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Cadherin-4

Cadherins are calcium-dependent cell adhesion proteins. They preferentially interact with themselves in a homophilic manner in connecting cells; cadherins may thus contribute to the sorting of heterogeneous cell types. May play an important role in retinal development.

AlphaFold DB , UniProt , Accession A0A2K5VYM4, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene CDH4, Length 916 aa.

						>A0A2K5VYM4_MACFA|A0A2K5VYM4|CDH4
MTAGAGVLLLLLSLSGALRAHNEDLTTRETCKAGFSEDDYTALISQNILEGEKLLQVKFSSCVGTKGTQYETNSVDFKVGSDGTVFATRELQVPSEQVAFTVTAWDSQTAERWDAVVRLLVAQTSSLHSGHKPQKGKKIVALDPSPPPKDTLLPWPRHQNADGLRRRKRDWVIPPINVPENSRGPFPQQLVRIRSDKDNDIPIRYSVTGVGADQPPMEVFSIDSMSGRMYVTRPMDREEHASYHLRAHAVDMNGNKVENPIDLYIYVIDMNDNRPEFINQVYNGSVDEGSKPGTYVMTVTANDADDSTTANGMVRYRIVTQTPQSPSQNMFTINSETGDIVTVAAGLDREKVQQYTVIVQATDMEGNLNYGLSNTATAIITVTDVNDNPPEFTASTFAGEVPENRVETVVANLTVMDRDQPHSPNWNAVYRIISGDPSGHFSVRTDPVTNEGMVTVVKAVDYELNRAFMLTVMVSNQAPLASGIQMSFQSTAGVTISVMDINEAPYFPSNHKLIRLEEGVPPGTVLTTFSAVDPDRFMQQAVRYSKLSDPANWLHINTTNGQITTAAVLDRESLYTKNNVYEATFLAADNGIPPASGTGTLQIYLIDINDNAPELLPKEAQICEKPNLNAINITAADADVDPNIGPYVFELPFVPAAVRKNWTITRLNGDYAQLSLRILYLEAGMYDVPIIVTDSGNPPLSNTSIIKVKVCPCDDNGDCTTIGAVAAAGLGTGAIVAILICILILLTMVLLFVMWMKRREKERHTKQLLIDPEDDVRDNILKYDEEGGGEEDQDYDLSQLQQPEAMGHVPSKAPGVRRVDERPVGAEPQYPVRPMVPHPGDIGDFINEGLRAADNDPTAPPYDSLLVFDYEGSGSTAGSVSSLNSSSSGDQDYDYLNDWGPRFKKLADMYGGGEED
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37	Very low	37.5	Very low	238 Å²	238	142.9 Å²	142.9	100%	1.172	90%	0.895	S	S	*	*				0	119.9	0	-83.1	166.6	157.7	0	0	107.6
2	T	40.9	Very low	37.1	Very low	138 Å²	138	146.2 Å²	146.2	85%	0.847	90%	0.9	S	S	*	*			trans	56.2	107.5	157.7	57.3	0	0	0	0	122.3
3	A	40.3	Very low	36.6	Very low	109 Å²	109	142.9 Å²	142.9	90%	0.901	89%	0.886	S	S	*	*			trans	56.3	136.2	138.5	0	0	0	0	0	120.5
4	G	29.7	Very low	36.5	Very low	78 Å²	78	144.9 Å²	144.9	80%	0.804	89%	0.887	S	S	*	*			cis	-167.8	147	8	0	0	0	0	0	111.2
5	A	43.9	Very low	36.4	Very low	112 Å²	112	143.5 Å²	143.5	93%	0.926	89%	0.885	S	S	*	*			trans	-86.4	129	174.1	0	0	0	0	0	109.5
6	G	41.3	Very low	35.7	Very low	75 Å²	75	139.3 Å²	139.3	77%	0.773	88%	0.88	S	S	*	*			trans	166.4	54	174.2	0	0	0	0	0	115.6
7	V	40	Very low	35.3	Very low	140 Å²	140	137.4 Å²	137.4	85%	0.848	88%	0.88	S	S	*	*	S	Bend	trans	-144.8	-13.1	163.3	-174.9	0	0	0	0	113.6	L9	V7-L9 VanDerWaalsContact C-N 3.34Å; V7-L9 PolarHBondContact O-N 3.45Å; V7-L9 VanDerWaalsContact O-N 3.13Å
8	L	36.4	Very low	34.9	Very low	179 Å²	179	138 Å²	138	94%	0.937	87%	0.874	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	39.7	-173	-148.9	80.6	0	0	0	115
9	L	34.6	Very low	34.8	Very low	168 Å²	168	142.9 Å²	142.9	88%	0.88	87%	0.874	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.8	13.7	178.8	-126.1	117.8	0	0	0	115.7	V7	V7-L9 VanDerWaalsContact C-N 3.34Å; V7-L9 PolarHBondContact O-N 3.45Å; V7-L9 VanDerWaalsContact O-N 3.13Å
10	L	35.4	Very low	34.5	Very low	161 Å²	161	140.2 Å²	140.2	84%	0.843	87%	0.867	S	S	*	*	S	Bend	trans	-114.1	8.6	-175.7	-128.2	97.3	0	0	0	116.3
11	L	33.4	Very low	34.2	Very low	174 Å²	174	142.5 Å²	142.5	91%	0.911	87%	0.867	S	S	*	*	S	Bend	trans	-127	20.5	-171.4	-82.3	163.6	0	0	0	115.8
