolarHBondContact O-CZ2 3.47Å; L517-I564 WeakPolarHBondContact O-CA 3.4Å; L517-L565 HydrophobicContact CB-CB 4.43Å; L517-L565 HydrophobicContact CD1-CD2 4.4Å; L517-L565 PolarHBondContact N-O 2.8Å; L517-L565 PolarHBondContact O-N 2.97Å; L517-L567 HydrophobicContact CD1-CD1 4.44Å; L517-Y578 HydrophobicContact CD1-CD1 3.75Å; L517-Y578 HydrophobicContact CD1-CD2 4.03Å; L517-Y578 HydrophobicContact CD1-CE1 4.46Å; L517-Y578 HydrophobicContact CD1-CG 3.49Å; L517-Y578 VanDerWaalsContact CD1-CG 3.49Å
518	T	96.4	Very high	92.7	Very high	48 Å²	48	48.5 Å²	48.5	29%	0.294	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	141.6	-175.4	-62.8	0	0	0	0	111.5	H503 P504 T562 I564	H503-T518 CarbonylContact C-O 3.1Å; P504-T518 VanDerWaalsContact CA-O 3.27Å; P504-T518 WeakPolarHBondContact CA-O 3.42Å; T518-T562 HydrophobicContact CG2-CG2 3.92Å; T518-I564 HydrophobicContact CG2-CG1 4.26Å
519	C	96.5	Very high	92.7	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.007	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	129.1	176.5	177.9	0	0	0	0	109.6	T502 W533 T562 S563 C580	T502-C519 WeakPolarHBondContact O-CA 3.41Å; C519-W533 HydrophobicContact CB-CH2 3.82Å; C519-W533 HydrophobicContact CB-CZ2 3.69Å; C519-T562 CarbonylContact O-C 3.44Å; C519-T562 VanDerWaalsContact O-CA 3.32Å; C519-T562 WeakPolarHBondContact O-CA 3.4Å; C519-S563 PolarHBondContact N-O 3.08Å; C519-S563 PolarHBondContact O-N 3.28Å; C519-C580 HydrophobicContact CB-CB 3.39Å; C519-C580 WeakPolarHBondContact CB-SG 3Å; C519-C580 WeakPolarHBondContact SG-CB 3.27Å; C519-C580 CovalentContact SG-SG 2.03Å; C519-C580 PolarHBondContact SG-SG 2.92Å
520	T	95.2	Very high	92.6	Very high	13 Å²	13	46.2 Å²	46.2	8%	0.08	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.7	178.5	-57.8	0	0	0	0	110.6	I500 R501 T502 E560 Y561 T562	I500-T520 CarbonylContact C-O 3.6Å; R501-T520 PolarHBondContact N-O 3.32Å; T502-T520 PolarHBondContact N-O 3.11Å; T502-T520 PolarHBondContact O-N 3.06Å; T520-E560 HydrophobicContact CG2-CG 3.81Å; T520-Y561 CarbonylContact C-O 3.21Å; T520-Y561 VanDerWaalsContact CA-O 3.32Å; T520-Y561 WeakPolarHBondContact CA-O 3.14Å; T520-T562 WeakPolarHBondContact CG2-OG1 3.17Å; T520-T562 PolarHBondContact OG1-OG1 3Å
521	A	94.6	Very high	92.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	162.7	174.3	0	0	0	0	0	111.9	P498 Q499 I500 M529 E560 Y561 V582	P498-A521 HydrophobicContact CB-CB 4.42Å; Q499-A521 CarbonylContact O-C 3.54Å; Q499-A521 VanDerWaalsContact O-CA 3.23Å; Q499-A521 WeakPolarHBondContact O-CA 3.01Å; I500-A521 HydrophobicContact CG1-CB 4.06Å; A521-M529 HydrophobicContact CB-SD 4.43Å; A521-E560 WeakPolarHBondContact O-CA 3.47Å; A521-Y561 PolarHBondContact N-O 2.82Å; A521-Y561 PolarHBondContact O-N 2.9Å; A521-V582 HydrophobicContact CB-CB 4.14Å; A521-V582 HydrophobicContact CB-CG1 3.98Å; A521-V582 HydrophobicContact CB-CG2 3.95Å
522	V	92.5	Very high	92.5	Very high	6 Å²	6	41 Å²	41	4%	0.036	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	149.4	175.5	-62.2	0	0	0	0	111.8	F495 Q499 R501 L559 E560	F495-V522 HydrophobicContact CD2-CG2 4.32Å; F495-V522 HydrophobicContact CE2-CB 4.04Å; F495-V522 HydrophobicContact CE2-CG2 3.7Å; Q499-V522 HydrophobicContact CB-CG2 4.14Å; Q499-V522 PolarHBondContact N-O 2.86Å; Q499-V522 PolarHBondContact O-N 3.31Å; R501-V522 HydrophobicContact CG-CG1 4.06Å; R501-V522 HydrophobicContact CG-CG2 3.74Å; V522-L559 CarbonylContact C-O 3.55Å; V522-L559 WeakPolarHBondContact CA-O 3.4Å; V522-E560 HydrophobicContact CG1-CB 4.1Å; V522-E560 HydrophobicContact CG1-CG 4.29Å
523	S	91.1	Very high	92.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	150.9	166.6	-173.8	0	0	0	0	110.4	F495 L496 S525 A558 L559	F495-S523 VanDerWaalsContact CE2-C 3.42Å; F495-S523 VanDerWaalsContact CE2-CA 3.47Å; F495-S523 WeakPolarHBondContact O-CA 3.48Å; F495-S523 PolarHBondContact O-OG 2.86Å; L496-S523 PolarHBondContact O-OG 2.93Å; L496-S523 VanDerWaalsContact O-OG 3.04Å; S523-S525 VanDerWaalsContact C-N 3.34Å; S523-S525 PolarHBondContact OG-N 2.79Å; S523-S525 VanDerWaalsContact OG-N 3.15Å; S523-A558 CarbonylContact O-C 3.48Å; S523-A558 WeakPolarHBondContact O-CA 3.45Å; S523-L559 PolarHBondContact N-O 2.8Å; S523-L559 PolarHBondContact O-N 3.38Å
524	S	88.4	Confident	92.3	Very high	27 Å²	27	34.7 Å²	34.7	19%	0.189	21%	0.208	C	C	.	.	S	Bend	trans	-84.7	-9	167.6	61.4	0	0	0	0	113.2	D494 F495	D494-S524 WeakPolarHBondContact CB-OG 3.32Å; D494-S524 WeakPolarHBondContact OD1-CB 3.48Å; D494-S524 PolarHBondContact OD1-OG 2.82Å; F495-S524 PolarHBondContact N-OG 3.06Å; F495-S524 PolarHBondContact O-N 2.83Å
525	S	85.2	Confident	92.1	Very high	7 Å²	7	31.7 Å²	31.7	5%	0.049	19%	0.19	C	C	.	.	S	Bend	trans	-76.4	145.4	170.2	-179.8	0	0	0	0	111.5	S523 S527 L559 F586	S523-S525 VanDerWaalsContact C-N 3.34Å; S523-S525 PolarHBondContact OG-N 2.79Å; S523-S525 VanDerWaalsContact OG-N 3.15Å; S525-S527 PolarHBondContact O-N 3.45Å; S525-S527 WeakPolarHBondContact OG-CB 3.31Å; S525-S527 PolarHBondContact OG-N 3.39Å; S525-L559 WeakPolarHBondContact O-CD1 3.19Å; S525-F586 WeakPolarHBondContact OG-CE2 3.26Å
526	D	84.9	Confident	91.5	Very high	145 Å²	145	34.4 Å²	34.4	78%	0.775	20%	0.204	S	C	*	.			trans	-70.2	-10.6	165.6	66.4	-32.3	0	0	0	113.9
527	S	86.7	Confident	90.3	Very high	16 Å²	16	31.5 Å²	31.5	11%	0.112	19%	0.187	C	C	.	.	S	Bend	trans	-56.9	125.9	-179	-172.7	0	0	0	0	111.3	S525 M529 H585	S525-S527 PolarHBondContact O-N 3.45Å; S525-S527 WeakPolarHBondContact OG-CB 3.31Å; S525-S527 PolarHBondContact OG-N 3.39Å; S527-M529 PolarHBondContact O-N 2.85Å; S527-M529 VanDerWaalsContact O-N 3.15Å; S527-H585 VanDerWaalsContact OG-CB 3.22Å; S527-H585 WeakPolarHBondContact OG-CB 3.17Å; S527-H585 PolarHBondContact OG-N 3.24Å; S527-H585 VanDerWaalsContact OG-N 3.11Å
528	P	89.8	Confident	89.5	Confident	108 Å²	108	35.8 Å²	35.8	70%	0.701	21%	0.206	S	C	*	.	P	Polyproline II helix	trans	-61.9	120.9	-174.5	24.3	-33.9	0	0	0	111
529	M	92.6	Very high	89	Confident	16 Å²	16	37 Å²	37	8%	0.079	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-75.8	149	169.8	-77.5	179.7	-82.9	0	0	110.7	P498 A521 S527 L559 Y561 V582 T583 N584	P498-M529 HydrophobicContact CB-SD 4Å; P498-M529 HydrophobicContact CG-CG 4.11Å; P498-M529 HydrophobicContact CG-SD 4.21Å; A521-M529 HydrophobicContact CB-SD 4.43Å; S527-M529 PolarHBondContact O-N 2.85Å; S527-M529 VanDerWaalsContact O-N 3.15Å; M529-L559 HydrophobicContact CE-CB 3.67Å; M529-L559 WeakPolarHBondContact CE-O 3.19Å; M529-Y561 HydrophobicContact CB-CD2 3.58Å; M529-Y561 HydrophobicContact CB-CE2 4.17Å; M529-Y561 HydrophobicContact CB-CG 3.9Å; M529-Y561 WeakPolarHBondContact O-CE2 3.24Å; M529-V582 HydrophobicContact CB-CG1 4.13Å; M529-V582 HydrophobicContact CG-CG1 4.21Å; M529-V582 HydrophobicContact SD-CG1 4.12Å; M529-T583 CarbonylContact C-O 3.47Å; M529-T583 WeakPolarHBondContact CA-O 3.35Å; M529-N584 HydrophobicContact CG-CB 4.03Å
530	S	92.9	Very high	88.7	Confident	61 Å²	61	38.9 Å²	38.9	43%	0.427	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	145.2	176.1	56.3	0	0	0	0	109.1	V582 T583	S530-V582 CarbonylContact O-C 3.59Å; S530-V582 WeakPolarHBondContact O-CA 3.11Å; S530-T583 PolarHBondContact N-O 2.92Å; S530-T583 PolarHBondContact O-N 2.92Å; S530-T583 PolarHBondContact OG-O 3.21Å
531	T	92.4	Very high	88.1	Confident	25 Å²	25	46.9 Å²	46.9	15%	0.153	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.8	179.7	-63.9	0	0	0	0	111.6	Y561 S563 C580 I581	T531-Y561 WeakPolarHBondContact OG1-CE1 3.18Å; T531-S563 WeakPolarHBondContact CG2-OG 3.47Å; T531-C580 VanDerWaalsContact CG2-SG 3.56Å; T531-I581 CarbonylContact C-O 3.51Å; T531-I581 VanDerWaalsContact CA-O 3.31Å; T531-I581 WeakPolarHBondContact CA-O 3.19Å
532	V	92.3	Very high	87.5	Confident	59 Å²	59	55.4 Å²	55.4	36%	0.358	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	135	167.1	178.5	0	0	0	0	108.4	I539 I581	V532-I539 HydrophobicContact CG1-CB 4.49Å; V532-I539 HydrophobicContact CG1-CD1 4.49Å; V532-I539 HydrophobicContact CG1-CG1 4.25Å; V532-I539 HydrophobicContact CG1-CG2 3.61Å; V532-I581 HydrophobicContact CB-CB 4.49Å; V532-I581 PolarHBondContact N-O 2.95Å; V532-I581 PolarHBondContact O-N 3.1Å
533	W	93.9	Very high	87.3	Confident	6 Å²	6	57.7 Å²	57.7	2%	0.023	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	143.8	171.2	-72.5	89	0	0	0	110.4	P504 L517 C519 L540 S563 L565 Q579 C580	P504-W533 HydrophobicContact CB-CH2 4.07Å; P504-W533 HydrophobicContact CB-CZ3 4.02Å; P504-W533 HydrophobicContact CG-CH2 4.34Å; P504-W533 HydrophobicContact CG-CZ3 4.05Å; L517-W533 HydrophobicContact CB-CH2 3.78Å; L517-W533 HydrophobicContact CB-CZ3 3.84Å; L517-W533 VanDerWaalsContact O-CH2 3.24Å; L517-W533 WeakPolarHBondContact O-CH2 3.35Å; L517-W533 VanDerWaalsContact O-CZ2 3.26Å; L517-W533 WeakPolarHBondContact O-CZ2 3.47Å; C519-W533 HydrophobicContact CB-CH2 3.82Å; C519-W533 HydrophobicContact CB-CZ2 3.69Å; W533-L540 HydrophobicContact CB-CD1 4.14Å; W533-L540 PolarHBondContact O-N 3.04Å; W533-S563 PolarHBondContact NE1-OG 2.95Å; W533-S563 VanDerWaalsContact NE1-OG 3.08Å; W533-L565 HydrophobicContact CB-CD2 4.15Å; W533-L565 HydrophobicContact CD2-CB 3.79Å; W533-L565 HydrophobicContact CD2-CD2 3.91Å; W533-L565 HydrophobicContact CD2-CG 4.48Å; W533-L565 HydrophobicContact CE3-CB 4.24Å; W533-L565 HydrophobicContact CE3-CD2 3.88Å; W533-L565 HydrophobicContact CG-CB 4.11Å; W533-L565 HydrophobicContact CG-CD2 4.04Å; W533-L565 HydrophobicContact CH2-CB 4.45Å; W533-L565 HydrophobicContact CZ2-CB 4.02Å; W533-Q579 WeakPolarHBondContact CA-O 3.5Å; W533-C580 HydrophobicContact CD2-CB 4.19Å; W533-C580 HydrophobicContact CE3-CB 4.02Å; W533-C580 HydrophobicContact CH2-CB 3.88Å; W533-C580 HydrophobicContact CZ2-CB 4.02Å; W533-C580 HydrophobicContact CZ3-CB 3.88Å
534	R	88.4	Confident	87.3	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.015	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	150.7	171.8	65.5	-174.8	-109.4	-158.9	12.1	110.9	D377 S537 E538 Y578 Q579 I581	D377-R534 IonicContact OD2-CZ 3.8Å; D377-R534 VanDerWaalsContact OD2-CZ 3.26Å; D377-R534 IonicContact OD2-NH1 3.24Å; D377-R534 PolarHBondContact OD2-NH1 3.27Å; D377-R534 IonicContact OD2-NH2 3.72Å; D377-R534 PolarHBondContact OD2-NH2 2.95Å; R534-S537 VanDerWaalsContact NH2-CB 3.28Å; R534-S537 PolarHBondContact NH2-OG 3.07Å; R534-E538 CarbonylContact C-O 3.52Å; R534-E538 WeakPolarHBondContact CA-O 3.38Å; R534-E538 WeakPolarHBondContact CB-O 3.39Å; R534-Y578 CarbonylContact O-C 3.56Å; R534-Y578 VanDerWaalsContact O-CA 3.27Å; R534-Y578 WeakPolarHBondContact O-CA 3.35Å; R534-Q579 HydrophobicContact CG-CB 3.72Å; R534-Q579 VanDerWaalsContact CZ-OE1 3.24Å; R534-Q579 PolarHBondContact N-O 2.9Å; R534-Q579 PolarHBondContact O-N 3.34Å; R534-I581 HydrophobicContact CG-CD1 4.42Å
535	K	90.9	Very high	87.5	Confident	38 Å²	38	62.2 Å²	62.2	17%	0.165	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	125.3	171.4	178.5	-172.4	-175.5	-72.3	0	108.2	S537 E538 L540 T573 D574 E575 Y578	K535-S537 PolarHBondContact O-N 3.04Å; K535-E538 PolarHBondContact N-O 2.94Å; K535-E538 PolarHBondContact O-N 3.43Å; K535-L540 HydrophobicContact CB-CD1 4.21Å; K535-L540 HydrophobicContact CB-CD2 3.81Å; K535-L540 HydrophobicContact CB-CG 4.15Å; K535-T573 VanDerWaalsContact CE-O 3.3Å; K535-T573 WeakPolarHBondContact CE-O 3.4Å; K535-T573 PolarHBondContact NZ-O 2.82Å; K535-D574 VanDerWaalsContact CE-C 3.45Å; K535-D574 VanDerWaalsContact CE-O 3.25Å; K535-D574 WeakPolarHBondContact CE-O 3.29Å; K535-E575 VanDerWaalsContact CE-O 3.24Å; K535-E575 WeakPolarHBondContact CE-O 3.39Å; K535-E575 PolarHBondContact NZ-O 3.29Å; K535-Y578 HydrophobicContact CB-CD1 4.25Å; K535-Y578 HydrophobicContact CB-CE1 4.05Å; K535-Y578 HydrophobicContact CD-CE1 4.26Å; K535-Y578 HydrophobicContact CD-CE2 4.13Å; K535-Y578 WeakPolarHBondContact CD-OH 3.37Å; K535-Y578 HydrophobicContact CG-CD2 4.43Å; K535-Y578 HydrophobicContact CG-CE1 4.19Å; K535-Y578 HydrophobicContact CG-CE2 3.98Å
536	D	83.5	Confident	88	Confident	66 Å²	66	66.1 Å²	66.1	35%	0.353	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	20.9	-178.7	-57.6	-55.1	0	0	0	114.4	G576 K577	D536-G576 WeakPolarHBondContact OD1-CA 3.39Å; D536-G576 WeakPolarHBondContact OD2-CA 3.25Å; D536-K577 PolarHBondContact N-O 3.19Å; D536-K577 PolarHBondContact OD1-N 3.47Å
537	S	72.3	Confident	88.4	Confident	10 Å²	10	62.7 Å²	62.7	7%	0.07	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	13.8	-174.7	-27.3	0	0	0	0	116.8	H349 W373 R534 K535	H349-S537 PolarHBondContact ND1-O 3.3Å; W373-S537 VanDerWaalsContact CZ2-CB 3.47Å; R534-S537 VanDerWaalsContact NH2-CB 3.28Å; R534-S537 PolarHBondContact NH2-OG 3.07Å; K535-S537 PolarHBondContact O-N 3.04Å
538	E	79.8	Confident	88.6	Confident	95 Å²	95	65.7 Å²	65.7	44%	0.444	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	139.7	158.3	-62	-171.8	-150.3	0	0	109.9	R325 R534 K535	R325-E538 IonicContact CZ-OE1 3.61Å; R325-E538 VanDerWaalsContact NH1-CD 3.29Å; R325-E538 IonicContact NH1-OE1 2.7Å; R325-E538 PolarHBondContact NH1-OE1 2.9Å; R325-E538 IonicContact NH1-OE2 2.75Å; R325-E538 IonicContact NH2-OE1 2.97Å; R325-E538 PolarHBondContact NH2-OE1 3.07Å; R534-E538 CarbonylContact C-O 3.52Å; R534-E538 WeakPolarHBondContact CA-O 3.38Å; R534-E538 WeakPolarHBondContact CB-O 3.39Å; K535-E538 PolarHBondContact N-O 2.94Å; K535-E538 PolarHBondContact O-N 3.43Å
539	I	84.4	Confident	88.6	Confident	74 Å²	74	64.5 Å²	64.5	38%	0.379	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	133.6	176.5	-68.9	172.3	0	0	0	109.2	V532 Y541	V532-I539 HydrophobicContact CG1-CB 4.49Å; V532-I539 HydrophobicContact CG1-CD1 4.49Å; V532-I539 HydrophobicContact CG1-CG1 4.25Å; V532-I539 HydrophobicContact CG1-CG2 3.61Å; I539-Y541 HydrophobicContact CB-CE2 3.82Å; I539-Y541 HydrophobicContact CG2-CD1 4.24Å; I539-Y541 HydrophobicContact CG2-CD2 4.19Å; I539-Y541 HydrophobicContact CG2-CE1 3.8Å; I539-Y541 HydrophobicContact CG2-CE2 3.75Å; I539-Y541 HydrophobicContact CG2-CG 4.42Å; I539-Y541 WeakPolarHBondContact O-CD2 3.43Å; I539-Y541 WeakPolarHBondContact O-CE2 3.39Å
540	L	89.9	Confident	88.3	Confident	41 Å²	41	71 Å²	71	22%	0.215	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-83.1	119.3	172.9	-62.9	177	0	0	0	109.6	W533 K535 V543 L565 Y578	W533-L540 HydrophobicContact CB-CD1 4.14Å; W533-L540 PolarHBondContact O-N 3.04Å; K535-L540 HydrophobicContact CB-CD1 4.21Å; K535-L540 HydrophobicContact CB-CD2 3.81Å; K535-L540 HydrophobicContact CB-CG 4.15Å; L540-V543 HydrophobicContact CB-CG1 3.95Å; L540-V543 HydrophobicContact CB-CG2 3.77Å; L540-V543 HydrophobicContact CD1-CG1 4.44Å; L540-L565 HydrophobicContact CD1-CD2 3.86Å; L540-Y578 HydrophobicContact CD1-CD1 4.01Å; L540-Y578 HydrophobicContact CD1-CE1 3.75Å
541	Y	84.6	Confident	87.6	Confident	181 Å²	181	77 Å²	77	71%	0.71	37%	0.372	S	S	*	.			trans	-108.5	150.5	172	-57	-84.6	0	0	0	109.1	I539 V543	I539-Y541 HydrophobicContact CB-CE2 3.82Å; I539-Y541 HydrophobicContact CG2-CD1 4.24Å; I539-Y541 HydrophobicContact CG2-CD2 4.19Å; I539-Y541 HydrophobicContact CG2-CE1 3.8Å; I539-Y541 HydrophobicContact CG2-CE2 3.75Å; I539-Y541 HydrophobicContact CG2-CG 4.42Å; I539-Y541 WeakPolarHBondContact O-CD2 3.43Å; I539-Y541 WeakPolarHBondContact O-CE2 3.39Å; Y541-V543 VanDerWaalsContact C-N 3.29Å; Y541-V543 PolarHBondContact O-N 3.1Å
542	D	81.8	Confident	86.5	Confident	178 Å²	178	81.5 Å²	81.5	95%	0.952	39%	0.386	S	S	*	.	S	Bend	trans	55.6	38.4	176.5	-148.4	32.3	0	0	0	114.4
543	V	86.7	Confident	85.1	Confident	54 Å²	54	86.2 Å²	86.2	33%	0.327	40%	0.404	S	S	.	.			trans	-102	149	175.3	-76.7	0	0	0	0	111.7	L540 Y541 V545 L565	L540-V543 HydrophobicContact CB-CG1 3.95Å; L540-V543 HydrophobicContact CB-CG2 3.77Å; L540-V543 HydrophobicContact CD1-CG1 4.44Å; Y541-V543 VanDerWaalsContact C-N 3.29Å; Y541-V543 PolarHBondContact O-N 3.1Å; V543-V545 HydrophobicContact CB-CG2 4.43Å; V543-V545 HydrophobicContact CG2-CG2 3.8Å; V543-V545 PolarHBondContact O-N 2.9Å; V543-L565 HydrophobicContact CB-CD1 3.84Å; V543-L565 HydrophobicContact CG1-CD1 4.41Å; V543-L565 HydrophobicContact CG2-CD1 4.03Å
544	D	92.2	Very high	83.2	Confident	86 Å²	86	95 Å²	95	46%	0.46	45%	0.446	S	S	.	.			trans	-73.6	113.4	177	-168.1	4.5	0	0	0	110.7	H566 F568	D544-H566 HydrophobicContact CB-CB 4.31Å; D544-H566 PolarHBondContact O-N 3.2Å; D544-F568 HydrophobicContact CB-CE2 4.04Å; D544-F568 VanDerWaalsContact OD2-CE2 3.29Å; D544-F568 WeakPolarHBondContact OD2-CE2 3.41Å
545	V	93.3	Very high	81.2	Confident	37 Å²	37	98.9 Å²	98.9	22%	0.224	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	109.1	-175.3	-176.2	0	0	0	0	110.2	V543 N547 S563 I564 L565	V543-V545 HydrophobicContact CB-CG2 4.43Å; V543-V545 HydrophobicContact CG2-CG2 3.8Å; V543-V545 PolarHBondContact O-N 2.9Å; V545-N547 PolarHBondContact O-ND2 2.84Å; V545-S563 WeakPolarHBondContact CG1-OG 3.41Å; V545-I564 CarbonylContact C-O 3.57Å; V545-I564 VanDerWaalsContact CA-O 3.26Å; V545-I564 WeakPolarHBondContact CA-O 3.4Å; V545-L565 HydrophobicContact CG2-CB 4.42Å; V545-L565 HydrophobicContact CG2-CD1 3.85Å
546	E	94.3	Very high	79.7	Confident	89 Å²	89	99.7 Å²	99.7	42%	0.416	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	136.9	169.8	-67.4	-175.8	124.1	0	0	110.3	F548 S563 I564 H566	E546-F548 HydrophobicContact CB-CE2 3.61Å; E546-F548 HydrophobicContact CB-CZ 3.77Å; E546-F548 HydrophobicContact CG-CZ 4.43Å; E546-S563 CarbonylContact O-C 3.5Å; E546-S563 WeakPolarHBondContact O-CA 3.4Å; E546-I564 PolarHBondContact N-O 3.2Å; E546-I564 PolarHBondContact O-N 3.45Å; E546-H566 IonicContact OE2-CD2 3.64Å; E546-H566 IonicContact OE2-CE1 3.54Å; E546-H566 IonicContact OE2-NE2 2.84Å; E546-H566 PolarHBondContact OE2-NE2 2.87Å
547	N	92.9	Very high	78.7	Confident	72 Å²	72	104.2 Å²	104.2	39%	0.385	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	130.5	179.1	-64.8	-83.7	0	0	0	110.3	V545 Y561 T562 S563	V545-N547 PolarHBondContact O-ND2 2.84Å; N547-Y561 HydrophobicContact CB-CE1 4.27Å; N547-Y561 WeakPolarHBondContact CB-OH 3.16Å; N547-Y561 VanDerWaalsContact CG-OH 3.25Å; N547-Y561 WeakPolarHBondContact OD1-CE1 3.34Å; N547-Y561 PolarHBondContact OD1-OH 3.14Å; N547-T562 CarbonylContact C-O 3.48Å; N547-T562 WeakPolarHBondContact CA-O 3.24Å; N547-S563 WeakPolarHBondContact OD1-CB 3.42Å; N547-S563 PolarHBondContact OD1-OG 2.87Å
548	F	91.5	Very high	79.1	Confident	80 Å²	80	104.1 Å²	104.1	35%	0.351	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	134.9	-174.8	-53.6	-86.4	0	0	0	110	E546 Y561 T562 I564	E546-F548 HydrophobicContact CB-CE2 3.61Å; E546-F548 HydrophobicContact CB-CZ 3.77Å; E546-F548 HydrophobicContact CG-CZ 4.43Å; F548-Y561 WeakPolarHBondContact O-CA 3.23Å; F548-T562 PolarHBondContact N-O 2.86Å; F548-T562 PolarHBondContact O-N 3.33Å; F548-I564 HydrophobicContact CD2-CD1 4.47Å; F548-I564 HydrophobicContact CE2-CD1 3.84Å; F548-I564 HydrophobicContact CE2-CG1 4.19Å
549	V	89.6	Confident	79.4	Confident	82 Å²	82	100.5 Å²	100.5	50%	0.497	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	134.7	175.7	-172.7	0	0	0	0	109.5	L559 E560 Y561	V549-L559 HydrophobicContact CG1-CD2 3.98Å; V549-E560 CarbonylContact C-O 3.59Å; V549-E560 WeakPolarHBondContact CA-O 3.43Å; V549-Y561 HydrophobicContact CG2-CD2 3.7Å; V549-Y561 HydrophobicContact CG2-CE2 4.05Å
550	R	85.9	Confident	79.8	Confident	152 Å²	152	98.3 Å²	98.3	57%	0.574	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.6	137	-178.8	-64	178.8	177.9	178.6	0.7	110.4	E560	R550-E560 HydrophobicContact CB-CB 4.27Å; R550-E560 PolarHBondContact N-O 2.91Å; R550-E560 PolarHBondContact O-N 2.9Å
551	Y	79.9	Confident	79.9	Confident	188 Å²	188	97.5 Å²	97.5	74%	0.737	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	116.7	171.5	-69.7	-96.1	0	0	0	109.1	L559	Y551-L559 HydrophobicContact CD1-CD2 3.72Å; Y551-L559 HydrophobicContact CD2-CD2 4.39Å; Y551-L559 HydrophobicContact CE1-CD2 3.41Å; Y551-L559 VanDerWaalsContact CE1-CD2 3.41Å; Y551-L559 HydrophobicContact CE1-CG 4.47Å; Y551-L559 HydrophobicContact CE2-CD2 4.12Å; Y551-L559 HydrophobicContact CG-CD2 4.2Å
552	R	69.3	Low	80.4	Confident	120 Å²	120	89.8 Å²	89.8	45%	0.453	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	119.9	175.6	-171.3	-175.4	-76.9	-147.6	-1.6	108.8	G556 A558 E560	R552-G556 VanDerWaalsContact O-O 3.07Å; R552-A558 PolarHBondContact N-O 2.85Å; R552-A558 PolarHBondContact O-N 2.91Å; R552-E560 IonicContact CZ-OE1 2.81Å; R552-E560 IonicContact NE-OE1 2.76Å; R552-E560 IonicContact NH2-OE1 3.21Å; R552-E560 PolarHBondContact NH2-OE1 2.86Å
553	Q	62.9	Low	81.1	Confident	157 Å²	157	81.3 Å²	81.3	73%	0.734	41%	0.409	S	S	*	.			trans	-106.4	5.3	-175.2	-69	-166.9	-27	0	0	115.1
554	Q	53.6	Low	81.6	Confident	192 Å²	192	80.3 Å²	80.3	90%	0.897	40%	0.401	S	S	*	.	S	Bend	trans	-102.8	-0.1	-170.3	-74.5	-175.3	-29.1	0	0	115.6
555	A	45	Very low	81.8	Confident	85 Å²	85	76.2 Å²	76.2	70%	0.702	38%	0.379	S	S	*	.	S	Bend	trans	-157.6	58.6	-179.8	0	0	0	0	0	111.7
556	G	60.5	Low	82	Confident	55 Å²	55	76.1 Å²	76.1	57%	0.567	38%	0.376	S	S	*	.	S	Bend	trans	79.5	163.6	-161.3	0	0	0	0	0	111.4	R552 A558	R552-G556 VanDerWaalsContact O-O 3.07Å; G556-A558 PolarHBondContact O-N 2.76Å
557	E	63.3	Low	82	Confident	161 Å²	161	72.8 Å²	72.8	75%	0.752	36%	0.361	S	S	*	.	S	Bend	trans	-78.8	118.6	172.9	-63.5	-163.9	142.5	0	0	108.9
558	A	80.4	Confident	82.1	Confident	8 Å²	8	74.9 Å²	74.9	7%	0.066	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	133.3	179	0	0	0	0	0	110.9	F495 S523 R552 G556	F495-A558 HydrophobicContact CE2-CB 4.41Å; F495-A558 HydrophobicContact CZ-CB 3.86Å; S523-A558 CarbonylContact O-C 3.48Å; S523-A558 WeakPolarHBondContact O-CA 3.45Å; R552-A558 PolarHBondContact N-O 2.85Å; R552-A558 PolarHBondContact O-N 2.91Å; G556-A558 PolarHBondContact O-N 2.76Å
559	L	86	Confident	82.2	Confident	18 Å²	18	76.5 Å²	76.5	9%	0.094	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	124.4	165.7	-74.4	-177.8	0	0	0	108.9	V522 S523 S525 M529 V549 Y551	V522-L559 CarbonylContact C-O 3.55Å; V522-L559 WeakPolarHBondContact CA-O 3.4Å; S523-L559 PolarHBondContact N-O 2.8Å; S523-L559 PolarHBondContact O-N 3.38Å; S525-L559 WeakPolarHBondContact O-CD1 3.19Å; M529-L559 HydrophobicContact CE-CB 3.67Å; M529-L559 WeakPolarHBondContact CE-O 3.19Å; V549-L559 HydrophobicContact CG1-CD2 3.98Å; Y551-L559 HydrophobicContact CD1-CD2 3.72Å; Y551-L559 HydrophobicContact CD2-CD2 4.39Å; Y551-L559 HydrophobicContact CE1-CD2 3.41Å; Y551-L559 VanDerWaalsContact CE1-CD2 3.41Å; Y551-L559 HydrophobicContact CE1-CG 4.47Å; Y551-L559 HydrophobicContact CE2-CD2 4.12Å; Y551-L559 HydrophobicContact CG-CD2 4.2Å
560	E	91.1	Very high	82.4	Confident	29 Å²	29	72.6 Å²	72.6	14%	0.136	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.7	167.9	175.1	175.4	-90.2	0	0	108.5	T520 A521 V522 V549 R550 R552	T520-E560 HydrophobicContact CG2-CG 3.81Å; A521-E560 WeakPolarHBondContact O-CA 3.47Å; V522-E560 HydrophobicContact CG1-CB 4.1Å; V522-E560 HydrophobicContact CG1-CG 4.29Å; V549-E560 CarbonylContact C-O 3.59Å; V549-E560 WeakPolarHBondContact CA-O 3.43Å; R550-E560 HydrophobicContact CB-CB 4.27Å; R550-E560 PolarHBondContact N-O 2.91Å; R550-E560 PolarHBondContact O-N 2.9Å; R552-E560 IonicContact CZ-OE1 2.81Å; R552-E560 IonicContact NE-OE1 2.76Å; R552-E560 IonicContact NH2-OE1 3.21Å; R552-E560 PolarHBondContact NH2-OE1 2.86Å
561	Y	93.3	Very high	82.8	Confident	24 Å²	24	67.9 Å²	67.9	9%	0.094	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	119.7	-179.7	-172	-71.5	0	0	0	109	T520 A521 M529 T531 N547 F548 V549	T520-Y561 CarbonylContact C-O 3.21Å; T520-Y561 VanDerWaalsContact CA-O 3.32Å; T520-Y561 WeakPolarHBondContact CA-O 3.14Å; A521-Y561 PolarHBondContact N-O 2.82Å; A521-Y561 PolarHBondContact O-N 2.9Å; M529-Y561 HydrophobicContact CB-CD2 3.58Å; M529-Y561 HydrophobicContact CB-CE2 4.17Å; M529-Y561 HydrophobicContact CB-CG 3.9Å; M529-Y561 WeakPolarHBondContact O-CE2 3.24Å; T531-Y561 WeakPolarHBondContact OG1-CE1 3.18Å; N547-Y561 HydrophobicContact CB-CE1 4.27Å; N547-Y561 WeakPolarHBondContact CB-OH 3.16Å; N547-Y561 VanDerWaalsContact CG-OH 3.25Å; N547-Y561 WeakPolarHBondContact OD1-CE1 3.34Å; N547-Y561 PolarHBondContact OD1-OH 3.14Å; F548-Y561 WeakPolarHBondContact O-CA 3.23Å; V549-Y561 HydrophobicContact CG2-CD2 3.7Å; V549-Y561 HydrophobicContact CG2-CE2 4.05Å
562	T	95.6	Very high	83.5	Confident	19 Å²	19	62.3 Å²	62.3	12%	0.117	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	133.8	174.3	-62.1	0	0	0	0	110	T518 C519 T520 N547 F548 I564	T518-T562 HydrophobicContact CG2-CG2 3.92Å; C519-T562 CarbonylContact O-C 3.44Å; C519-T562 VanDerWaalsContact O-CA 3.32Å; C519-T562 WeakPolarHBondContact O-CA 3.4Å; T520-T562 WeakPolarHBondContact CG2-OG1 3.17Å; T520-T562 PolarHBondContact OG1-OG1 3Å; N547-T562 CarbonylContact C-O 3.48Å; N547-T562 WeakPolarHBondContact CA-O 3.24Å; F548-T562 PolarHBondContact N-O 2.86Å; F548-T562 PolarHBondContact O-N 3.33Å; T562-I564 HydrophobicContact CG2-CG1 4.1Å
563	S	96.6	Very high	84.6	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.1	172.4	-165.2	0	0	0	0	109.1	C519 T531 W533 V545 E546 N547	C519-S563 PolarHBondContact N-O 3.08Å; C519-S563 PolarHBondContact O-N 3.28Å; T531-S563 WeakPolarHBondContact CG2-OG 3.47Å; W533-S563 PolarHBondContact NE1-OG 2.95Å; W533-S563 VanDerWaalsContact NE1-OG 3.08Å; V545-S563 WeakPolarHBondContact CG1-OG 3.41Å; E546-S563 CarbonylContact O-C 3.5Å; E546-S563 WeakPolarHBondContact O-CA 3.4Å; N547-S563 WeakPolarHBondContact OD1-CB 3.42Å; N547-S563 PolarHBondContact OD1-OG 2.87Å
564	I	96.6	Very high	86	Confident	33 Å²	33	55.6 Å²	55.6	17%	0.169	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	114	177.1	-52.2	-175.5	0	0	0	107.9	L517 T518 V545 E546 F548 T562	L517-I564 WeakPolarHBondContact O-CA 3.4Å; T518-I564 HydrophobicContact CG2-CG1 4.26Å; V545-I564 CarbonylContact C-O 3.57Å; V545-I564 VanDerWaalsContact CA-O 3.26Å; V545-I564 WeakPolarHBondContact CA-O 3.4Å; E546-I564 PolarHBondContact N-O 3.2Å; E546-I564 PolarHBondContact O-N 3.45Å; F548-I564 HydrophobicContact CD2-CD1 4.47Å; F548-I564 HydrophobicContact CE2-CD1 3.84Å; F548-I564 HydrophobicContact CE2-CG1 4.19Å; T562-I564 HydrophobicContact CG2-CG1 4.1Å