12	L	32.7	Very low	34.2	Very low	182 Å²	182	138.2 Å²	138.2	95%	0.953	85%	0.849	S	S	*	*	S	Bend	trans	-133.9	24.1	-177.7	-95.1	160.7	0	0	0	116
13	S	30.3	Very low	34	Very low	104 Å²	104	140.7 Å²	140.7	73%	0.727	85%	0.851	S	S	*	*	S	Bend	trans	-130.1	12.2	178.1	65.9	0	0	0	0	116.9
14	L	35.6	Very low	33.7	Very low	170 Å²	170	142.6 Å²	142.6	89%	0.89	85%	0.846	S	S	*	*	S	Bend	trans	-132.9	66.6	-178.9	-89.9	125	0	0	0	113
15	S	33.9	Very low	33.8	Very low	124 Å²	124	147.1 Å²	147.1	87%	0.867	85%	0.851	S	S	*	*	S	Bend	trans	-171	107.4	154.2	50.8	0	0	0	0	110.2
16	G	26.3	Very low	33.5	Very low	77 Å²	77	147.4 Å²	147.4	79%	0.794	84%	0.841	S	S	*	*			trans	125.4	67.2	161	0	0	0	0	0	117.1
17	A	28.5	Very low	33.2	Very low	107 Å²	107	150.2 Å²	150.2	88%	0.884	84%	0.844	S	S	*	*			trans	-131.4	103.5	143.1	0	0	0	0	0	108.3
18	L	28	Very low	33.1	Very low	148 Å²	148	155 Å²	155	78%	0.775	85%	0.846	S	S	*	*			trans	-65	134.9	175.2	-96.8	91.6	0	0	0	111.5
19	R	32.2	Very low	33.3	Very low	231 Å²	231	155.6 Å²	155.6	87%	0.872	85%	0.845	S	S	*	*				54.6	96.6	116.8	-139.3	179	-161.6	170.4	4.3	117
20	A	29.5	Very low	34.3	Very low	89 Å²	89	154.1 Å²	154.1	74%	0.736	84%	0.842	S	S	*	*			trans	170.5	99.6	131.3	0	0	0	0	0	111.3
21	H	28.9	Very low	35.8	Very low	188 Å²	188	150.5 Å²	150.5	87%	0.87	83%	0.83	S	S	*	*				173.3	115.2	121.3	-111	-77.2	0	0	0	109.8
22	N	37.4	Very low	37.6	Very low	149 Å²	149	151.2 Å²	151.2	80%	0.797	83%	0.825	S	S	*	*			trans	-64	132.1	153.6	-87.5	-8.9	0	0	0	108.1
23	E	35.2	Very low	39.8	Very low	190 Å²	190	144 Å²	144	89%	0.888	79%	0.792	S	S	*	*				164.8	144.5	119.5	-89.6	-178.3	171.9	0	0	110.7
24	D	33.6	Very low	42.3	Very low	148 Å²	148	139.7 Å²	139.7	79%	0.791	77%	0.765	S	S	*	*			trans	67.1	96.8	173.9	-85.9	-9.8	0	0	0	120.2
25	L	32.6	Very low	44.7	Very low	173 Å²	173	132.8 Å²	132.8	91%	0.906	73%	0.727	S	S	*	*			trans	-108.2	78.3	157.8	-142.5	89.4	0	0	0	109.2	T27	L25-T27 PolarHBondContact O-N 3.07Å
26	T	36.8	Very low	47.1	Very low	118 Å²	118	130.3 Å²	130.3	72%	0.724	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-73.1	120.1	159.5	52.6	0	0	0	0	108.3	R28	T26-R28 PolarHBondContact O-N 2.99Å
27	T	37	Very low	49.8	Very low	134 Å²	134	131.7 Å²	131.7	82%	0.822	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-54.7	117.2	173.8	45	0	0	0	0	111	L25	L25-T27 PolarHBondContact O-N 3.07Å
28	R	36.8	Very low	52	Low	241 Å²	241	133.5 Å²	133.5	91%	0.909	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-76.4	118.6	167.9	-114.8	176.5	174.3	172.3	-2	108.4	T26 T30	T26-R28 PolarHBondContact O-N 2.99Å; R28-T30 PolarHBondContact O-N 2.95Å
29	E	41.3	Very low	54.6	Low	192 Å²	192	129.2 Å²	129.2	90%	0.897	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-52.9	130	167.4	-70.5	175.1	153.9	0	0	110.2	C31	E29-C31 PolarHBondContact O-N 3.12Å
30	T	54.5	Low	57.2	Low	136 Å²	136	118.9 Å²	118.9	83%	0.834	63%	0.629	S	S	*	*			trans	-70.3	113.7	169.2	46.5	0	0	0	0	108.6	R28 K32	R28-T30 PolarHBondContact O-N 2.95Å; T30-K32 PolarHBondContact O-N 3.08Å
31	C	67.2	Low	59.9	Low	85 Å²	85	119.2 Å²	119.2	57%	0.574	62%	0.623	S	S	*	*			trans	-60.2	132.4	176.5	175.3	0	0	0	0	111.2	E29 C62	E29-C31 PolarHBondContact O-N 3.12Å; C31-C62 HydrophobicContact CB-CB 3.73Å; C31-C62 WeakPolarHBondContact CB-SG 3.47Å; C31-C62 PolarHBondContact O-SG 3.38Å; C31-C62 WeakPolarHBondContact SG-CA 3.37Å; C31-C62 WeakPolarHBondContact SG-CB 3.09Å; C31-C62 CovalentContact SG-SG 2.04Å; C31-C62 PolarHBondContact SG-SG 3.44Å
32	K	71.9	Confident	62.5	Low	189 Å²	189	111.2 Å²	111.2	82%	0.822	59%	0.589	S	S	*	*			trans	-114.2	121.9	174.1	-171.7	179.5	-179.2	-174.9	0	108.9	T30	T30-K32 PolarHBondContact O-N 3.08Å
33	A	77.9	Confident	64.6	Low	30 Å²	30	110.4 Å²	110.4	25%	0.248	58%	0.584	C	S	.	*			trans	-79.5	137.9	178.7	0	0	0	0	0	111.2	F59 S60 W113	A33-F59 HydrophobicContact CB-CZ 4.37Å; A33-S60 VanDerWaalsContact CA-O 3.25Å; A33-S60 WeakPolarHBondContact CA-O 3.46Å; A33-W113 HydrophobicContact CB-CZ2 4.14Å
34	G	83.8	Confident	66.9	Low	15 Å²	15	102 Å²	102	16%	0.155	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.5	165.7	-177.6	0	0	0	0	0	113.7	F59 S60	G34-F59 VanDerWaalsContact C-CD2 3.41Å; G34-S60 PolarHBondContact N-O 2.77Å; G34-S60 PolarHBondContact O-N 3.49Å; G34-S60 PolarHBondContact O-OG 2.79Å
35	F	86.1	Confident	69.1	Low	25 Å²	25	97.7 Å²	97.7	11%	0.11	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	151.5	168.2	-72.2	-77.2	0	0	0	110.5	E37 Y40 V57 K58 F59 Y70 V102 A104 W113 A115	F35-E37 VanDerWaalsContact C-N 3.26Å; F35-E37 WeakPolarHBondContact CB-O 3.2Å; F35-E37 PolarHBondContact O-N 2.84Å; F35-Y40 HydrophobicContact CB-CE2 4.45Å; F35-Y40 HydrophobicContact CD1-CE2 4.44Å; F35-V57 HydrophobicContact CD1-CB 4.29Å; F35-V57 HydrophobicContact CD1-CG2 4.49Å; F35-V57 HydrophobicContact CE1-CB 4.09Å; F35-V57 HydrophobicContact CE1-CG2 3.83Å; F35-K58 CarbonylContact C-O 3.28Å; F35-K58 WeakPolarHBondContact CA-O 3.24Å; F35-F59 HydrophobicContact CD1-CB 3.96Å; F35-F59 HydrophobicContact CD1-CD2 4.02Å; F35-F59 HydrophobicContact CD1-CG 4.5Å; F35-F59 HydrophobicContact CD2-CD2 4.08Å; F35-F59 HydrophobicContact CE1-CB 4.02Å; F35-F59 HydrophobicContact CE1-CD2 4.16Å; F35-F59 HydrophobicContact CE2-CD2 4.24Å; F35-F59 AromaticContact CG-CD2 3.98Å; F35-F59 HydrophobicContact CG-CD2 3.98Å; F35-F59 HydrophobicContact CZ-CD2 4.28Å; F35-Y70 HydrophobicContact CE1-CD1 4.4Å; F35-Y70 AromaticContact CE1-CE1 3.95Å; F35-Y70 HydrophobicContact CE1-CE1 3.95Å; F35-Y70 HydrophobicContact CZ-CD1 4.41Å; F35-Y70 HydrophobicContact CZ-CE1 4.27Å; F35-V102 HydrophobicContact CZ-CG1 4.49Å; F35-A104 HydrophobicContact CE1-CB 4.31Å; F35-A104 HydrophobicContact CE2-CB 3.9Å; F35-A104 HydrophobicContact CZ-CB 3.53Å; F35-W113 HydrophobicContact CD2-CB 4.15Å; F35-W113 HydrophobicContact CE2-CB 4.03Å; F35-W113 WeakPolarHBondContact CE2-O 3.37Å; F35-A115 HydrophobicContact CB-CB 4.29Å; F35-A115 HydrophobicContact CD1-CB 4.14Å; F35-A115 HydrophobicContact CD2-CB 3.63Å; F35-A115 HydrophobicContact CE1-CB 4.37Å; F35-A115 HydrophobicContact CE2-CB 3.86Å; F35-A115 HydrophobicContact CG-CB 3.77Å; F35-A115 HydrophobicContact CZ-CB 4.23Å
36	S	83.8	Confident	71.3	Confident	71 Å²	71	94 Å²	94	50%	0.497	50%	0.504	S	S	.	.	S	Bend	trans	-72.4	-21.5	178.1	60.8	0	0	0	0	113.7	Y40 K58	S36-Y40 PolarHBondContact N-OH 3.27Å; S36-Y40 PolarHBondContact OG-OH 2.75Å; S36-K58 PolarHBondContact N-O 2.76Å; S36-K58 WeakPolarHBondContact OG-CB 3.49Å