565	L	96.9	Very high	87.9	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	125.3	170.8	168.8	64.1	0	0	0	109.1	T516 L517 W533 L540 V543 V545 L567 Y578	T516-L565 WeakPolarHBondContact CA-O 3.34Å; L517-L565 HydrophobicContact CB-CB 4.43Å; L517-L565 HydrophobicContact CD1-CD2 4.4Å; L517-L565 PolarHBondContact N-O 2.8Å; L517-L565 PolarHBondContact O-N 2.97Å; W533-L565 HydrophobicContact CB-CD2 4.15Å; W533-L565 HydrophobicContact CD2-CB 3.79Å; W533-L565 HydrophobicContact CD2-CD2 3.91Å; W533-L565 HydrophobicContact CD2-CG 4.48Å; W533-L565 HydrophobicContact CE3-CB 4.24Å; W533-L565 HydrophobicContact CE3-CD2 3.88Å; W533-L565 HydrophobicContact CG-CB 4.11Å; W533-L565 HydrophobicContact CG-CD2 4.04Å; W533-L565 HydrophobicContact CH2-CB 4.45Å; W533-L565 HydrophobicContact CZ2-CB 4.02Å; L540-L565 HydrophobicContact CD1-CD2 3.86Å; V543-L565 HydrophobicContact CB-CD1 3.84Å; V543-L565 HydrophobicContact CG1-CD1 4.41Å; V543-L565 HydrophobicContact CG2-CD1 4.03Å; V545-L565 HydrophobicContact CG2-CB 4.42Å; V545-L565 HydrophobicContact CG2-CD1 3.85Å; L565-L567 HydrophobicContact CD1-CD2 4.18Å; L565-L567 HydrophobicContact CD2-CD2 4.33Å; L565-L567 HydrophobicContact CG-CD2 4.17Å; L565-L567 HydrophobicContact CG-CG 4.34Å; L565-Y578 HydrophobicContact CD2-CD1 3.67Å; L565-Y578 HydrophobicContact CD2-CE1 3.86Å
566	H	95.7	Very high	90.2	Very high	34 Å²	34	45.5 Å²	45.5	16%	0.157	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	128.2	176.4	-63.8	-77.6	0	0	0	110.6	T516 D544 E546 F568	T516-H566 WeakPolarHBondContact CG2-ND1 3.47Å; D544-H566 HydrophobicContact CB-CB 4.31Å; D544-H566 PolarHBondContact O-N 3.2Å; E546-H566 IonicContact OE2-CD2 3.64Å; E546-H566 IonicContact OE2-CE1 3.54Å; E546-H566 IonicContact OE2-NE2 2.84Å; E546-H566 PolarHBondContact OE2-NE2 2.87Å; H566-F568 HydrophobicContact CB-CD2 4.4Å; H566-F568 HydrophobicContact CB-CE2 3.56Å; H566-F568 HydrophobicContact CB-CZ 3.62Å
567	L	95.1	Very high	91.7	Very high	19 Å²	19	47.6 Å²	47.6	10%	0.099	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	112.8	175.9	-57.2	173.9	0	0	0	108.1	N514 V515 L517 L565 V570 Y578 L596	N514-L567 CarbonylContact C-O 3.44Å; N514-L567 WeakPolarHBondContact CA-O 3.18Å; V515-L567 HydrophobicContact CB-CB 4.38Å; V515-L567 PolarHBondContact N-O 2.84Å; V515-L567 PolarHBondContact O-N 2.94Å; L517-L567 HydrophobicContact CD1-CD1 4.44Å; L565-L567 HydrophobicContact CD1-CD2 4.18Å; L565-L567 HydrophobicContact CD2-CD2 4.33Å; L565-L567 HydrophobicContact CG-CD2 4.17Å; L565-L567 HydrophobicContact CG-CG 4.34Å; L567-V570 HydrophobicContact CB-CG2 3.72Å; L567-Y578 HydrophobicContact CD1-CE1 3.88Å; L567-Y578 HydrophobicContact CD1-CE2 4.36Å; L567-Y578 HydrophobicContact CD2-CE1 4.27Å; L567-L596 HydrophobicContact CD1-CD2 3.65Å
568	F	94.4	Very high	93.2	Very high	116 Å²	116	40 Å²	40	51%	0.509	20%	0.202	S	C	.	.			trans	-101.4	142.7	-175.4	-58.2	-84.7	0	0	0	111.7	N514 D544 H566 V570	N514-F568 HydrophobicContact CB-CD1 4.4Å; N514-F568 WeakPolarHBondContact OD1-CA 3.28Å; D544-F568 HydrophobicContact CB-CE2 4.04Å; D544-F568 VanDerWaalsContact OD2-CE2 3.29Å; D544-F568 WeakPolarHBondContact OD2-CE2 3.41Å; H566-F568 HydrophobicContact CB-CD2 4.4Å; H566-F568 HydrophobicContact CB-CE2 3.56Å; H566-F568 HydrophobicContact CB-CZ 3.62Å; F568-V570 VanDerWaalsContact C-N 3.29Å; F568-V570 PolarHBondContact O-N 3.33Å
569	N	93.5	Very high	93.7	Very high	114 Å²	114	40 Å²	40	61%	0.61	20%	0.2	S	C	*	.	S	Bend	trans	51.2	48.4	176.9	-175.4	71.8	0	0	0	112.5	M513 N514	M513-N569 PolarHBondContact O-N 2.83Å; N514-N569 PolarHBondContact OD1-N 2.88Å
570	V	94.9	Very high	94.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.196	C	C	.	.			trans	-54.6	136.5	-169.1	166.7	0	0	0	0	112.5	A509 R511 G512 M513 V515 L567 F568 D574 L596 V598	A509-V570 HydrophobicContact CB-CG1 4.41Å; R511-V570 CarbonylContact C-O 3.11Å; R511-V570 WeakPolarHBondContact CA-O 3.3Å; G512-V570 PolarHBondContact N-O 3.43Å; M513-V570 WeakPolarHBondContact O-CB 3.48Å; M513-V570 WeakPolarHBondContact O-CG2 3.24Å; M513-V570 PolarHBondContact O-N 2.88Å; V515-V570 HydrophobicContact CB-CG2 4.02Å; V515-V570 HydrophobicContact CG2-CB 4.49Å; V515-V570 HydrophobicContact CG2-CG2 3.85Å; L567-V570 HydrophobicContact CB-CG2 3.72Å; F568-V570 VanDerWaalsContact C-N 3.29Å; F568-V570 PolarHBondContact O-N 3.33Å; V570-D574 WeakPolarHBondContact CA-OD2 3.28Å; V570-D574 HydrophobicContact CG1-CB 4.17Å; V570-L596 HydrophobicContact CG1-CD2 4.12Å; V570-V598 HydrophobicContact CG1-CB 4.47Å; V570-V598 HydrophobicContact CG1-CG1 4.23Å; V570-V598 HydrophobicContact CG1-CG2 3.36Å
571	N	95	Very high	94.1	Very high	54 Å²	54	38.4 Å²	38.4	29%	0.289	19%	0.193	S	C	.	.			trans	-136.5	176	-174.9	90.5	97.5	0	0	0	111.8	T573 D574	N571-T573 PolarHBondContact ND2-OG1 3.06Å; N571-T573 PolarHBondContact O-N 2.91Å; N571-T573 VanDerWaalsContact O-N 3.15Å; N571-T573 PolarHBondContact OD1-N 3.41Å; N571-T573 VanDerWaalsContact OD1-N 3.07Å; N571-T573 PolarHBondContact OD1-OG1 3.25Å; N571-D574 PolarHBondContact N-OD2 2.96Å; N571-D574 PolarHBondContact ND2-OD2 3.18Å; N571-D574 VanDerWaalsContact O-CB 3.29Å; N571-D574 WeakPolarHBondContact O-CB 3.34Å; N571-D574 PolarHBondContact O-N 3.28Å
572	F	92.9	Very high	94.1	Very high	71 Å²	71	37.3 Å²	37.3	31%	0.311	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-60.8	-25.5	-175.2	-54.7	-60.3	0	0	0	114.4	D574 E575 V598 E600 H628	F572-D574 PolarHBondContact O-N 3.04Å; F572-E575 PolarHBondContact O-N 3.32Å; F572-V598 HydrophobicContact CD1-CB 4.22Å; F572-V598 HydrophobicContact CD1-CG1 4.09Å; F572-V598 HydrophobicContact CE1-CG1 4.25Å; F572-V598 WeakPolarHBondContact CE1-O 3.23Å; F572-E600 HydrophobicContact CZ-CB 4.01Å; F572-E600 WeakPolarHBondContact CZ-OE2 3.14Å; F572-H628 AromaticContact CD1-ND1 3.94Å; F572-H628 HydrophobicContact CE1-CB 3.73Å; F572-H628 AromaticContact CE1-CG 3.68Å; F572-H628 AromaticContact CE1-ND1 3.45Å; F572-H628 WeakPolarHBondContact CE1-ND1 3.31Å; F572-H628 HydrophobicContact CZ-CB 3.8Å
573	T	92.4	Very high	93.9	Very high	100 Å²	100	37.8 Å²	37.8	61%	0.613	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-67.7	-17.5	173.5	66.3	0	0	0	0	113.3	K535 N571	K535-T573 VanDerWaalsContact CE-O 3.3Å; K535-T573 WeakPolarHBondContact CE-O 3.4Å; K535-T573 PolarHBondContact NZ-O 2.82Å; N571-T573 PolarHBondContact ND2-OG1 3.06Å; N571-T573 PolarHBondContact O-N 2.91Å; N571-T573 VanDerWaalsContact O-N 3.15Å; N571-T573 PolarHBondContact OD1-N 3.41Å; N571-T573 VanDerWaalsContact OD1-N 3.07Å; N571-T573 PolarHBondContact OD1-OG1 3.25Å
574	D	93.6	Very high	93.6	Very high	35 Å²	35	38.4 Å²	38.4	19%	0.187	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-89.3	-8.7	179.7	-48.2	-42	0	0	0	111.8	K535 V570 N571 F572 G576 Y578 L596	K535-D574 VanDerWaalsContact CE-C 3.45Å; K535-D574 VanDerWaalsContact CE-O 3.25Å; K535-D574 WeakPolarHBondContact CE-O 3.29Å; V570-D574 WeakPolarHBondContact CA-OD2 3.28Å; V570-D574 HydrophobicContact CG1-CB 4.17Å; N571-D574 PolarHBondContact N-OD2 2.96Å; N571-D574 PolarHBondContact ND2-OD2 3.18Å; N571-D574 VanDerWaalsContact O-CB 3.29Å; N571-D574 WeakPolarHBondContact O-CB 3.34Å; N571-D574 PolarHBondContact O-N 3.28Å; F572-D574 PolarHBondContact O-N 3.04Å; D574-G576 PolarHBondContact O-N 3.21Å; D574-Y578 VanDerWaalsContact O-CE2 3.3Å; D574-Y578 WeakPolarHBondContact O-CE2 3.26Å; D574-Y578 PolarHBondContact O-OH 3.14Å; D574-Y578 VanDerWaalsContact O-OH 3.08Å; D574-L596 HydrophobicContact CB-CD2 4.28Å
575	E	93.8	Very high	93.1	Very high	57 Å²	57	42.9 Å²	42.9	27%	0.266	22%	0.215	S	C	.	.			trans	-60.9	127.9	171.5	-72.3	-151.4	114.6	0	0	111.2	K535 F572 T597 V598	K535-E575 VanDerWaalsContact CE-O 3.24Å; K535-E575 WeakPolarHBondContact CE-O 3.39Å; K535-E575 PolarHBondContact NZ-O 3.29Å; F572-E575 PolarHBondContact O-N 3.32Å; E575-T597 VanDerWaalsContact OE1-CA 3.27Å; E575-T597 WeakPolarHBondContact OE1-CA 3.25Å; E575-T597 VanDerWaalsContact OE1-CG2 3.26Å; E575-T597 WeakPolarHBondContact OE1-CG2 3.27Å; E575-V598 HydrophobicContact CG-CB 3.7Å; E575-V598 HydrophobicContact CG-CG2 3.76Å; E575-V598 PolarHBondContact OE1-N 3.4Å
576	G	92.2	Very high	92.5	Very high	8 Å²	8	44.1 Å²	44.1	8%	0.082	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.1	176.2	-177.6	0	0	0	0	0	115.3	D536 D574 K595 L596	D536-G576 WeakPolarHBondContact OD1-CA 3.39Å; D536-G576 WeakPolarHBondContact OD2-CA 3.25Å; D574-G576 PolarHBondContact O-N 3.21Å; G576-K595 CarbonylContact O-C 3.58Å; G576-K595 WeakPolarHBondContact O-CA 3Å; G576-L596 PolarHBondContact N-O 3.45Å; G576-L596 VanDerWaalsContact N-O 3.14Å; G576-L596 PolarHBondContact O-N 2.86Å
577	K	91.9	Very high	91.9	Very high	99 Å²	99	42.6 Å²	42.6	43%	0.43	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	101.8	173	-62.8	176.5	-169.4	166.7	0	110.1	D352 D536 A594	D352-K577 IonicContact OD2-NZ 3.56Å; D536-K577 PolarHBondContact N-O 3.19Å; D536-K577 PolarHBondContact OD1-N 3.47Å; K577-A594 CarbonylContact C-O 3.56Å; K577-A594 WeakPolarHBondContact CA-O 3.13Å
578	Y	94.4	Very high	91.5	Very high	3 Å²	3	42 Å²	42	1%	0.012	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	144.8	175.4	-71.4	-101.4	0	0	0	111.7	L517 R534 K535 L540 L565 L567 D574 K593 A594 L596	L517-Y578 HydrophobicContact CD1-CD1 3.75Å; L517-Y578 HydrophobicContact CD1-CD2 4.03Å; L517-Y578 HydrophobicContact CD1-CE1 4.46Å; L517-Y578 HydrophobicContact CD1-CG 3.49Å; L517-Y578 VanDerWaalsContact CD1-CG 3.49Å; R534-Y578 CarbonylContact O-C 3.56Å; R534-Y578 VanDerWaalsContact O-CA 3.27Å; R534-Y578 WeakPolarHBondContact O-CA 3.35Å; K535-Y578 HydrophobicContact CB-CD1 4.25Å; K535-Y578 HydrophobicContact CB-CE1 4.05Å; K535-Y578 HydrophobicContact CD-CE1 4.26Å; K535-Y578 HydrophobicContact CD-CE2 4.13Å; K535-Y578 WeakPolarHBondContact CD-OH 3.37Å; K535-Y578 HydrophobicContact CG-CD2 4.43Å; K535-Y578 HydrophobicContact CG-CE1 4.19Å; K535-Y578 HydrophobicContact CG-CE2 3.98Å; L540-Y578 HydrophobicContact CD1-CD1 4.01Å; L540-Y578 HydrophobicContact CD1-CE1 3.75Å; L565-Y578 HydrophobicContact CD2-CD1 3.67Å; L565-Y578 HydrophobicContact CD2-CE1 3.86Å; L567-Y578 HydrophobicContact CD1-CE1 3.88Å; L567-Y578 HydrophobicContact CD1-CE2 4.36Å; L567-Y578 HydrophobicContact CD2-CE1 4.27Å; D574-Y578 VanDerWaalsContact O-CE2 3.3Å; D574-Y578 WeakPolarHBondContact O-CE2 3.26Å; D574-Y578 PolarHBondContact O-OH 3.14Å; D574-Y578 VanDerWaalsContact O-OH 3.08Å; Y578-K593 CarbonylContact O-C 3.54Å; Y578-K593 WeakPolarHBondContact O-CA 3.34Å; Y578-A594 PolarHBondContact N-O 3.47Å; Y578-A594 PolarHBondContact O-N 2.87Å; Y578-L596 HydrophobicContact CD2-CB 4Å; Y578-L596 HydrophobicContact CE2-CB 3.78Å; Y578-L596 HydrophobicContact CE2-CD2 3.99Å
579	Q	92.5	Very high	91.1	Very high	6 Å²	6	39 Å²	39	3%	0.028	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	143.7	173.4	-165.3	-168.5	46.8	0	0	110.4	W533 R534 S591 K593	W533-Q579 WeakPolarHBondContact CA-O 3.5Å; R534-Q579 HydrophobicContact CG-CB 3.72Å; R534-Q579 VanDerWaalsContact CZ-OE1 3.24Å; R534-Q579 PolarHBondContact N-O 2.9Å; R534-Q579 PolarHBondContact O-N 3.34Å; Q579-S591 WeakPolarHBondContact CG-O 3.44Å; Q579-S591 VanDerWaalsContact CG-OG 3.25Å; Q579-S591 WeakPolarHBondContact CG-OG 3.37Å; Q579-S591 PolarHBondContact NE2-O 2.82Å; Q579-K593 HydrophobicContact CB-CG 4.35Å; Q579-K593 HydrophobicContact CG-CG 4.38Å
580	C	93.7	Very high	90.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	138.2	173.2	162.7	0	0	0	0	110.1	C519 T531 W533 S591	C519-C580 HydrophobicContact CB-CB 3.39Å; C519-C580 WeakPolarHBondContact CB-SG 3Å; C519-C580 WeakPolarHBondContact SG-CB 3.27Å; C519-C580 CovalentContact SG-SG 2.03Å; C519-C580 PolarHBondContact SG-SG 2.92Å; T531-C580 VanDerWaalsContact CG2-SG 3.56Å; W533-C580 HydrophobicContact CD2-CB 4.19Å; W533-C580 HydrophobicContact CE3-CB 4.02Å; W533-C580 HydrophobicContact CH2-CB 3.88Å; W533-C580 HydrophobicContact CZ2-CB 4.02Å; W533-C580 HydrophobicContact CZ3-CB 3.88Å; C580-S591 PolarHBondContact N-OG 2.65Å; C580-S591 PolarHBondContact O-N 3.34Å; C580-S591 PolarHBondContact O-OG 3.13Å
581	I	91.4	Very high	90.8	Very high	15 Å²	15	35.1 Å²	35.1	8%	0.077	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	114.1	178	-47.1	171.7	0	0	0	107.7	T531 V532 R534 N589 Y590	T531-I581 CarbonylContact C-O 3.51Å; T531-I581 VanDerWaalsContact CA-O 3.31Å; T531-I581 WeakPolarHBondContact CA-O 3.19Å; V532-I581 HydrophobicContact CB-CB 4.49Å; V532-I581 PolarHBondContact N-O 2.95Å; V532-I581 PolarHBondContact O-N 3.1Å; R534-I581 HydrophobicContact CG-CD1 4.42Å; I581-N589 CarbonylContact C-O 3.57Å; I581-N589 WeakPolarHBondContact CA-O 3.2Å; I581-Y590 HydrophobicContact CB-CD1 4.38Å; I581-Y590 HydrophobicContact CB-CE1 4.36Å; I581-Y590 HydrophobicContact CD1-CD1 4.16Å; I581-Y590 HydrophobicContact CD1-CE1 3.77Å; I581-Y590 HydrophobicContact CG1-CD1 3.76Å; I581-Y590 HydrophobicContact CG1-CE1 3.83Å; I581-Y590 HydrophobicContact CG2-CD1 3.96Å; I581-Y590 HydrophobicContact CG2-CE1 3.65Å; I581-Y590 HydrophobicContact CG2-CE2 4.36Å; I581-Y590 HydrophobicContact CG2-CG 4.45Å
582	V	92.7	Very high	90.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	130.5	179.6	-168.1	0	0	0	0	109.9	P498 I500 A521 M529 S530 S588 N589	P498-V582 HydrophobicContact CB-CB 4.38Å; P498-V582 HydrophobicContact CB-CG1 4.12Å; P498-V582 HydrophobicContact CG-CG1 4.47Å; I500-V582 HydrophobicContact CD1-CG2 4.37Å; I500-V582 HydrophobicContact CG1-CG2 4.29Å; A521-V582 HydrophobicContact CB-CB 4.14Å; A521-V582 HydrophobicContact CB-CG1 3.98Å; A521-V582 HydrophobicContact CB-CG2 3.95Å; M529-V582 HydrophobicContact CB-CG1 4.13Å; M529-V582 HydrophobicContact CG-CG1 4.21Å; M529-V582 HydrophobicContact SD-CG1 4.12Å; S530-V582 CarbonylContact O-C 3.59Å; S530-V582 WeakPolarHBondContact O-CA 3.11Å; V582-S588 CarbonylContact O-C 3.08Å; V582-S588 WeakPolarHBondContact O-CA 3.26Å; V582-N589 PolarHBondContact N-O 3.5Å; V582-N589 PolarHBondContact O-N 3.11Å
583	T	90.8	Very high	90.4	Very high	30 Å²	30	38.3 Å²	38.3	18%	0.184	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	135.1	-173.2	-56.1	0	0	0	0	111.7	M529 S530 G587 S588	M529-T583 CarbonylContact C-O 3.47Å; M529-T583 WeakPolarHBondContact CA-O 3.35Å; S530-T583 PolarHBondContact N-O 2.92Å; S530-T583 PolarHBondContact O-N 2.92Å; S530-T583 PolarHBondContact OG-O 3.21Å; T583-G587 WeakPolarHBondContact CA-O 3.27Å; T583-S588 VanDerWaalsContact CG2-OG 3.27Å; T583-S588 WeakPolarHBondContact CG2-OG 3.33Å; T583-S588 WeakPolarHBondContact OG1-CB 3.39Å; T583-S588 PolarHBondContact OG1-OG 3.14Å
584	N	90.1	Very high	90.5	Very high	12 Å²	12	33.6 Å²	33.6	6%	0.064	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	-167.7	163.1	76.1	2.1	0	0	0	110	L496 P498 M529 F586 G587	L496-N584 PolarHBondContact O-ND2 3.16Å; P498-N584 WeakPolarHBondContact CD-OD1 3.27Å; P498-N584 HydrophobicContact CG-CB 4.11Å; M529-N584 HydrophobicContact CG-CB 4.03Å; N584-F586 PolarHBondContact O-N 3.42Å; N584-F586 PolarHBondContact OD1-N 2.72Å; N584-G587 PolarHBondContact N-O 3.08Å; N584-G587 VanDerWaalsContact N-O 3.17Å; N584-G587 PolarHBondContact O-N 3.49Å
585	H	86.1	Confident	90.6	Very high	127 Å²	127	36.8 Å²	36.8	59%	0.588	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-26.3	-179.6	-168.7	73.5	0	0	0	114.3	M423 H473 S527	M423-H585 VanDerWaalsContact CE-O 3.32Å; M423-H585 WeakPolarHBondContact CE-O 3.42Å; H473-H585 AromaticContact NE2-CD2 3.92Å; H473-H585 AromaticContact NE2-NE2 3.9Å; S527-H585 VanDerWaalsContact OG-CB 3.22Å; S527-H585 WeakPolarHBondContact OG-CB 3.17Å; S527-H585 PolarHBondContact OG-N 3.24Å; S527-H585 VanDerWaalsContact OG-N 3.11Å
586	F	84.5	Confident	90.7	Very high	26 Å²	26	34.2 Å²	34.2	11%	0.114	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	3.1	-178.9	-58.2	-84.4	0	0	0	113.5	H473 L496 K497 S525 N584	H473-F586 HydrophobicContact CB-CE1 4.34Å; H473-F586 AromaticContact CD2-CD1 3.88Å; H473-F586 AromaticContact CD2-CE1 3.79Å; H473-F586 AromaticContact CE1-CE1 3.9Å; H473-F586 AromaticContact CG-CE1 3.74Å; H473-F586 AromaticContact ND1-CE1 3.81Å; H473-F586 AromaticContact NE2-CE1 3.91Å; L496-F586 HydrophobicContact CB-CB 4.19Å; L496-F586 HydrophobicContact CB-CD1 3.93Å; L496-F586 HydrophobicContact CB-CD2 3.85Å; L496-F586 HydrophobicContact CB-CE1 4.28Å; L496-F586 HydrophobicContact CB-CE2 4.23Å; L496-F586 HydrophobicContact CB-CG 3.7Å; L496-F586 HydrophobicContact CB-CZ 4.42Å; L496-F586 HydrophobicContact CD1-CD1 4.13Å; L496-F586 HydrophobicContact CD1-CE1 3.85Å; L496-F586 HydrophobicContact CD1-CZ 4.21Å; L496-F586 WeakPolarHBondContact O-CD2 3.3Å; K497-F586 HydrophobicContact CB-CB 4.47Å; S525-F586 WeakPolarHBondContact OG-CE2 3.26Å; N584-F586 PolarHBondContact O-N 3.42Å; N584-F586 PolarHBondContact OD1-N 2.72Å
587	G	83.3	Confident	90.9	Very high	3 Å²	3	34.8 Å²	34.8	3%	0.031	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	125.8	-173.5	168	0	0	0	0	0	114.9	P498 T583 N584	P498-G587 WeakPolarHBondContact CD-O 3.44Å; T583-G587 WeakPolarHBondContact CA-O 3.27Å; N584-G587 PolarHBondContact N-O 3.08Å; N584-G587 VanDerWaalsContact N-O 3.17Å; N584-G587 PolarHBondContact O-N 3.49Å
588	S	86.3	Confident	91.1	Very high	5 Å²	5	30 Å²	30	4%	0.035	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	146.6	-174.7	-58.6	0	0	0	0	112.4	K497 V582 T583	K497-S588 WeakPolarHBondContact CE-O 3.33Å; K497-S588 PolarHBondContact NZ-O 2.81Å; V582-S588 CarbonylContact O-C 3.08Å; V582-S588 WeakPolarHBondContact O-CA 3.26Å; T583-S588 VanDerWaalsContact CG2-OG 3.27Å; T583-S588 WeakPolarHBondContact CG2-OG 3.33Å; T583-S588 WeakPolarHBondContact OG1-CB 3.39Å; T583-S588 PolarHBondContact OG1-OG 3.14Å
589	N	87.4	Confident	91.1	Very high	55 Å²	55	30 Å²	30	29%	0.294	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	151.9	172.7	-160.8	-5.8	0	0	0	110.6	P498 I500 I581 V582	P498-N589 WeakPolarHBondContact O-CB 3.09Å; P498-N589 PolarHBondContact O-ND2 3.05Å; I500-N589 HydrophobicContact CD1-CB 4.31Å; I500-N589 HydrophobicContact CG1-CB 4.46Å; I581-N589 CarbonylContact C-O 3.57Å; I581-N589 WeakPolarHBondContact CA-O 3.2Å; V582-N589 PolarHBondContact N-O 3.5Å; V582-N589 PolarHBondContact O-N 3.11Å
590	Y	89.4	Confident	91.2	Very high	27 Å²	27	32.7 Å²	32.7	11%	0.106	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131.5	-163.4	-65	-100.7	0	0	0	110.9	W373 E376 D377 I581	W373-Y590 HydrophobicContact CB-CE1 3.92Å; E376-Y590 HydrophobicContact CB-CD2 4.37Å; E376-Y590 HydrophobicContact CB-CE2 3.47Å; E376-Y590 VanDerWaalsContact CB-CE2 3.47Å; E376-Y590 VanDerWaalsContact O-CD2 3.26Å; E376-Y590 WeakPolarHBondContact O-CD2 3.48Å; E376-Y590 WeakPolarHBondContact O-CE2 3.37Å; D377-Y590 HydrophobicContact CB-CD1 3.78Å; D377-Y590 HydrophobicContact CB-CE1 4.24Å; D377-Y590 HydrophobicContact CB-CG 3.95Å; I581-Y590 HydrophobicContact CB-CD1 4.38Å; I581-Y590 HydrophobicContact CB-CE1 4.36Å; I581-Y590 HydrophobicContact CD1-CD1 4.16Å; I581-Y590 HydrophobicContact CD1-CE1 3.77Å; I581-Y590 HydrophobicContact CG1-CD1 3.76Å; I581-Y590 HydrophobicContact CG1-CE1 3.83Å; I581-Y590 HydrophobicContact CG2-CD1 3.96Å; I581-Y590 HydrophobicContact CG2-CE1 3.65Å; I581-Y590 HydrophobicContact CG2-CE2 4.36Å; I581-Y590 HydrophobicContact CG2-CG 4.45Å
591	S	92.1	Very high	91.1	Very high	5 Å²	5	37.4 Å²	37.4	4%	0.035	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-71.3	170.7	178.1	78.5	0	0	0	0	112	P504 Q579 C580	P504-S591 WeakPolarHBondContact CD-OG 3.29Å; Q579-S591 WeakPolarHBondContact CG-O 3.44Å; Q579-S591 VanDerWaalsContact CG-OG 3.25Å; Q579-S591 WeakPolarHBondContact CG-OG 3.37Å; Q579-S591 PolarHBondContact NE2-O 2.82Å; C580-S591 PolarHBondContact N-OG 2.65Å; C580-S591 PolarHBondContact O-N 3.34Å; C580-S591 PolarHBondContact O-OG 3.13Å
592	Q	90.6	Very high	91.2	Very high	129 Å²	129	37.2 Å²	37.2	60%	0.603	18%	0.18	S	C	*	.	P	Polyproline II helix	trans	-61.7	150.6	159.7	-63.4	-179.2	31.6	0	0	109.9	H503	H503-Q592 HydrophobicContact CB-CB 4.14Å; H503-Q592 HydrophobicContact CB-CG 4.46Å; H503-Q592 VanDerWaalsContact CD2-CD 3.48Å; H503-Q592 PolarHBondContact CD2-NE2 2.94Å; H503-Q592 PolarHBondContact ND1-N 2.95Å; H503-Q592 PolarHBondContact NE2-NE2 3.13Å
593	K	89.8	Confident	91.3	Very high	63 Å²	63	39.4 Å²	39.4	27%	0.274	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-80.6	116.1	177.3	-71	175	176.9	170.9	0	108.7	D352 Y578 Q579	D352-K593 IonicContact OD1-NZ 2.71Å; D352-K593 PolarHBondContact OD1-NZ 2.91Å; D352-K593 IonicContact OD2-NZ 2.92Å; D352-K593 PolarHBondContact OD2-NZ 2.92Å; Y578-K593 CarbonylContact O-C 3.54Å; Y578-K593 WeakPolarHBondContact O-CA 3.34Å; Q579-K593 HydrophobicContact CB-CG 4.35Å; Q579-K593 HydrophobicContact CG-CG 4.38Å
594	A	94.9	Very high	91.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	129	176.3	0	0	0	0	0	110.7	P504 E505 K577 Y578	P504-A594 HydrophobicContact CB-CB 3.81Å; P504-A594 HydrophobicContact CG-CB 3.87Å; E505-A594 WeakPolarHBondContact O-CB 3.26Å; K577-A594 CarbonylContact C-O 3.56Å; K577-A594 WeakPolarHBondContact CA-O 3.13Å; Y578-A594 PolarHBondContact N-O 3.47Å; Y578-A594 PolarHBondContact O-N 2.87Å
595	K	95.4	Very high	91.6	Very high	101 Å²	101	45 Å²	45	44%	0.439	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	129.7	172.8	-166.9	-168.7	178.4	-141.4	0	110.1	T506 I507 G576 T597	T506-K595 CarbonylContact C-O 3.12Å; T506-K595 WeakPolarHBondContact CA-O 3.34Å; T506-K595 HydrophobicContact CG2-CB 4.02Å; T506-K595 WeakPolarHBondContact CG2-O 3.48Å; T506-K595 PolarHBondContact OG1-N 3.46Å; I507-K595 PolarHBondContact N-O 3.06Å; G576-K595 CarbonylContact O-C 3.58Å; G576-K595 WeakPolarHBondContact O-CA 3Å; K595-T597 WeakPolarHBondContact CD-OG1 3.32Å; K595-T597 VanDerWaalsContact CE-OG1 3.31Å; K595-T597 WeakPolarHBondContact CE-OG1 3.31Å; K595-T597 PolarHBondContact NZ-OG1 3.24Å
596	L	96.3	Very high	91.9	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	128.2	158.3	-178.2	53.2	0	0	0	108.6	I507 A509 V515 L567 V570 D574 G576 Y578 V598	I507-L596 HydrophobicContact CB-CD1 4.17Å; I507-L596 HydrophobicContact CG2-CD1 4.04Å; I507-L596 WeakPolarHBondContact O-CA 3.39Å; A509-L596 HydrophobicContact CB-CD1 4.01Å; V515-L596 HydrophobicContact CG1-CD1 4.28Å; V515-L596 HydrophobicContact CG2-CD1 4.36Å; L567-L596 HydrophobicContact CD1-CD2 3.65Å; V570-L596 HydrophobicContact CG1-CD2 4.12Å; D574-L596 HydrophobicContact CB-CD2 4.28Å; G576-L596 PolarHBondContact N-O 3.45Å; G576-L596 VanDerWaalsContact N-O 3.14Å; G576-L596 PolarHBondContact O-N 2.86Å; Y578-L596 HydrophobicContact CD2-CB 4Å; Y578-L596 HydrophobicContact CE2-CB 3.78Å; Y578-L596 HydrophobicContact CE2-CD2 3.99Å; L596-V598 HydrophobicContact CD1-CG2 4.49Å; L596-V598 HydrophobicContact CG-CG2 4.18Å
597	T	95.1	Very high	92.3	Very high	20 Å²	20	44.1 Å²	44.1	12%	0.123	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	135.5	172.2	-49.4	0	0	0	0	108.1	I507 I508 A509 E575 K595	I507-T597 PolarHBondContact O-N 3.34Å; I508-T597 WeakPolarHBondContact CA-O 3.47Å; A509-T597 PolarHBondContact N-O 3.15Å; E575-T597 VanDerWaalsContact OE1-CA 3.27Å; E575-T597 WeakPolarHBondContact OE1-CA 3.25Å; E575-T597 VanDerWaalsContact OE1-CG2 3.26Å; E575-T597 WeakPolarHBondContact OE1-CG2 3.27Å; K595-T597 WeakPolarHBondContact CD-OG1 3.32Å; K595-T597 VanDerWaalsContact CE-OG1 3.31Å; K595-T597 WeakPolarHBondContact CE-OG1 3.31Å; K595-T597 PolarHBondContact NZ-OG1 3.24Å
598	V	95.8	Very high	92.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	111.3	-173.3	-178.1	0	0	0	0	109.2	R511 V570 F572 E575 L596 H628	R511-V598 HydrophobicContact CB-CG1 4.25Å; V570-V598 HydrophobicContact CG1-CB 4.47Å; V570-V598 HydrophobicContact CG1-CG1 4.23Å; V570-V598 HydrophobicContact CG1-CG2 3.36Å; F572-V598 HydrophobicContact CD1-CB 4.22Å; F572-V598 HydrophobicContact CD1-CG1 4.09Å; F572-V598 HydrophobicContact CE1-CG1 4.25Å; F572-V598 WeakPolarHBondContact CE1-O 3.23Å; E575-V598 HydrophobicContact CG-CB 3.7Å; E575-V598 HydrophobicContact CG-CG2 3.76Å; E575-V598 PolarHBondContact OE1-N 3.4Å; L596-V598 HydrophobicContact CD1-CG2 4.49Å; L596-V598 HydrophobicContact CG-CG2 4.18Å; V598-H628 PolarHBondContact O-ND1 3.32Å
599	N	94.7	Very high	93.2	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.016	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	157.6	179.1	-61.8	-19.5	0	0	0	110.7	I508 A509 L510 R511 H628 I680 A681	I508-N599 WeakPolarHBondContact CG2-ND2 3.38Å; A509-N599 PolarHBondContact O-N 2.84Å; L510-N599 CarbonylContact C-O 3.51Å; L510-N599 WeakPolarHBondContact CA-O 3.37Å; L510-N599 HydrophobicContact CD2-CB 4.43Å; R511-N599 PolarHBondContact N-O 3.3Å; N599-H628 CarbonylContact C-O 3.59Å; N599-H628 WeakPolarHBondContact CA-O 3.48Å; N599-H628 VanDerWaalsContact CB-O 3.27Å; N599-H628 WeakPolarHBondContact CB-O 3.36Å; N599-I680 WeakPolarHBondContact ND2-CD1 3.4Å; N599-A681 HydrophobicContact CB-CB 3.73Å
600	E	94.2	Very high	93.6	Very high	61 Å²	61	54.1 Å²	54.1	29%	0.285	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	124	173.4	-179.7	151.8	-128.2	0	0	107.6	R511 F572 H628 N679	R511-E600 WeakPolarHBondContact CD-OE1 3.49Å; R511-E600 IonicContact CZ-OE1 2.71Å; R511-E600 IonicContact NE-OE1 3.33Å; R511-E600 VanDerWaalsContact NH1-CD 3.3Å; R511-E600 IonicContact NH1-OE1 3.8Å; R511-E600 PolarHBondContact NH1-OE1 3.09Å; R511-E600 IonicContact NH1-OE2 2.94Å; R511-E600 PolarHBondContact NH1-OE2 3.03Å; R511-E600 VanDerWaalsContact NH1-OE2 3.09Å; F572-E600 HydrophobicContact CZ-CB 4.01Å; F572-E600 WeakPolarHBondContact CZ-OE2 3.14Å; E600-H628 HydrophobicContact CB-CB 3.9Å; E600-H628 PolarHBondContact N-O 2.99Å; E600-H628 PolarHBondContact O-N 2.84Å; E600-N679 PolarHBondContact O-ND2 3.01Å
601	M	91.8	Very high	93.9	Very high	100 Å²	100	54.9 Å²	54.9	49%	0.493	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	154.5	177.4	-77	-164.2	-63.7	0	0	110.3	L510 A681	L510-M601 HydrophobicContact CD1-CE 4.34Å; L510-M601 HydrophobicContact CD1-CG 4.25Å; L510-M601 HydrophobicContact CD1-SD 4.3Å; L510-M601 HydrophobicContact CD2-CG 4.13Å; M601-A681 HydrophobicContact CG-CB 3.88Å
602	P	94.8	Very high	94	Very high	10 Å²	10	58.9 Å²	58.9	7%	0.065	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	150.7	-179.3	-20.5	32.4	0	0	0	112.4	E626 P631 A677 N679 L684	P602-E626 CarbonylContact C-O 3.58Å; P602-E626 WeakPolarHBondContact CA-O 3.31Å; P602-P631 HydrophobicContact CB-CB 3.96Å; P602-P631 HydrophobicContact CB-CG 4.3Å; P602-P631 HydrophobicContact CG-CB 4.01Å; P602-A677 HydrophobicContact CB-CB 4.18Å; P602-N679 WeakPolarHBondContact CD-OD1 3.4Å; P602-N679 HydrophobicContact CG-CB 4.45Å; P602-L684 HydrophobicContact CB-CD1 4.19Å; P602-L684 HydrophobicContact CB-CD2 3.94Å; P602-L684 HydrophobicContact CB-CG 4.01Å; P602-L684 HydrophobicContact CG-CD2 4.28Å; P602-L684 WeakPolarHBondContact O-CD1 3.28Å; P602-L684 VanDerWaalsContact O-CD2 3.27Å; P602-L684 WeakPolarHBondContact O-CD2 3.48Å