37	E	82.3	Confident	73.5	Confident	106 Å²	106	92.6 Å²	92.6	50%	0.495	49%	0.492	S	S	.	.			trans	-142.7	145.8	-178.5	-64.1	171.5	-154.9	0	0	108.1	F35 Y40	F35-E37 VanDerWaalsContact C-N 3.26Å; F35-E37 WeakPolarHBondContact CB-O 3.2Å; F35-E37 PolarHBondContact O-N 2.84Å; E37-Y40 HydrophobicContact CB-CD2 4.42Å; E37-Y40 HydrophobicContact CB-CE1 4.17Å; E37-Y40 HydrophobicContact CB-CE2 3.99Å; E37-Y40 WeakPolarHBondContact O-CE2 3.45Å
38	D	75.2	Confident	75.7	Confident	145 Å²	145	86.2 Å²	86.2	78%	0.775	45%	0.453	S	S	*	.	S	Bend	trans	-81.9	-23.7	177.8	-64.6	-35.6	0	0	0	112.3	V116	D38-V116 PolarHBondContact O-N 2.96Å; D38-V116 VanDerWaalsContact O-N 3.1Å
39	D	82.5	Confident	78	Confident	58 Å²	58	79.7 Å²	79.7	31%	0.31	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	124.7	178.5	-161.3	-19.5	0	0	0	110.7	V116 R118	D39-V116 CarbonylContact C-O 3.59Å; D39-V116 WeakPolarHBondContact CA-O 3.37Å; D39-R118 IonicContact OD1-NE 3.26Å; D39-R118 WeakPolarHBondContact OD2-CD 3.36Å; D39-R118 IonicContact OD2-CZ 3.28Å; D39-R118 IonicContact OD2-NE 2.9Å; D39-R118 PolarHBondContact OD2-NE 3.34Å; D39-R118 IonicContact OD2-NH2 3.99Å
40	Y	86.1	Confident	80.1	Confident	15 Å²	15	77.5 Å²	77.5	6%	0.059	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	114.3	179	-70.7	-96.4	0	0	0	110.5	F35 S36 E37 V57 K58 A115 V116 V117 R118	F35-Y40 HydrophobicContact CB-CE2 4.45Å; F35-Y40 HydrophobicContact CD1-CE2 4.44Å; S36-Y40 PolarHBondContact N-OH 3.27Å; S36-Y40 PolarHBondContact OG-OH 2.75Å; E37-Y40 HydrophobicContact CB-CD2 4.42Å; E37-Y40 HydrophobicContact CB-CE1 4.17Å; E37-Y40 HydrophobicContact CB-CE2 3.99Å; E37-Y40 WeakPolarHBondContact O-CE2 3.45Å; Y40-V57 HydrophobicContact CD1-CG1 4.26Å; Y40-V57 HydrophobicContact CD2-CB 4.37Å; Y40-V57 HydrophobicContact CD2-CG1 3.76Å; Y40-V57 HydrophobicContact CE1-CB 4.34Å; Y40-V57 HydrophobicContact CE1-CG1 4.43Å; Y40-V57 HydrophobicContact CE2-CB 4.06Å; Y40-V57 HydrophobicContact CE2-CG1 3.96Å; Y40-V57 HydrophobicContact CG-CG1 3.91Å; Y40-K58 PolarHBondContact OH-N 3.48Å; Y40-K58 VanDerWaalsContact OH-N 3.1Å; Y40-K58 PolarHBondContact OH-O 2.78Å; Y40-A115 HydrophobicContact CD2-CB 4.19Å; Y40-A115 HydrophobicContact CE2-CB 4.02Å; Y40-V116 PolarHBondContact N-O 2.99Å; Y40-V117 CarbonylContact O-C 3.56Å; Y40-V117 WeakPolarHBondContact O-CA 3.28Å; Y40-R118 PolarHBondContact O-N 3.13Å
41	T	86.6	Confident	81.4	Confident	96 Å²	96	72.8 Å²	72.8	59%	0.589	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.6	179.3	56.5	0	0	0	0	112.2	R118	T41-R118 CarbonylContact C-O 3.53Å; T41-R118 VanDerWaalsContact CA-O 3.29Å; T41-R118 WeakPolarHBondContact CA-O 3.44Å; T41-R118 HydrophobicContact CG2-CB 4.12Å
42	A	84.2	Confident	82.3	Confident	19 Å²	19	72.1 Å²	72.1	16%	0.157	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	144	171.9	0	0	0	0	0	112.6	L55 R118 L119 L120	A42-L55 HydrophobicContact CB-CB 4Å; A42-L55 HydrophobicContact CB-CD2 3.66Å; A42-L55 HydrophobicContact CB-CG 4.46Å; A42-R118 PolarHBondContact N-O 3Å; A42-L119 HydrophobicContact CB-CD2 4.04Å; A42-L119 WeakPolarHBondContact O-CA 3.41Å; A42-L120 PolarHBondContact O-N 3.25Å