603	S	94.4	Very high	94.1	Very high	47 Å²	47	54.2 Å²	54.2	33%	0.329	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	132.2	176	154.6	0	0	0	0	108.4	L605 A625 E626	S603-L605 PolarHBondContact O-N 3.15Å; S603-A625 CarbonylContact O-C 3.53Å; S603-A625 WeakPolarHBondContact O-CA 3.4Å; S603-A625 VanDerWaalsContact O-CB 3.23Å; S603-A625 WeakPolarHBondContact O-CB 3.27Å; S603-E626 WeakPolarHBondContact CB-OE1 3.47Å; S603-E626 PolarHBondContact N-O 2.91Å; S603-E626 PolarHBondContact O-N 3.08Å; S603-E626 PolarHBondContact OG-OE1 2.87Å
604	F	94.3	Very high	94.2	Very high	55 Å²	55	57.6 Å²	57.6	24%	0.241	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	114.8	-179.7	-79.3	-56.7	0	0	0	111.3	T607 A625 A677 L684 A686	F604-T607 HydrophobicContact CB-CG2 3.76Å; F604-T607 HydrophobicContact CD1-CG2 4.29Å; F604-T607 HydrophobicContact CD2-CG2 3.91Å; F604-T607 HydrophobicContact CG-CG2 3.76Å; F604-A625 HydrophobicContact CD1-CB 4.2Å; F604-A677 HydrophobicContact CE1-CB 3.87Å; F604-A677 HydrophobicContact CZ-CB 4.35Å; F604-L684 HydrophobicContact CD2-CD1 3.65Å; F604-L684 HydrophobicContact CE2-CB 3.97Å; F604-L684 HydrophobicContact CE2-CD1 3.73Å; F604-L684 HydrophobicContact CE2-CG 4.34Å; F604-L684 HydrophobicContact CG-CD1 4.13Å; F604-L684 HydrophobicContact CZ-CB 4.41Å; F604-L684 HydrophobicContact CZ-CD1 4.26Å; F604-A686 HydrophobicContact CD2-CB 4.29Å; F604-A686 HydrophobicContact CE1-CB 4.45Å; F604-A686 HydrophobicContact CE2-CB 3.71Å; F604-A686 HydrophobicContact CZ-CB 3.82Å
605	L	92.6	Very high	94	Very high	105 Å²	105	59.7 Å²	59.7	55%	0.55	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-33.9	169	-66.7	177.2	0	0	0	111.8	S603 A624 E626	S603-L605 PolarHBondContact O-N 3.15Å; L605-A624 HydrophobicContact CB-CB 3.83Å; L605-A624 PolarHBondContact N-O 2.6Å; L605-E626 HydrophobicContact CD1-CB 4.07Å; L605-E626 HydrophobicContact CD2-CG 4.3Å; L605-E626 HydrophobicContact CG-CB 4.22Å; L605-E626 HydrophobicContact CG-CG 4.26Å
606	K	91.9	Very high	93.6	Very high	72 Å²	72	57.1 Å²	57.1	31%	0.313	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	137.2	173.4	-56.3	172.8	-168.3	147.8	0	108.7	E622 C623 A624 D658	K606-E622 HydrophobicContact CB-CB 4.45Å; K606-E622 HydrophobicContact CD-CB 4.11Å; K606-C623 WeakPolarHBondContact O-CA 3.43Å; K606-A624 HydrophobicContact CB-CB 3.71Å; K606-A624 HydrophobicContact CD-CB 3.84Å; K606-A624 HydrophobicContact CG-CB 3.69Å; K606-A624 PolarHBondContact N-O 2.95Å; K606-A624 VanDerWaalsContact N-O 3.12Å; K606-A624 PolarHBondContact O-N 3.17Å; K606-D658 HydrophobicContact CD-CB 4.2Å; K606-D658 IonicContact NZ-OD2 2.86Å; K606-D658 PolarHBondContact NZ-OD2 2.86Å
607	T	94	Very high	93.3	Very high	61 Å²	61	58.7 Å²	58.7	37%	0.374	32%	0.318	S	S	.	.			trans	-116	148.5	170.3	55.5	0	0	0	0	110.1	F604 E622 A686	F604-T607 HydrophobicContact CB-CG2 3.76Å; F604-T607 HydrophobicContact CD1-CG2 4.29Å; F604-T607 HydrophobicContact CD2-CG2 3.91Å; F604-T607 HydrophobicContact CG-CG2 3.76Å; T607-E622 CarbonylContact C-O 3.19Å; T607-A686 HydrophobicContact CG2-CB 3.72Å
608	P	94.1	Very high	93	Very high	8 Å²	8	62.9 Å²	62.9	5%	0.052	34%	0.338	C	S	.	.			trans	-63.2	152.6	175.1	28.3	-36	0	0	0	111	L621 E622 W635 C675 A686 A688	P608-L621 HydrophobicContact CB-CB 4.22Å; P608-E622 VanDerWaalsContact CA-O 3.29Å; P608-E622 WeakPolarHBondContact CA-O 3.28Å; P608-W635 HydrophobicContact CB-CH2 3.93Å; P608-W635 HydrophobicContact CB-CZ3 4.01Å; P608-W635 HydrophobicContact CG-CH2 4.21Å; P608-W635 HydrophobicContact CG-CZ3 4.09Å; P608-C675 HydrophobicContact CG-CB 4.24Å; P608-A686 HydrophobicContact CG-CB 4.46Å; P608-A688 HydrophobicContact CB-CB 3.72Å; P608-A688 HydrophobicContact CG-CB 4.18Å
609	M	93.9	Very high	92.9	Very high	147 Å²	147	63 Å²	63	72%	0.724	34%	0.339	S	S	*	.			trans	-125	151.3	179.5	-63.8	-172.8	-179.7	0	0	110.8	L611 A688	M609-L611 PolarHBondContact O-N 2.91Å; M609-A688 VanDerWaalsContact C-CB 3.45Å; M609-A688 WeakPolarHBondContact O-CB 3.12Å
610	D	96.5	Very high	92.7	Very high	118 Å²	118	68.9 Å²	68.9	63%	0.631	36%	0.361	S	S	*	.			trans	-55.6	127.9	177.9	-70.3	-44	0	0	0	111.7	S689	D610-S689 WeakPolarHBondContact CA-O 3.19Å; D610-S689 WeakPolarHBondContact OD1-CB 3.35Å; D610-S689 PolarHBondContact OD1-N 3.15Å; D610-S689 PolarHBondContact OD1-OG 3.02Å
611	L	94.5	Very high	92.6	Very high	44 Å²	44	66.2 Å²	66.2	23%	0.23	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	120.5	-174.1	-178.5	59.1	0	0	0	111	M609 A619 L621 S689 L690 T691	M609-L611 PolarHBondContact O-N 2.91Å; L611-A619 HydrophobicContact CD2-CB 3.73Å; L611-L621 HydrophobicContact CB-CD2 4.31Å; L611-L621 HydrophobicContact CD2-CD2 4.49Å; L611-S689 PolarHBondContact N-O 2.69Å; L611-L690 HydrophobicContact CB-CD1 4.24Å; L611-L690 HydrophobicContact CD2-CD1 4.17Å; L611-L690 HydrophobicContact CG-CD1 4.17Å; L611-L690 WeakPolarHBondContact O-CA 3.24Å; L611-T691 PolarHBondContact O-N 2.84Å
612	T	94.3	Very high	92.5	Very high	89 Å²	89	64.7 Å²	64.7	55%	0.546	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119.4	170.9	-62.1	0	0	0	0	109.9	T691 L693	T612-T691 WeakPolarHBondContact CA-O 3.42Å; T612-T691 HydrophobicContact CG2-CG2 4.14Å; T612-L693 HydrophobicContact CG2-CD1 3.57Å; T612-L693 HydrophobicContact CG2-CD2 4.11Å; T612-L693 HydrophobicContact CG2-CG 3.76Å
613	I	93.3	Very high	92.3	Very high	30 Å²	30	64.3 Å²	64.3	15%	0.154	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	160.2	-171.9	-151.2	174.9	0	0	0	112.3	A617 M618 V665 L690 T691 V692 L693	I613-A617 HydrophobicContact CD1-CB 3.59Å; I613-A617 HydrophobicContact CG1-CB 3.72Å; I613-M618 VanDerWaalsContact CD1-C 3.48Å; I613-M618 WeakPolarHBondContact CD1-O 3.45Å; I613-V665 HydrophobicContact CG2-CB 4.47Å; I613-V665 HydrophobicContact CG2-CG1 4.15Å; I613-V665 HydrophobicContact CG2-CG2 4.49Å; I613-L690 HydrophobicContact CG2-CD1 4.13Å; I613-T691 PolarHBondContact N-O 2.88Å; I613-V692 CarbonylContact O-C 3.54Å; I613-V692 WeakPolarHBondContact O-CA 3.39Å; I613-L693 PolarHBondContact O-N 2.74Å
614	R	91.3	Very high	92.1	Very high	134 Å²	134	62.1 Å²	62.1	51%	0.506	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	152.6	174.9	-64.6	-173.3	-177.4	-141.8	0.2	111.8	A617 L693 L772	R614-A617 VanDerWaalsContact O-CB 3.26Å; R614-A617 WeakPolarHBondContact O-CB 3.49Å; R614-A617 PolarHBondContact O-N 2.9Å; R614-L693 CarbonylContact C-O 3.34Å; R614-L693 VanDerWaalsContact CA-O 3.26Å; R614-L693 WeakPolarHBondContact CA-O 3.4Å; R614-L772 HydrophobicContact CG-CD1 4.17Å
615	T	91.6	Very high	92.1	Very high	46 Å²	46	60.4 Å²	60.4	28%	0.282	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	145.4	167.7	45.6	0	0	0	0	111.4	A617 V665 I667 V692 L693 E694	T615-A617 PolarHBondContact O-N 2.83Å; T615-V665 CarbonylContact C-O 3.44Å; T615-V665 VanDerWaalsContact CA-O 3.28Å; T615-V665 WeakPolarHBondContact CA-O 3.32Å; T615-I667 HydrophobicContact CG2-CD1 4.07Å; T615-I667 HydrophobicContact CG2-CG1 4.16Å; T615-V692 HydrophobicContact CG2-CG1 3.6Å; T615-L693 PolarHBondContact N-O 3.23Å; T615-E694 HydrophobicContact CG2-CB 3.86Å; T615-E694 HydrophobicContact CG2-CG 4.19Å
616	G	87.5	Confident	92.1	Very high	46 Å²	46	60.1 Å²	60.1	47%	0.474	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	-13.3	-177.1	0	0	0	0	0	115.8	N664 V665	G616-N664 WeakPolarHBondContact CA-OD1 3.45Å; G616-V665 PolarHBondContact N-O 2.83Å
617	A	88.9	Confident	92.1	Very high	36 Å²	36	57.6 Å²	57.6	30%	0.298	31%	0.309	S	S	.	.	S	Bend	trans	-76	-178.6	175.1	0	0	0	0	0	112.4	I613 R614 T615 N664 V665	I613-A617 HydrophobicContact CD1-CB 3.59Å; I613-A617 HydrophobicContact CG1-CB 3.72Å; R614-A617 VanDerWaalsContact O-CB 3.26Å; R614-A617 WeakPolarHBondContact O-CB 3.49Å; R614-A617 PolarHBondContact O-N 2.9Å; T615-A617 PolarHBondContact O-N 2.83Å; A617-N664 WeakPolarHBondContact O-CA 3.19Å; A617-N664 PolarHBondContact O-N 2.03Å; A617-V665 WeakPolarHBondContact O-CG2 3.39Å; A617-V665 PolarHBondContact O-N 2.94Å
618	M	89.7	Confident	91.9	Very high	109 Å²	109	58.1 Å²	58.1	54%	0.537	31%	0.307	S	S	.	.			trans	-107.6	117.6	173.4	-179.7	-174.1	-71.5	0	0	110.1	I613 F661 I662	I613-M618 VanDerWaalsContact CD1-C 3.48Å; I613-M618 WeakPolarHBondContact CD1-O 3.45Å; M618-F661 HydrophobicContact CE-CD2 3.91Å; M618-F661 HydrophobicContact CE-CE2 3.85Å; M618-F661 HydrophobicContact CG-CB 4.32Å; M618-F661 HydrophobicContact CG-CD2 3.98Å; M618-F661 HydrophobicContact SD-CB 4.44Å; M618-F661 HydrophobicContact SD-CD2 3.76Å; M618-F661 HydrophobicContact SD-CE2 4.23Å; M618-F661 HydrophobicContact SD-CG 4.25Å; M618-I662 CarbonylContact C-O 3.54Å; M618-I662 VanDerWaalsContact CA-O 3.28Å; M618-I662 WeakPolarHBondContact CA-O 3.36Å
619	A	92.2	Very high	91.9	Very high	3 Å²	3	60.2 Å²	60.2	3%	0.025	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.8	169.8	0	0	0	0	0	109.9	L611 F661 I662 V665 L690	L611-A619 HydrophobicContact CD2-CB 3.73Å; A619-F661 CarbonylContact O-C 3.59Å; A619-F661 WeakPolarHBondContact O-CA 3.36Å; A619-F661 VanDerWaalsContact O-CB 3.23Å; A619-F661 WeakPolarHBondContact O-CB 3.41Å; A619-I662 HydrophobicContact CB-CB 4.45Å; A619-I662 PolarHBondContact N-O 2.91Å; A619-I662 PolarHBondContact O-N 2.74Å; A619-V665 HydrophobicContact CB-CG2 3.64Å; A619-L690 HydrophobicContact CB-CD1 3.88Å; A619-L690 HydrophobicContact CB-CD2 4.15Å
620	R	91.3	Very high	91.7	Very high	126 Å²	126	57.2 Å²	57.2	48%	0.475	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	126.5	175.7	175.6	177.5	171.3	115	-7.6	108.6	E622 V659 F660	R620-E622 HydrophobicContact CG-CG 4.45Å; R620-E622 IonicContact CZ-OE1 3.27Å; R620-E622 IonicContact NE-OE1 3.68Å; R620-E622 PolarHBondContact NE-OE1 3.02Å; R620-E622 IonicContact NH2-OE1 3.36Å; R620-E622 PolarHBondContact NH2-OE1 2.95Å; R620-V659 HydrophobicContact CG-CG1 4.18Å; R620-V659 VanDerWaalsContact NH2-CG2 3.26Å; R620-F660 WeakPolarHBondContact CA-O 3.43Å
621	L	91.4	Very high	91.5	Very high	5 Å²	5	52.4 Å²	52.4	3%	0.026	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	140.3	169.5	-57.5	176	0	0	0	107.6	P608 L611 W635 F660 Y673 A688	P608-L621 HydrophobicContact CB-CB 4.22Å; L611-L621 HydrophobicContact CB-CD2 4.31Å; L611-L621 HydrophobicContact CD2-CD2 4.49Å; L621-W635 HydrophobicContact CB-CH2 3.68Å; L621-W635 HydrophobicContact CB-CZ3 4.07Å; L621-W635 HydrophobicContact CD1-CH2 4.45Å; L621-W635 HydrophobicContact CD1-CZ3 3.99Å; L621-F660 HydrophobicContact CB-CB 4.4Å; L621-F660 HydrophobicContact CB-CD1 4.13Å; L621-F660 HydrophobicContact CD1-CD1 4.02Å; L621-F660 HydrophobicContact CD1-CE1 4.36Å; L621-F660 HydrophobicContact CG-CD1 4.27Å; L621-F660 PolarHBondContact N-O 2.81Å; L621-F660 PolarHBondContact O-N 2.83Å; L621-Y673 HydrophobicContact CD1-CD1 4.04Å; L621-Y673 HydrophobicContact CD1-CD2 4.35Å; L621-Y673 HydrophobicContact CD1-CG 3.7Å; L621-A688 HydrophobicContact CD2-CB 4.49Å
622	E	89.9	Confident	91.4	Very high	68 Å²	68	57.4 Å²	57.4	32%	0.318	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	138.5	-179.9	-51.6	-165.6	164.9	0	0	109.2	K606 T607 P608 R620 D658 V659	K606-E622 HydrophobicContact CB-CB 4.45Å; K606-E622 HydrophobicContact CD-CB 4.11Å; T607-E622 CarbonylContact C-O 3.19Å; P608-E622 VanDerWaalsContact CA-O 3.29Å; P608-E622 WeakPolarHBondContact CA-O 3.28Å; R620-E622 HydrophobicContact CG-CG 4.45Å; R620-E622 IonicContact CZ-OE1 3.27Å; R620-E622 IonicContact NE-OE1 3.68Å; R620-E622 PolarHBondContact NE-OE1 3.02Å; R620-E622 IonicContact NH2-OE1 3.36Å; R620-E622 PolarHBondContact NH2-OE1 2.95Å; E622-D658 WeakPolarHBondContact CA-O 3.48Å; E622-V659 HydrophobicContact CG-CG2 4.22Å
623	C	91.4	Very high	91.2	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.007	30%	0.304	C	S	.	.			trans	-152.7	116.1	172.4	-170.6	0	0	0	0	110.8	K606 W635 D658 C675	K606-C623 WeakPolarHBondContact O-CA 3.43Å; C623-W635 HydrophobicContact CB-CH2 3.7Å; C623-W635 HydrophobicContact CB-CZ2 3.37Å; C623-D658 PolarHBondContact N-O 3.17Å; C623-C675 HydrophobicContact CB-CB 3.64Å; C623-C675 WeakPolarHBondContact CB-SG 3.14Å; C623-C675 WeakPolarHBondContact SG-CB 2.91Å; C623-C675 CovalentContact SG-SG 2.02Å; C623-C675 PolarHBondContact SG-SG 2.83Å
624	A	90.2	Very high	91.1	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.008	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.5	-175.7	0	0	0	0	0	108.8	L605 K606 D658	L605-A624 HydrophobicContact CB-CB 3.83Å; L605-A624 PolarHBondContact N-O 2.6Å; K606-A624 HydrophobicContact CB-CB 3.71Å; K606-A624 HydrophobicContact CD-CB 3.84Å; K606-A624 HydrophobicContact CG-CB 3.69Å; K606-A624 PolarHBondContact N-O 2.95Å; K606-A624 VanDerWaalsContact N-O 3.12Å; K606-A624 PolarHBondContact O-N 3.17Å; A624-D658 HydrophobicContact CB-CB 3.59Å; A624-D658 VanDerWaalsContact CB-OD1 3.31Å; A624-D658 WeakPolarHBondContact CB-OD1 3.33Å; A624-D658 WeakPolarHBondContact CB-OD2 3.31Å
625	A	92.9	Very high	91.2	Very high	19 Å²	19	51.2 Å²	51.2	16%	0.157	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	142.8	172	0	0	0	0	0	112.3	S603 F604 P631 I633 A677	S603-A625 CarbonylContact O-C 3.53Å; S603-A625 WeakPolarHBondContact O-CA 3.4Å; S603-A625 VanDerWaalsContact O-CB 3.23Å; S603-A625 WeakPolarHBondContact O-CB 3.27Å; F604-A625 HydrophobicContact CD1-CB 4.2Å; A625-P631 HydrophobicContact CB-CB 4.45Å; A625-P631 HydrophobicContact CB-CG 3.65Å; A625-P631 VanDerWaalsContact O-CG 3.25Å; A625-P631 WeakPolarHBondContact O-CG 3.4Å; A625-I633 HydrophobicContact CB-CD1 3.87Å; A625-A677 HydrophobicContact CB-CB 3.48Å; A625-A677 VanDerWaalsContact CB-CB 3.48Å
626	E	93.4	Very high	91.3	Very high	99 Å²	99	51.6 Å²	51.6	46%	0.463	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	169.4	169.3	67.2	-170.8	168.6	0	0	110.4	P602 S603 L605	P602-E626 CarbonylContact C-O 3.58Å; P602-E626 WeakPolarHBondContact CA-O 3.31Å; S603-E626 WeakPolarHBondContact CB-OE1 3.47Å; S603-E626 PolarHBondContact N-O 2.91Å; S603-E626 PolarHBondContact O-N 3.08Å; S603-E626 PolarHBondContact OG-OE1 2.87Å; L605-E626 HydrophobicContact CD1-CB 4.07Å; L605-E626 HydrophobicContact CD2-CG 4.3Å; L605-E626 HydrophobicContact CG-CB 4.22Å; L605-E626 HydrophobicContact CG-CG 4.26Å
627	G	91.6	Very high	91.6	Very high	20 Å²	20	50.3 Å²	50.3	21%	0.206	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154	168.7	178	0	0	0	0	0	111.6	P629 A630	G627-P629 CarbonylContact C-O 3.46Å; G627-P629 CarbonylContact O-C 3.4Å; G627-A630 WeakPolarHBondContact O-CA 3.44Å; G627-A630 PolarHBondContact O-N 2.91Å
628	H	90.9	Very high	91.8	Very high	72 Å²	72	53.1 Å²	53.1	33%	0.333	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	118.8	178.4	-168.5	-110	0	0	0	111.6	F572 V598 N599 E600	F572-H628 AromaticContact CD1-ND1 3.94Å; F572-H628 HydrophobicContact CE1-CB 3.73Å; F572-H628 AromaticContact CE1-CG 3.68Å; F572-H628 AromaticContact CE1-ND1 3.45Å; F572-H628 WeakPolarHBondContact CE1-ND1 3.31Å; F572-H628 HydrophobicContact CZ-CB 3.8Å; V598-H628 PolarHBondContact O-ND1 3.32Å; N599-H628 CarbonylContact C-O 3.59Å; N599-H628 WeakPolarHBondContact CA-O 3.48Å; N599-H628 VanDerWaalsContact CB-O 3.27Å; N599-H628 WeakPolarHBondContact CB-O 3.36Å; E600-H628 HydrophobicContact CB-CB 3.9Å; E600-H628 PolarHBondContact N-O 2.99Å; E600-H628 PolarHBondContact O-N 2.84Å
629	P	93.1	Very high	91.7	Very high	52 Å²	52	50.6 Å²	50.6	34%	0.338	28%	0.283	S	S	.	.	S	Bend	cis	-56.7	161.5	-12.3	-23.2	35	0	0	0	113	G627 N679 I680	G627-P629 CarbonylContact C-O 3.46Å; G627-P629 CarbonylContact O-C 3.4Å; P629-N679 WeakPolarHBondContact O-CB 3.44Å; P629-N679 PolarHBondContact O-ND2 2.96Å; P629-I680 HydrophobicContact CG-CD1 3.94Å; P629-I680 HydrophobicContact CG-CG1 3.94Å
630	A	90.1	Very high	91.6	Very high	84 Å²	84	51.8 Å²	51.8	69%	0.694	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-54.3	133.2	-179.4	0	0	0	0	0	111.6	G627	G627-A630 WeakPolarHBondContact O-CA 3.44Å; G627-A630 PolarHBondContact O-N 2.91Å
631	P	92.5	Very high	91.4	Very high	17 Å²	17	51.3 Å²	51.3	11%	0.11	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-74.7	138.6	-175.1	30.2	-35.3	0	0	0	112.4	P602 A625 I633 A677 Q678	P602-P631 HydrophobicContact CB-CB 3.96Å; P602-P631 HydrophobicContact CB-CG 4.3Å; P602-P631 HydrophobicContact CG-CB 4.01Å; A625-P631 HydrophobicContact CB-CB 4.45Å; A625-P631 HydrophobicContact CB-CG 3.65Å; A625-P631 VanDerWaalsContact O-CG 3.25Å; A625-P631 WeakPolarHBondContact O-CG 3.4Å; P631-I633 PolarHBondContact O-N 2.68Å; P631-A677 HydrophobicContact CB-CB 4.22Å; P631-Q678 CarbonylContact C-O 3.54Å; P631-Q678 WeakPolarHBondContact CA-O 3.4Å
632	Q	92.2	Very high	91.2	Very high	149 Å²	149	55.7 Å²	55.7	70%	0.696	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	121.6	167.4	-175.6	174.8	-3	0	0	109.4	Q678	Q632-Q678 PolarHBondContact N-O 2.8Å; Q632-Q678 PolarHBondContact O-N 2.71Å
633	I	90.6	Very high	91.3	Very high	55 Å²	55	53.1 Å²	53.1	28%	0.282	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	135	169.7	-58	-57.9	0	0	0	109.7	A625 P631 M676 A677	A625-I633 HydrophobicContact CB-CD1 3.87Å; P631-I633 PolarHBondContact O-N 2.68Å; I633-M676 WeakPolarHBondContact CA-O 3.33Å; I633-A677 HydrophobicContact CD1-CB 3.75Å
634	S	91.1	Very high	91.2	Very high	40 Å²	40	53.6 Å²	53.6	28%	0.28	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	158.5	173.8	58.6	0	0	0	0	110.9	C675 M676	S634-C675 CarbonylContact O-C 3.57Å; S634-C675 WeakPolarHBondContact O-CA 3.17Å; S634-M676 PolarHBondContact N-O 3.26Å; S634-M676 PolarHBondContact O-N 3.18Å; S634-M676 PolarHBondContact OG-O 3.35Å
635	W	91.9	Very high	91.1	Very high	27 Å²	27	53.6 Å²	53.6	10%	0.102	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	146.3	-175.9	-66.5	84.6	0	0	0	111.7	P608 L621 C623 F643 F660 S674 C675	P608-W635 HydrophobicContact CB-CH2 3.93Å; P608-W635 HydrophobicContact CB-CZ3 4.01Å; P608-W635 HydrophobicContact CG-CH2 4.21Å; P608-W635 HydrophobicContact CG-CZ3 4.09Å; L621-W635 HydrophobicContact CB-CH2 3.68Å; L621-W635 HydrophobicContact CB-CZ3 4.07Å; L621-W635 HydrophobicContact CD1-CH2 4.45Å; L621-W635 HydrophobicContact CD1-CZ3 3.99Å; C623-W635 HydrophobicContact CB-CH2 3.7Å; C623-W635 HydrophobicContact CB-CZ2 3.37Å; W635-F643 HydrophobicContact CB-CZ 4.05Å; W635-F643 WeakPolarHBondContact O-CZ 3.24Å; W635-F660 HydrophobicContact CD2-CB 4.27Å; W635-F660 HydrophobicContact CD2-CD2 4.33Å; W635-F660 HydrophobicContact CD2-CG 4.24Å; W635-F660 HydrophobicContact CG-CD2 4.26Å; W635-F660 HydrophobicContact CH2-CB 4.08Å; W635-F660 HydrophobicContact CZ2-CB 3.5Å; W635-F660 VanDerWaalsContact CZ2-CB 3.5Å; W635-F660 HydrophobicContact CZ2-CG 4.27Å; W635-S674 CarbonylContact C-O 3.56Å; W635-S674 WeakPolarHBondContact CA-O 3.26Å; W635-C675 HydrophobicContact CD2-CB 4.18Å; W635-C675 HydrophobicContact CE3-CB 3.93Å; W635-C675 HydrophobicContact CH2-CB 3.98Å; W635-C675 HydrophobicContact CZ2-CB 4.2Å; W635-C675 HydrophobicContact CZ3-CB 3.83Å
636	Q	93.9	Very high	90.7	Very high	55 Å²	55	54.8 Å²	54.8	26%	0.257	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	155.6	166.2	-78.4	172.5	10.8	0	0	110.5	G640 Y673 S674 M676	Q636-G640 CarbonylContact C-O 3.52Å; Q636-G640 VanDerWaalsContact CA-O 3.23Å; Q636-G640 WeakPolarHBondContact CA-O 3.34Å; Q636-G640 VanDerWaalsContact CB-O 3.27Å; Q636-G640 WeakPolarHBondContact CB-O 3.38Å; Q636-G640 WeakPolarHBondContact CG-O 3.36Å; Q636-Y673 WeakPolarHBondContact O-CA 3.38Å; Q636-S674 PolarHBondContact N-O 3.2Å; Q636-S674 PolarHBondContact O-N 3.36Å; Q636-M676 HydrophobicContact CB-CE 4.36Å; Q636-M676 HydrophobicContact CG-CE 3.58Å
637	K	93.7	Very high	90.4	Very high	19 Å²	19	57.2 Å²	57.2	8%	0.083	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.9	166.6	-175.9	-176.6	-172.9	-68.6	0	108.7	G639 G640 F643 D669 M670 I672 Y673	K637-G639 PolarHBondContact O-N 2.73Å; K637-G639 VanDerWaalsContact O-N 3.14Å; K637-G640 PolarHBondContact N-O 2.77Å; K637-G640 CarbonylContact O-C 3.57Å; K637-G640 PolarHBondContact O-N 2.99Å; K637-F643 HydrophobicContact CB-CD1 3.77Å; K637-F643 HydrophobicContact CB-CE1 3.63Å; K637-F643 HydrophobicContact CB-CG 4.48Å; K637-F643 HydrophobicContact CB-CZ 4.21Å; K637-F643 HydrophobicContact CD-CD1 4.45Å; K637-D669 WeakPolarHBondContact CE-O 3.43Å; K637-M670 WeakPolarHBondContact CE-O 3.43Å; K637-M670 PolarHBondContact NZ-O 3.14Å; K637-I672 CarbonylContact C-O 3.58Å; K637-I672 WeakPolarHBondContact CA-O 3.41Å; K637-Y673 HydrophobicContact CB-CE1 4.42Å; K637-Y673 HydrophobicContact CD-CE2 4.25Å; K637-Y673 HydrophobicContact CG-CE1 4.45Å; K637-Y673 HydrophobicContact CG-CE2 4.15Å
638	D	93.7	Very high	90.2	Very high	94 Å²	94	60.4 Å²	60.4	50%	0.503	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	35	179.6	-54.7	-51.3	0	0	0	113.6	G640 G671 I672	D638-G640 VanDerWaalsContact C-N 3.32Å; D638-G671 WeakPolarHBondContact OD1-CA 3.26Å; D638-I672 PolarHBondContact N-O 2.87Å; D638-I672 PolarHBondContact OD1-N 2.64Å
639	G	88.2	Confident	89.9	Confident	56 Å²	56	67.5 Å²	67.5	58%	0.577	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	7.4	-176.6	0	0	0	0	0	115.5	K637	K637-G639 PolarHBondContact O-N 2.73Å; K637-G639 VanDerWaalsContact O-N 3.14Å
640	G	89.9	Confident	89.8	Confident	29 Å²	29	66 Å²	66	30%	0.299	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-129.5	-178.2	179.9	0	0	0	0	0	113.8	Q636 K637 D638	Q636-G640 CarbonylContact C-O 3.52Å; Q636-G640 VanDerWaalsContact CA-O 3.23Å; Q636-G640 WeakPolarHBondContact CA-O 3.34Å; Q636-G640 VanDerWaalsContact CB-O 3.27Å; Q636-G640 WeakPolarHBondContact CB-O 3.38Å; Q636-G640 WeakPolarHBondContact CG-O 3.36Å; K637-G640 PolarHBondContact N-O 2.77Å; K637-G640 CarbonylContact O-C 3.57Å; K637-G640 PolarHBondContact O-N 2.99Å; D638-G640 VanDerWaalsContact C-N 3.32Å
641	T	86.5	Confident	89.6	Confident	115 Å²	115	64.1 Å²	64.1	71%	0.706	33%	0.334	S	S	*	.	S	Bend	trans	-109.5	7.5	-177.1	51.9	0	0	0	0	113.9	F643	T641-F643 VanDerWaalsContact O-CD2 3.31Å; T641-F643 WeakPolarHBondContact O-CD2 3.34Å; T641-F643 PolarHBondContact O-N 2.85Å
642	D	87.8	Confident	89	Confident	97 Å²	97	67 Å²	67	52%	0.519	35%	0.346	S	S	.	.			trans	-84.5	109.3	173.3	-174.6	39.7	0	0	0	110.9	R647	D642-R647 IonicContact OD1-CZ 3.79Å; D642-R647 IonicContact OD1-NH1 2.73Å; D642-R647 PolarHBondContact OD1-NH1 2.68Å; D642-R647 IonicContact OD2-CZ 2.68Å; D642-R647 IonicContact OD2-NH1 3.8Å; D642-R647 PolarHBondContact OD2-NH1 3.05Å
643	F	92.1	Very high	88.3	Confident	15 Å²	15	63.8 Å²	63.8	7%	0.066	34%	0.336	C	S	.	.			trans	-111.9	110.5	176.2	-65.3	-93.6	0	0	0	109.3	W635 K637 T641 A645 A646 R647 M651 F660 Y673	W635-F643 HydrophobicContact CB-CZ 4.05Å; W635-F643 WeakPolarHBondContact O-CZ 3.24Å; K637-F643 HydrophobicContact CB-CD1 3.77Å; K637-F643 HydrophobicContact CB-CE1 3.63Å; K637-F643 HydrophobicContact CB-CG 4.48Å; K637-F643 HydrophobicContact CB-CZ 4.21Å; K637-F643 HydrophobicContact CD-CD1 4.45Å; T641-F643 VanDerWaalsContact O-CD2 3.31Å; T641-F643 WeakPolarHBondContact O-CD2 3.34Å; T641-F643 PolarHBondContact O-N 2.85Å; F643-A645 VanDerWaalsContact C-N 3.28Å; F643-A645 PolarHBondContact O-N 3.18Å; F643-A646 HydrophobicContact CB-CB 3.74Å; F643-A646 WeakPolarHBondContact O-CB 3.5Å; F643-A646 PolarHBondContact O-N 2.95Å; F643-R647 PolarHBondContact O-N 2.93Å; F643-M651 HydrophobicContact CB-CE 4.22Å; F643-M651 HydrophobicContact CB-SD 3.48Å; F643-M651 WeakPolarHBondContact CB-SD 3.05Å; F643-M651 HydrophobicContact CD1-CE 3.97Å; F643-M651 HydrophobicContact CD1-SD 3.49Å; F643-M651 WeakPolarHBondContact CD1-SD 3.16Å; F643-M651 HydrophobicContact CD2-CE 3.72Å; F643-M651 HydrophobicContact CD2-SD 4.08Å; F643-M651 HydrophobicContact CE1-CE 4.17Å; F643-M651 HydrophobicContact CE1-SD 4.14Å; F643-M651 HydrophobicContact CE2-CE 3.95Å; F643-M651 HydrophobicContact CG-CE 3.73Å; F643-M651 HydrophobicContact CG-SD 3.43Å; F643-M651 WeakPolarHBondContact CG-SD 3.48Å; F643-M651 HydrophobicContact CZ-CE 4.16Å; F643-F660 HydrophobicContact CE1-CZ 4.41Å; F643-Y673 AromaticContact CD1-CE1 3.88Å; F643-Y673 HydrophobicContact CD1-CE1 3.88Å; F643-Y673 HydrophobicContact CE1-CD1 4.04Å; F643-Y673 AromaticContact CE1-CE1 3.71Å; F643-Y673 HydrophobicContact CE1-CE1 3.71Å
644	P	89.1	Confident	87.6	Confident	11 Å²	11	64.8 Å²	64.8	7%	0.071	34%	0.341	C	S	.	.	H	α-helix	trans	-53.9	-44.4	176.8	-29.1	37.1	0	0	0	112.7	A646 R647 E648 E668	P644-A646 VanDerWaalsContact C-N 3.28Å; P644-A646 PolarHBondContact O-N 2.91Å; P644-R647 PolarHBondContact O-N 3.17Å; P644-E648 PolarHBondContact O-N 3.36Å; P644-E668 HydrophobicContact CB-CB 4.4Å; P644-E668 HydrophobicContact CB-CG 3.88Å
645	A	87.5	Confident	86.6	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-57.3	-29.9	172.1	0	0	0	0	0	115.1	F643 R649 R650 M651 I662 D669	F643-A645 VanDerWaalsContact C-N 3.28Å; F643-A645 PolarHBondContact O-N 3.18Å; A645-R649 PolarHBondContact O-N 3.05Å; A645-R649 VanDerWaalsContact O-N 3.16Å; A645-R650 HydrophobicContact CB-CB 4.12Å; A645-R650 WeakPolarHBondContact O-CA 3.35Å; A645-R650 PolarHBondContact O-N 3.2Å; A645-M651 HydrophobicContact CB-CB 3.82Å; A645-M651 PolarHBondContact O-N 3.29Å; A645-M651 VanDerWaalsContact O-N 3.1Å; A645-I662 HydrophobicContact CB-CB 4.46Å; A645-I662 HydrophobicContact CB-CD1 4.08Å; A645-I662 HydrophobicContact CB-CG1 4.05Å; A645-I662 HydrophobicContact CB-CG2 3.65Å; A645-D669 WeakPolarHBondContact CB-OD1 3.24Å; A645-D669 PolarHBondContact N-OD1 2.9Å
646	A	85.6	Confident	85.5	Confident	45 Å²	45	75.2 Å²	75.2	37%	0.372	40%	0.395	S	S	.	.	H	α-helix	trans	-72.6	-41.9	176.4	0	0	0	0	0	111.8	F643 P644 E648 R649 M651	F643-A646 HydrophobicContact CB-CB 3.74Å; F643-A646 WeakPolarHBondContact O-CB 3.5Å; F643-A646 PolarHBondContact O-N 2.95Å; P644-A646 VanDerWaalsContact C-N 3.28Å; P644-A646 PolarHBondContact O-N 2.91Å; A646-E648 PolarHBondContact O-N 3.24Å; A646-R649 PolarHBondContact O-N 2.97Å; A646-M651 HydrophobicContact CB-CB 4.23Å; A646-M651 HydrophobicContact CB-CE 4.36Å; A646-M651 HydrophobicContact CB-SD 3.91Å
647	R	86	Confident	84.4	Confident	150 Å²	150	76.3 Å²	76.3	57%	0.566	40%	0.403	S	S	*	.	H	α-helix	trans	-57.5	-36	175.5	-57.2	-171.2	-63.6	-128.8	4.4	111.6	D642 F643 P644	D642-R647 IonicContact OD1-CZ 3.79Å; D642-R647 IonicContact OD1-NH1 2.73Å; D642-R647 PolarHBondContact OD1-NH1 2.68Å; D642-R647 IonicContact OD2-CZ 2.68Å; D642-R647 IonicContact OD2-NH1 3.8Å; D642-R647 PolarHBondContact OD2-NH1 3.05Å; F643-R647 PolarHBondContact O-N 2.93Å; P644-R647 PolarHBondContact O-N 3.17Å
648	E	87.3	Confident	83.7	Confident	87 Å²	87	78 Å²	78	41%	0.407	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	3.9	178.6	-60.1	-166.2	127.2	0	0	114.7	P644 A646 R650 K666	P644-E648 PolarHBondContact O-N 3.36Å; A646-E648 PolarHBondContact O-N 3.24Å; E648-R650 HydrophobicContact CB-CG 4.1Å; E648-R650 PolarHBondContact O-N 3.28Å; E648-R650 IonicContact OE2-CZ 3.2Å; E648-R650 VanDerWaalsContact OE2-CZ 3.27Å; E648-R650 IonicContact OE2-NE 3.73Å; E648-R650 PolarHBondContact OE2-NE 2.84Å; E648-R650 IonicContact OE2-NH2 3.09Å; E648-R650 PolarHBondContact OE2-NH2 2.92Å; E648-K666 IonicContact OE1-NZ 3.65Å; E648-K666 PolarHBondContact OE1-NZ 2.69Å; E648-K666 WeakPolarHBondContact OE2-CE 3.36Å; E648-K666 IonicContact OE2-NZ 2.71Å; E648-K666 PolarHBondContact OE2-NZ 3.34Å
649	R	85	Confident	82.9	Confident	221 Å²	221	73.7 Å²	73.7	83%	0.834	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	29.1	-177.3	-51	-179.9	-178.2	-178.3	-0.9	114.4	A645 A646	A645-R649 PolarHBondContact O-N 3.05Å; A645-R649 VanDerWaalsContact O-N 3.16Å; A646-R649 PolarHBondContact O-N 2.97Å
650	R	90.3	Very high	82.6	Confident	21 Å²	21	71.1 Å²	71.1	8%	0.079	36%	0.363	C	S	.	.			trans	-92	-17.9	173.7	-67.9	-170.7	-62.4	98.8	-0	113.2	A645 E648 H652 I662 A663 N664 D669	A645-R650 HydrophobicContact CB-CB 4.12Å; A645-R650 WeakPolarHBondContact O-CA 3.35Å; A645-R650 PolarHBondContact O-N 3.2Å; E648-R650 HydrophobicContact CB-CG 4.1Å; E648-R650 PolarHBondContact O-N 3.28Å; E648-R650 IonicContact OE2-CZ 3.2Å; E648-R650 VanDerWaalsContact OE2-CZ 3.27Å; E648-R650 IonicContact OE2-NE 3.73Å; E648-R650 PolarHBondContact OE2-NE 2.84Å; E648-R650 IonicContact OE2-NH2 3.09Å; E648-R650 PolarHBondContact OE2-NH2 2.92Å; R650-H652 PolarHBondContact O-CD2 3.24Å; R650-H652 VanDerWaalsContact O-CD2 3.26Å; R650-I662 CarbonylContact O-C 3.52Å; R650-I662 WeakPolarHBondContact O-CA 3.29Å; R650-A663 WeakPolarHBondContact CB-O 3.47Å; R650-A663 WeakPolarHBondContact CD-O 3.44Å; R650-A663 PolarHBondContact NH1-O 2.86Å; R650-A663 PolarHBondContact O-N 2.78Å; R650-N664 PolarHBondContact NH1-O 3.48Å; R650-N664 VanDerWaalsContact NH1-O 3.15Å; R650-D669 IonicContact CZ-OD1 2.9Å; R650-D669 IonicContact CZ-OD2 3.18Å; R650-D669 IonicContact NH1-OD1 2.85Å; R650-D669 IonicContact NH1-OD2 2.68Å; R650-D669 PolarHBondContact NH1-OD2 3.09Å; R650-D669 IonicContact NH2-OD1 2.71Å; R650-D669 PolarHBondContact NH2-OD1 3.44Å; R650-D669 IonicContact NH2-OD2 3.58Å; R650-D669 PolarHBondContact NH2-OD2 3.01Å
651	M	85.8	Confident	82.5	Confident	43 Å²	43	71.5 Å²	71.5	21%	0.212	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.1	177.9	173.2	166.3	141.8	0	0	110.9	F643 A645 A646 F660	F643-M651 HydrophobicContact CB-CE 4.22Å; F643-M651 HydrophobicContact CB-SD 3.48Å; F643-M651 WeakPolarHBondContact CB-SD 3.05Å; F643-M651 HydrophobicContact CD1-CE 3.97Å; F643-M651 HydrophobicContact CD1-SD 3.49Å; F643-M651 WeakPolarHBondContact CD1-SD 3.16Å; F643-M651 HydrophobicContact CD2-CE 3.72Å; F643-M651 HydrophobicContact CD2-SD 4.08Å; F643-M651 HydrophobicContact CE1-CE 4.17Å; F643-M651 HydrophobicContact CE1-SD 4.14Å; F643-M651 HydrophobicContact CE2-CE 3.95Å; F643-M651 HydrophobicContact CG-CE 3.73Å; F643-M651 HydrophobicContact CG-SD 3.43Å; F643-M651 WeakPolarHBondContact CG-SD 3.48Å; F643-M651 HydrophobicContact CZ-CE 4.16Å; A645-M651 HydrophobicContact CB-CB 3.82Å; A645-M651 PolarHBondContact O-N 3.29Å; A645-M651 VanDerWaalsContact O-N 3.1Å; A646-M651 HydrophobicContact CB-CB 4.23Å; A646-M651 HydrophobicContact CB-CE 4.36Å; A646-M651 HydrophobicContact CB-SD 3.91Å; M651-F660 HydrophobicContact CE-CE2 3.74Å; M651-F660 HydrophobicContact CE-CZ 4.39Å; M651-F660 HydrophobicContact CG-CE2 3.53Å; M651-F660 HydrophobicContact CG-CZ 3.83Å; M651-F660 HydrophobicContact SD-CE2 3.59Å; M651-F660 VanDerWaalsContact SD-CE2 3.59Å; M651-F660 HydrophobicContact SD-CZ 3.71Å
652	H	81.1	Confident	82.7	Confident	78 Å²	78	66 Å²	66	36%	0.361	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.7	-179.1	-57	-81.5	0	0	0	110.4	R650 F661	R650-H652 PolarHBondContact O-CD2 3.24Å; R650-H652 VanDerWaalsContact O-CD2 3.26Å; H652-F661 HydrophobicContact CB-CD1 3.86Å; H652-F661 HydrophobicContact CB-CD2 4.14Å; H652-F661 HydrophobicContact CB-CE1 3.47Å; H652-F661 VanDerWaalsContact CB-CE1 3.47Å; H652-F661 HydrophobicContact CB-CE2 3.78Å; H652-F661 HydrophobicContact CB-CG 4.18Å; H652-F661 HydrophobicContact CB-CZ 3.44Å; H652-F661 VanDerWaalsContact CB-CZ 3.44Å; H652-F661 AromaticContact CD2-CD2 3.85Å; H652-F661 AromaticContact CD2-CE2 3.26Å; H652-F661 WeakPolarHBondContact CD2-CE2 3.41Å; H652-F661 AromaticContact CD2-CZ 3.67Å; H652-F661 AromaticContact CG-CE2 3.69Å; H652-F661 AromaticContact CG-CZ 3.59Å; H652-F661 PolarHBondContact N-O 3.03Å; H652-F661 PolarHBondContact O-N 2.76Å
653	V	77.6	Confident	82.7	Confident	81 Å²	81	62.6 Å²	62.6	49%	0.491	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.5	172.6	-171.6	0	0	0	0	107.2	F660	V653-F660 HydrophobicContact CG2-CD2 4.22Å
654	M	76.2	Confident	82.5	Confident	76 Å²	76	66.4 Å²	66.4	37%	0.374	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	93.8	174.7	-62.5	-174.3	78.2	0	0	107.7	E656 D657 D658 V659 F661	M654-E656 VanDerWaalsContact C-N 3.34Å; M654-E656 PolarHBondContact O-N 2.73Å; M654-D657 HydrophobicContact CB-CB 4.03Å; M654-D657 WeakPolarHBondContact CE-OD2 3.47Å; M654-D657 PolarHBondContact O-N 3.04Å; M654-D658 PolarHBondContact O-N 3.11Å; M654-V659 HydrophobicContact CB-CB 4.35Å; M654-V659 PolarHBondContact N-O 2.85Å; M654-V659 PolarHBondContact O-N 3.02Å; M654-V659 VanDerWaalsContact O-N 3.1Å; M654-F661 HydrophobicContact CG-CD1 4.44Å; M654-F661 HydrophobicContact CG-CE1 3.96Å; M654-F661 HydrophobicContact SD-CD1 4.26Å; M654-F661 HydrophobicContact SD-CE1 3.66Å
655	P	68.8	Low	82.7	Confident	101 Å²	101	66 Å²	66	66%	0.656	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-59.4	-42.9	-176.4	-25.5	35.6	0	0	0	112.9	D657 D658	P655-D657 PolarHBondContact O-N 2.64Å; P655-D658 PolarHBondContact O-N 3.28Å
656	E	70.4	Confident	83	Confident	185 Å²	185	69 Å²	69	86%	0.864	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-65.6	-21.6	-178.6	-48.5	-60.3	139.9	0	0	114.1	M654	M654-E656 VanDerWaalsContact C-N 3.34Å; M654-E656 PolarHBondContact O-N 2.73Å
657	D	69.1	Low	83.2	Confident	79 Å²	79	70 Å²	70	42%	0.422	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-101.7	-3.4	-179	-74.3	-71.4	0	0	0	113.1	M654 P655 V659	M654-D657 HydrophobicContact CB-CB 4.03Å; M654-D657 WeakPolarHBondContact CE-OD2 3.47Å; M654-D657 PolarHBondContact O-N 3.04Å; P655-D657 PolarHBondContact O-N 2.64Å; D657-V659 VanDerWaalsContact C-N 3.28Å; D657-V659 HydrophobicContact CB-CB 4.03Å; D657-V659 HydrophobicContact CB-CG2 4Å; D657-V659 VanDerWaalsContact O-CG2 3.28Å; D657-V659 WeakPolarHBondContact O-CG2 3.19Å; D657-V659 PolarHBondContact O-N 2.78Å
658	D	79.3	Confident	83.4	Confident	55 Å²	55	66.8 Å²	66.8	29%	0.294	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	29.8	-166.8	-52.3	-63.1	0	0	0	114.5	K606 E622 C623 A624 M654 P655	K606-D658 HydrophobicContact CD-CB 4.2Å; K606-D658 IonicContact NZ-OD2 2.86Å; K606-D658 PolarHBondContact NZ-OD2 2.86Å; E622-D658 WeakPolarHBondContact CA-O 3.48Å; C623-D658 PolarHBondContact N-O 3.17Å; A624-D658 HydrophobicContact CB-CB 3.59Å; A624-D658 VanDerWaalsContact CB-OD1 3.31Å; A624-D658 WeakPolarHBondContact CB-OD1 3.33Å; A624-D658 WeakPolarHBondContact CB-OD2 3.31Å; M654-D658 PolarHBondContact O-N 3.11Å; P655-D658 PolarHBondContact O-N 3.28Å
659	V	78	Confident	83.7	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.012	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.5	-162.9	164.4	0	0	0	0	113.7	R620 E622 M654 D657 F661	R620-V659 HydrophobicContact CG-CG1 4.18Å; R620-V659 VanDerWaalsContact NH2-CG2 3.26Å; E622-V659 HydrophobicContact CG-CG2 4.22Å; M654-V659 HydrophobicContact CB-CB 4.35Å; M654-V659 PolarHBondContact N-O 2.85Å; M654-V659 PolarHBondContact O-N 3.02Å; M654-V659 VanDerWaalsContact O-N 3.1Å; D657-V659 VanDerWaalsContact C-N 3.28Å; D657-V659 HydrophobicContact CB-CB 4.03Å; D657-V659 HydrophobicContact CB-CG2 4Å; D657-V659 VanDerWaalsContact O-CG2 3.28Å; D657-V659 WeakPolarHBondContact O-CG2 3.19Å; D657-V659 PolarHBondContact O-N 2.78Å; V659-F661 HydrophobicContact CG1-CD1 4.2Å
660	F	80.9	Confident	84.1	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.009	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.8	165.3	176.8	-97.8	0	0	0	109.5	R620 L621 W635 F643 M651 V653 I662 Y673	R620-F660 WeakPolarHBondContact CA-O 3.43Å; L621-F660 HydrophobicContact CB-CB 4.4Å; L621-F660 HydrophobicContact CB-CD1 4.13Å; L621-F660 HydrophobicContact CD1-CD1 4.02Å; L621-F660 HydrophobicContact CD1-CE1 4.36Å; L621-F660 HydrophobicContact CG-CD1 4.27Å; L621-F660 PolarHBondContact N-O 2.81Å; L621-F660 PolarHBondContact O-N 2.83Å; W635-F660 HydrophobicContact CD2-CB 4.27Å; W635-F660 HydrophobicContact CD2-CD2 4.33Å; W635-F660 HydrophobicContact CD2-CG 4.24Å; W635-F660 HydrophobicContact CG-CD2 4.26Å; W635-F660 HydrophobicContact CH2-CB 4.08Å; W635-F660 HydrophobicContact CZ2-CB 3.5Å; W635-F660 VanDerWaalsContact CZ2-CB 3.5Å; W635-F660 HydrophobicContact CZ2-CG 4.27Å; F643-F660 HydrophobicContact CE1-CZ 4.41Å; M651-F660 HydrophobicContact CE-CE2 3.74Å; M651-F660 HydrophobicContact CE-CZ 4.39Å; M651-F660 HydrophobicContact CG-CE2 3.53Å; M651-F660 HydrophobicContact CG-CZ 3.83Å; M651-F660 HydrophobicContact SD-CE2 3.59Å; M651-F660 VanDerWaalsContact SD-CE2 3.59Å; M651-F660 HydrophobicContact SD-CZ 3.71Å; V653-F660 HydrophobicContact CG2-CD2 4.22Å; F660-I662 HydrophobicContact CE1-CD1 3.79Å; F660-I662 HydrophobicContact CE1-CG1 3.76Å; F660-I662 HydrophobicContact CZ-CD1 3.92Å; F660-I662 HydrophobicContact CZ-CG1 3.83Å; F660-Y673 AromaticContact CE1-CD1 3.72Å; F660-Y673 HydrophobicContact CE1-CD1 3.72Å; F660-Y673 AromaticContact CE1-CE1 3.6Å; F660-Y673 HydrophobicContact CE1-CE1 3.6Å; F660-Y673 HydrophobicContact CZ-CD1 4.06Å; F660-Y673 AromaticContact CZ-CE1 3.7Å; F660-Y673 HydrophobicContact CZ-CE1 3.7Å
661	F	88.3	Confident	84.3	Confident	37 Å²	37	55.4 Å²	55.4	16%	0.162	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	148.7	171.9	74.6	-92.4	0	0	0	114.3	M618 A619 H652 M654 V659	M618-F661 HydrophobicContact CE-CD2 3.91Å; M618-F661 HydrophobicContact CE-CE2 3.85Å; M618-F661 HydrophobicContact CG-CB 4.32Å; M618-F661 HydrophobicContact CG-CD2 3.98Å; M618-F661 HydrophobicContact SD-CB 4.44Å; M618-F661 HydrophobicContact SD-CD2 3.76Å; M618-F661 HydrophobicContact SD-CE2 4.23Å; M618-F661 HydrophobicContact SD-CG 4.25Å; A619-F661 CarbonylContact O-C 3.59Å; A619-F661 WeakPolarHBondContact O-CA 3.36Å; A619-F661 VanDerWaalsContact O-CB 3.23Å; A619-F661 WeakPolarHBondContact O-CB 3.41Å; H652-F661 HydrophobicContact CB-CD1 3.86Å; H652-F661 HydrophobicContact CB-CD2 4.14Å; H652-F661 HydrophobicContact CB-CE1 3.47Å; H652-F661 VanDerWaalsContact CB-CE1 3.47Å; H652-F661 HydrophobicContact CB-CE2 3.78Å; H652-F661 HydrophobicContact CB-CG 4.18Å; H652-F661 HydrophobicContact CB-CZ 3.44Å; H652-F661 VanDerWaalsContact CB-CZ 3.44Å; H652-F661 AromaticContact CD2-CD2 3.85Å; H652-F661 AromaticContact CD2-CE2 3.26Å; H652-F661 WeakPolarHBondContact CD2-CE2 3.41Å; H652-F661 AromaticContact CD2-CZ 3.67Å; H652-F661 AromaticContact CG-CE2 3.69Å; H652-F661 AromaticContact CG-CZ 3.59Å; H652-F661 PolarHBondContact N-O 3.03Å; H652-F661 PolarHBondContact O-N 2.76Å; M654-F661 HydrophobicContact CG-CD1 4.44Å; M654-F661 HydrophobicContact CG-CE1 3.96Å; M654-F661 HydrophobicContact SD-CD1 4.26Å; M654-F661 HydrophobicContact SD-CE1 3.66Å; V659-F661 HydrophobicContact CG1-CD1 4.2Å
662	I	91.5	Very high	84.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	115.2	173.2	-63.6	173.1	0	0	0	107.5	M618 A619 A645 R650 F660 V665 D669 Y673 L690	M618-I662 CarbonylContact C-O 3.54Å; M618-I662 VanDerWaalsContact CA-O 3.28Å; M618-I662 WeakPolarHBondContact CA-O 3.36Å; A619-I662 HydrophobicContact CB-CB 4.45Å; A619-I662 PolarHBondContact N-O 2.91Å; A619-I662 PolarHBondContact O-N 2.74Å; A645-I662 HydrophobicContact CB-CB 4.46Å; A645-I662 HydrophobicContact CB-CD1 4.08Å; A645-I662 HydrophobicContact CB-CG1 4.05Å; A645-I662 HydrophobicContact CB-CG2 3.65Å; R650-I662 CarbonylContact O-C 3.52Å; R650-I662 WeakPolarHBondContact O-CA 3.29Å; F660-I662 HydrophobicContact CE1-CD1 3.79Å; F660-I662 HydrophobicContact CE1-CG1 3.76Å; F660-I662 HydrophobicContact CZ-CD1 3.92Å; F660-I662 HydrophobicContact CZ-CG1 3.83Å; I662-V665 HydrophobicContact CB-CG2 4.2Å; I662-V665 HydrophobicContact CG2-CG2 3.89Å; I662-V665 WeakPolarHBondContact O-CG2 3.21Å; I662-D669 HydrophobicContact CD1-CB 4.43Å; I662-Y673 HydrophobicContact CD1-CE1 3.93Å; I662-Y673 WeakPolarHBondContact CD1-OH 3.42Å; I662-L690 HydrophobicContact CD1-CD2 4.29Å
663	A	86.8	Confident	85.5	Confident	26 Å²	26	53.8 Å²	53.8	22%	0.215	29%	0.285	C	S	.	.	S	Bend	trans	-79.6	152.2	172.1	0	0	0	0	0	111.2	R650 V665	R650-A663 WeakPolarHBondContact CB-O 3.47Å; R650-A663 WeakPolarHBondContact CD-O 3.44Å; R650-A663 PolarHBondContact NH1-O 2.86Å; R650-A663 PolarHBondContact O-N 2.78Å; A663-V665 PolarHBondContact O-N 3.15Å
664	N	88.4	Confident	86.3	Confident	95 Å²	95	50.6 Å²	50.6	51%	0.508	27%	0.266	S	S	.	.	S	Bend	trans	48.5	56.2	175.1	-172.8	22.9	0	0	0	112.1	G616 A617 R650	G616-N664 WeakPolarHBondContact CA-OD1 3.45Å; A617-N664 WeakPolarHBondContact O-CA 3.19Å; A617-N664 PolarHBondContact O-N 2.03Å; R650-N664 PolarHBondContact NH1-O 3.48Å; R650-N664 VanDerWaalsContact NH1-O 3.15Å
665	V	93.8	Very high	87.2	Confident	1 Å²	1	47 Å²	47	1%	0.006	25%	0.248	C	C	.	.			trans	-59.5	137.5	-172.1	176.2	0	0	0	0	111.3	I613 T615 G616 A617 A619 I662 A663 D669 V692	I613-V665 HydrophobicContact CG2-CB 4.47Å; I613-V665 HydrophobicContact CG2-CG1 4.15Å; I613-V665 HydrophobicContact CG2-CG2 4.49Å; T615-V665 CarbonylContact C-O 3.44Å; T615-V665 VanDerWaalsContact CA-O 3.28Å; T615-V665 WeakPolarHBondContact CA-O 3.32Å; G616-V665 PolarHBondContact N-O 2.83Å; A617-V665 WeakPolarHBondContact O-CG2 3.39Å; A617-V665 PolarHBondContact O-N 2.94Å; A619-V665 HydrophobicContact CB-CG2 3.64Å; I662-V665 HydrophobicContact CB-CG2 4.2Å; I662-V665 HydrophobicContact CG2-CG2 3.89Å; I662-V665 WeakPolarHBondContact O-CG2 3.21Å; A663-V665 PolarHBondContact O-N 3.15Å; V665-D669 HydrophobicContact CG1-CB 4.32Å; V665-V692 HydrophobicContact CG1-CB 4.34Å; V665-V692 HydrophobicContact CG1-CG1 3.82Å; V665-V692 HydrophobicContact CG1-CG2 3.5Å
666	K	92.4	Very high	88.4	Confident	65 Å²	65	44.4 Å²	44.4	28%	0.283	23%	0.228	S	C	.	.			trans	-117.5	164	177.8	-65.3	-177.4	179.2	-176.1	0	111.8	E648 E668 D669	E648-K666 IonicContact OE1-NZ 3.65Å; E648-K666 PolarHBondContact OE1-NZ 2.69Å; E648-K666 WeakPolarHBondContact OE2-CE 3.36Å; E648-K666 IonicContact OE2-NZ 2.71Å; E648-K666 PolarHBondContact OE2-NZ 3.34Å; K666-E668 HydrophobicContact CB-CG 3.91Å; K666-E668 HydrophobicContact CD-CG 4.04Å; K666-E668 WeakPolarHBondContact CD-OE1 3.27Å; K666-E668 IonicContact NZ-OE1 2.68Å; K666-E668 PolarHBondContact NZ-OE1 2.79Å; K666-E668 PolarHBondContact O-N 2.84Å; K666-D669 PolarHBondContact N-OD2 3.37Å; K666-D669 WeakPolarHBondContact O-CB 2.85Å; K666-D669 PolarHBondContact O-N 2.81Å
667	I	90	Very high	89.5	Confident	65 Å²	65	35.6 Å²	35.6	33%	0.333	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-55.9	-34.8	173.9	-62	-62.7	0	0	0	112.5	T615 D669 M670 V692 E694	T615-I667 HydrophobicContact CG2-CD1 4.07Å; T615-I667 HydrophobicContact CG2-CG1 4.16Å; I667-D669 PolarHBondContact O-N 3.4Å; I667-M670 WeakPolarHBondContact O-CB 3.41Å; I667-M670 PolarHBondContact O-N 2.71Å; I667-M670 VanDerWaalsContact O-N 3.14Å; I667-V692 HydrophobicContact CD1-CB 4.12Å; I667-V692 HydrophobicContact CD1-CG1 3.99Å; I667-E694 HydrophobicContact CD1-CB 4.03Å
668	E	91.3	Very high	90.8	Very high	83 Å²	83	37.8 Å²	37.8	39%	0.388	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-67.5	-17	177.1	63.5	-177.8	144.6	0	0	114.5	P644 K666 M670	P644-E668 HydrophobicContact CB-CB 4.4Å; P644-E668 HydrophobicContact CB-CG 3.88Å; K666-E668 HydrophobicContact CB-CG 3.91Å; K666-E668 HydrophobicContact CD-CG 4.04Å; K666-E668 WeakPolarHBondContact CD-OE1 3.27Å; K666-E668 IonicContact NZ-OE1 2.68Å; K666-E668 PolarHBondContact NZ-OE1 2.79Å; K666-E668 PolarHBondContact O-N 2.84Å; E668-M670 VanDerWaalsContact C-N 3.29Å
669	D	93.3	Very high	91.4	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-81	-10.1	174.7	-52.1	-42.8	0	0	0	112.1	K637 A645 R650 I662 V665 K666 I667 G671 Y673 L690	K637-D669 WeakPolarHBondContact CE-O 3.43Å; A645-D669 WeakPolarHBondContact CB-OD1 3.24Å; A645-D669 PolarHBondContact N-OD1 2.9Å; R650-D669 IonicContact CZ-OD1 2.9Å; R650-D669 IonicContact CZ-OD2 3.18Å; R650-D669 IonicContact NH1-OD1 2.85Å; R650-D669 IonicContact NH1-OD2 2.68Å; R650-D669 PolarHBondContact NH1-OD2 3.09Å; R650-D669 IonicContact NH2-OD1 2.71Å; R650-D669 PolarHBondContact NH2-OD1 3.44Å; R650-D669 IonicContact NH2-OD2 3.58Å; R650-D669 PolarHBondContact NH2-OD2 3.01Å; I662-D669 HydrophobicContact CD1-CB 4.43Å; V665-D669 HydrophobicContact CG1-CB 4.32Å; K666-D669 PolarHBondContact N-OD2 3.37Å; K666-D669 WeakPolarHBondContact O-CB 2.85Å; K666-D669 PolarHBondContact O-N 2.81Å; I667-D669 PolarHBondContact O-N 3.4Å; D669-G671 PolarHBondContact O-N 3.42Å; D669-Y673 WeakPolarHBondContact O-CE2 3.22Å; D669-Y673 PolarHBondContact O-OH 2.9Å; D669-Y673 VanDerWaalsContact O-OH 3.09Å; D669-L690 HydrophobicContact CB-CD2 4.38Å
670	M	93.8	Very high	92	Very high	76 Å²	76	41.9 Å²	41.9	37%	0.374	22%	0.215	S	C	.	.			trans	-59.4	134.1	176.3	-177.8	-175.7	-74.8	0	0	111.2	K637 I667 E668 L690 T691 V692	K637-M670 WeakPolarHBondContact CE-O 3.43Å; K637-M670 PolarHBondContact NZ-O 3.14Å; I667-M670 WeakPolarHBondContact O-CB 3.41Å; I667-M670 PolarHBondContact O-N 2.71Å; I667-M670 VanDerWaalsContact O-N 3.14Å; E668-M670 VanDerWaalsContact C-N 3.29Å; M670-L690 WeakPolarHBondContact CA-O 3.32Å; M670-L690 VanDerWaalsContact CG-O 3.32Å; M670-L690 WeakPolarHBondContact CG-O 3.32Å; M670-T691 HydrophobicContact CE-CG2 4.37Å; M670-V692 HydrophobicContact CB-CG2 4.23Å; M670-V692 HydrophobicContact CE-CB 4.37Å; M670-V692 WeakPolarHBondContact CE-O 3.46Å
671	G	94.4	Very high	92.4	Very high	14 Å²	14	42.9 Å²	42.9	14%	0.144	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.7	-175.9	-179.7	0	0	0	0	0	113.3	D638 D669 L690	D638-G671 WeakPolarHBondContact OD1-CA 3.26Å; D669-G671 PolarHBondContact O-N 3.42Å; G671-L690 PolarHBondContact N-O 3.19Å; G671-L690 PolarHBondContact O-N 2.97Å
672	I	96.5	Very high	92.5	Very high	86 Å²	86	42.2 Å²	42.2	44%	0.441	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.5	172.4	-59.1	175.9	0	0	0	108.8	K637 D638 N687 A688	K637-I672 CarbonylContact C-O 3.58Å; K637-I672 WeakPolarHBondContact CA-O 3.41Å; D638-I672 PolarHBondContact N-O 2.87Å; D638-I672 PolarHBondContact OD1-N 2.64Å; I672-N687 HydrophobicContact CG2-CB 4.15Å; I672-A688 CarbonylContact C-O 2.86Å; I672-A688 WeakPolarHBondContact CA-O 2.97Å
673	Y	94.8	Very high	92.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118.9	175.6	-76.5	-102.5	0	0	0	109.3	L621 Q636 K637 F643 F660 I662 D669 N687 A688 L690	L621-Y673 HydrophobicContact CD1-CD1 4.04Å; L621-Y673 HydrophobicContact CD1-CD2 4.35Å; L621-Y673 HydrophobicContact CD1-CG 3.7Å; Q636-Y673 WeakPolarHBondContact O-CA 3.38Å; K637-Y673 HydrophobicContact CB-CE1 4.42Å; K637-Y673 HydrophobicContact CD-CE2 4.25Å; K637-Y673 HydrophobicContact CG-CE1 4.45Å; K637-Y673 HydrophobicContact CG-CE2 4.15Å; F643-Y673 AromaticContact CD1-CE1 3.88Å; F643-Y673 HydrophobicContact CD1-CE1 3.88Å; F643-Y673 HydrophobicContact CE1-CD1 4.04Å; F643-Y673 AromaticContact CE1-CE1 3.71Å; F643-Y673 HydrophobicContact CE1-CE1 3.71Å; F660-Y673 AromaticContact CE1-CD1 3.72Å; F660-Y673 HydrophobicContact CE1-CD1 3.72Å; F660-Y673 AromaticContact CE1-CE1 3.6Å; F660-Y673 HydrophobicContact CE1-CE1 3.6Å; F660-Y673 HydrophobicContact CZ-CD1 4.06Å; F660-Y673 AromaticContact CZ-CE1 3.7Å; F660-Y673 HydrophobicContact CZ-CE1 3.7Å; I662-Y673 HydrophobicContact CD1-CE1 3.93Å; I662-Y673 WeakPolarHBondContact CD1-OH 3.42Å; D669-Y673 WeakPolarHBondContact O-CE2 3.22Å; D669-Y673 PolarHBondContact O-OH 2.9Å; D669-Y673 VanDerWaalsContact O-OH 3.09Å; Y673-N687 WeakPolarHBondContact O-CA 2.96Å; Y673-A688 PolarHBondContact N-O 3.29Å; Y673-A688 PolarHBondContact O-N 3.22Å; Y673-L690 HydrophobicContact CD2-CB 3.87Å; Y673-L690 HydrophobicContact CE2-CB 3.78Å; Y673-L690 HydrophobicContact CE2-CD2 3.83Å; Y673-L690 HydrophobicContact CE2-CG 4.43Å
674	S	95.1	Very high	93	Very high	14 Å²	14	45.9 Å²	45.9	10%	0.098	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	114.2	179.4	-66.2	0	0	0	0	109.5	W635 Q636 A686 N687	W635-S674 CarbonylContact C-O 3.56Å; W635-S674 WeakPolarHBondContact CA-O 3.26Å; Q636-S674 PolarHBondContact N-O 3.2Å; Q636-S674 PolarHBondContact O-N 3.36Å; S674-A686 WeakPolarHBondContact CA-O 3.18Å; S674-N687 VanDerWaalsContact CB-OD1 3.25Å; S674-N687 WeakPolarHBondContact CB-OD1 3.38Å; S674-N687 PolarHBondContact OG-OD1 2.93Å
675	C	93.9	Very high	93.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	141.3	164.7	-179.8	0	0	0	0	109.6	P608 C623 S634 W635 S685 A686	P608-C675 HydrophobicContact CG-CB 4.24Å; C623-C675 HydrophobicContact CB-CB 3.64Å; C623-C675 WeakPolarHBondContact CB-SG 3.14Å; C623-C675 WeakPolarHBondContact SG-CB 2.91Å; C623-C675 CovalentContact SG-SG 2.02Å; C623-C675 PolarHBondContact SG-SG 2.83Å; S634-C675 CarbonylContact O-C 3.57Å; S634-C675 WeakPolarHBondContact O-CA 3.17Å; W635-C675 HydrophobicContact CD2-CB 4.18Å; W635-C675 HydrophobicContact CE3-CB 3.93Å; W635-C675 HydrophobicContact CH2-CB 3.98Å; W635-C675 HydrophobicContact CZ2-CB 4.2Å; W635-C675 HydrophobicContact CZ3-CB 3.83Å; C675-S685 CarbonylContact O-C 3.56Å; C675-S685 WeakPolarHBondContact O-CA 3.41Å; C675-S685 WeakPolarHBondContact O-CB 3.45Å; C675-A686 PolarHBondContact N-O 3.02Å; C675-A686 PolarHBondContact O-N 2.87Å
676	M	94.2	Very high	93.3	Very high	47 Å²	47	45.8 Å²	45.8	23%	0.232	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	129.3	172.5	-59.3	166.1	-70.9	0	0	109.4	I633 S634 Q636 L684	I633-M676 WeakPolarHBondContact CA-O 3.33Å; S634-M676 PolarHBondContact N-O 3.26Å; S634-M676 PolarHBondContact O-N 3.18Å; S634-M676 PolarHBondContact OG-O 3.35Å; Q636-M676 HydrophobicContact CB-CE 4.36Å; Q636-M676 HydrophobicContact CG-CE 3.58Å; M676-L684 CarbonylContact C-O 3.52Å; M676-L684 WeakPolarHBondContact CA-O 3.47Å
677	A	94.8	Very high	93.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	124.2	172.7	0	0	0	0	0	108.8	P602 F604 A625 P631 I633 G683 L684	P602-A677 HydrophobicContact CB-CB 4.18Å; F604-A677 HydrophobicContact CE1-CB 3.87Å; F604-A677 HydrophobicContact CZ-CB 4.35Å; A625-A677 HydrophobicContact CB-CB 3.48Å; A625-A677 VanDerWaalsContact CB-CB 3.48Å; P631-A677 HydrophobicContact CB-CB 4.22Å; I633-A677 HydrophobicContact CD1-CB 3.75Å; A677-G683 CarbonylContact O-C 3.47Å; A677-G683 WeakPolarHBondContact O-CA 3.13Å; A677-L684 PolarHBondContact N-O 3.08Å; A677-L684 PolarHBondContact O-N 2.71Å
678	Q	94.6	Very high	93.8	Very high	125 Å²	125	44.5 Å²	44.5	58%	0.584	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.1	135.9	-175.1	-171.9	174.7	13.9	0	0	112.8	P631 Q632	P631-Q678 CarbonylContact C-O 3.54Å; P631-Q678 WeakPolarHBondContact CA-O 3.4Å; Q632-Q678 PolarHBondContact N-O 2.8Å; Q632-Q678 PolarHBondContact O-N 2.71Å
679	N	93.4	Very high	94	Very high	19 Å²	19	42.5 Å²	42.5	10%	0.102	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	-170.8	165.9	71.9	9.4	0	0	0	110.4	E600 P602 P629 A681 G682	E600-N679 PolarHBondContact O-ND2 3.01Å; P602-N679 WeakPolarHBondContact CD-OD1 3.4Å; P602-N679 HydrophobicContact CG-CB 4.45Å; P629-N679 WeakPolarHBondContact O-CB 3.44Å; P629-N679 PolarHBondContact O-ND2 2.96Å; N679-A681 PolarHBondContact O-N 3.44Å; N679-A681 WeakPolarHBondContact OD1-CA 3.33Å; N679-A681 WeakPolarHBondContact OD1-CB 3.25Å; N679-A681 PolarHBondContact OD1-N 2.84Å; N679-G682 PolarHBondContact N-O 3.04Å; N679-G682 PolarHBondContact O-N 2.79Å; N679-G682 VanDerWaalsContact O-O 3.07Å; N679-G682 PolarHBondContact OD1-N 2.83Å; N679-G682 PolarHBondContact OD1-O 3.06Å
680	I	90.6	Very high	94.1	Very high	124 Å²	124	42.6 Å²	42.6	64%	0.636	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-7.3	-180	57.5	164.1	0	0	0	114.7	N599 P629	N599-I680 WeakPolarHBondContact ND2-CD1 3.4Å; P629-I680 HydrophobicContact CG-CD1 3.94Å; P629-I680 HydrophobicContact CG-CG1 3.94Å
681	A	88.8	Confident	94.2	Very high	23 Å²	23	41.3 Å²	41.3	19%	0.19	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-23	173	0	0	0	0	0	113.3	L510 N599 M601 N679	L510-A681 HydrophobicContact CD2-CB 3.47Å; L510-A681 VanDerWaalsContact CD2-CB 3.47Å; N599-A681 HydrophobicContact CB-CB 3.73Å; M601-A681 HydrophobicContact CG-CB 3.88Å; N679-A681 PolarHBondContact O-N 3.44Å; N679-A681 WeakPolarHBondContact OD1-CA 3.33Å; N679-A681 WeakPolarHBondContact OD1-CB 3.25Å; N679-A681 PolarHBondContact OD1-N 2.84Å
682	G	91.3	Very high	94.2	Very high	24 Å²	24	40.6 Å²	40.6	25%	0.247	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.5	-170.7	178.8	0	0	0	0	0	113	N679	N679-G682 PolarHBondContact N-O 3.04Å; N679-G682 PolarHBondContact O-N 2.79Å; N679-G682 VanDerWaalsContact O-O 3.07Å; N679-G682 PolarHBondContact OD1-N 2.83Å; N679-G682 PolarHBondContact OD1-O 3.06Å
683	G	92.6	Very high	94	Very high	49 Å²	49	38.2 Å²	38.2	51%	0.505	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	153.8	174.2	0	0	0	0	0	112.6	A677	A677-G683 CarbonylContact O-C 3.47Å; A677-G683 WeakPolarHBondContact O-CA 3.13Å
684	L	94.2	Very high	93.8	Very high	54 Å²	54	41 Å²	41	28%	0.283	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	156.8	-178	18.9	147	0	0	0	110	P602 F604 M676 A677	P602-L684 HydrophobicContact CB-CD1 4.19Å; P602-L684 HydrophobicContact CB-CD2 3.94Å; P602-L684 HydrophobicContact CB-CG 4.01Å; P602-L684 HydrophobicContact CG-CD2 4.28Å; P602-L684 WeakPolarHBondContact O-CD1 3.28Å; P602-L684 VanDerWaalsContact O-CD2 3.27Å; P602-L684 WeakPolarHBondContact O-CD2 3.48Å; F604-L684 HydrophobicContact CD2-CD1 3.65Å; F604-L684 HydrophobicContact CE2-CB 3.97Å; F604-L684 HydrophobicContact CE2-CD1 3.73Å; F604-L684 HydrophobicContact CE2-CG 4.34Å; F604-L684 HydrophobicContact CG-CD1 4.13Å; F604-L684 HydrophobicContact CZ-CB 4.41Å; F604-L684 HydrophobicContact CZ-CD1 4.26Å; M676-L684 CarbonylContact C-O 3.52Å; M676-L684 WeakPolarHBondContact CA-O 3.47Å; A677-L684 PolarHBondContact N-O 3.08Å; A677-L684 PolarHBondContact O-N 2.71Å
685	S	94.9	Very high	93.5	Very high	79 Å²	79	43.5 Å²	43.5	55%	0.552	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.8	146.8	-177.8	60.4	0	0	0	0	112.7	C675	C675-S685 CarbonylContact O-C 3.56Å; C675-S685 WeakPolarHBondContact O-CA 3.41Å; C675-S685 WeakPolarHBondContact O-CB 3.45Å