43	L	82.2	Confident	83.1	Confident	132 Å²	132	68.5 Å²	68.5	69%	0.691	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.8	174	-76.6	159	0	0	0	110.1	L120 A122	L43-L120 CarbonylContact C-O 3.5Å; L43-L120 WeakPolarHBondContact CA-O 3.39Å; L43-L120 HydrophobicContact CD2-CB 3.98Å; L43-A122 HydrophobicContact CD2-CB 4.43Å
44	I	83.1	Confident	83.6	Confident	14 Å²	14	68.2 Å²	68.2	7%	0.072	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	159.6	-176.4	57.7	156.4	0	0	0	111.6	I48 L54 V93 L119 L120 V121 A122	I44-I48 HydrophobicContact CD1-CD1 3.47Å; I44-I48 VanDerWaalsContact CD1-CD1 3.47Å; I44-I48 HydrophobicContact CD1-CG1 4.11Å; I44-L54 HydrophobicContact CG2-CD2 4.03Å; I44-V93 HydrophobicContact CD1-CB 4.37Å; I44-V93 HydrophobicContact CD1-CG1 4.22Å; I44-V93 HydrophobicContact CD1-CG2 3.8Å; I44-L119 HydrophobicContact CD1-CB 3.62Å; I44-L119 HydrophobicContact CD1-CD1 4.17Å; I44-L119 HydrophobicContact CD1-CG 4.48Å; I44-L119 HydrophobicContact CG1-CB 3.95Å; I44-L119 HydrophobicContact CG2-CB 4.37Å; I44-L119 HydrophobicContact CG2-CD2 4.06Å; I44-L120 WeakPolarHBondContact CG1-O 3.14Å; I44-L120 PolarHBondContact N-O 2.74Å; I44-V121 WeakPolarHBondContact O-CA 3.44Å; I44-A122 PolarHBondContact O-N 3.48Å
45	S	79.1	Confident	83.9	Confident	58 Å²	58	68.5 Å²	68.5	41%	0.406	37%	0.369	S	S	.	.			trans	-73.6	156	168.8	47	0	0	0	0	111.4	N47	S45-N47 PolarHBondContact O-N 2.9Å; S45-N47 PolarHBondContact OG-O 2.88Å
46	Q	79.6	Confident	84.1	Confident	95 Å²	95	71.3 Å²	71.3	44%	0.444	38%	0.382	S	S	.	.	S	Bend	trans	-61.6	-26.2	178.8	-167.3	173.3	12.9	0	0	113.2	V93 V121	Q46-V93 PolarHBondContact O-N 2.85Å; Q46-V121 HydrophobicContact CB-CG1 3.87Å; Q46-V121 HydrophobicContact CG-CG1 4.3Å
47	N	82.3	Confident	84.3	Confident	88 Å²	88	68 Å²	68	47%	0.471	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.5	174.4	-60.7	-15.5	0	0	0	108.4	S45	S45-N47 PolarHBondContact O-N 2.9Å; S45-N47 PolarHBondContact OG-O 2.88Å
48	I	84.1	Confident	84.5	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.1	175.2	-56.7	177.9	0	0	0	108.5	I44 E52 L54 F77 A87 E90 L91 V93	I44-I48 HydrophobicContact CD1-CD1 3.47Å; I44-I48 VanDerWaalsContact CD1-CD1 3.47Å; I44-I48 HydrophobicContact CD1-CG1 4.11Å; I48-E52 WeakPolarHBondContact CA-OE2 3.39Å; I48-E52 HydrophobicContact CG2-CB 3.96Å; I48-E52 HydrophobicContact CG2-CG 4.45Å; I48-L54 HydrophobicContact CD1-CD1 4.17Å; I48-L54 HydrophobicContact CD1-CD2 3.96Å; I48-L54 HydrophobicContact CG1-CD2 4.38Å; I48-L54 HydrophobicContact CG2-CD2 3.83Å; I48-F77 HydrophobicContact CD1-CE1 4.4Å; I48-A87 HydrophobicContact CG2-CB 3.51Å; I48-E90 WeakPolarHBondContact O-CA 3.2Å; I48-L91 HydrophobicContact CB-CB 4.47Å; I48-L91 PolarHBondContact N-O 2.88Å; I48-L91 PolarHBondContact O-N 2.87Å; I48-V93 HydrophobicContact CD1-CG2 3.77Å; I48-V93 HydrophobicContact CG1-CG2 4.13Å
49	L	84.6	Confident	84.9	Confident	105 Å²	105	63.6 Å²	63.6	55%	0.55	33%	0.331	S	S	.	.			trans	-83.6	151.2	178.4	-62.1	175.1	0	0	0	111.6	G51 E52	L49-G51 PolarHBondContact O-N 2.86Å; L49-E52 PolarHBondContact N-OE2 3.21Å; L49-E52 WeakPolarHBondContact O-CB 3.5Å; L49-E52 PolarHBondContact O-N 2.74Å; L49-E52 VanDerWaalsContact O-N 3.08Å
50	E	85.4	Confident	84.8	Confident	146 Å²	146	63.9 Å²	63.9	68%	0.682	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	125.6	174.1	-176.8	176.8	166	0	0	111
51	G	81.9	Confident	84.2	Confident	37 Å²	37	64.2 Å²	64.2	38%	0.381	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	3	-178.7	0	0	0	0	0	115.5	L49 A87	L49-G51 PolarHBondContact O-N 2.86Å; G51-A87 WeakPolarHBondContact CA-O 3.45Å; G51-A87 PolarHBondContact N-O 3.1Å
52	E	86.4	Confident	83.4	Confident	70 Å²	70	62.5 Å²	62.5	33%	0.327	33%	0.334	S	S	.	.			trans	-64.3	134.9	175.5	-172.3	169.8	179.1	0	0	111.5	I48 L49 L54 F86 A87	I48-E52 WeakPolarHBondContact CA-OE2 3.39Å; I48-E52 HydrophobicContact CG2-CB 3.96Å; I48-E52 HydrophobicContact CG2-CG 4.45Å; L49-E52 PolarHBondContact N-OE2 3.21Å; L49-E52 WeakPolarHBondContact O-CB 3.5Å; L49-E52 PolarHBondContact O-N 2.74Å; L49-E52 VanDerWaalsContact O-N 3.08Å; E52-L54 HydrophobicContact CG-CD2 4.35Å; E52-F86 VanDerWaalsContact O-CA 3.27Å; E52-F86 WeakPolarHBondContact O-CA 3.41Å; E52-A87 PolarHBondContact O-N 2.99Å
53	K	88.6	Confident	82.5	Confident	113 Å²	113	67.3 Å²	67.3	49%	0.491	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	121.3	176.9	172	168.5	177.8	145.4	0	109.2	T84 F86	K53-T84 HydrophobicContact CB-CG2 4.39Å; K53-T84 HydrophobicContact CD-CG2 3.47Å; K53-T84 VanDerWaalsContact CD-CG2 3.47Å; K53-T84 VanDerWaalsContact CE-CG2 3.41Å; K53-T84 HydrophobicContact CG-CG2 3.49Å; K53-T84 VanDerWaalsContact CG-CG2 3.49Å; K53-T84 PolarHBondContact NZ-OG1 3Å; K53-F86 HydrophobicContact CB-CD1 4.12Å; K53-F86 HydrophobicContact CB-CE1 3.98Å; K53-F86 HydrophobicContact CG-CE1 4.48Å
54	L	87.8	Confident	81.5	Confident	24 Å²	24	62.9 Å²	62.9	13%	0.126	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-57	-172.9	-57.9	174.4	0	0	0	112	I44 I48 E52 F77 V85 L119	I44-L54 HydrophobicContact CG2-CD2 4.03Å; I48-L54 HydrophobicContact CD1-CD1 4.17Å; I48-L54 HydrophobicContact CD1-CD2 3.96Å; I48-L54 HydrophobicContact CG1-CD2 4.38Å; I48-L54 HydrophobicContact CG2-CD2 3.83Å; E52-L54 HydrophobicContact CG-CD2 4.35Å; L54-F77 HydrophobicContact CD1-CD1 3.62Å; L54-F77 HydrophobicContact CD1-CE1 3.46Å; L54-F77 VanDerWaalsContact CD1-CE1 3.46Å; L54-V85 PolarHBondContact N-O 3.29Å; L54-L119 HydrophobicContact CB-CD2 4.42Å; L54-L119 HydrophobicContact CD1-CD1 3.75Å
55	L	90.9	Very high	80.3	Confident	21 Å²	21	67 Å²	67	11%	0.11	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	176.3	176.2	68.2	78.1	0	0	0	111.1	A42 V57 V85 V117 L119	A42-L55 HydrophobicContact CB-CB 4Å; A42-L55 HydrophobicContact CB-CD2 3.66Å; A42-L55 HydrophobicContact CB-CG 4.46Å; L55-V57 HydrophobicContact CD1-CG1 3.78Å; L55-V85 HydrophobicContact CD1-CG2 4.01Å; L55-V85 PolarHBondContact O-N 3.34Å; L55-V117 HydrophobicContact CD1-CG1 4.48Å; L55-V117 HydrophobicContact CD1-CG2 4.29Å; L55-V117 HydrophobicContact CD2-CG1 3.59Å; L55-V117 HydrophobicContact CG-CG1 4.28Å; L55-L119 HydrophobicContact CD2-CD2 4.04Å
56	Q	89.6	Confident	79.3	Confident	84 Å²	84	73.8 Å²	73.8	39%	0.393	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	120.7	175.4	-177	171	9.2	0	0	110.6	D82 G83	Q56-D82 PolarHBondContact NE2-O 3.35Å; Q56-G83 WeakPolarHBondContact CA-O 3.4Å