686	A	95.6	Very high	93.4	Very high	14 Å²	14	43.8 Å²	43.8	12%	0.116	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	140.3	175.4	0	0	0	0	0	110.5	F604 T607 P608 S674 C675	F604-A686 HydrophobicContact CD2-CB 4.29Å; F604-A686 HydrophobicContact CE1-CB 4.45Å; F604-A686 HydrophobicContact CE2-CB 3.71Å; F604-A686 HydrophobicContact CZ-CB 3.82Å; T607-A686 HydrophobicContact CG2-CB 3.72Å; P608-A686 HydrophobicContact CG-CB 4.46Å; S674-A686 WeakPolarHBondContact CA-O 3.18Å; C675-A686 PolarHBondContact N-O 3.02Å; C675-A686 PolarHBondContact O-N 2.87Å
687	N	96.1	Very high	93.2	Very high	100 Å²	100	43.7 Å²	43.7	54%	0.535	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	146.3	-168.5	-62.6	-18.6	0	0	0	111.8	I672 Y673 S674	I672-N687 HydrophobicContact CG2-CB 4.15Å; Y673-N687 WeakPolarHBondContact O-CA 2.96Å; S674-N687 VanDerWaalsContact CB-OD1 3.25Å; S674-N687 WeakPolarHBondContact CB-OD1 3.38Å; S674-N687 PolarHBondContact OG-OD1 2.93Å
688	A	95.8	Very high	93	Very high	3 Å²	3	46.3 Å²	46.3	3%	0.025	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	151.5	168.7	0	0	0	0	0	111.5	P608 M609 L621 I672 Y673	P608-A688 HydrophobicContact CB-CB 3.72Å; P608-A688 HydrophobicContact CG-CB 4.18Å; M609-A688 VanDerWaalsContact C-CB 3.45Å; M609-A688 WeakPolarHBondContact O-CB 3.12Å; L621-A688 HydrophobicContact CD2-CB 4.49Å; I672-A688 CarbonylContact C-O 2.86Å; I672-A688 WeakPolarHBondContact CA-O 2.97Å; Y673-A688 PolarHBondContact N-O 3.29Å; Y673-A688 PolarHBondContact O-N 3.22Å
689	S	96.3	Very high	92.7	Very high	41 Å²	41	45.4 Å²	45.4	29%	0.287	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	133.8	173.1	65.8	0	0	0	0	112.1	D610 L611	D610-S689 WeakPolarHBondContact CA-O 3.19Å; D610-S689 WeakPolarHBondContact OD1-CB 3.35Å; D610-S689 PolarHBondContact OD1-N 3.15Å; D610-S689 PolarHBondContact OD1-OG 3.02Å; L611-S689 PolarHBondContact N-O 2.69Å
690	L	95.4	Very high	92.4	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.016	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	110.8	168.9	177.4	57.1	0	0	0	109	L611 I613 A619 I662 D669 M670 G671 Y673 V692	L611-L690 HydrophobicContact CB-CD1 4.24Å; L611-L690 HydrophobicContact CD2-CD1 4.17Å; L611-L690 HydrophobicContact CG-CD1 4.17Å; L611-L690 WeakPolarHBondContact O-CA 3.24Å; I613-L690 HydrophobicContact CG2-CD1 4.13Å; A619-L690 HydrophobicContact CB-CD1 3.88Å; A619-L690 HydrophobicContact CB-CD2 4.15Å; I662-L690 HydrophobicContact CD1-CD2 4.29Å; D669-L690 HydrophobicContact CB-CD2 4.38Å; M670-L690 WeakPolarHBondContact CA-O 3.32Å; M670-L690 VanDerWaalsContact CG-O 3.32Å; M670-L690 WeakPolarHBondContact CG-O 3.32Å; G671-L690 PolarHBondContact N-O 3.19Å; G671-L690 PolarHBondContact O-N 2.97Å; Y673-L690 HydrophobicContact CD2-CB 3.87Å; Y673-L690 HydrophobicContact CE2-CB 3.78Å; Y673-L690 HydrophobicContact CE2-CD2 3.83Å; Y673-L690 HydrophobicContact CE2-CG 4.43Å; L690-V692 HydrophobicContact CG-CG2 4.21Å
691	T	94.8	Very high	92.2	Very high	48 Å²	48	51.5 Å²	51.5	29%	0.294	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	124.6	176.3	-65	0	0	0	0	110.3	L611 T612 I613 M670 L693	L611-T691 PolarHBondContact O-N 2.84Å; T612-T691 WeakPolarHBondContact CA-O 3.42Å; T612-T691 HydrophobicContact CG2-CG2 4.14Å; I613-T691 PolarHBondContact N-O 2.88Å; M670-T691 HydrophobicContact CE-CG2 4.37Å; T691-L693 HydrophobicContact CG2-CD2 4.05Å
692	V	94.4	Very high	92.3	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.9	-176.5	-169.4	0	0	0	0	111	I613 T615 V665 I667 M670 L690 S722	I613-V692 CarbonylContact O-C 3.54Å; I613-V692 WeakPolarHBondContact O-CA 3.39Å; T615-V692 HydrophobicContact CG2-CG1 3.6Å; V665-V692 HydrophobicContact CG1-CB 4.34Å; V665-V692 HydrophobicContact CG1-CG1 3.82Å; V665-V692 HydrophobicContact CG1-CG2 3.5Å; I667-V692 HydrophobicContact CD1-CB 4.12Å; I667-V692 HydrophobicContact CD1-CG1 3.99Å; M670-V692 HydrophobicContact CB-CG2 4.23Å; M670-V692 HydrophobicContact CE-CB 4.37Å; M670-V692 WeakPolarHBondContact CE-O 3.46Å; L690-V692 HydrophobicContact CG-CG2 4.21Å; V692-S722 WeakPolarHBondContact O-CB 3.35Å; V692-S722 PolarHBondContact O-OG 2.98Å
693	L	92.2	Very high	92.3	Very high	35 Å²	35	58.4 Å²	58.4	18%	0.183	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.8	-178.5	-49.5	-177	0	0	0	111	T612 I613 R614 T615 T691 S722 L772	T612-L693 HydrophobicContact CG2-CD1 3.57Å; T612-L693 HydrophobicContact CG2-CD2 4.11Å; T612-L693 HydrophobicContact CG2-CG 3.76Å; I613-L693 PolarHBondContact O-N 2.74Å; R614-L693 CarbonylContact C-O 3.34Å; R614-L693 VanDerWaalsContact CA-O 3.26Å; R614-L693 WeakPolarHBondContact CA-O 3.4Å; T615-L693 PolarHBondContact N-O 3.23Å; T691-L693 HydrophobicContact CG2-CD2 4.05Å; L693-S722 CarbonylContact C-O 3.46Å; L693-S722 VanDerWaalsContact CA-O 3.26Å; L693-S722 WeakPolarHBondContact CA-O 3.44Å; L693-S722 WeakPolarHBondContact CB-O 3.19Å; L693-L772 HydrophobicContact CB-CD1 3.72Å; L693-L772 HydrophobicContact CB-CD2 4.42Å; L693-L772 HydrophobicContact CB-CG 4.38Å; L693-L772 HydrophobicContact CD1-CD2 4.14Å
694	E	91	Very high	92.3	Very high	59 Å²	59	60.9 Å²	60.9	28%	0.276	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	135.8	-173.8	-179.8	-179.7	-119.1	0	0	110	T615 I667 G721 S722 N770	T615-E694 HydrophobicContact CG2-CB 3.86Å; T615-E694 HydrophobicContact CG2-CG 4.19Å; I667-E694 HydrophobicContact CD1-CB 4.03Å; E694-G721 WeakPolarHBondContact O-CA 3.46Å; E694-G721 WeakPolarHBondContact OE2-CA 3.27Å; E694-G721 PolarHBondContact OE2-N 3.07Å; E694-S722 PolarHBondContact N-O 3.09Å; E694-S722 PolarHBondContact O-N 2.98Å; E694-S722 VanDerWaalsContact O-O 3.12Å; E694-N770 PolarHBondContact O-ND2 2.84Å
695	T	89.5	Confident	92.2	Very high	66 Å²	66	61.5 Å²	61.5	41%	0.405	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	154.3	178.5	40.5	0	0	0	0	111.6	S697 L772	T695-S697 PolarHBondContact O-N 3.04Å; T695-L772 HydrophobicContact CG2-CB 3.76Å; T695-L772 HydrophobicContact CG2-CD1 4.25Å
696	P	91	Very high	92	Very high	6 Å²	6	61.7 Å²	61.7	4%	0.039	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	131.6	176.9	-19.9	33.7	0	0	0	110.3	G720 P725 M768 N770 E775	P696-G720 WeakPolarHBondContact CA-O 3.27Å; P696-P725 HydrophobicContact CB-CB 3.97Å; P696-P725 HydrophobicContact CB-CG 4.42Å; P696-P725 HydrophobicContact CG-CB 4.21Å; P696-M768 HydrophobicContact CB-CB 4.28Å; P696-M768 HydrophobicContact CB-CG 3.57Å; P696-M768 HydrophobicContact CB-SD 3.54Å; P696-M768 VanDerWaalsContact CB-SD 3.54Å; P696-N770 WeakPolarHBondContact CD-OD1 3.25Å; P696-N770 HydrophobicContact CG-CB 4.14Å; P696-E775 HydrophobicContact CB-CB 4.2Å; P696-E775 WeakPolarHBondContact O-CB 3.46Å
697	S	90.1	Very high	91.8	Very high	45 Å²	45	61.5 Å²	61.5	32%	0.315	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	152.2	-179.2	65.2	0	0	0	0	112.2	T695 I699 A719 G720 M768	T695-S697 PolarHBondContact O-N 3.04Å; S697-I699 PolarHBondContact O-N 3.29Å; S697-A719 CarbonylContact O-C 3.1Å; S697-A719 WeakPolarHBondContact O-CA 3.31Å; S697-G720 PolarHBondContact N-O 2.78Å; S697-G720 VanDerWaalsContact N-O 3.1Å; S697-G720 PolarHBondContact O-N 3.09Å; S697-M768 PolarHBondContact N-SD 3.45Å; S697-M768 VanDerWaalsContact N-SD 3.35Å
698	F	90.7	Very high	91.4	Very high	55 Å²	55	59.2 Å²	59.2	24%	0.241	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	116.7	173.4	-65	-80	0	0	0	110	R700 L702 C766 M768 E775	F698-R700 WeakPolarHBondContact CB-O 3.38Å; F698-R700 PolarHBondContact O-N 3.11Å; F698-L702 HydrophobicContact CD1-CD1 4.17Å; F698-L702 HydrophobicContact CD1-CD2 3.66Å; F698-L702 HydrophobicContact CD1-CG 3.9Å; F698-L702 HydrophobicContact CE1-CD1 3.63Å; F698-L702 HydrophobicContact CE1-CD2 3.73Å; F698-L702 HydrophobicContact CE1-CG 3.88Å; F698-L702 HydrophobicContact CZ-CD1 3.95Å; F698-C766 HydrophobicContact CE1-CB 4.49Å; F698-M768 HydrophobicContact CD1-CE 3.35Å; F698-M768 HydrophobicContact CD2-CE 4.18Å; F698-M768 HydrophobicContact CE1-CE 3.35Å; F698-M768 HydrophobicContact CE2-CE 4.18Å; F698-M768 HydrophobicContact CG-CE 3.77Å; F698-M768 HydrophobicContact CZ-CE 3.76Å; F698-E775 HydrophobicContact CD2-CG 4.27Å; F698-E775 HydrophobicContact CE2-CG 3.85Å
699	I	88.3	Confident	91.1	Very high	107 Å²	107	66.9 Å²	66.9	55%	0.549	34%	0.342	S	S	.	.	S	Bend	trans	-69	-23.6	178.8	-57.6	-171.9	0	0	0	111.2	S697 I718	S697-I699 PolarHBondContact O-N 3.29Å; I699-I718 HydrophobicContact CB-CB 4.45Å; I699-I718 HydrophobicContact CB-CG2 4.02Å; I699-I718 HydrophobicContact CD1-CG2 4.16Å; I699-I718 HydrophobicContact CG1-CG2 4.37Å; I699-I718 PolarHBondContact N-O 3.23Å
700	R	85.9	Confident	90.6	Very high	160 Å²	160	66.7 Å²	66.7	60%	0.604	35%	0.347	S	S	*	.	S	Bend	trans	-136.6	150.2	173	-63.6	-177	-178.7	172.1	-0	109.3	F698	F698-R700 WeakPolarHBondContact CB-O 3.38Å; F698-R700 PolarHBondContact O-N 3.11Å
701	P	87	Confident	90.3	Very high	110 Å²	110	71.2 Å²	71.2	71%	0.714	37%	0.368	S	S	*	.			trans	-51	146.7	167.5	-24.7	34.8	0	0	0	111.3
702	L	91.1	Very high	90.2	Very high	38 Å²	38	72.2 Å²	72.2	20%	0.199	37%	0.374	C	S	.	.			trans	-77.7	131.2	169.6	-61.3	-177.3	0	0	0	108.7	F698 Q716 C717 G777 H778 I779	F698-L702 HydrophobicContact CD1-CD1 4.17Å; F698-L702 HydrophobicContact CD1-CD2 3.66Å; F698-L702 HydrophobicContact CD1-CG 3.9Å; F698-L702 HydrophobicContact CE1-CD1 3.63Å; F698-L702 HydrophobicContact CE1-CD2 3.73Å; F698-L702 HydrophobicContact CE1-CG 3.88Å; F698-L702 HydrophobicContact CZ-CD1 3.95Å; L702-Q716 WeakPolarHBondContact CD2-O 3.46Å; L702-C717 HydrophobicContact CD2-CB 4.35Å; L702-G777 VanDerWaalsContact CD1-CA 3.47Å; L702-H778 WeakPolarHBondContact CB-O 3.43Å; L702-I779 HydrophobicContact CB-CD1 4.44Å; L702-I779 HydrophobicContact CB-CG1 3.81Å; L702-I779 HydrophobicContact CD1-CG1 4.32Å; L702-I779 HydrophobicContact CD2-CD1 4.23Å; L702-I779 HydrophobicContact CD2-CG1 4.43Å; L702-I779 HydrophobicContact CG-CG1 4.42Å
703	E	91.2	Very high	90.1	Very high	155 Å²	155	72.2 Å²	72.2	72%	0.724	37%	0.374	S	S	*	.			trans	-111.5	123.2	-175.2	-68.1	178.2	178.5	0	0	110.6	I779	E703-I779 WeakPolarHBondContact O-CG2 3.3Å
704	D	93.1	Very high	90.2	Very high	100 Å²	100	72.4 Å²	72.4	54%	0.535	38%	0.376	S	S	.	.			trans	-61.3	140.1	172.8	-73.5	-15.7	0	0	0	111	Y780	D704-Y780 WeakPolarHBondContact OD1-CD2 3.49Å; D704-Y780 PolarHBondContact OD1-N 2.96Å
705	K	92.8	Very high	90.3	Very high	67 Å²	67	69.7 Å²	69.7	29%	0.291	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	127.2	-170.2	-166.4	157.7	-171.8	149.8	0	111.5	V707 V714 L715 Y780 L781 N782	K705-V707 HydrophobicContact CG-CG1 4.21Å; K705-V714 WeakPolarHBondContact CD-O 3.45Å; K705-V714 WeakPolarHBondContact CE-O 3.23Å; K705-V714 PolarHBondContact NZ-O 2.9Å; K705-L715 HydrophobicContact CB-CD2 4.14Å; K705-L715 HydrophobicContact CD-CD2 4.21Å; K705-Y780 PolarHBondContact N-O 3.49Å; K705-L781 HydrophobicContact CB-CD1 4.32Å; K705-L781 CarbonylContact O-C 3.54Å; K705-L781 WeakPolarHBondContact O-CA 3.34Å; K705-L781 WeakPolarHBondContact O-CD1 3.31Å; K705-N782 PolarHBondContact O-N 2.83Å
706	T	90.7	Very high	90.5	Very high	84 Å²	84	70.8 Å²	70.8	52%	0.515	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	133.5	168	-55.1	0	0	0	0	109	N782 I784	T706-N782 VanDerWaalsContact CA-O 3.31Å; T706-N782 WeakPolarHBondContact CA-O 3.22Å; T706-N782 HydrophobicContact CG2-CB 4.13Å; T706-I784 HydrophobicContact CG2-CD1 4.08Å; T706-I784 HydrophobicContact CG2-CG1 4.15Å; T706-I784 HydrophobicContact CG2-CG2 4.11Å
707	V	90.8	Very high	90.5	Very high	9 Å²	9	70.5 Å²	70.5	6%	0.055	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	153.2	173	-61.3	0	0	0	0	109.6	K705 E711 A713 A756 L781 N782 V783 I784	K705-V707 HydrophobicContact CG-CG1 4.21Å; V707-E711 HydrophobicContact CB-CB 4.31Å; V707-A713 HydrophobicContact CG1-CB 4.05Å; V707-A713 HydrophobicContact CG2-CB 4.43Å; V707-A756 HydrophobicContact CG2-CB 3.73Å; V707-L781 HydrophobicContact CG1-CD1 4.49Å; V707-L781 HydrophobicContact CG2-CD1 4.03Å; V707-N782 PolarHBondContact N-O 3.05Å; V707-V783 HydrophobicContact CG2-CB 4.48Å; V707-V783 HydrophobicContact CG2-CG1 4.4Å; V707-V783 HydrophobicContact CG2-CG2 3.89Å; V707-V783 WeakPolarHBondContact O-CA 3.47Å; V707-I784 PolarHBondContact O-N 3.21Å
708	T	88.3	Confident	90.5	Very high	53 Å²	53	70.3 Å²	70.3	33%	0.325	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	151.5	167.2	69.7	0	0	0	0	110.2	G710 E711 I784	T708-G710 PolarHBondContact O-N 2.85Å; T708-E711 WeakPolarHBondContact CA-OE2 3.16Å; T708-E711 WeakPolarHBondContact CB-OE2 3.47Å; T708-E711 PolarHBondContact N-OE2 2.86Å; T708-E711 WeakPolarHBondContact O-CB 3.46Å; T708-E711 PolarHBondContact O-N 2.86Å; T708-E711 WeakPolarHBondContact OG1-CG 3.38Å; T708-E711 PolarHBondContact OG1-OE2 3.02Å; T708-I784 CarbonylContact C-O 3.48Å; T708-I784 WeakPolarHBondContact CA-O 3.36Å; T708-I784 HydrophobicContact CG2-CD1 4.23Å; T708-I784 HydrophobicContact CG2-CG1 4.03Å
709	R	88.2	Confident	90.4	Very high	164 Å²	164	68.1 Å²	68.1	62%	0.619	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	123.8	-178.8	-177.6	-176.6	173.4	-176.3	-1.4	110.8	A756 V783 I784	R709-A756 WeakPolarHBondContact CA-O 3.09Å; R709-V783 HydrophobicContact CB-CG1 4.11Å; R709-I784 PolarHBondContact N-O 2.85Å
710	G	85.2	Confident	90.4	Very high	37 Å²	37	63.6 Å²	63.6	38%	0.381	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.3	-9.6	-177.2	0	0	0	0	0	115.2	T708 D755 A756	T708-G710 PolarHBondContact O-N 2.85Å; G710-D755 WeakPolarHBondContact CA-OD1 3.01Å; G710-A756 PolarHBondContact N-O 2.65Å
711	E	90.8	Very high	90.5	Very high	98 Å²	98	56.8 Å²	56.8	46%	0.458	31%	0.308	S	S	.	.	S	Bend	trans	-76.4	168.9	170.4	-70.6	-177.5	117.5	0	0	112.2	V707 T708 A756	V707-E711 HydrophobicContact CB-CB 4.31Å; T708-E711 WeakPolarHBondContact CA-OE2 3.16Å; T708-E711 WeakPolarHBondContact CB-OE2 3.47Å; T708-E711 PolarHBondContact N-OE2 2.86Å; T708-E711 WeakPolarHBondContact O-CB 3.46Å; T708-E711 PolarHBondContact O-N 2.86Å; T708-E711 WeakPolarHBondContact OG1-CG 3.38Å; T708-E711 PolarHBondContact OG1-OE2 3.02Å; E711-A756 VanDerWaalsContact O-CB 3.25Å; E711-A756 WeakPolarHBondContact O-CB 3.22Å; E711-A756 PolarHBondContact O-N 3.04Å
712	T	91.6	Very high	90.7	Very high	69 Å²	69	52.6 Å²	52.6	42%	0.423	28%	0.282	S	S	.	.			trans	-94.1	115.4	175.4	-61.5	0	0	0	0	110.7	V714 I752 I753 V754	T712-V714 HydrophobicContact CG2-CG2 4.36Å; T712-I752 HydrophobicContact CG2-CG2 3.61Å; T712-I753 CarbonylContact C-O 3.45Å; T712-I753 VanDerWaalsContact CA-O 3.29Å; T712-I753 WeakPolarHBondContact CA-O 3.42Å; T712-V754 HydrophobicContact CG2-CG2 4.09Å
713	A	92.6	Very high	90.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	146.3	168.6	0	0	0	0	0	110.6	V707 I752 I753 L781	V707-A713 HydrophobicContact CG1-CB 4.05Å; V707-A713 HydrophobicContact CG2-CB 4.43Å; A713-I752 CarbonylContact O-C 3.15Å; A713-I752 WeakPolarHBondContact O-CA 3.24Å; A713-I753 HydrophobicContact CB-CB 4.26Å; A713-I753 PolarHBondContact N-O 2.84Å; A713-I753 PolarHBondContact O-N 2.75Å; A713-L781 HydrophobicContact CB-CD1 3.82Å; A713-L781 HydrophobicContact CB-CD2 3.94Å
714	V	93.7	Very high	90.4	Very high	38 Å²	38	50.4 Å²	50.4	23%	0.23	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	110.3	172.6	-178.1	0	0	0	0	107.3	K705 T712 L751 I752	K705-V714 WeakPolarHBondContact CD-O 3.45Å; K705-V714 WeakPolarHBondContact CE-O 3.23Å; K705-V714 PolarHBondContact NZ-O 2.9Å; T712-V714 HydrophobicContact CG2-CG2 4.36Å; V714-L751 WeakPolarHBondContact CA-O 3.26Å; V714-I752 HydrophobicContact CG1-CG1 4.14Å; V714-I752 HydrophobicContact CG2-CG1 4.18Å; V714-I752 HydrophobicContact CG2-CG2 4.28Å
715	L	93.6	Very high	90.3	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	131	-179.9	-43.7	-176.8	0	0	0	108	K705 W729 L751 I753 Y764 I779 L781	K705-L715 HydrophobicContact CB-CD2 4.14Å; K705-L715 HydrophobicContact CD-CD2 4.21Å; L715-W729 HydrophobicContact CB-CH2 3.88Å; L715-W729 HydrophobicContact CB-CZ3 4.14Å; L715-W729 HydrophobicContact CD1-CZ3 4.45Å; L715-L751 HydrophobicContact CB-CB 4.4Å; L715-L751 HydrophobicContact CD1-CD2 4.32Å; L715-L751 PolarHBondContact N-O 2.97Å; L715-L751 PolarHBondContact O-N 2.86Å; L715-I753 HydrophobicContact CD1-CD1 4.45Å; L715-Y764 HydrophobicContact CD1-CD1 3.72Å; L715-Y764 HydrophobicContact CD1-CD2 3.64Å; L715-Y764 HydrophobicContact CD1-CE1 4.21Å; L715-Y764 HydrophobicContact CD1-CE2 4.16Å; L715-Y764 HydrophobicContact CD1-CG 3.4Å; L715-Y764 VanDerWaalsContact CD1-CG 3.4Å; L715-I779 HydrophobicContact CB-CD1 3.86Å; L715-I779 HydrophobicContact CD2-CG2 3.97Å; L715-L781 HydrophobicContact CD2-CD1 4.35Å
716	Q	92.8	Very high	90.3	Very high	90 Å²	90	53.1 Å²	53.1	42%	0.421	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	126.6	-172.4	-53.6	-163	-0.2	0	0	111.4	L702 L750	L702-Q716 WeakPolarHBondContact CD2-O 3.46Å; Q716-L750 HydrophobicContact CB-CD2 4.07Å; Q716-L750 HydrophobicContact CG-CD2 3.68Å
717	C	91.2	Very high	90.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.273	C	S	.	.			trans	-129.9	74.4	175.6	179.9	0	0	0	0	109	L702 A719 L727 W729 Q749 C766	L702-C717 HydrophobicContact CD2-CB 4.35Å; C717-A719 PolarHBondContact O-N 3.3Å; C717-L727 HydrophobicContact CB-CD2 4.21Å; C717-L727 WeakPolarHBondContact O-CD2 3.38Å; C717-W729 HydrophobicContact CB-CH2 3.75Å; C717-W729 HydrophobicContact CB-CZ2 3.41Å; C717-W729 VanDerWaalsContact CB-CZ2 3.41Å; C717-Q749 CarbonylContact C-O 3.54Å; C717-Q749 PolarHBondContact N-O 2.91Å; C717-Q749 WeakPolarHBondContact O-CA 3.23Å; C717-Q749 VanDerWaalsContact O-CB 3.24Å; C717-Q749 WeakPolarHBondContact O-CB 3.33Å; C717-Q749 WeakPolarHBondContact O-CG 3.46Å; C717-C766 HydrophobicContact CB-CB 3.61Å; C717-C766 WeakPolarHBondContact CB-SG 3.36Å; C717-C766 WeakPolarHBondContact SG-CB 3.45Å; C717-C766 CovalentContact SG-SG 2.03Å; C717-C766 PolarHBondContact SG-SG 3.2Å
718	I	90.6	Very high	90.4	Very high	41 Å²	41	54.3 Å²	54.3	21%	0.21	30%	0.296	C	S	.	.			trans	-79.5	114.6	-178.4	-48.5	-61.9	0	0	0	108.8	I699 Q749 L750	I699-I718 HydrophobicContact CB-CB 4.45Å; I699-I718 HydrophobicContact CB-CG2 4.02Å; I699-I718 HydrophobicContact CD1-CG2 4.16Å; I699-I718 HydrophobicContact CG1-CG2 4.37Å; I699-I718 PolarHBondContact N-O 3.23Å; I718-Q749 HydrophobicContact CD1-CB 4.26Å; I718-L750 HydrophobicContact CD1-CD2 4.25Å
719	A	88.9	Confident	90.6	Very high	9 Å²	9	52 Å²	52	7%	0.074	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	134.2	-168.8	0	0	0	0	0	112.9	S697 C717 P725 L727 Q749 M768	S697-A719 CarbonylContact O-C 3.1Å; S697-A719 WeakPolarHBondContact O-CA 3.31Å; C717-A719 PolarHBondContact O-N 3.3Å; A719-P725 HydrophobicContact CB-CG 3.77Å; A719-L727 HydrophobicContact CB-CD1 3.84Å; A719-L727 HydrophobicContact CB-CD2 4.25Å; A719-L727 HydrophobicContact CB-CG 4.4Å; A719-Q749 PolarHBondContact O-NE2 2.93Å; A719-M768 HydrophobicContact CB-CB 4.49Å; A719-M768 HydrophobicContact CB-CE 3.51Å; A719-M768 HydrophobicContact CB-SD 3.73Å
720	G	88.5	Confident	90.9	Very high	12 Å²	12	45.4 Å²	45.4	12%	0.124	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	175.6	171.4	0	0	0	0	0	111.8	P696 S697 P725	P696-G720 WeakPolarHBondContact CA-O 3.27Å; S697-G720 PolarHBondContact N-O 2.78Å; S697-G720 VanDerWaalsContact N-O 3.1Å; S697-G720 PolarHBondContact O-N 3.09Å; G720-P725 WeakPolarHBondContact O-CG 3.44Å
721	G	88.3	Confident	91.3	Very high	16 Å²	16	45.4 Å²	45.4	17%	0.165	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	127.3	155.5	-176.5	0	0	0	0	0	113.5	E694 P723 A724	E694-G721 WeakPolarHBondContact O-CA 3.46Å; E694-G721 WeakPolarHBondContact OE2-CA 3.27Å; E694-G721 PolarHBondContact OE2-N 3.07Å; G721-P723 CarbonylContact C-O 3.56Å; G721-P723 CarbonylContact O-C 3.59Å; G721-A724 WeakPolarHBondContact O-CA 3.03Å; G721-A724 PolarHBondContact O-N 2.93Å
722	S	89.9	Confident	91.2	Very high	23 Å²	23	44.9 Å²	44.9	16%	0.161	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	114.9	-177.7	176.2	0	0	0	0	109.6	V692 L693 E694	V692-S722 WeakPolarHBondContact O-CB 3.35Å; V692-S722 PolarHBondContact O-OG 2.98Å; L693-S722 CarbonylContact C-O 3.46Å; L693-S722 VanDerWaalsContact CA-O 3.26Å; L693-S722 WeakPolarHBondContact CA-O 3.44Å; L693-S722 WeakPolarHBondContact CB-O 3.19Å; E694-S722 PolarHBondContact N-O 3.09Å; E694-S722 PolarHBondContact O-N 2.98Å; E694-S722 VanDerWaalsContact O-O 3.12Å
723	P	89.6	Confident	90.8	Very high	61 Å²	61	47 Å²	47	40%	0.396	26%	0.258	S	S	.	.	S	Bend	cis	-63.6	157.4	-2.1	-19	33.5	0	0	0	112.7	G721 N770 T771	G721-P723 CarbonylContact C-O 3.56Å; G721-P723 CarbonylContact O-C 3.59Å; P723-N770 WeakPolarHBondContact O-CB 3.46Å; P723-N770 PolarHBondContact O-ND2 2.99Å; P723-T771 WeakPolarHBondContact CD-OG1 3.25Å
724	A	88.4	Confident	90.6	Very high	85 Å²	85	48.2 Å²	48.2	70%	0.702	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-53.9	129.4	-179.7	0	0	0	0	0	111.7	G721	G721-A724 WeakPolarHBondContact O-CA 3.03Å; G721-A724 PolarHBondContact O-N 2.93Å
725	P	90.7	Very high	90.3	Very high	18 Å²	18	51.5 Å²	51.5	12%	0.117	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-75.4	152.9	-173.4	31.4	-37.4	0	0	0	113.1	P696 A719 G720 L727 M768 S769 N770	P696-P725 HydrophobicContact CB-CB 3.97Å; P696-P725 HydrophobicContact CB-CG 4.42Å; P696-P725 HydrophobicContact CG-CB 4.21Å; A719-P725 HydrophobicContact CB-CG 3.77Å; G720-P725 WeakPolarHBondContact O-CG 3.44Å; P725-L727 HydrophobicContact CG-CD1 4.45Å; P725-L727 WeakPolarHBondContact O-CD1 3.4Å; P725-M768 HydrophobicContact CB-CB 4.21Å; P725-S769 CarbonylContact C-O 3.37Å; P725-S769 VanDerWaalsContact CA-O 3.25Å; P725-S769 WeakPolarHBondContact CA-O 3.46Å; P725-N770 HydrophobicContact CB-CB 4.35Å
726	R	91.4	Very high	90.1	Very high	207 Å²	207	52.4 Å²	52.4	78%	0.781	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	135.4	170.6	-60.2	-178.1	-179.6	-168.8	0	109.5	M768 S769	R726-M768 CarbonylContact O-C 3.53Å; R726-M768 WeakPolarHBondContact O-CA 3.34Å; R726-S769 PolarHBondContact N-O 2.89Å; R726-S769 PolarHBondContact O-N 3.38Å
727	L	92.7	Very high	89.8	Confident	15 Å²	15	55 Å²	55	8%	0.079	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	139.9	-177.5	-76.4	75.2	0	0	0	112.6	C717 A719 P725 N748 Q749 I767 M768	C717-L727 HydrophobicContact CB-CD2 4.21Å; C717-L727 WeakPolarHBondContact O-CD2 3.38Å; A719-L727 HydrophobicContact CB-CD1 3.84Å; A719-L727 HydrophobicContact CB-CD2 4.25Å; A719-L727 HydrophobicContact CB-CG 4.4Å; P725-L727 HydrophobicContact CG-CD1 4.45Å; P725-L727 WeakPolarHBondContact O-CD1 3.4Å; L727-N748 HydrophobicContact CB-CB 3.96Å; L727-N748 PolarHBondContact O-ND2 3.01Å; L727-Q749 HydrophobicContact CD1-CG 4.32Å; L727-Q749 HydrophobicContact CD2-CB 4.17Å; L727-Q749 HydrophobicContact CD2-CG 3.65Å; L727-I767 WeakPolarHBondContact CA-O 3.2Å; L727-M768 HydrophobicContact CD1-CB 4.37Å; L727-M768 HydrophobicContact CG-CB 4.14Å
728	N	91.6	Very high	89.5	Confident	102 Å²	102	59 Å²	59	55%	0.545	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	148.8	173.4	-172.2	21.6	0	0	0	109.9	I767	N728-I767 PolarHBondContact N-O 3.48Å; N728-I767 PolarHBondContact O-N 3.32Å
729	W	93.4	Very high	89.4	Confident	6 Å²	6	60.3 Å²	60.3	2%	0.023	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	141	-177.9	-71.3	83.7	0	0	0	111.8	L715 C717 L736 F744 N748 L751 T765 C766 I779	L715-W729 HydrophobicContact CB-CH2 3.88Å; L715-W729 HydrophobicContact CB-CZ3 4.14Å; L715-W729 HydrophobicContact CD1-CZ3 4.45Å; C717-W729 HydrophobicContact CB-CH2 3.75Å; C717-W729 HydrophobicContact CB-CZ2 3.41Å; C717-W729 VanDerWaalsContact CB-CZ2 3.41Å; W729-L736 HydrophobicContact CB-CD2 3.79Å; W729-L736 WeakPolarHBondContact O-CB 3.35Å; W729-F744 HydrophobicContact CB-CE1 4.27Å; W729-F744 AromaticContact CD1-CE1 3.64Å; W729-F744 HydrophobicContact CG-CE1 4.1Å; W729-N748 PolarHBondContact NE1-O 3.4Å; W729-L751 HydrophobicContact CB-CD2 4.33Å; W729-L751 HydrophobicContact CD2-CB 4.13Å; W729-L751 HydrophobicContact CD2-CD2 3.87Å; W729-L751 HydrophobicContact CE3-CB 4.46Å; W729-L751 HydrophobicContact CE3-CD2 3.85Å; W729-L751 HydrophobicContact CG-CD2 4.13Å; W729-L751 HydrophobicContact CH2-CB 4.25Å; W729-L751 HydrophobicContact CZ2-CB 3.9Å; W729-L751 HydrophobicContact CZ3-CD2 4.4Å; W729-T765 WeakPolarHBondContact CA-O 3.43Å; W729-C766 HydrophobicContact CD2-CB 4.26Å; W729-C766 HydrophobicContact CE3-CB 4.14Å; W729-C766 HydrophobicContact CH2-CB 4.18Å; W729-C766 HydrophobicContact CZ2-CB 4.28Å; W729-C766 HydrophobicContact CZ3-CB 4.1Å; W729-I779 HydrophobicContact CH2-CD1 3.97Å; W729-I779 HydrophobicContact CZ3-CD1 4.16Å
730	T	93.9	Very high	89.3	Confident	24 Å²	24	68.9 Å²	68.9	15%	0.147	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	156.9	173.5	52.9	0	0	0	0	110.3	G734 Y764 T765 I767	T730-G734 CarbonylContact C-O 3.51Å; T730-G734 WeakPolarHBondContact CA-O 3.3Å; T730-G734 WeakPolarHBondContact CB-O 3.42Å; T730-Y764 CarbonylContact O-C 3.09Å; T730-Y764 WeakPolarHBondContact O-CA 3.23Å; T730-T765 PolarHBondContact N-O 3.21Å; T730-T765 PolarHBondContact O-N 3.33Å; T730-T765 WeakPolarHBondContact OG1-CB 3.29Å; T730-I767 HydrophobicContact CG2-CD1 4.1Å
731	K	93.3	Very high	89.3	Confident	37 Å²	37	70.9 Å²	70.9	16%	0.161	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132.6	178.2	-174.4	-175.7	-168.9	-81.5	0	109.7	D733 G734 L736 E759 D760 A761 Y764	K731-D733 PolarHBondContact O-N 3.32Å; K731-G734 PolarHBondContact N-O 3.34Å; K731-G734 CarbonylContact O-C 3.59Å; K731-G734 PolarHBondContact O-N 3.14Å; K731-G734 VanDerWaalsContact O-O 3.06Å; K731-L736 HydrophobicContact CB-CD1 4.01Å; K731-E759 PolarHBondContact NZ-O 3.08Å; K731-D760 WeakPolarHBondContact CE-O 3.18Å; K731-A761 PolarHBondContact NZ-O 3.49Å; K731-Y764 HydrophobicContact CB-CD1 4.37Å; K731-Y764 HydrophobicContact CB-CE1 4.25Å; K731-Y764 HydrophobicContact CD-CE1 4.06Å; K731-Y764 HydrophobicContact CD-CE2 4.08Å; K731-Y764 WeakPolarHBondContact CD-OH 3.35Å; K731-Y764 WeakPolarHBondContact CE-OH 3.2Å; K731-Y764 HydrophobicContact CG-CD1 4.46Å; K731-Y764 HydrophobicContact CG-CD2 4.5Å; K731-Y764 HydrophobicContact CG-CE1 4.15Å; K731-Y764 HydrophobicContact CG-CE2 4.15Å
732	D	88.6	Confident	89.5	Confident	87 Å²	87	70.8 Å²	70.8	47%	0.465	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	42.4	179	-56.5	-45.2	0	0	0	112.1	G734 G762 K763	D732-G734 PolarHBondContact O-N 3.32Å; D732-G762 VanDerWaalsContact OD1-CA 3.28Å; D732-G762 WeakPolarHBondContact OD1-CA 3.3Å; D732-K763 PolarHBondContact N-O 3.44Å; D732-K763 PolarHBondContact OD1-N 2.97Å
733	D	84.2	Confident	89.6	Confident	113 Å²	113	74.9 Å²	74.9	60%	0.604	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	5.6	-175.5	-61.5	-44.7	0	0	0	116.2	K731 K763	K731-D733 PolarHBondContact O-N 3.32Å; D733-K763 IonicContact OD1-NZ 2.65Å; D733-K763 PolarHBondContact OD1-NZ 3.46Å; D733-K763 IonicContact OD2-NZ 2.62Å; D733-K763 PolarHBondContact OD2-NZ 2.87Å
734	G	88.1	Confident	89.7	Confident	26 Å²	26	75.5 Å²	75.5	27%	0.268	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	170.4	169.4	0	0	0	0	0	114.1	T730 K731 D732 L736	T730-G734 CarbonylContact C-O 3.51Å; T730-G734 WeakPolarHBondContact CA-O 3.3Å; T730-G734 WeakPolarHBondContact CB-O 3.42Å; K731-G734 PolarHBondContact N-O 3.34Å; K731-G734 CarbonylContact O-C 3.59Å; K731-G734 PolarHBondContact O-N 3.14Å; K731-G734 VanDerWaalsContact O-O 3.06Å; D732-G734 PolarHBondContact O-N 3.32Å; G734-L736 PolarHBondContact O-N 2.03Å
735	P	86.9	Confident	89.7	Confident	108 Å²	108	73.2 Å²	73.2	70%	0.701	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.3	134.7	177.7	27	-34.6	0	0	0	111.1	L737	P735-L737 PolarHBondContact O-N 3.31Å; P735-L737 VanDerWaalsContact O-N 3.15Å
736	L	89.8	Confident	89.5	Confident	21 Å²	21	75.3 Å²	75.3	11%	0.11	40%	0.397	C	S	.	.			trans	-65.5	115.1	177.6	174	58.3	0	0	0	110	W729 K731 G734 V738 F744 L751 Y764	W729-L736 HydrophobicContact CB-CD2 3.79Å; W729-L736 WeakPolarHBondContact O-CB 3.35Å; K731-L736 HydrophobicContact CB-CD1 4.01Å; G734-L736 PolarHBondContact O-N 2.03Å; L736-V738 VanDerWaalsContact C-N 3.35Å; L736-V738 HydrophobicContact CD2-CG2 4.47Å; L736-V738 HydrophobicContact CG-CG2 4.19Å; L736-V738 PolarHBondContact O-N 3.07Å; L736-F744 HydrophobicContact CD2-CE1 4.32Å; L736-F744 HydrophobicContact CD2-CZ 3.89Å; L736-L751 HydrophobicContact CD2-CD1 4.33Å; L736-L751 HydrophobicContact CD2-CD2 3.56Å; L736-Y764 HydrophobicContact CD1-CD1 4.44Å; L736-Y764 HydrophobicContact CD1-CE1 3.78Å
737	L	85.6	Confident	89.3	Confident	145 Å²	145	69.5 Å²	69.5	76%	0.759	39%	0.393	S	S	*	.			trans	-76.7	85.3	174.6	-65	177.3	0	0	0	109.8	P735 T739	P735-L737 PolarHBondContact O-N 3.31Å; P735-L737 VanDerWaalsContact O-N 3.15Å; L737-T739 PolarHBondContact O-N 3.15Å
738	V	85.7	Confident	89.1	Confident	83 Å²	83	72 Å²	72	50%	0.503	41%	0.407	S	S	.	.			trans	-62.7	118.9	178.4	-176	0	0	0	0	110	L736 H742 F744	L736-V738 VanDerWaalsContact C-N 3.35Å; L736-V738 HydrophobicContact CD2-CG2 4.47Å; L736-V738 HydrophobicContact CG-CG2 4.19Å; L736-V738 PolarHBondContact O-N 3.07Å; V738-H742 HydrophobicContact CG1-CB 3.97Å; V738-F744 HydrophobicContact CG1-CE2 4.08Å; V738-F744 HydrophobicContact CG2-CE2 3.76Å; V738-F744 HydrophobicContact CG2-CZ 3.93Å
739	T	87.4	Confident	89	Confident	68 Å²	68	69.2 Å²	69.2	42%	0.417	39%	0.391	S	S	.	.			trans	-108.1	173.6	172.7	63.3	0	0	0	0	110.6	L737 R741 H742	L737-T739 PolarHBondContact O-N 3.15Å; T739-R741 PolarHBondContact O-N 3.35Å; T739-R741 PolarHBondContact OG1-N 3.07Å; T739-H742 PolarHBondContact O-N 3.42Å; T739-H742 PolarHBondContact OG1-ND1 2.91Å
740	E	86.6	Confident	89	Confident	189 Å²	189	70.9 Å²	70.9	88%	0.883	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-12.1	173	-61.7	-176.5	168.7	0	0	113.9	F743	E740-F743 WeakPolarHBondContact O-CE2 3.44Å; E740-F743 VanDerWaalsContact O-CZ 3.24Å; E740-F743 WeakPolarHBondContact O-CZ 3.47Å
741	R	88.9	Confident	88.9	Confident	54 Å²	54	69.8 Å²	69.8	20%	0.204	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-14.5	172.2	-60.6	-162.1	-64.3	90.9	-2.4	113.6	T739 I753 V754 D755 E759 D760	T739-R741 PolarHBondContact O-N 3.35Å; T739-R741 PolarHBondContact OG1-N 3.07Å; R741-I753 WeakPolarHBondContact O-CA 3.39Å; R741-V754 WeakPolarHBondContact CB-O 3.32Å; R741-V754 WeakPolarHBondContact CD-O 3Å; R741-V754 PolarHBondContact NH1-O 3.34Å; R741-V754 PolarHBondContact O-N 2.89Å; R741-D755 PolarHBondContact NH1-O 3.02Å; R741-D755 VanDerWaalsContact NH1-O 3.1Å; R741-E759 IonicContact CZ-OE1 3.72Å; R741-E759 IonicContact NH2-OE1 3.94Å; R741-E759 PolarHBondContact NH2-OE1 3.06Å; R741-D760 IonicContact CZ-OD1 3.26Å; R741-D760 IonicContact CZ-OD2 3.13Å; R741-D760 VanDerWaalsContact CZ-OD2 3.24Å; R741-D760 IonicContact NH1-OD1 2.83Å; R741-D760 IonicContact NH1-OD2 2.69Å; R741-D760 PolarHBondContact NH1-OD2 3.15Å; R741-D760 IonicContact NH2-OD1 2.74Å; R741-D760 PolarHBondContact NH2-OD1 3.24Å; R741-D760 IonicContact NH2-OD2 2.91Å; R741-D760 PolarHBondContact NH2-OD2 3.47Å
742	H	92.3	Very high	88.9	Confident	14 Å²	14	70 Å²	70	7%	0.065	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.3	-174.1	-72	73.5	0	0	0	111.8	V738 T739 I752 D760	V738-H742 HydrophobicContact CG1-CB 3.97Å; T739-H742 PolarHBondContact O-N 3.42Å; T739-H742 PolarHBondContact OG1-ND1 2.91Å; H742-I752 CarbonylContact C-O 3.47Å; H742-I752 WeakPolarHBondContact CA-O 3.2Å; H742-D760 IonicContact CE1-OD1 2.64Å
743	F	91.8	Very high	89.2	Confident	109 Å²	109	65.9 Å²	65.9	48%	0.478	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	138	179.6	-57.3	-92.4	0	0	0	111.6	E740 I752 V754	E740-F743 WeakPolarHBondContact O-CE2 3.44Å; E740-F743 VanDerWaalsContact O-CZ 3.24Å; E740-F743 WeakPolarHBondContact O-CZ 3.47Å; F743-I752 HydrophobicContact CB-CB 4.25Å; F743-I752 PolarHBondContact N-O 3.45Å; F743-I752 PolarHBondContact O-N 2.87Å; F743-V754 HydrophobicContact CD2-CG2 4.01Å; F743-V754 HydrophobicContact CE2-CG2 3.83Å
744	F	92.1	Very high	89.5	Confident	75 Å²	75	63.1 Å²	63.1	33%	0.329	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	134.7	174.2	-61.3	-86.4	0	0	0	110.7	W729 L736 V738 N748 L750 L751	W729-F744 HydrophobicContact CB-CE1 4.27Å; W729-F744 AromaticContact CD1-CE1 3.64Å; W729-F744 HydrophobicContact CG-CE1 4.1Å; L736-F744 HydrophobicContact CD2-CE1 4.32Å; L736-F744 HydrophobicContact CD2-CZ 3.89Å; V738-F744 HydrophobicContact CG1-CE2 4.08Å; V738-F744 HydrophobicContact CG2-CE2 3.76Å; V738-F744 HydrophobicContact CG2-CZ 3.93Å; F744-N748 HydrophobicContact CD1-CB 4.37Å; F744-L750 WeakPolarHBondContact CA-O 3.44Å; F744-L751 HydrophobicContact CD1-CD1 4.08Å; F744-L751 HydrophobicContact CE1-CB 4.5Å; F744-L751 HydrophobicContact CE1-CD1 3.7Å; F744-L751 HydrophobicContact CE1-CD2 4.49Å; F744-L751 HydrophobicContact CE1-CG 4.45Å; F744-L751 HydrophobicContact CZ-CD1 3.98Å
745	A	88.1	Confident	89.6	Confident	37 Å²	37	66.5 Å²	66.5	31%	0.306	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	166.6	175.6	0	0	0	0	0	111.5	A747 N748 Q749 L750 I752	A745-A747 PolarHBondContact O-N 2.83Å; A745-N748 PolarHBondContact O-N 3.07Å; A745-Q749 PolarHBondContact O-N 2.79Å; A745-L750 HydrophobicContact CB-CB 4.1Å; A745-L750 HydrophobicContact CB-CD1 4.24Å; A745-L750 PolarHBondContact N-O 3.15Å; A745-L750 PolarHBondContact O-N 2.83Å; A745-I752 HydrophobicContact CB-CD1 4.38Å
746	A	87.8	Confident	89.7	Confident	61 Å²	61	61.3 Å²	61.3	50%	0.504	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	58.4	-179.2	0	0	0	0	0	113.5	N748 Q749 L750	A746-N748 VanDerWaalsContact C-N 3.33Å; A746-N748 PolarHBondContact O-N 3.08Å; A746-Q749 HydrophobicContact CB-CB 4.32Å; A746-Q749 WeakPolarHBondContact O-CB 3.37Å; A746-Q749 VanDerWaalsContact O-CG 3.24Å; A746-Q749 WeakPolarHBondContact O-CG 3.36Å; A746-Q749 PolarHBondContact O-N 3.32Å; A746-L750 HydrophobicContact CB-CD1 4.16Å; A746-L750 HydrophobicContact CB-CG 4.25Å
747	A	86.3	Confident	89.5	Confident	86 Å²	86	60.6 Å²	60.6	71%	0.711	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	47.1	-178.3	0	0	0	0	0	113.6	A745 Q749	A745-A747 PolarHBondContact O-N 2.83Å; A747-Q749 PolarHBondContact O-N 3.18Å
748	N	89.3	Confident	89.5	Confident	68 Å²	68	58.1 Å²	58.1	36%	0.364	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	9.7	-175.7	-54.7	-8.1	0	0	0	115.4	L727 W729 F744 A745 A746 L750	L727-N748 HydrophobicContact CB-CB 3.96Å; L727-N748 PolarHBondContact O-ND2 3.01Å; W729-N748 PolarHBondContact NE1-O 3.4Å; F744-N748 HydrophobicContact CD1-CB 4.37Å; A745-N748 PolarHBondContact O-N 3.07Å; A746-N748 VanDerWaalsContact C-N 3.33Å; A746-N748 PolarHBondContact O-N 3.08Å; N748-L750 VanDerWaalsContact C-N 3.25Å; N748-L750 PolarHBondContact O-N 3.27Å
749	Q	89.9	Confident	89.6	Confident	43 Å²	43	60 Å²	60	20%	0.201	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-16	174	-63.5	-173.2	13	0	0	113.5	C717 I718 A719 L727 A745 A746 A747	C717-Q749 CarbonylContact C-O 3.54Å; C717-Q749 PolarHBondContact N-O 2.91Å; C717-Q749 WeakPolarHBondContact O-CA 3.23Å; C717-Q749 VanDerWaalsContact O-CB 3.24Å; C717-Q749 WeakPolarHBondContact O-CB 3.33Å; C717-Q749 WeakPolarHBondContact O-CG 3.46Å; I718-Q749 HydrophobicContact CD1-CB 4.26Å; A719-Q749 PolarHBondContact O-NE2 2.93Å; L727-Q749 HydrophobicContact CD1-CG 4.32Å; L727-Q749 HydrophobicContact CD2-CB 4.17Å; L727-Q749 HydrophobicContact CD2-CG 3.65Å; A745-Q749 PolarHBondContact O-N 2.79Å; A746-Q749 HydrophobicContact CB-CB 4.32Å; A746-Q749 WeakPolarHBondContact O-CB 3.37Å; A746-Q749 VanDerWaalsContact O-CG 3.24Å; A746-Q749 WeakPolarHBondContact O-CG 3.36Å; A746-Q749 PolarHBondContact O-N 3.32Å; A747-Q749 PolarHBondContact O-N 3.18Å
750	L	91.8	Very high	89.6	Confident	41 Å²	41	57 Å²	57	22%	0.215	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.8	174.5	-59.9	174.6	0	0	0	109.7	Q716 I718 F744 A745 A746 N748	Q716-L750 HydrophobicContact CB-CD2 4.07Å; Q716-L750 HydrophobicContact CG-CD2 3.68Å; I718-L750 HydrophobicContact CD1-CD2 4.25Å; F744-L750 WeakPolarHBondContact CA-O 3.44Å; A745-L750 HydrophobicContact CB-CB 4.1Å; A745-L750 HydrophobicContact CB-CD1 4.24Å; A745-L750 PolarHBondContact N-O 3.15Å; A745-L750 PolarHBondContact O-N 2.83Å; A746-L750 HydrophobicContact CB-CD1 4.16Å; A746-L750 HydrophobicContact CB-CG 4.25Å; N748-L750 VanDerWaalsContact C-N 3.25Å; N748-L750 PolarHBondContact O-N 3.27Å
751	L	93.3	Very high	89.7	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	115	169	173.5	54.3	0	0	0	109	V714 L715 W729 L736 F744 I753 Y764	V714-L751 WeakPolarHBondContact CA-O 3.26Å; L715-L751 HydrophobicContact CB-CB 4.4Å; L715-L751 HydrophobicContact CD1-CD2 4.32Å; L715-L751 PolarHBondContact N-O 2.97Å; L715-L751 PolarHBondContact O-N 2.86Å; W729-L751 HydrophobicContact CB-CD2 4.33Å; W729-L751 HydrophobicContact CD2-CB 4.13Å; W729-L751 HydrophobicContact CD2-CD2 3.87Å; W729-L751 HydrophobicContact CE3-CB 4.46Å; W729-L751 HydrophobicContact CE3-CD2 3.85Å; W729-L751 HydrophobicContact CG-CD2 4.13Å; W729-L751 HydrophobicContact CH2-CB 4.25Å; W729-L751 HydrophobicContact CZ2-CB 3.9Å; W729-L751 HydrophobicContact CZ3-CD2 4.4Å; L736-L751 HydrophobicContact CD2-CD1 4.33Å; L736-L751 HydrophobicContact CD2-CD2 3.56Å; F744-L751 HydrophobicContact CD1-CD1 4.08Å; F744-L751 HydrophobicContact CE1-CB 4.5Å; F744-L751 HydrophobicContact CE1-CD1 3.7Å; F744-L751 HydrophobicContact CE1-CD2 4.49Å; F744-L751 HydrophobicContact CE1-CG 4.45Å; F744-L751 HydrophobicContact CZ-CD1 3.98Å; L751-I753 HydrophobicContact CG-CG1 4.38Å; L751-Y764 HydrophobicContact CD2-CD1 3.67Å; L751-Y764 HydrophobicContact CD2-CE1 3.9Å
752	I	93.3	Very high	89.9	Confident	42 Å²	42	47.8 Å²	47.8	22%	0.215	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	132.8	-177.8	-57.3	170.4	0	0	0	108	T712 A713 V714 H742 F743 A745 V754	T712-I752 HydrophobicContact CG2-CG2 3.61Å; A713-I752 CarbonylContact O-C 3.15Å; A713-I752 WeakPolarHBondContact O-CA 3.24Å; V714-I752 HydrophobicContact CG1-CG1 4.14Å; V714-I752 HydrophobicContact CG2-CG1 4.18Å; V714-I752 HydrophobicContact CG2-CG2 4.28Å; H742-I752 CarbonylContact C-O 3.47Å; H742-I752 WeakPolarHBondContact CA-O 3.2Å; F743-I752 HydrophobicContact CB-CB 4.25Å; F743-I752 PolarHBondContact N-O 3.45Å; F743-I752 PolarHBondContact O-N 2.87Å; A745-I752 HydrophobicContact CB-CD1 4.38Å; I752-V754 HydrophobicContact CG2-CG2 4.32Å
753	I	94	Very high	90	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	110	179	-47.5	177.5	0	0	0	107.9	T712 A713 L715 R741 L751 D760 Y764 L781	T712-I753 CarbonylContact C-O 3.45Å; T712-I753 VanDerWaalsContact CA-O 3.29Å; T712-I753 WeakPolarHBondContact CA-O 3.42Å; A713-I753 HydrophobicContact CB-CB 4.26Å; A713-I753 PolarHBondContact N-O 2.84Å; A713-I753 PolarHBondContact O-N 2.75Å; L715-I753 HydrophobicContact CD1-CD1 4.45Å; R741-I753 WeakPolarHBondContact O-CA 3.39Å; L751-I753 HydrophobicContact CG-CG1 4.38Å; I753-D760 HydrophobicContact CG2-CB 4.45Å; I753-Y764 HydrophobicContact CD1-CE1 3.77Å; I753-Y764 HydrophobicContact CD1-CE2 4.32Å; I753-Y764 WeakPolarHBondContact CD1-OH 3.45Å; I753-L781 HydrophobicContact CD1-CD2 3.91Å
754	V	91.3	Very high	90.1	Very high	56 Å²	56	43.6 Å²	43.6	34%	0.339	26%	0.259	S	S	.	.	S	Bend	trans	-87	148.1	-178.5	-176.3	0	0	0	0	109.8	T712 R741 F743 I752	T712-V754 HydrophobicContact CG2-CG2 4.09Å; R741-V754 WeakPolarHBondContact CB-O 3.32Å; R741-V754 WeakPolarHBondContact CD-O 3Å; R741-V754 PolarHBondContact NH1-O 3.34Å; R741-V754 PolarHBondContact O-N 2.89Å; F743-V754 HydrophobicContact CD2-CG2 4.01Å; F743-V754 HydrophobicContact CE2-CG2 3.83Å; I752-V754 HydrophobicContact CG2-CG2 4.32Å
755	D	88.5	Confident	90.2	Very high	96 Å²	96	40.2 Å²	40.2	51%	0.513	24%	0.244	S	C	.	.	S	Bend	trans	51.1	62.5	-179.1	-173.9	30.6	0	0	0	111.5	G710 R741 G757	G710-D755 WeakPolarHBondContact CA-OD1 3.01Å; R741-D755 PolarHBondContact NH1-O 3.02Å; R741-D755 VanDerWaalsContact NH1-O 3.1Å; D755-G757 PolarHBondContact O-N 3.03Å
756	A	89.1	Confident	90.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.23	C	C	.	.			trans	-63.6	117.1	-171.5	0	0	0	0	0	111.8	V707 R709 G710 E711 D760 V783	V707-A756 HydrophobicContact CG2-CB 3.73Å; R709-A756 WeakPolarHBondContact CA-O 3.09Å; G710-A756 PolarHBondContact N-O 2.65Å; E711-A756 VanDerWaalsContact O-CB 3.25Å; E711-A756 WeakPolarHBondContact O-CB 3.22Å; E711-A756 PolarHBondContact O-N 3.04Å; A756-D760 WeakPolarHBondContact CA-OD2 3.48Å; A756-V783 HydrophobicContact CB-CG1 4.46Å; A756-V783 HydrophobicContact CB-CG2 4.3Å
757	G	87.4	Confident	90.7	Very high	6 Å²	6	36.9 Å²	36.9	6%	0.062	21%	0.213	C	C	.	.			trans	-94.2	168.9	177.7	0	0	0	0	0	112.8	D755 E759 D760 V783	D755-G757 PolarHBondContact O-N 3.03Å; G757-E759 VanDerWaalsContact C-OE2 3.3Å; G757-E759 VanDerWaalsContact CA-OE2 3.29Å; G757-E759 WeakPolarHBondContact CA-OE2 3.42Å; G757-E759 PolarHBondContact O-N 3.22Å; G757-D760 PolarHBondContact N-OD2 3.12Å; G757-D760 PolarHBondContact O-N 3.31Å; G757-D760 VanDerWaalsContact O-N 3.13Å; G757-V783 WeakPolarHBondContact O-CG2 3.36Å
758	L	85.4	Confident	91	Very high	93 Å²	93	32.8 Å²	32.8	49%	0.487	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.1	177.4	-64.1	177	0	0	0	112.1	A761 V783	L758-A761 WeakPolarHBondContact O-CB 3.47Å; L758-A761 PolarHBondContact O-N 3.09Å; L758-V783 HydrophobicContact CD2-CB 4.31Å; L758-V783 HydrophobicContact CD2-CG1 4.2Å; L758-V783 VanDerWaalsContact CD2-O 3.3Å; L758-V783 WeakPolarHBondContact CD2-O 3.36Å
759	E	86	Confident	91.1	Very high	122 Å²	122	31.6 Å²	31.6	57%	0.57	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-22.7	173.2	73	-76.6	-175.4	0	0	113.9	K731 R741 G757 A761	K731-E759 PolarHBondContact NZ-O 3.08Å; R741-E759 IonicContact CZ-OE1 3.72Å; R741-E759 IonicContact NH2-OE1 3.94Å; R741-E759 PolarHBondContact NH2-OE1 3.06Å; G757-E759 VanDerWaalsContact C-OE2 3.3Å; G757-E759 VanDerWaalsContact CA-OE2 3.29Å; G757-E759 WeakPolarHBondContact CA-OE2 3.42Å; G757-E759 PolarHBondContact O-N 3.22Å; E759-A761 VanDerWaalsContact C-N 3.31Å
760	D	88.4	Confident	91.2	Very high	6 Å²	6	30.9 Å²	30.9	3%	0.032	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-20.3	174.4	-58.4	-40.8	0	0	0	111.4	K731 R741 H742 I753 A756 G757 G762 Y764 L781	K731-D760 WeakPolarHBondContact CE-O 3.18Å; R741-D760 IonicContact CZ-OD1 3.26Å; R741-D760 IonicContact CZ-OD2 3.13Å; R741-D760 VanDerWaalsContact CZ-OD2 3.24Å; R741-D760 IonicContact NH1-OD1 2.83Å; R741-D760 IonicContact NH1-OD2 2.69Å; R741-D760 PolarHBondContact NH1-OD2 3.15Å; R741-D760 IonicContact NH2-OD1 2.74Å; R741-D760 PolarHBondContact NH2-OD1 3.24Å; R741-D760 IonicContact NH2-OD2 2.91Å; R741-D760 PolarHBondContact NH2-OD2 3.47Å; H742-D760 IonicContact CE1-OD1 2.64Å; I753-D760 HydrophobicContact CG2-CB 4.45Å; A756-D760 WeakPolarHBondContact CA-OD2 3.48Å; G757-D760 PolarHBondContact N-OD2 3.12Å; G757-D760 PolarHBondContact O-N 3.31Å; G757-D760 VanDerWaalsContact O-N 3.13Å; D760-G762 PolarHBondContact O-N 2.89Å; D760-Y764 VanDerWaalsContact O-CE2 3.25Å; D760-Y764 WeakPolarHBondContact O-CE2 3.49Å; D760-Y764 PolarHBondContact O-OH 2.83Å; D760-Y764 VanDerWaalsContact O-OH 3.13Å; D760-L781 HydrophobicContact CB-CD2 4.25Å
761	A	89.7	Confident	91	Very high	33 Å²	33	34.4 Å²	34.4	27%	0.273	20%	0.197	S	C	.	.			trans	-59.5	136.6	175.1	0	0	0	0	0	110.7	K731 L758 E759 L781 V783	K731-A761 PolarHBondContact NZ-O 3.49Å; L758-A761 WeakPolarHBondContact O-CB 3.47Å; L758-A761 PolarHBondContact O-N 3.09Å; E759-A761 VanDerWaalsContact C-N 3.31Å; A761-L781 CarbonylContact C-O 3.48Å; A761-L781 WeakPolarHBondContact CA-O 3.47Å; A761-V783 HydrophobicContact CB-CB 4.31Å; A761-V783 HydrophobicContact CB-CG2 4.14Å
762	G	91.8	Very high	90.7	Very high	16 Å²	16	36 Å²	36	17%	0.165	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154	-176.1	-175.7	0	0	0	0	0	114.9	D732 D760 L781	D732-G762 VanDerWaalsContact OD1-CA 3.28Å; D732-G762 WeakPolarHBondContact OD1-CA 3.3Å; D760-G762 PolarHBondContact O-N 2.89Å; G762-L781 PolarHBondContact N-O 3.44Å; G762-L781 PolarHBondContact O-N 3.26Å
763	K	94.6	Very high	90.5	Very high	35 Å²	35	35.3 Å²	35.3	15%	0.152	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	99.1	-178.2	-178.1	-159.3	-178	-156.2	0	110	D732 D733 H778 Y780	D732-K763 PolarHBondContact N-O 3.44Å; D732-K763 PolarHBondContact OD1-N 2.97Å; D733-K763 IonicContact OD1-NZ 2.65Å; D733-K763 PolarHBondContact OD1-NZ 3.46Å; D733-K763 IonicContact OD2-NZ 2.62Å; D733-K763 PolarHBondContact OD2-NZ 2.87Å; K763-H778 VanDerWaalsContact CE-CE1 3.47Å; K763-H778 WeakPolarHBondContact CE-CE1 3.44Å; K763-H778 WeakPolarHBondContact CE-ND1 3.46Å; K763-H778 HydrophobicContact CG-CB 4.36Å; K763-Y780 HydrophobicContact CB-CD1 4.05Å; K763-Y780 HydrophobicContact CB-CE1 3.75Å; K763-Y780 HydrophobicContact CD-CE1 4.47Å; K763-Y780 HydrophobicContact CG-CD1 4.38Å; K763-Y780 HydrophobicContact CG-CE1 3.8Å
764	Y	94.8	Very high	90.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	132.5	171.1	-71.6	-100.6	0	0	0	109.5	L715 T730 K731 L736 L751 I753 D760 H778 I779 L781	L715-Y764 HydrophobicContact CD1-CD1 3.72Å; L715-Y764 HydrophobicContact CD1-CD2 3.64Å; L715-Y764 HydrophobicContact CD1-CE1 4.21Å; L715-Y764 HydrophobicContact CD1-CE2 4.16Å; L715-Y764 HydrophobicContact CD1-CG 3.4Å; L715-Y764 VanDerWaalsContact CD1-CG 3.4Å; T730-Y764 CarbonylContact O-C 3.09Å; T730-Y764 WeakPolarHBondContact O-CA 3.23Å; K731-Y764 HydrophobicContact CB-CD1 4.37Å; K731-Y764 HydrophobicContact CB-CE1 4.25Å; K731-Y764 HydrophobicContact CD-CE1 4.06Å; K731-Y764 HydrophobicContact CD-CE2 4.08Å; K731-Y764 WeakPolarHBondContact CD-OH 3.35Å; K731-Y764 WeakPolarHBondContact CE-OH 3.2Å; K731-Y764 HydrophobicContact CG-CD1 4.46Å; K731-Y764 HydrophobicContact CG-CD2 4.5Å; K731-Y764 HydrophobicContact CG-CE1 4.15Å; K731-Y764 HydrophobicContact CG-CE2 4.15Å; L736-Y764 HydrophobicContact CD1-CD1 4.44Å; L736-Y764 HydrophobicContact CD1-CE1 3.78Å; L751-Y764 HydrophobicContact CD2-CD1 3.67Å; L751-Y764 HydrophobicContact CD2-CE1 3.9Å; I753-Y764 HydrophobicContact CD1-CE1 3.77Å; I753-Y764 HydrophobicContact CD1-CE2 4.32Å; I753-Y764 WeakPolarHBondContact CD1-OH 3.45Å; D760-Y764 VanDerWaalsContact O-CE2 3.25Å; D760-Y764 WeakPolarHBondContact O-CE2 3.49Å; D760-Y764 PolarHBondContact O-OH 2.83Å; D760-Y764 VanDerWaalsContact O-OH 3.13Å; Y764-H778 CarbonylContact O-C 3.57Å; Y764-H778 VanDerWaalsContact O-CA 3.29Å; Y764-H778 WeakPolarHBondContact O-CA 3.2Å; Y764-I779 PolarHBondContact N-O 2.59Å; Y764-I779 PolarHBondContact O-N 2.03Å; Y764-L781 HydrophobicContact CD2-CB 3.98Å; Y764-L781 HydrophobicContact CE2-CB 3.84Å; Y764-L781 HydrophobicContact CE2-CD2 3.85Å; Y764-L781 HydrophobicContact CE2-CG 4.47Å
765	T	93.6	Very high	90.3	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.018	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	122.6	175.5	-54.7	0	0	0	0	109.4	W729 T730 I767 R776 G777 H778	W729-T765 WeakPolarHBondContact CA-O 3.43Å; T730-T765 PolarHBondContact N-O 3.21Å; T730-T765 PolarHBondContact O-N 3.33Å; T730-T765 WeakPolarHBondContact OG1-CB 3.29Å; T765-I767 HydrophobicContact CG2-CG1 4.1Å; T765-R776 HydrophobicContact CG2-CB 4.46Å; T765-G777 CarbonylContact C-O 3.51Å; T765-G777 WeakPolarHBondContact CA-O 3Å; T765-H778 WeakPolarHBondContact CG2-ND1 3.43Å; T765-H778 PolarHBondContact OG1-CE1 2.83Å; T765-H778 VanDerWaalsContact OG1-CE1 3.32Å; T765-H778 PolarHBondContact OG1-ND1 3.14Å
766	C	93	Very high	90.6	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.007	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	132.8	166.5	-172.8	0	0	0	0	109.2	F698 C717 W729 R776 G777	F698-C766 HydrophobicContact CE1-CB 4.49Å; C717-C766 HydrophobicContact CB-CB 3.61Å; C717-C766 WeakPolarHBondContact CB-SG 3.36Å; C717-C766 WeakPolarHBondContact SG-CB 3.45Å; C717-C766 CovalentContact SG-SG 2.03Å; C717-C766 PolarHBondContact SG-SG 3.2Å; W729-C766 HydrophobicContact CD2-CB 4.26Å; W729-C766 HydrophobicContact CE3-CB 4.14Å; W729-C766 HydrophobicContact CH2-CB 4.18Å; W729-C766 HydrophobicContact CZ2-CB 4.28Å; W729-C766 HydrophobicContact CZ3-CB 4.1Å; C766-R776 WeakPolarHBondContact O-CA 3.43Å; C766-G777 PolarHBondContact N-O 3.19Å; C766-G777 PolarHBondContact O-N 3.22Å; C766-G777 VanDerWaalsContact O-N 3.1Å
767	I	92.3	Very high	90.6	Very high	27 Å²	27	43 Å²	43	14%	0.138	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.3	178.3	-52.4	176.7	0	0	0	107	L727 N728 T730 T765 T774 R776	L727-I767 WeakPolarHBondContact CA-O 3.2Å; N728-I767 PolarHBondContact N-O 3.48Å; N728-I767 PolarHBondContact O-N 3.32Å; T730-I767 HydrophobicContact CG2-CD1 4.1Å; T765-I767 HydrophobicContact CG2-CG1 4.1Å; I767-T774 HydrophobicContact CG2-CG2 3.73Å; I767-R776 HydrophobicContact CB-CG 4.3Å; I767-R776 HydrophobicContact CG1-CG 4.03Å; I767-R776 HydrophobicContact CG2-CG 4.03Å
768	M	93.3	Very high	90.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	136.1	178.9	63.6	166.9	83.5	0	0	111	P696 S697 F698 A719 P725 R726 L727 T774 E775	P696-M768 HydrophobicContact CB-CB 4.28Å; P696-M768 HydrophobicContact CB-CG 3.57Å; P696-M768 HydrophobicContact CB-SD 3.54Å; P696-M768 VanDerWaalsContact CB-SD 3.54Å; S697-M768 PolarHBondContact N-SD 3.45Å; S697-M768 VanDerWaalsContact N-SD 3.35Å; F698-M768 HydrophobicContact CD1-CE 3.35Å; F698-M768 HydrophobicContact CD2-CE 4.18Å; F698-M768 HydrophobicContact CE1-CE 3.35Å; F698-M768 HydrophobicContact CE2-CE 4.18Å; F698-M768 HydrophobicContact CG-CE 3.77Å; F698-M768 HydrophobicContact CZ-CE 3.76Å; A719-M768 HydrophobicContact CB-CB 4.49Å; A719-M768 HydrophobicContact CB-CE 3.51Å; A719-M768 HydrophobicContact CB-SD 3.73Å; P725-M768 HydrophobicContact CB-CB 4.21Å; R726-M768 CarbonylContact O-C 3.53Å; R726-M768 WeakPolarHBondContact O-CA 3.34Å; L727-M768 HydrophobicContact CD1-CB 4.37Å; L727-M768 HydrophobicContact CG-CB 4.14Å; M768-T774 CarbonylContact O-C 3.57Å; M768-T774 VanDerWaalsContact O-CA 3.26Å; M768-T774 WeakPolarHBondContact O-CA 3.24Å; M768-E775 HydrophobicContact CG-CB 3.86Å; M768-E775 PolarHBondContact N-O 3.09Å; M768-E775 PolarHBondContact O-N 3.18Å; M768-E775 HydrophobicContact SD-CB 4.36Å
769	S	91.7	Very high	91.4	Very high	43 Å²	43	42.2 Å²	42.2	30%	0.301	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	141	-176	61.3	0	0	0	0	114.1	P725 R726 G773 T774	P725-S769 CarbonylContact C-O 3.37Å; P725-S769 VanDerWaalsContact CA-O 3.25Å; P725-S769 WeakPolarHBondContact CA-O 3.46Å; R726-S769 PolarHBondContact N-O 2.89Å; R726-S769 PolarHBondContact O-N 3.38Å; S769-G773 WeakPolarHBondContact CA-O 3.32Å; S769-T774 WeakPolarHBondContact CB-OG1 3.3Å
770	N	92.1	Very high	91.8	Very high	29 Å²	29	41.6 Å²	41.6	16%	0.155	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	-170	168.7	78.1	4.6	0	0	0	110.3	E694 P696 P723 P725 L772 G773	E694-N770 PolarHBondContact O-ND2 2.84Å; P696-N770 WeakPolarHBondContact CD-OD1 3.25Å; P696-N770 HydrophobicContact CG-CB 4.14Å; P723-N770 WeakPolarHBondContact O-CB 3.46Å; P723-N770 PolarHBondContact O-ND2 2.99Å; P725-N770 HydrophobicContact CB-CB 4.35Å; N770-L772 PolarHBondContact O-N 3.37Å; N770-L772 WeakPolarHBondContact OD1-CB 3.49Å; N770-L772 PolarHBondContact OD1-N 2.91Å; N770-G773 PolarHBondContact N-O 3.11Å; N770-G773 PolarHBondContact O-N 3.1Å; N770-G773 VanDerWaalsContact O-O 3.13Å; N770-G773 PolarHBondContact OD1-N 3.39Å
771	T	88.4	Confident	92	Very high	115 Å²	115	41.3 Å²	41.3	71%	0.706	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-13.2	-178.6	48.5	0	0	0	0	114.7	P723	P723-T771 WeakPolarHBondContact CD-OG1 3.25Å
772	L	87	Confident	92	Very high	32 Å²	32	43.8 Å²	43.8	17%	0.168	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-19.3	179.8	-59.1	-168	0	0	0	114.5	R614 L693 T695 N770	R614-L772 HydrophobicContact CG-CD1 4.17Å; L693-L772 HydrophobicContact CB-CD1 3.72Å; L693-L772 HydrophobicContact CB-CD2 4.42Å; L693-L772 HydrophobicContact CB-CG 4.38Å; L693-L772 HydrophobicContact CD1-CD2 4.14Å; T695-L772 HydrophobicContact CG2-CB 3.76Å; T695-L772 HydrophobicContact CG2-CD1 4.25Å; N770-L772 PolarHBondContact O-N 3.37Å; N770-L772 WeakPolarHBondContact OD1-CB 3.49Å; N770-L772 PolarHBondContact OD1-N 2.91Å
773	G	87.9	Confident	91.9	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	173.9	-172.5	-174.3	0	0	0	0	0	115.2	S769 N770	S769-G773 WeakPolarHBondContact CA-O 3.32Å; N770-G773 PolarHBondContact N-O 3.11Å; N770-G773 PolarHBondContact O-N 3.1Å; N770-G773 VanDerWaalsContact O-O 3.13Å; N770-G773 PolarHBondContact OD1-N 3.39Å
774	T	90.4	Very high	91.5	Very high	73 Å²	73	46.3 Å²	46.3	45%	0.448	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	124.4	175.4	-64.5	0	0	0	0	109.2	I767 M768 S769	I767-T774 HydrophobicContact CG2-CG2 3.73Å; M768-T774 CarbonylContact O-C 3.57Å; M768-T774 VanDerWaalsContact O-CA 3.26Å; M768-T774 WeakPolarHBondContact O-CA 3.24Å; S769-T774 WeakPolarHBondContact CB-OG1 3.3Å
775	E	91.9	Very high	90.5	Very high	90 Å²	90	49.7 Å²	49.7	42%	0.421	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	150.7	-177	-169.5	48	-99	0	0	110.2	P696 F698 M768	P696-E775 HydrophobicContact CB-CB 4.2Å; P696-E775 WeakPolarHBondContact O-CB 3.46Å; F698-E775 HydrophobicContact CD2-CG 4.27Å; F698-E775 HydrophobicContact CE2-CG 3.85Å; M768-E775 HydrophobicContact CG-CB 3.86Å; M768-E775 PolarHBondContact N-O 3.09Å; M768-E775 PolarHBondContact O-N 3.18Å; M768-E775 HydrophobicContact SD-CB 4.36Å