57	V	88.3	Confident	78.4	Confident	1 Å²	1	70.6 Å²	70.6	1%	0.006	39%	0.388	C	S	.	.			trans	-81.1	139.1	172.6	-60.6	0	0	0	0	109.6	F35 Y40 L55 Y70 G83 V102 V117	F35-V57 HydrophobicContact CD1-CB 4.29Å; F35-V57 HydrophobicContact CD1-CG2 4.49Å; F35-V57 HydrophobicContact CE1-CB 4.09Å; F35-V57 HydrophobicContact CE1-CG2 3.83Å; Y40-V57 HydrophobicContact CD1-CG1 4.26Å; Y40-V57 HydrophobicContact CD2-CB 4.37Å; Y40-V57 HydrophobicContact CD2-CG1 3.76Å; Y40-V57 HydrophobicContact CE1-CB 4.34Å; Y40-V57 HydrophobicContact CE1-CG1 4.43Å; Y40-V57 HydrophobicContact CE2-CB 4.06Å; Y40-V57 HydrophobicContact CE2-CG1 3.96Å; Y40-V57 HydrophobicContact CG-CG1 3.91Å; L55-V57 HydrophobicContact CD1-CG1 3.78Å; V57-Y70 HydrophobicContact CG2-CD1 4.49Å; V57-Y70 HydrophobicContact CG2-CE1 4.38Å; V57-G83 VanDerWaalsContact CG2-O 3.31Å; V57-G83 WeakPolarHBondContact CG2-O 3.12Å; V57-G83 PolarHBondContact N-O 3.17Å; V57-V102 HydrophobicContact CG2-CG1 4.01Å; V57-V117 HydrophobicContact CG1-CG2 3.98Å
58	K	86.3	Confident	77.9	Confident	143 Å²	143	67 Å²	67	62%	0.622	37%	0.369	S	S	*	.			trans	-109	120.5	179.8	-70	178.6	-176.7	170.2	0	109.7	F35 S36 Y40	F35-K58 CarbonylContact C-O 3.28Å; F35-K58 WeakPolarHBondContact CA-O 3.24Å; S36-K58 PolarHBondContact N-O 2.76Å; S36-K58 WeakPolarHBondContact OG-CB 3.49Å; Y40-K58 PolarHBondContact OH-N 3.48Å; Y40-K58 VanDerWaalsContact OH-N 3.1Å; Y40-K58 PolarHBondContact OH-O 2.78Å
59	F	83.5	Confident	77.8	Confident	16 Å²	16	72.5 Å²	72.5	7%	0.07	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	132.5	176.1	-176.7	-98.4	0	0	0	110.3	A33 G34 F35 T68 Y70 A104 W113	A33-F59 HydrophobicContact CB-CZ 4.37Å; G34-F59 VanDerWaalsContact C-CD2 3.41Å; F35-F59 HydrophobicContact CD1-CB 3.96Å; F35-F59 HydrophobicContact CD1-CD2 4.02Å; F35-F59 HydrophobicContact CD1-CG 4.5Å; F35-F59 HydrophobicContact CD2-CD2 4.08Å; F35-F59 HydrophobicContact CE1-CB 4.02Å; F35-F59 HydrophobicContact CE1-CD2 4.16Å; F35-F59 HydrophobicContact CE2-CD2 4.24Å; F35-F59 AromaticContact CG-CD2 3.98Å; F35-F59 HydrophobicContact CG-CD2 3.98Å; F35-F59 HydrophobicContact CZ-CD2 4.28Å; F59-T68 HydrophobicContact CD1-CG2 3.78Å; F59-T68 HydrophobicContact CE1-CG2 3.85Å; F59-Y70 HydrophobicContact CB-CE1 4Å; F59-Y70 VanDerWaalsContact CB-OH 3.3Å; F59-Y70 WeakPolarHBondContact CB-OH 3.42Å; F59-A104 HydrophobicContact CD2-CB 3.83Å; F59-A104 HydrophobicContact CE2-CB 3.92Å; F59-A104 HydrophobicContact CG-CB 4.15Å; F59-A104 HydrophobicContact CZ-CB 4.3Å; F59-W113 HydrophobicContact CE2-CB 3.91Å; F59-W113 AromaticContact CE2-CD2 3.79Å; F59-W113 HydrophobicContact CE2-CD2 3.79Å; F59-W113 AromaticContact CE2-CE3 3.87Å; F59-W113 HydrophobicContact CE2-CE3 3.87Å; F59-W113 AromaticContact CE2-CG 3.81Å; F59-W113 HydrophobicContact CE2-CG 3.81Å; F59-W113 AromaticContact CZ-CD2 3.76Å; F59-W113 HydrophobicContact CZ-CD2 3.76Å; F59-W113 AromaticContact CZ-CE3 3.52Å; F59-W113 HydrophobicContact CZ-CE3 3.52Å; F59-W113 HydrophobicContact CZ-CG 4.29Å; F59-W113 HydrophobicContact CZ-CH2 4.45Å; F59-W113 AromaticContact CZ-CZ3 3.91Å; F59-W113 HydrophobicContact CZ-CZ3 3.91Å