776	R	92.8	Very high	89.3	Confident	140 Å²	140	54.5 Å²	54.5	53%	0.528	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	143.8	-174	-67.5	-167.7	174.3	85.3	-2.5	112.4	T765 C766 I767	T765-R776 HydrophobicContact CG2-CB 4.46Å; C766-R776 WeakPolarHBondContact O-CA 3.43Å; I767-R776 HydrophobicContact CB-CG 4.3Å; I767-R776 HydrophobicContact CG1-CG 4.03Å; I767-R776 HydrophobicContact CG2-CG 4.03Å
777	G	90.7	Very high	87.2	Confident	11 Å²	11	60.1 Å²	60.1	11%	0.113	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	157.5	178.2	0	0	0	0	0	111.6	L702 T765 C766	L702-G777 VanDerWaalsContact CD1-CA 3.47Å; T765-G777 CarbonylContact C-O 3.51Å; T765-G777 WeakPolarHBondContact CA-O 3Å; C766-G777 PolarHBondContact N-O 3.19Å; C766-G777 PolarHBondContact O-N 3.22Å; C766-G777 VanDerWaalsContact O-N 3.1Å
778	H	94.1	Very high	84.8	Confident	80 Å²	80	66.1 Å²	66.1	37%	0.37	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	148.5	-170.3	-52	-53.7	0	0	0	111.7	L702 K763 Y764 T765	L702-H778 WeakPolarHBondContact CB-O 3.43Å; K763-H778 VanDerWaalsContact CE-CE1 3.47Å; K763-H778 WeakPolarHBondContact CE-CE1 3.44Å; K763-H778 WeakPolarHBondContact CE-ND1 3.46Å; K763-H778 HydrophobicContact CG-CB 4.36Å; Y764-H778 CarbonylContact O-C 3.57Å; Y764-H778 VanDerWaalsContact O-CA 3.29Å; Y764-H778 WeakPolarHBondContact O-CA 3.2Å; T765-H778 WeakPolarHBondContact CG2-ND1 3.43Å; T765-H778 PolarHBondContact OG1-CE1 2.83Å; T765-H778 VanDerWaalsContact OG1-CE1 3.32Å; T765-H778 PolarHBondContact OG1-ND1 3.14Å
779	I	94.4	Very high	82	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.01	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	124.4	167.9	-64.2	168.8	0	0	0	106.8	L702 E703 L715 W729 Y764	L702-I779 HydrophobicContact CB-CD1 4.44Å; L702-I779 HydrophobicContact CB-CG1 3.81Å; L702-I779 HydrophobicContact CD1-CG1 4.32Å; L702-I779 HydrophobicContact CD2-CD1 4.23Å; L702-I779 HydrophobicContact CD2-CG1 4.43Å; L702-I779 HydrophobicContact CG-CG1 4.42Å; E703-I779 WeakPolarHBondContact O-CG2 3.3Å; L715-I779 HydrophobicContact CB-CD1 3.86Å; L715-I779 HydrophobicContact CD2-CG2 3.97Å; W729-I779 HydrophobicContact CH2-CD1 3.97Å; W729-I779 HydrophobicContact CZ3-CD1 4.16Å; Y764-I779 PolarHBondContact N-O 2.59Å; Y764-I779 PolarHBondContact O-N 2.03Å
780	Y	94.3	Very high	79.2	Confident	109 Å²	109	74.9 Å²	74.9	43%	0.427	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	121.1	168.8	-65.1	-84.7	0	0	0	109.7	D704 K705 K763	D704-Y780 WeakPolarHBondContact OD1-CD2 3.49Å; D704-Y780 PolarHBondContact OD1-N 2.96Å; K705-Y780 PolarHBondContact N-O 3.49Å; K763-Y780 HydrophobicContact CB-CD1 4.05Å; K763-Y780 HydrophobicContact CB-CE1 3.75Å; K763-Y780 HydrophobicContact CD-CE1 4.47Å; K763-Y780 HydrophobicContact CG-CD1 4.38Å; K763-Y780 HydrophobicContact CG-CE1 3.8Å
781	L	93.6	Very high	76.4	Confident	0 Å²	0	78.4 Å²	78.4	0%	0	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	116.5	169.9	179.4	55.3	0	0	0	108.8	K705 V707 A713 L715 I753 D760 A761 G762 Y764 V783	K705-L781 HydrophobicContact CB-CD1 4.32Å; K705-L781 CarbonylContact O-C 3.54Å; K705-L781 WeakPolarHBondContact O-CA 3.34Å; K705-L781 WeakPolarHBondContact O-CD1 3.31Å; V707-L781 HydrophobicContact CG1-CD1 4.49Å; V707-L781 HydrophobicContact CG2-CD1 4.03Å; A713-L781 HydrophobicContact CB-CD1 3.82Å; A713-L781 HydrophobicContact CB-CD2 3.94Å; L715-L781 HydrophobicContact CD2-CD1 4.35Å; I753-L781 HydrophobicContact CD1-CD2 3.91Å; D760-L781 HydrophobicContact CB-CD2 4.25Å; A761-L781 CarbonylContact C-O 3.48Å; A761-L781 WeakPolarHBondContact CA-O 3.47Å; G762-L781 PolarHBondContact N-O 3.44Å; G762-L781 PolarHBondContact O-N 3.26Å; Y764-L781 HydrophobicContact CD2-CB 3.98Å; Y764-L781 HydrophobicContact CE2-CB 3.84Å; Y764-L781 HydrophobicContact CE2-CD2 3.85Å; Y764-L781 HydrophobicContact CE2-CG 4.47Å; L781-V783 HydrophobicContact CG-CG2 4.19Å
782	N	90.4	Very high	73.9	Confident	85 Å²	85	78.4 Å²	78.4	46%	0.455	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129.1	171.7	-71.8	-40.1	0	0	0	109.5	K705 T706 V707	K705-N782 PolarHBondContact O-N 2.83Å; T706-N782 VanDerWaalsContact CA-O 3.31Å; T706-N782 WeakPolarHBondContact CA-O 3.22Å; T706-N782 HydrophobicContact CG2-CB 4.13Å; V707-N782 PolarHBondContact N-O 3.05Å
783	V	88.9	Confident	71.4	Confident	14 Å²	14	85.6 Å²	85.6	9%	0.085	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	114.7	176.2	-174.5	0	0	0	0	109.1	V707 R709 A756 G757 L758 A761 L781	V707-V783 HydrophobicContact CG2-CB 4.48Å; V707-V783 HydrophobicContact CG2-CG1 4.4Å; V707-V783 HydrophobicContact CG2-CG2 3.89Å; V707-V783 WeakPolarHBondContact O-CA 3.47Å; R709-V783 HydrophobicContact CB-CG1 4.11Å; A756-V783 HydrophobicContact CB-CG1 4.46Å; A756-V783 HydrophobicContact CB-CG2 4.3Å; G757-V783 WeakPolarHBondContact O-CG2 3.36Å; L758-V783 HydrophobicContact CD2-CB 4.31Å; L758-V783 HydrophobicContact CD2-CG1 4.2Å; L758-V783 VanDerWaalsContact CD2-O 3.3Å; L758-V783 WeakPolarHBondContact CD2-O 3.36Å; A761-V783 HydrophobicContact CB-CB 4.31Å; A761-V783 HydrophobicContact CB-CG2 4.14Å; L781-V783 HydrophobicContact CG-CG2 4.19Å
784	I	85.8	Confident	68.8	Low	90 Å²	90	89.8 Å²	89.8	46%	0.462	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	143.7	-176.4	59.9	171.9	0	0	0	112	T706 V707 T708 R709	T706-I784 HydrophobicContact CG2-CD1 4.08Å; T706-I784 HydrophobicContact CG2-CG1 4.15Å; T706-I784 HydrophobicContact CG2-CG2 4.11Å; V707-I784 PolarHBondContact O-N 3.21Å; T708-I784 CarbonylContact C-O 3.48Å; T708-I784 WeakPolarHBondContact CA-O 3.36Å; T708-I784 HydrophobicContact CG2-CD1 4.23Å; T708-I784 HydrophobicContact CG2-CG1 4.03Å; R709-I784 PolarHBondContact N-O 2.85Å
785	S	73.8	Confident	66.1	Low	71 Å²	71	91.1 Å²	91.1	50%	0.497	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-93.2	134.7	172	-64	0	0	0	0	110.2
786	S	68.8	Low	63.4	Low	105 Å²	105	95.2 Å²	95.2	73%	0.734	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-71.2	128.7	-175.5	-168.4	0	0	0	0	112.5
787	P	49.5	Very low	60.5	Low	118 Å²	118	92.2 Å²	92.2	77%	0.766	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-81.7	150.7	172.4	34.1	-34	0	0	0	111.7
788	N	41.5	Very low	57.7	Low	153 Å²	153	100.3 Å²	100.3	82%	0.818	59%	0.59	S	S	*	*			trans	-146.7	161.3	-175.5	-160.7	13.2	0	0	0	113.5
789	C	33.8	Very low	54.8	Low	89 Å²	89	105.1 Å²	105.1	60%	0.601	61%	0.613	S	S	*	*			trans	78.8	107.4	165.5	-72.1	0	0	0	0	121.7
790	D	32.2	Very low	52.1	Low	138 Å²	138	112 Å²	112	74%	0.738	65%	0.65	S	S	*	*				93.3	113.7	115.7	-78.4	-57	0	0	0	125.6
791	S	33.7	Very low	49.4	Very low	104 Å²	104	114.8 Å²	114.8	73%	0.727	67%	0.672	S	S	*	*			trans	72.8	118.5	132.5	75.5	0	0	0	0	122.1
792	S	37.4	Very low	46.7	Very low	114 Å²	114	118.4 Å²	118.4	80%	0.797	71%	0.709	S	S	*	*				170.4	122.9	100.1	63.5	0	0	0	0	116.1
793	Q	34.4	Very low	44.2	Very low	183 Å²	183	125.5 Å²	125.5	86%	0.855	73%	0.73	S	S	*	*			trans	48	129.6	147.6	-63.1	-168.8	-9.9	0	0	125.5
794	S	32.5	Very low	42.4	Very low	117 Å²	117	130.7 Å²	130.7	82%	0.818	76%	0.762	S	S	*	*			trans	77.1	143.2	147.6	78.1	0	0	0	0	118.8
795	S	33.8	Very low	41	Very low	100 Å²	100	132 Å²	132	70%	0.699	78%	0.775	S	S	*	*			cis	-148.7	143.4	17	53.8	0	0	0	0	116
796	I	34.7	Very low	40	Very low	177 Å²	177	134 Å²	134	91%	0.908	78%	0.784	S	S	*	*			trans	61.9	122.5	149.3	-59.1	163.8	0	0	0	119.7
797	G	31.6	Very low	39.4	Very low	77 Å²	77	131.6 Å²	131.6	79%	0.794	78%	0.775	S	S	*	*			trans	158.4	92.3	165.6	0	0	0	0	0	111.5
798	H	32.9	Very low	39.8	Very low	181 Å²	181	131.9 Å²	131.9	84%	0.838	77%	0.769	S	S	*	*			trans	-131.4	122.6	-170.2	-147.6	-56.8	0	0	0	109.6
799	E	34	Very low	40.5	Very low	180 Å²	180	129.2 Å²	129.2	84%	0.841	76%	0.758	S	S	*	*			trans	-168.2	117.9	152.1	-115.1	166.3	-165.1	0	0	111.8
800	D	37.2	Very low	41.7	Very low	147 Å²	147	130.2 Å²	130.2	79%	0.786	76%	0.756	S	S	*	*			trans	55.3	151.7	142.5	-63.5	15.3	0	0	0	125
801	D	37	Very low	43	Very low	167 Å²	167	129.2 Å²	129.2	89%	0.893	75%	0.749	S	S	*	*			trans	-73.1	143.9	-171.7	-66.4	-67.6	0	0	0	115
802	G	37.3	Very low	44.4	Very low	76 Å²	76	128.6 Å²	128.6	78%	0.784	74%	0.741	S	S	*	*			trans	-155.5	105.9	172.4	0	0	0	0	0	113.9
803	W	37.3	Very low	45.8	Very low	234 Å²	234	127.2 Å²	127.2	89%	0.886	73%	0.728	S	S	*	*			trans	-85	160.8	179.3	-89.1	46.8	0	0	0	113.6
804	T	51.2	Low	47.3	Very low	123 Å²	123	122.5 Å²	122.5	76%	0.755	71%	0.711	S	S	*	*			trans	63.8	113.5	166.7	62.3	0	0	0	0	119.4
805	T	56.9	Low	49	Very low	119 Å²	119	121.1 Å²	121.1	73%	0.73	70%	0.7	S	S	*	*	S	Bend	trans	-156.8	-27.6	148.4	-8.4	0	0	0	0	113.8	G807	T805-G807 PolarHBondContact O-N 3.37Å
806	V	53.3	Low	50.8	Low	113 Å²	113	120.2 Å²	120.2	69%	0.685	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-69.8	-30.1	-177.1	-175.8	0	0	0	0	113.4	I808 V809	V806-I808 PolarHBondContact O-N 3.22Å; V806-V809 PolarHBondContact O-N 3.48Å
807	G	56.3	Low	52.7	Low	54 Å²	54	115.8 Å²	115.8	56%	0.557	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-66.3	-8.4	-176	0	0	0	0	0	116.2	T805	T805-G807 PolarHBondContact O-N 3.37Å
808	I	56.9	Low	54.8	Low	123 Å²	123	116 Å²	116	63%	0.631	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-93.2	-30.7	-177.7	-65.3	175.9	0	0	0	112	V806	V806-I808 PolarHBondContact O-N 3.22Å
809	V	56.9	Low	56.8	Low	98 Å²	98	109 Å²	109	59%	0.594	64%	0.637	S	S	*	*	H	α-helix	trans	-71.2	-39.3	-175.7	-178	0	0	0	0	112	V806 I811 V812 V813	V806-V809 PolarHBondContact O-N 3.48Å; V809-I811 VanDerWaalsContact C-N 3.33Å; V809-I811 PolarHBondContact O-N 2.9Å; V809-V812 PolarHBondContact O-N 3.24Å; V809-V813 PolarHBondContact O-N 3.42Å
810	I	58.3	Low	59	Low	110 Å²	110	104.5 Å²	104.5	56%	0.564	62%	0.622	S	S	*	*	H	α-helix	trans	-65.8	-36.1	-176.8	-62.2	176.5	0	0	0	111.6	V812 V813 V814	I810-V812 PolarHBondContact O-N 2.98Å; I810-V813 PolarHBondContact O-N 3.44Å; I810-V814 HydrophobicContact CG2-CG2 4.48Å; I810-V814 WeakPolarHBondContact O-CG2 3.31Å; I810-V814 PolarHBondContact O-N 3.01Å
811	I	59.7	Low	60.8	Low	116 Å²	116	100.7 Å²	100.7	60%	0.595	61%	0.606	S	S	*	*	H	α-helix	trans	-67.3	-38.4	-178.5	-63.7	176.9	0	0	0	111.2	V809 C815	V809-I811 VanDerWaalsContact C-N 3.33Å; V809-I811 PolarHBondContact O-N 2.9Å; I811-C815 PolarHBondContact O-N 3.48Å; I811-C815 PolarHBondContact O-SG 3.46Å; I811-C815 VanDerWaalsContact O-SG 3.41Å
812	V	62.3	Low	62.8	Low	91 Å²	91	97.7 Å²	97.7	55%	0.552	59%	0.59	S	S	*	*	H	α-helix	trans	-64.9	-45.3	178.2	178.6	0	0	0	0	111.4	V809 I810 V814 C815 C816	V809-V812 PolarHBondContact O-N 3.24Å; I810-V812 PolarHBondContact O-N 2.98Å; V812-V814 PolarHBondContact O-N 3.5Å; V812-C815 PolarHBondContact O-N 2.95Å; V812-C816 PolarHBondContact O-N 3.45Å; V812-C816 PolarHBondContact O-SG 3.49Å
813	V	66.6	Low	64.8	Low	86 Å²	86	99.2 Å²	99.2	52%	0.521	58%	0.579	S	S	.	*	H	α-helix	trans	-64.8	-42.4	-177.9	177.9	0	0	0	0	111.7	V809 I810 C815 C816 V817	V809-V813 PolarHBondContact O-N 3.42Å; I810-V813 PolarHBondContact O-N 3.44Å; V813-C815 PolarHBondContact O-N 3.35Å; V813-C816 PolarHBondContact O-N 3.41Å; V813-V817 PolarHBondContact O-N 3.45Å
814	V	65.9	Low	66.4	Low	84 Å²	84	96.3 Å²	96.3	51%	0.509	57%	0.568	S	S	.	*	H	α-helix	trans	-63.5	-40.5	179.2	172.9	0	0	0	0	111.6	I810 V812 C816 V817 V818	I810-V814 HydrophobicContact CG2-CG2 4.48Å; I810-V814 WeakPolarHBondContact O-CG2 3.31Å; I810-V814 PolarHBondContact O-N 3.01Å; V812-V814 PolarHBondContact O-N 3.5Å; V814-C816 PolarHBondContact O-N 3.34Å; V814-V817 PolarHBondContact O-N 3.38Å; V814-V818 HydrophobicContact CG1-CG2 4.48Å; V814-V818 WeakPolarHBondContact O-CG2 3.38Å; V814-V818 PolarHBondContact O-N 3.48Å
815	C	68.8	Low	67.8	Low	87 Å²	87	95 Å²	95	59%	0.588	56%	0.56	S	S	*	*	H	α-helix	trans	-62.1	-39.3	176.2	-72.1	0	0	0	0	113	I811 V812 V813 G819	I811-C815 PolarHBondContact O-N 3.48Å; I811-C815 PolarHBondContact O-SG 3.46Å; I811-C815 VanDerWaalsContact O-SG 3.41Å; V812-C815 PolarHBondContact O-N 2.95Å; V813-C815 PolarHBondContact O-N 3.35Å; C815-G819 PolarHBondContact O-N 3.22Å; C815-G819 VanDerWaalsContact O-N 3.11Å
816	C	70.8	Confident	68.8	Low	81 Å²	81	94.1 Å²	94.1	55%	0.547	55%	0.549	S	S	.	.	H	α-helix	trans	-66	-42.3	178	-68.2	0	0	0	0	112.9	V812 V813 V814 T820	V812-C816 PolarHBondContact O-N 3.45Å; V812-C816 PolarHBondContact O-SG 3.49Å; V813-C816 PolarHBondContact O-N 3.41Å; V814-C816 PolarHBondContact O-N 3.34Å; C816-T820 WeakPolarHBondContact O-CG2 3.43Å; C816-T820 PolarHBondContact O-N 3.18Å; C816-T820 PolarHBondContact O-OG1 3.23Å
817	V	75	Confident	69.8	Low	84 Å²	84	91.9 Å²	91.9	51%	0.509	54%	0.536	S	S	.	.	H	α-helix	trans	-66.6	-46.5	-179.8	177.5	0	0	0	0	111	V813 V814 G819 T820 S821	V813-V817 PolarHBondContact O-N 3.45Å; V814-V817 PolarHBondContact O-N 3.38Å; V817-G819 PolarHBondContact O-N 3.16Å; V817-T820 PolarHBondContact O-N 3.45Å; V817-T820 PolarHBondContact O-OG1 3.42Å; V817-S821 PolarHBondContact O-N 3.48Å; V817-S821 VanDerWaalsContact O-N 3.16Å; V817-S821 PolarHBondContact O-OG 3.44Å; V817-S821 VanDerWaalsContact O-OG 3.08Å
818	V	76.2	Confident	70.8	Confident	82 Å²	82	93.8 Å²	93.8	50%	0.497	53%	0.532	S	S	.	.	H	α-helix	trans	-63.6	-40	179.2	175.6	0	0	0	0	111.9	V814 S821 L822	V814-V818 HydrophobicContact CG1-CG2 4.48Å; V814-V818 WeakPolarHBondContact O-CG2 3.38Å; V814-V818 PolarHBondContact O-N 3.48Å; V818-S821 PolarHBondContact O-N 3.28Å; V818-L822 HydrophobicContact CG1-CD1 4.12Å; V818-L822 PolarHBondContact O-N 3.28Å
819	G	75.5	Confident	71.7	Confident	34 Å²	34	94.5 Å²	94.5	35%	0.351	53%	0.528	S	S	.	.	H	α-helix	trans	-62.9	-45.6	178.3	0	0	0	0	0	113.4	C815 V817 L822 I823	C815-G819 PolarHBondContact O-N 3.22Å; C815-G819 VanDerWaalsContact O-N 3.11Å; V817-G819 PolarHBondContact O-N 3.16Å; G819-L822 PolarHBondContact O-N 3.43Å; G819-I823 WeakPolarHBondContact O-CG1 3.43Å; G819-I823 PolarHBondContact O-N 3.11Å
820	T	80	Confident	72.3	Confident	85 Å²	85	95.2 Å²	95.2	52%	0.521	53%	0.525	S	S	.	.	H	α-helix	trans	-68	-35.4	179.1	56.2	0	0	0	0	113	C816 V817 I823 W824	C816-T820 WeakPolarHBondContact O-CG2 3.43Å; C816-T820 PolarHBondContact O-N 3.18Å; C816-T820 PolarHBondContact O-OG1 3.23Å; V817-T820 PolarHBondContact O-N 3.45Å; V817-T820 PolarHBondContact O-OG1 3.42Å; T820-I823 PolarHBondContact O-N 3.46Å; T820-W824 PolarHBondContact O-N 3.39Å
821	S	74.9	Confident	72.6	Confident	67 Å²	67	96.2 Å²	96.2	47%	0.469	53%	0.529	S	S	.	.	H	α-helix	trans	-64.5	-41.9	175.5	-58.3	0	0	0	0	112.7	V817 V818 I823 W824 V825	V817-S821 PolarHBondContact O-N 3.48Å; V817-S821 VanDerWaalsContact O-N 3.16Å; V817-S821 PolarHBondContact O-OG 3.44Å; V817-S821 VanDerWaalsContact O-OG 3.08Å; V818-S821 PolarHBondContact O-N 3.28Å; S821-I823 VanDerWaalsContact C-N 3.34Å; S821-I823 PolarHBondContact O-N 3.47Å; S821-W824 PolarHBondContact O-N 3.5Å; S821-V825 PolarHBondContact O-N 3.41Å
822	L	79.5	Confident	72.7	Confident	105 Å²	105	99.2 Å²	99.2	55%	0.55	53%	0.532	S	S	.	.	H	α-helix	trans	-64.3	-36.7	179.1	-79.1	165.1	0	0	0	112.8	V818 G819 V825 I826	V818-L822 HydrophobicContact CG1-CD1 4.12Å; V818-L822 PolarHBondContact O-N 3.28Å; G819-L822 PolarHBondContact O-N 3.43Å; L822-V825 PolarHBondContact O-N 3.41Å; L822-I826 WeakPolarHBondContact O-CG1 3.4Å; L822-I826 PolarHBondContact O-N 3.43Å; L822-I826 VanDerWaalsContact O-N 3.12Å
823	I	78.3	Confident	72.6	Confident	107 Å²	107	101.9 Å²	101.9	55%	0.549	53%	0.533	S	S	.	.	H	α-helix	trans	-62.6	-44.6	176.8	-67	167.6	0	0	0	110.8	G819 T820 S821 V825 I826 V827	G819-I823 WeakPolarHBondContact O-CG1 3.43Å; G819-I823 PolarHBondContact O-N 3.11Å; T820-I823 PolarHBondContact O-N 3.46Å; S821-I823 VanDerWaalsContact C-N 3.34Å; S821-I823 PolarHBondContact O-N 3.47Å; I823-V825 PolarHBondContact O-N 3.43Å; I823-I826 PolarHBondContact O-N 3.49Å; I823-V827 WeakPolarHBondContact O-CG2 3.41Å; I823-V827 PolarHBondContact O-N 2.97Å
824	W	71.9	Confident	71.9	Confident	174 Å²	174	105.8 Å²	105.8	66%	0.659	54%	0.543	S	S	*	.	H	α-helix	trans	-63.5	-37.8	177.1	-92.7	96.4	0	0	0	113.2	T820 S821 I826 V827 I828	T820-W824 PolarHBondContact O-N 3.39Å; S821-W824 PolarHBondContact O-N 3.5Å; W824-I826 VanDerWaalsContact C-N 3.34Å; W824-I826 PolarHBondContact O-N 3.4Å; W824-V827 PolarHBondContact O-N 2.95Å; W824-I828 HydrophobicContact CE3-CD1 4.29Å; W824-I828 HydrophobicContact CE3-CG1 4.41Å; W824-I828 WeakPolarHBondContact O-CB 3.07Å; W824-I828 VanDerWaalsContact O-CG1 3.3Å; W824-I828 WeakPolarHBondContact O-CG1 3.48Å; W824-I828 PolarHBondContact O-N 3.34Å
825	V	80.2	Confident	71.2	Confident	95 Å²	95	108.1 Å²	108.1	58%	0.576	55%	0.552	S	S	*	*	H	α-helix	trans	-62.1	-41.3	174.2	173	0	0	0	0	111.4	S821 L822 I823 I828 Y829	S821-V825 PolarHBondContact O-N 3.41Å; L822-V825 PolarHBondContact O-N 3.41Å; I823-V825 PolarHBondContact O-N 3.43Å; V825-I828 PolarHBondContact O-N 3.2Å; V825-Y829 VanDerWaalsContact O-CB 3.31Å; V825-Y829 WeakPolarHBondContact O-CB 3.03Å; V825-Y829 PolarHBondContact O-N 3.2Å
826	I	77.2	Confident	70.2	Confident	100 Å²	100	110.4 Å²	110.4	51%	0.513	55%	0.554	S	S	.	*	H	α-helix	trans	-66.1	-41.2	177.3	-67.3	166.2	0	0	0	111.4	L822 I823 W824 Y829 H830	L822-I826 WeakPolarHBondContact O-CG1 3.4Å; L822-I826 PolarHBondContact O-N 3.43Å; L822-I826 VanDerWaalsContact O-N 3.12Å; I823-I826 PolarHBondContact O-N 3.49Å; W824-I826 VanDerWaalsContact C-N 3.34Å; W824-I826 PolarHBondContact O-N 3.4Å; I826-Y829 PolarHBondContact O-N 3.04Å; I826-H830 PolarHBondContact O-N 3.42Å
827	V	75.3	Confident	68.9	Low	66 Å²	66	113.1 Å²	113.1	40%	0.4	56%	0.563	S	S	.	*	H	α-helix	trans	-63.1	-48.2	176	171.5	0	0	0	0	111.1	I823 W824 Y829 H830 M831	I823-V827 WeakPolarHBondContact O-CG2 3.41Å; I823-V827 PolarHBondContact O-N 2.97Å; W824-V827 PolarHBondContact O-N 2.95Å; V827-Y829 VanDerWaalsContact C-N 3.32Å; V827-Y829 PolarHBondContact O-N 3.12Å; V827-H830 PolarHBondContact O-N 3.17Å; V827-M831 HydrophobicContact CG1-CG 4.44Å; V827-M831 HydrophobicContact CG1-SD 4.19Å; V827-M831 WeakPolarHBondContact O-CG 3.45Å; V827-M831 PolarHBondContact O-N 3.29Å
828	I	76.4	Confident	67.3	Low	95 Å²	95	119.8 Å²	119.8	49%	0.487	58%	0.581	S	S	.	*	H	α-helix	trans	-61.4	-41.7	178.2	-69	166.4	0	0	0	110.8	W824 V825 M831 R832	W824-I828 HydrophobicContact CE3-CD1 4.29Å; W824-I828 HydrophobicContact CE3-CG1 4.41Å; W824-I828 WeakPolarHBondContact O-CB 3.07Å; W824-I828 VanDerWaalsContact O-CG1 3.3Å; W824-I828 WeakPolarHBondContact O-CG1 3.48Å; W824-I828 PolarHBondContact O-N 3.34Å; V825-I828 PolarHBondContact O-N 3.2Å; I828-M831 PolarHBondContact O-N 3.23Å; I828-R832 WeakPolarHBondContact O-CB 3.43Å; I828-R832 PolarHBondContact O-N 3.07Å
829	Y	76.7	Confident	65.3	Low	138 Å²	138	119.9 Å²	119.9	54%	0.541	59%	0.585	S	S	.	*	H	α-helix	trans	-60.8	-45.7	175.3	177.8	-102.8	0	0	0	112.3	V825 I826 V827 R833	V825-Y829 VanDerWaalsContact O-CB 3.31Å; V825-Y829 WeakPolarHBondContact O-CB 3.03Å; V825-Y829 PolarHBondContact O-N 3.2Å; I826-Y829 PolarHBondContact O-N 3.04Å; V827-Y829 VanDerWaalsContact C-N 3.32Å; V827-Y829 PolarHBondContact O-N 3.12Å; Y829-R833 WeakPolarHBondContact O-CB 3.32Å; Y829-R833 PolarHBondContact O-N 3.49Å
830	H	68.8	Low	63.4	Low	112 Å²	112	125.6 Å²	125.6	52%	0.519	61%	0.606	S	S	.	*	H	α-helix	trans	-69.6	-35.1	178.2	-92	-73.6	0	0	0	114.1	I826 V827 K834	I826-H830 PolarHBondContact O-N 3.42Å; V827-H830 PolarHBondContact O-N 3.17Å; H830-K834 PolarHBondContact O-N 2.8Å
831	M	64.7	Low	61.1	Low	132 Å²	132	128.5 Å²	128.5	65%	0.65	62%	0.624	S	S	*	*	H	α-helix	trans	-68.6	-43.6	174.4	-70.3	-171.2	77.3	0	0	111.3	V827 I828 R833 K834	V827-M831 HydrophobicContact CG1-CG 4.44Å; V827-M831 HydrophobicContact CG1-SD 4.19Å; V827-M831 WeakPolarHBondContact O-CG 3.45Å; V827-M831 PolarHBondContact O-N 3.29Å; I828-M831 PolarHBondContact O-N 3.23Å; M831-R833 PolarHBondContact O-N 3.41Å; M831-K834 PolarHBondContact O-N 2.89Å
832	R	62.4	Low	59	Low	179 Å²	179	132.5 Å²	132.5	68%	0.675	64%	0.64	S	S	*	*	H	α-helix	trans	-63.2	-43.8	178.9	-157	172.1	-166	156.4	5.3	111.8	I828 K834 N835	I828-R832 WeakPolarHBondContact O-CB 3.43Å; I828-R832 PolarHBondContact O-N 3.07Å; R832-K834 PolarHBondContact O-N 2.86Å; R832-N835 PolarHBondContact O-N 2.72Å
833	R	59.3	Low	56.7	Low	147 Å²	147	133 Å²	133	56%	0.555	65%	0.647	S	S	*	*	H	α-helix	trans	-62.8	-22.4	176.8	-173.6	170.8	176	177.8	-1.8	114.1	Y829 M831	Y829-R833 WeakPolarHBondContact O-CB 3.32Å; Y829-R833 PolarHBondContact O-N 3.49Å; M831-R833 PolarHBondContact O-N 3.41Å
834	K	51.3	Low	54.6	Low	168 Å²	168	136.3 Å²	136.3	73%	0.73	66%	0.66	S	S	*	*	H	α-helix	trans	-83.1	-15.2	173.7	-87.2	-165.4	170.1	-168.3	0	114.6	H830 M831 R832	H830-K834 PolarHBondContact O-N 2.8Å; M831-K834 PolarHBondContact O-N 2.89Å; R832-K834 PolarHBondContact O-N 2.86Å
835	N	52	Low	52.6	Low	132 Å²	132	136.2 Å²	136.2	71%	0.706	67%	0.668	S	S	*	*	H	α-helix	trans	-95.1	-9.3	-179.4	-80.2	19.6	0	0	0	113.8	R832	R832-N835 PolarHBondContact O-N 2.72Å
836	E	48	Very low	50.1	Low	136 Å²	136	137.7 Å²	137.7	64%	0.636	67%	0.671	S	S	*	*	S	Bend	trans	-89	-17.2	177.9	-69.6	173.1	166.4	0	0	112.7	Y838	E836-Y838 VanDerWaalsContact C-N 3.34Å; E836-Y838 PolarHBondContact O-N 3.19Å
837	D	43.5	Very low	47.7	Very low	137 Å²	137	140.1 Å²	140.1	73%	0.733	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	6.5	178.6	-78.9	-30.4	0	0	0	114.4
838	Y	40.6	Very low	45.5	Very low	225 Å²	225	144.6 Å²	144.6	88%	0.882	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.8	16.9	-176.7	-115.8	-87.2	0	0	0	115.5	E836	E836-Y838 VanDerWaalsContact C-N 3.34Å; E836-Y838 PolarHBondContact O-N 3.19Å
839	S	35	Very low	43.8	Very low	84 Å²	84	145.5 Å²	145.5	59%	0.587	72%	0.718	S	S	*	*	S	Bend	trans	-128.9	92.6	171.2	61.6	0	0	0	0	111.4
840	I	36	Very low	41.6	Very low	153 Å²	153	142.7 Å²	142.7	79%	0.785	72%	0.724	S	S	*	*			trans	159.1	108.7	147.2	-81.8	152.6	0	0	0	108.5
841	T	31.4	Very low	39.6	Very low	147 Å²	147	144.1 Å²	144.1	90%	0.902	74%	0.735	S	S	*	*			trans	-155.8	146.3	144.5	-2.5	0	0	0	0	107.3
842	N	30.9	Very low	38	Very low	151 Å²	151	144.9 Å²	144.9	81%	0.807	74%	0.74	S	S	*	*			trans	-95	177.3	-159.4	-70.1	-18.1	0	0	0	114
843	T	30.5	Very low	36.9	Very low	114 Å²	114	141.6 Å²	141.6	70%	0.699	74%	0.742	S	S	*	*			trans	-65.7	160.6	178.8	44.6	0	0	0	0	115.4
844	E	34.8	Very low	35.5	Very low	177 Å²	177	139 Å²	139	83%	0.827	75%	0.746	S	S	*	*			trans	91.2	135.4	143	-83.7	159.6	172.6	0	0	123
845	E	30.6	Very low	34.4	Very low	173 Å²	173	141.6 Å²	141.6	81%	0.808	75%	0.753	S	S	*	*			trans	80.6	128.5	154	-70.1	-156.6	142.4	0	0	125.2
846	L	27.3	Very low	33.3	Very low	125 Å²	125	143 Å²	143	65%	0.654	76%	0.76	S	S	*	*			trans	60.4	101.2	147.4	-88.2	77.6	0	0	0	121.3
847	N	26.4	Very low	32.5	Very low	151 Å²	151	142 Å²	142	81%	0.807	77%	0.768	S	S	*	*				165.5	154.5	88.2	-91.9	-37.2	0	0	0	115.8
848	L	30	Very low	31.8	Very low	160 Å²	160	141.3 Å²	141.3	84%	0.838	77%	0.774	S	S	*	*			trans	-81.7	174.5	167.9	-84.2	160.7	0	0	0	111
849	P	38.8	Very low	31.2	Very low	114 Å²	114	140.1 Å²	140.1	74%	0.74	78%	0.776	S	S	*	*			cis	-147.2	169.6	24.7	44.6	-25	0	0	0	120.4
850	A	30.6	Very low	30.8	Very low	79 Å²	79	139.3 Å²	139.3	65%	0.653	78%	0.781	S	S	*	*			trans	74.1	151.6	138.8	0	0	0	0	0	124.6
851	D	27	Very low	30.3	Very low	142 Å²	142	137.9 Å²	137.9	76%	0.759	78%	0.78	S	S	*	*			trans	97.1	86	144.7	-69.8	-9.6	0	0	0	125.6
852	I	31.3	Very low	30	Very low	148 Å²	148	138.4 Å²	138.4	76%	0.759	78%	0.776	S	S	*	*			trans	64.7	-176.3	130.6	-9.5	-174.4	0	0	0	118.7
853	P	39	Very low	29.7	Very low	111 Å²	111	136 Å²	136	72%	0.721	77%	0.771	S	S	*	*				-123.6	179.9	-109.8	42.7	-26.9	0	0	0	118.5
854	S	30.1	Very low	29.7	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	78%	0.78	S	S	*	*			trans	-46.2	147	162.2	54.9	0	0	0	0	116.6
855	Y	28.8	Very low	29.7	Very low	223 Å²	223	136.3 Å²	136.3	88%	0.875	77%	0.774	S	S	*	*				-169.9	158.1	98.7	-117.8	-86.4	0	0	0	113.4
856	L	29.6	Very low	29.5	Very low	163 Å²	163	136.4 Å²	136.4	85%	0.853	77%	0.774	S	S	*	*			trans	-89.2	133.3	160.9	-80.4	80.1	0	0	0	110.1
857	S	29.5	Very low	29.6	Very low	113 Å²	113	138.5 Å²	138.5	79%	0.79	78%	0.781	S	S	*	*			trans	-170.9	128.4	140.2	59.6	0	0	0	0	112.7
858	S	29.2	Very low	29.5	Very low	123 Å²	123	134.1 Å²	134.1	86%	0.86	77%	0.771	S	S	*	*			trans	-177.1	147.1	136.7	38.8	0	0	0	0	111.5
859	Q	28.7	Very low	29.4	Very low	200 Å²	200	137.4 Å²	137.4	94%	0.935	77%	0.774	S	S	*	*			trans	-91.8	148	157.3	-65.4	178.8	-15.5	0	0	107.9
860	G	26.7	Very low	28.8	Very low	67 Å²	67	136.3 Å²	136.3	69%	0.691	77%	0.769	S	S	*	*			trans	-178.4	82.2	178.6	0	0	0	0	0	117.1
861	T	25.5	Very low	28.6	Very low	123 Å²	123	139.7 Å²	139.7	76%	0.755	78%	0.776	S	S	*	*			trans	47.9	128	139.3	55.2	0	0	0	0	122.8
862	L	24.8	Very low	28.7	Very low	159 Å²	159	137.6 Å²	137.6	83%	0.832	77%	0.773	S	S	*	*			trans	66	143.3	137.5	-59.9	166.8	0	0	0	118.8
863	S	24.8	Very low	28.6	Very low	100 Å²	100	139.4 Å²	139.4	70%	0.699	78%	0.778	S	S	*	*			cis	-171.2	142	-11.4	47.2	0	0	0	0	110.5
864	E	30	Very low	28.1	Very low	191 Å²	191	139.4 Å²	139.4	89%	0.893	79%	0.787	S	S	*	*			trans	-93	144.6	170.4	-68.1	-174.9	135.1	0	0	113.1
865	P	35.3	Very low	28	Very low	107 Å²	107	138.8 Å²	138.8	70%	0.695	80%	0.796	S	S	*	*			trans	-90.5	133.9	142.1	3.6	16.9	0	0	0	109.5
866	Q	26.2	Very low	28.1	Very low	175 Å²	175	133.3 Å²	133.3	82%	0.818	79%	0.79	S	S	*	*				57.6	128.4	78.5	-73.3	-160.3	-56.9	0	0	113.4
867	E	28.3	Very low	28.1	Very low	169 Å²	169	134 Å²	134	79%	0.79	79%	0.788	S	S	*	*			cis	-146.5	172.6	13.8	-98.9	161	-175.7	0	0	109.6
868	G	25.1	Very low	28.2	Very low	59 Å²	59	136.6 Å²	136.6	61%	0.608	79%	0.788	S	S	*	*			cis	154.4	154.1	-1.4	0	0	0	0	0	111.9
869	Y	27.3	Very low	28.4	Very low	229 Å²	229	137.4 Å²	137.4	90%	0.898	78%	0.778	S	S	*	*			trans	61.9	150.8	166.4	-66.3	-81.5	0	0	0	118.7
870	S	26.6	Very low	28.5	Very low	90 Å²	90	133.9 Å²	133.9	63%	0.629	77%	0.765	S	S	*	*			cis	-163.8	162.3	-6.4	48.8	0	0	0	0	112.1
871	N	27.7	Very low	28.5	Very low	150 Å²	150	138.6 Å²	138.6	80%	0.802	77%	0.771	S	S	*	*			trans	37.1	144	139.4	-60.6	0.7	0	0	0	121.9
872	S	28	Very low	29.5	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	77%	0.772	S	S	*	*			cis	-176.9	174.2	-0.3	45.8	0	0	0	0	113.3
873	E	29	Very low	31.1	Very low	185 Å²	185	136.6 Å²	136.6	86%	0.864	77%	0.77	S	S	*	*			trans	88.3	135.9	156.1	-63.1	-167.1	139.6	0	0	123.3
874	A	28.9	Very low	31.5	Very low	111 Å²	111	136.2 Å²	136.2	92%	0.917	77%	0.772	S	S	*	*			trans	50.4	135.7	161.4	0	0	0	0	0	120.6
875	G	27.7	Very low	31.6	Very low	79 Å²	79	135.1 Å²	135.1	81%	0.814	77%	0.773	S	S	*	*			cis	-178	170.2	-3.4	0	0	0	0	0	108.2
876	S	30.7	Very low	31.3	Very low	107 Å²	107	133.2 Å²	133.2	75%	0.748	77%	0.773	S	S	*	*			cis	-167.9	172.4	17.1	58.8	0	0	0	0	112.8
877	H	30.8	Very low	31.4	Very low	178 Å²	178	136.1 Å²	136.1	82%	0.824	78%	0.778	S	S	*	*			trans	80.1	134.3	159.9	-77.1	-66.6	0	0	0	124.1
878	Q	30.7	Very low	31.4	Very low	167 Å²	167	135.3 Å²	135.3	78%	0.78	78%	0.777	S	S	*	*			trans	-163.2	162.5	-171.5	-87.9	-172.6	-79.9	0	0	108.5
879	Q	32.8	Very low	31.5	Very low	140 Å²	140	140.8 Å²	140.8	65%	0.654	79%	0.787	S	S	*	*			cis	-174	176	-25.7	-149.6	176.5	-9.7	0	0	109.1
880	L	30.9	Very low	31.5	Very low	127 Å²	127	139.6 Å²	139.6	67%	0.665	79%	0.786	S	S	*	*			trans	72.3	126.3	152.3	-66.3	163.8	0	0	0	122.8
881	M	27.1	Very low	31.4	Very low	166 Å²	166	138.1 Å²	138.1	82%	0.818	79%	0.785	S	S	*	*			trans	66.8	178.7	133.4	-69.2	-173.1	176.2	0	0	118.9
882	P	47.1	Very low	31.4	Very low	119 Å²	119	137.4 Å²	137.4	77%	0.773	79%	0.787	S	S	*	*			cis	-133.3	-175.1	1.1	43.5	-26	0	0	0	116.8
883	P	58.5	Low	31.3	Very low	121 Å²	121	140 Å²	140	79%	0.786	79%	0.792	S	S	*	*			trans	-115.6	163.5	171.8	40.3	-31.4	0	0	0	115.7
884	A	32.7	Very low	31.1	Very low	91 Å²	91	135 Å²	135	75%	0.752	79%	0.79	S	S	*	*			trans	150	135.6	137.1	0	0	0	0	0	117.5
885	N	32.7	Very low	31.1	Very low	169 Å²	169	133.4 Å²	133.4	90%	0.904	79%	0.786	S	S	*	*			trans	38.5	131	148.5	-61.5	-10.7	0	0	0	124.8
886	G	27.8	Very low	31.1	Very low	67 Å²	67	136.3 Å²	136.3	69%	0.691	79%	0.787	S	S	*	*				142.6	86.2	129.2	0	0	0	0	0	123.4
887	Y	29	Very low	31	Very low	236 Å²	236	136.1 Å²	136.1	93%	0.925	79%	0.786	S	S	*	*			trans	68	155.9	144.2	-79.9	-82.6	0	0	0	125.2
888	I	27.9	Very low	30.8	Very low	152 Å²	152	133.1 Å²	133.1	78%	0.779	78%	0.781	S	S	*	*			trans	97.6	95.1	158.1	-46.4	-163.2	0	0	0	121
889	H	27.1	Very low	30.6	Very low	173 Å²	173	135.5 Å²	135.5	80%	0.801	78%	0.782	S	S	*	*			trans	44.9	138.2	135.1	-90.4	-61.5	0	0	0	126.7
890	K	27.8	Very low	30.3	Very low	204 Å²	204	134.6 Å²	134.6	89%	0.887	79%	0.786	S	S	*	*			trans	70.9	142.1	159.7	-62.9	173.4	-179.9	179.2	0	115.9
891	G	25.4	Very low	30.1	Very low	59 Å²	59	135.5 Å²	135.5	61%	0.608	79%	0.79	S	S	*	*			cis	160.8	164.2	-5	0	0	0	0	0	111.1
892	T	26.5	Very low	29.9	Very low	136 Å²	136	132.5 Å²	132.5	83%	0.834	79%	0.785	S	S	*	*			trans	61	155.1	175.7	51.8	0	0	0	0	116.1
893	D	26.3	Very low	28.9	Very low	152 Å²	152	131.9 Å²	131.9	81%	0.813	78%	0.783	S	S	*	*			cis	-160.3	160.6	-13.6	-109	-21.3	0	0	0	110.5
894	G	25.8	Very low	27.4	Very low	80 Å²	80	132.7 Å²	132.7	83%	0.825	78%	0.781	S	S	*	*			trans	76.7	136.4	156.8	0	0	0	0	0	118.5
895	G	27.6	Very low	27	Very low	79 Å²	79	133 Å²	133	81%	0.814	78%	0.776	S	S	*	*			cis	114.7	78.3	-14	0	0	0	0	0	116.8
896	T	27.8	Very low	26.6	Very low	139 Å²	139	135 Å²	135	85%	0.853	77%	0.773	S	S	*	*			trans	-138.5	124.4	157.8	41.9	0	0	0	0	108
897	S	27.9	Very low	26.7	Very low	103 Å²	103	137.7 Å²	137.7	72%	0.72	77%	0.771	S	S	*	*			cis	75.7	107.9	44.4	-162.3	0	0	0	0	111.9
898	T	28	Very low	26.7	Very low	116 Å²	116	133.5 Å²	133.5	71%	0.712	77%	0.765	S	S	*	*				-179.5	166.3	87.6	33.3	0	0	0	0	108.8
899	R	27	Very low	26.6	Very low	216 Å²	216	129.7 Å²	129.7	82%	0.815	76%	0.756	S	S	*	*			cis	-160.5	138.4	3.7	-117.2	166.3	172.7	-174.3	-2.8	107.3
900	V	26.6	Very low	26.7	Very low	122 Å²	122	129.2 Å²	129.2	74%	0.739	76%	0.759	S	S	*	*				76.1	137.3	93	102.2	0	0	0	0	113.4
901	I	26.4	Very low	26.7	Very low	145 Å²	145	126.3 Å²	126.3	74%	0.744	75%	0.752	S	S	*	*			cis	-134.7	164.6	25.4	-56.3	177.3	0	0	0	112.4
902	C	22.6	Very low	26.8	Very low	104 Å²	104	131 Å²	131	70%	0.703	75%	0.753	S	S	*	*			trans	-48	-178.9	160.2	-40.9	0	0	0	0	114.1
903	S	26.7	Very low	26.8	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	75%	0.749	S	S	*	*			cis	-179.7	154.1	39.4	36.6	0	0	0	0	108.8
904	D	26.4	Very low	26.8	Very low	138 Å²	138	131.9 Å²	131.9	74%	0.738	75%	0.746	S	S	*	*			cis	-161	-163.8	0.7	-127.6	76.6	0	0	0	114.6
905	C	23.8	Very low	27.5	Very low	98 Å²	98	133.9 Å²	133.9	66%	0.662	74%	0.742	S	S	*	*			trans	-64.6	150.7	-175.2	-55.4	0	0	0	0	119.5
906	Y	25	Very low	27.3	Very low	212 Å²	212	141.7 Å²	141.7	83%	0.831	75%	0.747	S	S	*	*				-164.6	162.8	101.5	-123.3	-89.7	0	0	0	114.3
907	D	29.3	Very low	27.3	Very low	123 Å²	123	141 Å²	141	66%	0.658	73%	0.734	S	S	*	*			trans	-68.8	174	-172.7	-52.3	-60.6	0	0	0	114.8
908	N	27.9	Very low	27.3	Very low	147 Å²	147	145.2 Å²	145.2	79%	0.786	74%	0.736	S	S	*	*			cis	-161.3	165.3	24.3	-147.6	-31.6	0	0	0	114.2
909	A	27.3	Very low	27.1	Very low	72 Å²	72	144.9 Å²	144.9	60%	0.595	74%	0.737	S	S	*	*			trans	36.7	121	161.2	0	0	0	0	0	119.2
910	N	27.9	Very low	27.4	Very low	163 Å²	163	139.9 Å²	139.9	87%	0.872	73%	0.732	S	S	*	*			cis	-146.7	169.3	39.3	-102.7	-41.4	0	0	0	114.1
911	I	27.7	Very low	27.3	Very low	144 Å²	144	144.2 Å²	144.2	74%	0.738	74%	0.737	S	S	*	*			trans	-108.4	124.2	-156	-76.8	175.4	0	0	0	114.2
912	Y	27.4	Very low	27.1	Very low	158 Å²	158	142.3 Å²	142.3	62%	0.62	73%	0.732	S	S	*	*			trans	44.9	154.2	140.7	-68.1	-114.3	0	0	0	121.2	R914	Y912-R914 HydrophobicContact CD1-CB 4.28Å; Y912-R914 HydrophobicContact CD1-CG 3.85Å; Y912-R914 VanDerWaalsContact CE1-CD 3.48Å; Y912-R914 HydrophobicContact CE1-CG 4.05Å; Y912-R914 PolarHBondContact OH-NH1 3.39Å; Y912-R914 PolarHBondContact OH-NH2 2.65Å
913	S	27.3	Very low	27.2	Very low	108 Å²	108	147 Å²	147	76%	0.755	74%	0.736	S	S	*	*			cis	-130.9	120.9	7.8	51.5	0	0	0	0	110.8
914	R	26.6	Very low	27.2	Very low	197 Å²	197	148.1 Å²	148.1	74%	0.743	73%	0.733	S	S	*	*				76.5	108.8	71.5	-90.1	-149.3	178.8	164.3	2.4	115.7	Y912	Y912-R914 HydrophobicContact CD1-CB 4.28Å; Y912-R914 HydrophobicContact CD1-CG 3.85Å; Y912-R914 VanDerWaalsContact CE1-CD 3.48Å; Y912-R914 HydrophobicContact CE1-CG 4.05Å; Y912-R914 PolarHBondContact OH-NH1 3.39Å; Y912-R914 PolarHBondContact OH-NH2 2.65Å
915	T	39.9	Very low	27.3	Very low	123 Å²	123	145.6 Å²	145.6	76%	0.755	73%	0.731	S	S	*	*			trans	-79.8	177	159.3	47.8	0	0	0	0	112.1
916	R	23.2	Very low	27.4	Very low	243 Å²	243	149.4 Å²	149.4	92%	0.917	74%	0.739	S	S	*	*			trans	-154.7	122.7	147.4	-131.5	-175.3	-175.7	-176.9	-0.4	112.9
917	E	28.3	Very low	27.6	Very low	123 Å²	123	147.4 Å²	147.4	58%	0.575	74%	0.737	S	S	*	*			trans	-84.7	-178.3	157.1	-56	137.9	110.4	0	0	108.9
918	Y	28.6	Very low	27.4	Very low	193 Å²	193	148.1 Å²	148.1	76%	0.757	74%	0.741	S	S	*	*			cis	-154.6	165.9	21.6	-88.3	-57.4	0	0	0	109.2
919	C	23.1	Very low	27.3	Very low	109 Å²	109	146.6 Å²	146.6	74%	0.736	74%	0.737	S	S	*	*			cis	-132.2	-109	-11.2	-173.6	0	0	0	0	108.3
920	P	33.6	Very low	27.5	Very low	110 Å²	110	150.1 Å²	150.1	71%	0.714	75%	0.745	S	S	*	*			cis	-118.3	167.5	-6.8	30.9	-9.2	0	0	0	116.3
921	Y	24.2	Very low	27.4	Very low	214 Å²	214	148 Å²	148	84%	0.839	73%	0.733	S	S	*	*			trans	19.3	108.3	157.7	-70.7	-76.6	0	0	0	122.9
922	T	23.2	Very low	27.4	Very low	105 Å²	105	148.5 Å²	148.5	64%	0.644	73%	0.733	S	S	*	*			trans	5.2	132	130.7	54.3	0	0	0	0	119
923	Y	24.1	Very low	27.5	Very low	203 Å²	203	146.3 Å²	146.3	80%	0.796	74%	0.736	S	S	*	*				-150.8	131.7	74.1	-107.8	-114	0	0	0	109.6
924	I	26.2	Very low	27.5	Very low	128 Å²	128	148.5 Å²	148.5	66%	0.656	74%	0.738	S	S	*	*				61.5	99.5	86.4	-61.3	172.7	0	0	0	110.9
925	A	28.4	Very low	27.4	Very low	84 Å²	84	144 Å²	144	69%	0.694	74%	0.737	S	S	*	*				76.6	150.8	82.5	0	0	0	0	0	112.1
926	E	25.9	Very low	26.7	Very low	178 Å²	178	143.3 Å²	143.3	83%	0.832	74%	0.737	S	S	*	*			cis	-121.1	153.5	26.8	-77.9	166.2	161.5	0	0	111.9
927	E	28.7	Very low	26.8	Very low	170 Å²	170	138.8 Å²	138.8	79%	0.794	73%	0.731	S	S	*	*				69.3	141.4	56.6	-78.2	-167	-158.2	0	0	114.8
928	D	26.3	Very low	26.4	Very low	139 Å²	139	140.9 Å²	140.9	74%	0.743	74%	0.742	S	S	*	*			cis	-159.8	-173.6	-31.5	-145	-25.6	0	0	0	110.7
929	V	26.3	Very low	26.3	Very low	115 Å²	115	137.1 Å²	137.1	70%	0.697	74%	0.739	S	S	*	*			trans	-121.9	168.5	177.8	173.3	0	0	0	0	109.8
930	L	30	Very low	26.3	Very low	146 Å²	146	140.5 Å²	140.5	76%	0.764	74%	0.744	S	S	*	*			trans	76.1	159.1	167.8	-110.3	74.4	0	0	0	115.7
931	D	26.9	Very low	25.9	Very low	118 Å²	118	143.6 Å²	143.6	63%	0.631	75%	0.751	S	S	*	*			cis	-147.3	172.8	-11.8	-152.5	-3.4	0	0	0	112.5
932	Q	28.2	Very low	26.7	Very low	154 Å²	154	138.2 Å²	138.2	72%	0.72	74%	0.743	S	S	*	*			trans	-55.3	154.7	160.7	-53.5	167.2	13.5	0	0	111.3
933	T	29	Very low	26.9	Very low	112 Å²	112	141.4 Å²	141.4	69%	0.687	75%	0.748	S	S	*	*				179.5	153.8	74.6	27.4	0	0	0	0	114.5
934	L	26.6	Very low	27.1	Very low	154 Å²	154	137.9 Å²	137.9	81%	0.806	74%	0.738	S	S	*	*			trans	63.2	103.5	141.4	-68.4	166.3	0	0	0	122.6
935	S	24.8	Very low	27	Very low	104 Å²	104	137.5 Å²	137.5	73%	0.727	74%	0.742	S	S	*	*				54.7	113.1	114	170.8	0	0	0	0	120.6
936	S	25	Very low	26.9	Very low	107 Å²	107	143.1 Å²	143.1	75%	0.748	75%	0.747	S	S	*	*				-179.8	145.8	93.2	45.6	0	0	0	0	116.1
937	L	24.5	Very low	26.8	Very low	149 Å²	149	140.7 Å²	140.7	78%	0.78	74%	0.738	S	S	*	*			trans	26.3	119.7	147.9	-73.6	158.1	0	0	0	122.5
938	M	21.5	Very low	26.7	Very low	167 Å²	167	137.1 Å²	137.1	82%	0.823	74%	0.738	S	S	*	*				87.6	143.2	127	-89.2	-173.7	-173.4	0	0	123.3
939	V	24.8	Very low	26.8	Very low	114 Å²	114	138 Å²	138	69%	0.691	74%	0.737	S	S	*	*			trans	91.6	120.6	145.6	163.3	0	0	0	0	120.2
940	Q	24.6	Very low	26.8	Very low	179 Å²	179	139.8 Å²	139.8	84%	0.836	74%	0.743	S	S	*	*			trans	68.6	98.9	152.9	-77.7	163.8	-3.8	0	0	122
941	M	23.8	Very low	27.4	Very low	176 Å²	176	137.4 Å²	137.4	87%	0.867	74%	0.736	S	S	*	*				-51.3	155.1	121.9	-91.9	-164.3	-70	0	0	110.8
942	P	41.9	Very low	27.5	Very low	101 Å²	101	139.3 Å²	139.3	66%	0.656	74%	0.741	S	S	*	*			cis	-151.1	-176	46.2	45.4	-25.9	0	0	0	117.5
943	K	26.3	Very low	27.5	Very low	172 Å²	172	138 Å²	138	75%	0.748	74%	0.739	S	S	*	*			trans	40	147.9	133.2	-71	168.1	152.5	-129.3	0	120
944	E	28.6	Very low	27.5	Very low	129 Å²	129	138.7 Å²	138.7	60%	0.603	74%	0.743	S	S	*	*			cis	-170.1	159	28.4	-142.6	147	-135.4	0	0	112.5
945	T	25.7	Very low	27.7	Very low	119 Å²	119	137.2 Å²	137.2	73%	0.73	74%	0.741	S	S	*	*			trans	60	156.6	150.3	43.7	0	0	0	0	121.6
946	Y	25.2	Very low	27.9	Very low	203 Å²	203	136.3 Å²	136.3	80%	0.796	74%	0.74	S	S	*	*			cis	-168.5	158.5	-32.5	-132.1	-136.8	0	0	0	109.5
947	L	24.1	Very low	28.1	Very low	126 Å²	126	138.3 Å²	138.3	66%	0.66	74%	0.741	S	S	*	*			trans	27	121.9	156.2	-65	176.8	0	0	0	123
948	A	27.3	Very low	28.2	Very low	96 Å²	96	139.3 Å²	139.3	79%	0.793	74%	0.742	S	S	*	*				-164.7	106.8	123.6	0	0	0	0	0	109.2
949	H	27	Very low	28.5	Very low	156 Å²	156	135.5 Å²	135.5	72%	0.722	73%	0.731	S	S	*	*				68.2	88.8	84.6	-79.7	-71.2	0	0	0	116.8
950	L	26.4	Very low	28.5	Very low	154 Å²	154	137.6 Å²	137.6	81%	0.806	74%	0.738	S	S	*	*				4	154.1	108.7	-78.2	165.2	0	0	0	117.1
951	P	42.5	Very low	28.7	Very low	96 Å²	96	137.1 Å²	137.1	62%	0.623	74%	0.739	S	S	*	*			cis	-161.1	-166.9	49.3	47.9	-26.7	0	0	0	119.2
952	Q	29.4	Very low	28.9	Very low	157 Å²	157	132.9 Å²	132.9	73%	0.734	73%	0.727	S	S	*	*			trans	68.2	157.8	154.7	-66.4	-174.5	-80.9	0	0	119.4
953	D	28.8	Very low	28.1	Very low	127 Å²	127	133.1 Å²	133.1	68%	0.679	73%	0.731	S	S	*	*			cis	-171.4	170.8	-21.7	-94.4	-10.5	0	0	0	106.5
954	T	28.7	Very low	28.1	Very low	127 Å²	127	129 Å²	129	78%	0.779	73%	0.729	S	S	*	*			cis	-130.5	-168.1	3.8	51.3	0	0	0	0	108.1
955	T	29.6	Very low	28	Very low	123 Å²	123	130.8 Å²	130.8	76%	0.755	74%	0.743	S	S	*	*			cis	-134.5	172.5	5.3	54.5	0	0	0	0	109.6
956	A	30.2	Very low	28.2	Very low	85 Å²	85	128.4 Å²	128.4	70%	0.702	74%	0.742	S	S	*	*			cis	93.2	93.5	8.9	0	0	0	0	0	118.8
957	L	28.8	Very low	28.4	Very low	149 Å²	149	127.7 Å²	127.7	78%	0.78	75%	0.746	S	S	*	*			trans	-157.4	116	140.6	-124.1	94.7	0	0	0	106.4
958	E	27.7	Very low	29.4	Very low	169 Å²	169	126.1 Å²	126.1	79%	0.79	74%	0.744	S	S	*	*				72.1	142.4	100.7	-72.4	-176.8	-171.3	0	0	116.5
959	S	26.6	Very low	29.3	Very low	87 Å²	87	127 Å²	127	61%	0.608	74%	0.744	S	S	*	*			cis	175.8	153.1	-42.5	47.7	0	0	0	0	110.8
960	L	25.1	Very low	29.4	Very low	158 Å²	158	123.7 Å²	123.7	83%	0.827	74%	0.743	S	S	*	*			trans	71.2	162.7	156.3	-66.9	156.5	0	0	0	119.7
961	I	29.8	Very low	29.5	Very low	169 Å²	169	125.7 Å²	125.7	87%	0.867	75%	0.746	S	S	*	*			trans	71.3	137.6	171	-58.4	162.7	0	0	0	113.7
962	S	27.9	Very low	29.6	Very low	88 Å²	88	126 Å²	126	62%	0.615	75%	0.748	S	S	*	*			cis	-160.4	128.6	-13.6	165.4	0	0	0	0	106
963	S	23.9	Very low	29.8	Very low	106 Å²	106	123.8 Å²	123.8	74%	0.741	75%	0.745	S	S	*	*				44.6	140.5	89.2	46.8	0	0	0	0	118
964	A	26.4	Very low	29.9	Very low	84 Å²	84	123.2 Å²	123.2	69%	0.694	74%	0.742	S	S	*	*			trans	66.3	154.1	170.7	0	0	0	0	0	117
965	D	26.8	Very low	30.2	Very low	167 Å²	167	123.6 Å²	123.6	89%	0.893	74%	0.735	S	S	*	*			cis	-161.2	159	-21.6	-92.1	-27	0	0	0	106.2
966	G	29.4	Very low	30.3	Very low	70 Å²	70	123.4 Å²	123.4	72%	0.722	73%	0.726	S	S	*	*			cis	175.4	-157.3	0.3	0	0	0	0	0	113.1
967	E	30.8	Very low	30.5	Very low	187 Å²	187	128.7 Å²	128.7	87%	0.874	73%	0.727	S	S	*	*			trans	-53.6	-178.2	169.6	-102.3	-173.5	-158.9	0	0	115.8
968	P	43.5	Very low	30.6	Very low	94 Å²	94	128.5 Å²	128.5	61%	0.61	73%	0.726	S	S	*	*			cis	-136.9	-175.4	2.2	29.3	-6	0	0	0	116.1
969	S	26.5	Very low	30.6	Very low	114 Å²	114	125 Å²	125	80%	0.797	72%	0.72	S	S	*	*			trans	71	157.2	144.7	71.7	0	0	0	0	119.5
970	A	28	Very low	30.8	Very low	86 Å²	86	129 Å²	129	71%	0.711	73%	0.729	S	S	*	*			cis	-164.5	175.5	-26.3	0	0	0	0	0	110.9
971	F	30.2	Very low	30.8	Very low	196 Å²	196	131 Å²	131	86%	0.86	73%	0.731	S	S	*	*			trans	-23.8	155.2	158.7	-72.4	-86.7	0	0	0	117.5
972	P	43.7	Very low	30.8	Very low	102 Å²	102	131.8 Å²	131.8	66%	0.662	73%	0.728	S	S	*	*			cis	-149.2	158.2	35.8	42.3	-22.6	0	0	0	120.1
973	T	33.4	Very low	30.7	Very low	111 Å²	111	134.7 Å²	134.7	68%	0.681	74%	0.736	S	S	*	*			trans	65	151.6	140.8	54.9	0	0	0	0	120.6
974	N	32	Very low	30.8	Very low	115 Å²	115	134.3 Å²	134.3	62%	0.615	73%	0.733	S	S	*	*			cis	-161.1	158.5	0.1	-123.4	-13.2	0	0	0	115.3
975	H	34.3	Very low	30.8	Very low	136 Å²	136	136 Å²	136	63%	0.63	74%	0.74	S	S	*	*			trans	50.9	146.3	153.2	-59.6	-63	0	0	0	121.6
976	E	32.4	Very low	30.7	Very low	119 Å²	119	134.4 Å²	134.4	56%	0.556	74%	0.736	S	S	*	*			cis	-154.3	134.4	-12.6	-111.2	174.4	173.4	0	0	108.6
977	R	32.7	Very low	31.3	Very low	195 Å²	195	136.4 Å²	136.4	74%	0.736	74%	0.737	S	S	*	*				74.7	140.9	78.9	-165.9	-149.1	-87.2	164.6	-1.9	111.8
978	I	31	Very low	31	Very low	146 Å²	146	136.2 Å²	136.2	75%	0.749	74%	0.738	S	S	*	*			cis	-134.2	-176.6	17	-4.3	178.8	0	0	0	108.7
979	S	28.6	Very low	30.3	Very low	96 Å²	96	137.9 Å²	137.9	67%	0.671	75%	0.752	S	S	*	*			cis	-158.8	143.2	0.9	37.2	0	0	0	0	113.1
980	E	29.8	Very low	30.3	Very low	169 Å²	169	136 Å²	136	79%	0.79	75%	0.751	S	S	*	*			trans	22.2	135	141.5	-48.6	-169.6	162	0	0	123.1
981	K	26.6	Very low	30.3	Very low	201 Å²	201	141.3 Å²	141.3	87%	0.874	76%	0.761	S	S	*	*				-162.4	-177.2	90.4	-114	173.3	-174.2	170	0	115
982	K	28.7	Very low	30.3	Very low	186 Å²	186	138.8 Å²	138.8	81%	0.809	76%	0.762	S	S	*	*			trans	-132.4	140.3	-147	-142.5	-177.8	-174.8	176.7	0	113.7
983	L	27.1	Very low	29.7	Very low	148 Å²	148	142.4 Å²	142.4	78%	0.775	78%	0.775	S	S	*	*			trans	32	125.9	147.9	-98	71.2	0	0	0	122.7
984	S	25.4	Very low	29.4	Very low	99 Å²	99	145.3 Å²	145.3	69%	0.692	78%	0.78	S	S	*	*				91.9	148.3	117.2	75.8	0	0	0	0	123.2
985	S	25.7	Very low	29.5	Very low	119 Å²	119	150 Å²	150	83%	0.832	79%	0.79	S	S	*	*			trans	90.8	154	154.1	75.9	0	0	0	0	120.4
986	T	25.6	Very low	29.3	Very low	133 Å²	133	149.5 Å²	149.5	82%	0.816	80%	0.798	S	S	*	*			trans	-104.9	-178.2	-169.7	43.8	0	0	0	0	111.4
987	P	40.7	Very low	29	Very low	113 Å²	113	149.1 Å²	149.1	73%	0.734	80%	0.803	S	S	*	*			cis	-131.7	-179.5	-23.2	31.8	-12.2	0	0	0	114.5
988	M	25.3	Very low	28.7	Very low	182 Å²	182	149.8 Å²	149.8	90%	0.897	81%	0.806	S	S	*	*			trans	77.1	150.3	145.9	-127	-179.4	-177.2	0	0	121.3
989	S	27.8	Very low	28.5	Very low	129 Å²	129	150.3 Å²	150.3	90%	0.902	81%	0.811	S	S	*	*			trans	70.1	133.2	174	73.2	0	0	0	0	117.5
990	G	27.2	Very low	28.7	Very low	75 Å²	75	151 Å²	151	77%	0.773	81%	0.805	S	S	*	*			trans	133.4	81.1	-179.7	0	0	0	0	0	114.2
991	E	29	Very low	28.6	Very low	198 Å²	198	149.9 Å²	149.9	93%	0.925	81%	0.805	S	S	*	*			trans	39.6	109.9	157	-57.8	-171.6	150.3	0	0	120.1
992	T	28.4	Very low	28.8	Very low	143 Å²	143	150.2 Å²	150.2	88%	0.877	80%	0.801	S	S	*	*			trans	-86.8	134.4	167.7	39.4	0	0	0	0	111.7
993	L	31.5	Very low	28.8	Very low	178 Å²	178	149 Å²	149	93%	0.932	80%	0.798	S	S	*	*			trans	-126.6	90.4	164.6	-101.8	168.7	0	0	0	110.7
994	Q	27.1	Very low	29	Very low	171 Å²	171	149.7 Å²	149.7	80%	0.799	80%	0.802	S	S	*	*			trans	-135.6	132.3	161.1	-80.2	-158.3	3.8	0	0	110.9
995	R	34.3	Very low	29	Very low	215 Å²	215	148.9 Å²	148.9	81%	0.811	81%	0.809	S	S	*	*			trans	41.8	126.4	150.3	-59.5	-178.2	175.1	-165.4	-1.1	119.6	V997	R995-V997 HydrophobicContact CB-CG2 4.39Å
996	P	31.1	Very low	29.2	Very low	125 Å²	125	151.2 Å²	151.2	81%	0.812	81%	0.811	S	S	*	*				-111.4	153.7	115.4	33.8	-32.6	0	0	0	110.4
997	V	25.5	Very low	30.3	Very low	110 Å²	110	149.8 Å²	149.8	67%	0.667	80%	0.804	S	S	*	*			cis	79	90.9	13.6	-167.9	0	0	0	0	115.9	R995	R995-V997 HydrophobicContact CB-CG2 4.39Å
998	W	27.2	Very low	29.7	Very low	209 Å²	209	153.1 Å²	153.1	79%	0.792	81%	0.809	S	S	*	*			trans	48.3	137.2	134.4	-70	35	0	0	0	120.6	I1000	W998-I1000 HydrophobicContact CE3-CD1 3.87Å; W998-I1000 HydrophobicContact CZ3-CD1 3.73Å
999	N	25.4	Very low	31.4	Very low	158 Å²	158	149.4 Å²	149.4	85%	0.845	80%	0.799	S	S	*	*				-157.5	172.4	108.8	-125.1	-45.5	0	0	0	115.7
1000	I	33.7	Very low	32.4	Very low	109 Å²	109	148.6 Å²	148.6	56%	0.559	79%	0.79	S	S	*	*			trans	-120.4	139.8	-166.8	-63.9	158.6	0	0	0	110.6	W998	W998-I1000 HydrophobicContact CE3-CD1 3.87Å; W998-I1000 HydrophobicContact CZ3-CD1 3.73Å
1001	N	28.2	Very low	32.5	Very low	146 Å²	146	154.2 Å²	154.2	78%	0.781	79%	0.794	S	S	*	*			trans	169.1	156.9	137.5	-89	-44.3	0	0	0	109.3
1002	R	30.8	Very low	32.3	Very low	208 Å²	208	149.2 Å²	149.2	79%	0.785	78%	0.781	S	S	*	*			cis	154.7	113.4	-19.5	175.7	-166.5	-147.6	-154	10.2	105.4
1003	E	28.5	Very low	32.4	Very low	161 Å²	161	151.1 Å²	151.1	75%	0.752	78%	0.78	S	S	*	*			trans	177.5	134.5	134.4	-99.3	176.4	-165.2	0	0	115.2
1004	L	30.1	Very low	32.3	Very low	163 Å²	163	150.9 Å²	150.9	85%	0.853	77%	0.774	S	S	*	*			trans	45.5	120.3	141.6	-60.4	165.2	0	0	0	122
1005	G	27	Very low	33.2	Very low	81 Å²	81	148 Å²	148	84%	0.835	77%	0.77	S	S	*	*			trans	173.7	97.1	162.6	0	0	0	0	0	116.6
1006	L	29	Very low	32.8	Very low	168 Å²	168	143.2 Å²	143.2	88%	0.88	76%	0.764	S	S	*	*			trans	-139.3	163.3	168.7	-86.2	175	0	0	0	107.7
1007	P	48.9	Very low	32.7	Very low	104 Å²	104	144.7 Å²	144.7	68%	0.675	76%	0.76	S	S	*	*			cis	-137.6	164.8	-4.6	40.9	-24	0	0	0	116.8
1008	H	27.7	Very low	32.7	Very low	183 Å²	183	147.4 Å²	147.4	85%	0.847	77%	0.765	S	S	*	*			trans	56.2	166.8	142.5	-81.4	-48.8	0	0	0	123.7
1009	P	60.8	Low	32.9	Very low	103 Å²	103	142.4 Å²	142.4	67%	0.669	76%	0.763	S	S	*	*			trans	-106.3	-169.9	-156.4	43.3	-37.2	0	0	0	114.7
1010	P	49.5	Very low	33.8	Very low	112 Å²	112	140.1 Å²	140.1	73%	0.727	76%	0.757	S	S	*	*				-151.8	152.6	102.1	39.9	-22.6	0	0	0	118.8
1011	F	28.5	Very low	33.7	Very low	193 Å²	193	142.9 Å²	142.9	85%	0.846	77%	0.767	S	S	*	*			trans	58.5	115.7	137.3	-83.2	-113.1	0	0	0	123.4
1012	S	26.2	Very low	33.6	Very low	93 Å²	93	141.8 Å²	141.8	65%	0.65	76%	0.76	S	S	*	*				125.2	145.1	98.7	67.2	0	0	0	0	121.5
1013	Q	28.8	Very low	33.5	Very low	183 Å²	183	138.7 Å²	138.7	86%	0.855	76%	0.755	S	S	*	*			trans	73.1	103.2	145.3	-77.7	170.8	15.9	0	0	122.8
1014	Q	30.2	Very low	33.6	Very low	173 Å²	173	138.3 Å²	138.3	81%	0.808	75%	0.753	S	S	*	*			trans	-49.1	164	130.2	-72.6	-179.4	-32.4	0	0	111.6
1015	P	45.3	Very low	33.5	Very low	111 Å²	111	136.3 Å²	136.3	72%	0.721	74%	0.743	S	S	*	*			cis	-155.8	154.1	39.7	39.6	-16.5	0	0	0	121.8
1016	V	27.6	Very low	33.6	Very low	114 Å²	114	141.1 Å²	141.1	69%	0.691	74%	0.744	S	S	*	*				57.9	161.6	129.1	-167.6	0	0	0	0	121.2
1017	H	27.9	Very low	33.5	Very low	156 Å²	156	136.5 Å²	136.5	72%	0.722	74%	0.737	S	S	*	*			trans	79	143.1	176.2	-60.3	-89.4	0	0	0	115.2
1018	E	25.1	Very low	32.5	Very low	167 Å²	167	139.8 Å²	139.8	78%	0.78	75%	0.748	S	S	*	*			cis	-156.7	161.9	-4.8	-132.9	157.2	-147.3	0	0	112.3
1019	S	31.2	Very low	32.6	Very low	105 Å²	105	136 Å²	136	73%	0.734	75%	0.748	S	S	*	*			trans	-88.3	153.8	159.6	-45.2	0	0	0	0	109
1020	P	45.7	Very low	30.9	Very low	110 Å²	110	134.4 Å²	134.4	71%	0.714	75%	0.75	S	S	*	*				-160.8	162.8	89.1	41.9	-21.9	0	0	0	119.3
1021	Q	29.9	Very low	29.9	Very low	166 Å²	166	137.3 Å²	137.3	78%	0.776	76%	0.759	S	S	*	*			trans	64.1	123.2	134.9	-75.4	-175.3	-10.7	0	0	125.6
1022	L	27.4	Very low	30.2	Very low	123 Å²	123	136.6 Å²	136.6	64%	0.644	76%	0.758	S	S	*	*				88	135.1	119.8	-72.5	172.3	0	0	0	124.8
1023	H	28.9	Very low	31.3	Very low	144 Å²	144	137 Å²	137	67%	0.667	76%	0.758	S	S	*	*			trans	88.1	118.2	138.5	-78.4	-41.6	0	0	0	123.7
1024	Q	29.3	Very low	31.4	Very low	153 Å²	153	135 Å²	135	72%	0.715	75%	0.754	S	S	*	*				90.2	114.4	126.7	-77.5	179	-23.8	0	0	122.7
1025	N	28.5	Very low	31.1	Very low	120 Å²	120	132.1 Å²	132.1	64%	0.642	75%	0.751	S	S	*	*				75.8	135.6	125.9	-75.8	38.2	0	0	0	123.7
1026	E	30.2	Very low	30.3	Very low	182 Å²	182	131.8 Å²	131.8	85%	0.85	75%	0.752	S	S	*	*			trans	70.1	144.1	141.4	-70.8	163.8	-124.2	0	0	120.4
1027	G	26.4	Very low	30.5	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	76%	0.756	S	S	*	*			trans	148.3	49.1	155.7	0	0	0	0	0	120.9
1028	L	28.3	Very low	30.6	Very low	174 Å²	174	128.9 Å²	128.9	91%	0.911	76%	0.76	S	S	*	*			trans	35.2	135.1	143.4	-73.8	159.1	0	0	0	122.6
1029	A	28.4	Very low	31	Very low	102 Å²	102	125.8 Å²	125.8	84%	0.843	76%	0.756	S	S	*	*			trans	65.2	140.3	159.1	0	0	0	0	0	117.5
1030	G	25.7	Very low	31	Very low	70 Å²	70	129.2 Å²	129.2	72%	0.722	76%	0.763	S	S	*	*			cis	108.4	109.6	5.1	0	0	0	0	0	111.9
1031	L	29.4	Very low	30.2	Very low	173 Å²	173	128.7 Å²	128.7	91%	0.906	76%	0.762	S	S	*	*			trans	-170.7	96.9	169	-105.3	164.7	0	0	0	110.4
1032	E	33.6	Very low	30	Very low	178 Å²	178	126.6 Å²	126.6	83%	0.832	76%	0.764	S	S	*	*			trans	-78.9	166.7	140.7	-99.9	-174.1	167.7	0	0	107.9
1033	P	49.1	Very low	30.1	Very low	102 Å²	102	128.2 Å²	128.2	66%	0.662	77%	0.768	S	S	*	*			cis	-148.8	179.6	33.9	39.4	-16.9	0	0	0	119
1034	D	30.5	Very low	30.2	Very low	141 Å²	141	130.5 Å²	130.5	75%	0.754	77%	0.771	S	S	*	*				100.1	146.3	128.6	-114.5	-44.3	0	0	0	123.7
1035	C	25.9	Very low	30.2	Very low	112 Å²	112	129.2 Å²	129.2	76%	0.757	77%	0.768	S	S	*	*			trans	67.9	141.2	162.8	-72.4	0	0	0	0	120
1036	S	28.5	Very low	30.4	Very low	105 Å²	105	131.1 Å²	131.1	73%	0.734	77%	0.773	S	S	*	*			cis	-165.6	133.3	-7.1	54.4	0	0	0	0	115.2
1037	A	31.2	Very low	30.4	Very low	93 Å²	93	127.3 Å²	127.3	77%	0.769	76%	0.758	S	S	*	*			trans	59.1	151.3	132.6	0	0	0	0	0	125
1038	S	29.5	Very low	30.6	Very low	116 Å²	116	132 Å²	132	81%	0.811	76%	0.761	S	S	*	*			trans	88	147.2	156.1	81.2	0	0	0	0	119.4
1039	S	32.8	Very low	30.5	Very low	101 Å²	101	126.8 Å²	126.8	71%	0.706	75%	0.75	S	S	*	*			cis	-170.1	172.7	-27	57.9	0	0	0	0	111.6
1040	M	31.1	Very low	30.6	Very low	178 Å²	178	131.9 Å²	131.9	88%	0.877	75%	0.753	S	S	*	*			trans	73.3	156.7	165.6	-67.9	-173.7	167.4	0	0	119.1
1041	S	30.4	Very low	30.8	Very low	98 Å²	98	134.7 Å²	134.7	69%	0.685	75%	0.751	S	S	*	*				175.6	132.4	-54.2	49.5	0	0	0	0	112.6
1042	C	25.7	Very low	30.8	Very low	122 Å²	122	135.8 Å²	135.8	82%	0.824	75%	0.749	S	S	*	*			trans	-179.5	130.6	148.7	-101	0	0	0	0	108.8
1043	H	29.6	Very low	30.5	Very low	157 Å²	157	130.4 Å²	130.4	73%	0.727	73%	0.731	S	S	*	*				72.3	132.1	69.7	-91.5	17.4	0	0	0	114.2
1044	R	31.2	Very low	29.6	Very low	193 Å²	193	136.4 Å²	136.4	73%	0.728	74%	0.741	S	S	*	*			cis	-172.3	169.4	2.3	-152.9	-178.1	179.8	175	0.8	112.4
1045	L	28.6	Very low	29.5	Very low	126 Å²	126	135.2 Å²	135.2	66%	0.66	74%	0.739	S	S	*	*			trans	77.9	139.1	163.4	-55.8	174.3	0	0	0	116.2
1046	Q	32.2	Very low	29.6	Very low	160 Å²	160	139.9 Å²	139.9	75%	0.748	74%	0.74	S	S	*	*			cis	76.4	139.3	42.8	-71.6	-170.5	-87	0	0	113.3
1047	D	30.5	Very low	29.6	Very low	101 Å²	101	141.7 Å²	141.7	54%	0.54	74%	0.742	S	S	.	*			cis	-160.2	170.9	-1.3	-137.9	-53.1	0	0	0	111.5
1048	H	30.9	Very low	29.5	Very low	170 Å²	170	145.1 Å²	145.1	79%	0.787	75%	0.745	S	S	*	*			trans	62.1	149	166.5	-47.2	-27.6	0	0	0	117.3
1049	G	26.8	Very low	29.6	Very low	65 Å²	65	147.4 Å²	147.4	67%	0.67	74%	0.743	S	S	*	*			cis	111.4	102.4	-4.8	0	0	0	0	0	114.3
1050	F	29.9	Very low	29.5	Very low	209 Å²	209	150.2 Å²	150.2	92%	0.917	75%	0.75	S	S	*	*			trans	-155.9	140	151.8	-116.2	-74.2	0	0	0	112.1
1051	D	30.2	Very low	29.4	Very low	128 Å²	128	145.4 Å²	145.4	68%	0.684	75%	0.746	S	S	*	*			trans	-102	141.9	174.9	166.9	27	0	0	0	109.2
1052	F	28.9	Very low	29.4	Very low	197 Å²	197	146.6 Å²	146.6	86%	0.864	76%	0.755	S	S	*	*			trans	-149.1	136.6	150.5	-122.1	-76.5	0	0	0	113.7
1053	S	27.2	Very low	29.8	Very low	65 Å²	65	150.4 Å²	150.4	46%	0.455	76%	0.761	S	S	.	*			trans	-104.5	160.6	-165.7	74.5	0	0	0	0	114.9
1054	R	29.2	Very low	30	Very low	228 Å²	228	146.1 Å²	146.1	86%	0.86	76%	0.759	S	S	*	*			trans	73.7	159.7	158.7	-59.3	165.1	177.1	-178.8	0.6	115
1055	T	28.7	Very low	30.2	Very low	115 Å²	115	147.3 Å²	147.3	71%	0.706	79%	0.788	S	S	*	*			cis	-154.3	140	22.4	-28.7	0	0	0	0	114.1
1056	R	28.3	Very low	30.3	Very low	211 Å²	211	148.4 Å²	148.4	80%	0.796	79%	0.794	S	S	*	*			trans	40.8	134.7	141.4	-80.6	179	-177.9	173.6	0.1	123.6
1057	N	28.1	Very low	30.2	Very low	142 Å²	142	147.8 Å²	147.8	76%	0.759	80%	0.797	S	S	*	*			trans	69.3	147.4	141.8	-55.5	13.2	0	0	0	115.4
1058	I	30.7	Very low	30.2	Very low	165 Å²	165	150.4 Å²	150.4	85%	0.846	81%	0.811	S	S	*	*			cis	-141.8	164.7	41.4	-85.4	175.7	0	0	0	111.5
1059	Q	30.1	Very low	30.2	Very low	164 Å²	164	149.2 Å²	149.2	77%	0.766	81%	0.812	S	S	*	*			trans	-74.6	140.7	169.8	-62.4	158.6	-115.6	0	0	111.4
1060	D	31	Very low	30.4	Very low	160 Å²	160	154.5 Å²	154.5	86%	0.856	82%	0.821	S	S	*	*				-170.7	165.2	106.1	-89.6	-24.1	0	0	0	108.8
1061	G	28.5	Very low	30.4	Very low	77 Å²	77	150.9 Å²	150.9	79%	0.794	82%	0.815	S	S	*	*			trans	-127.6	173.5	-174.4	0	0	0	0	0	112.9
1062	S	32.1	Very low	30.4	Very low	124 Å²	124	152.5 Å²	152.5	87%	0.867	82%	0.824	S	S	*	*			trans	-150	136.3	161.2	49.1	0	0	0	0	109.7
1063	E	33.7	Very low	30.5	Very low	202 Å²	202	149.1 Å²	149.1	94%	0.944	82%	0.821	S	S	*	*			trans	-70.8	150.1	168.3	-59.1	160.4	124.8	0	0	109.3
1064	G	34.4	Very low	30.8	Very low	67 Å²	67	156.1 Å²	156.1	69%	0.691	85%	0.852	S	S	*	*			trans	166.3	75.1	179.1	0	0	0	0	0	114.9
1065	T	35.1	Very low	31	Very low	218 Å²	218	149.5 Å²	149.5	100%	1.337	85%	0.851	S	S	*	*			trans	25	0	155.7	58.3	0	0	0	0	118.4

Retrieved 1,065 of 1,065 residues in 481.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).