60	S	81.6	Confident	77.9	Confident	64 Å²	64	68.9 Å²	68.9	45%	0.448	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	119.4	176.1	60.4	0	0	0	0	109.6	A33 G34	A33-S60 VanDerWaalsContact CA-O 3.25Å; A33-S60 WeakPolarHBondContact CA-O 3.46Å; G34-S60 PolarHBondContact N-O 2.77Å; G34-S60 PolarHBondContact O-N 3.49Å; G34-S60 PolarHBondContact O-OG 2.79Å
61	S	73.1	Confident	78	Confident	22 Å²	22	66.9 Å²	66.9	15%	0.154	37%	0.365	C	S	.	.			trans	-109.2	139.4	174.2	171.3	0	0	0	0	110.1	V63 G64	S61-V63 PolarHBondContact O-N 2.83Å; S61-V63 PolarHBondContact OG-N 2.95Å; S61-G64 PolarHBondContact O-N 3.13Å
62	C	69.9	Low	78.3	Confident	61 Å²	61	66.9 Å²	66.9	41%	0.412	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-13.2	179.5	-61.7	0	0	0	0	114.6	C31	C31-C62 HydrophobicContact CB-CB 3.73Å; C31-C62 WeakPolarHBondContact CB-SG 3.47Å; C31-C62 PolarHBondContact O-SG 3.38Å; C31-C62 WeakPolarHBondContact SG-CA 3.37Å; C31-C62 WeakPolarHBondContact SG-CB 3.09Å; C31-C62 CovalentContact SG-SG 2.04Å; C31-C62 PolarHBondContact SG-SG 3.44Å
63	V	63.8	Low	78.3	Confident	120 Å²	120	68.8 Å²	68.8	73%	0.727	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	2.4	178.6	-167	0	0	0	0	111.2	S61	S61-V63 PolarHBondContact O-N 2.83Å; S61-V63 PolarHBondContact OG-N 2.95Å
64	G	61.3	Low	78.2	Confident	38 Å²	38	64.6 Å²	64.6	39%	0.392	36%	0.355	S	S	.	.			trans	87	160.2	-173.9	0	0	0	0	0	112.9	S61 K66	S61-G64 PolarHBondContact O-N 3.13Å; G64-K66 PolarHBondContact O-N 3.35Å
65	T	58	Low	78	Confident	101 Å²	101	68.7 Å²	68.7	62%	0.62	38%	0.38	S	S	*	.	S	Bend	trans	-70.7	2.5	-170.7	53.6	0	0	0	0	115.4	G67	T65-G67 PolarHBondContact O-N 3.36Å
66	K	58.6	Low	77.8	Confident	200 Å²	200	69.8 Å²	69.8	87%	0.87	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	78.1	179.2	-75.3	-173.5	176.7	-179.7	0	110.4	G64	G64-K66 PolarHBondContact O-N 3.35Å
67	G	61.2	Low	77.8	Confident	28 Å²	28	66.3 Å²	66.3	29%	0.289	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	152.6	-14.1	175.7	0	0	0	0	0	115.3	T65 S107	T65-G67 PolarHBondContact O-N 3.36Å; G67-S107 PolarHBondContact O-OG 3.43Å; G67-S107 VanDerWaalsContact O-OG 3.06Å
68	T	72.1	Confident	77.9	Confident	12 Å²	12	71.4 Å²	71.4	7%	0.074	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	123.3	176.5	-46.1	0	0	0	0	110.4	F59 Y70 A104 W105	F59-T68 HydrophobicContact CD1-CG2 3.78Å; F59-T68 HydrophobicContact CE1-CG2 3.85Å; T68-Y70 HydrophobicContact CG2-CE1 4.44Å; T68-A104 HydrophobicContact CG2-CB 3.9Å; T68-W105 WeakPolarHBondContact CA-O 3.27Å
69	Q	80.3	Confident	78.2	Confident	117 Å²	117	65.8 Å²	65.8	55%	0.547	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	147.3	172	-69.2	-174.8	-22.7	0	0	109.5	A104 W105	Q69-A104 WeakPolarHBondContact O-CA 3.05Å; Q69-W105 PolarHBondContact N-O 3.01Å; Q69-W105 PolarHBondContact O-N 2.65Å
70	Y	87.6	Confident	78.2	Confident	29 Å²	29	65.9 Å²	65.9	11%	0.114	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	134.4	177.6	-59.9	-84.3	0	0	0	110.1	F35 V57 F59 T68 V79 G80 V102 T103 A104	F35-Y70 HydrophobicContact CE1-CD1 4.4Å; F35-Y70 AromaticContact CE1-CE1 3.95Å; F35-Y70 HydrophobicContact CE1-CE1 3.95Å; F35-Y70 HydrophobicContact CZ-CD1 4.41Å; F35-Y70 HydrophobicContact CZ-CE1 4.27Å; V57-Y70 HydrophobicContact CG2-CD1 4.49Å; V57-Y70 HydrophobicContact CG2-CE1 4.38Å; F59-Y70 HydrophobicContact CB-CE1 4Å; F59-Y70 VanDerWaalsContact CB-OH 3.3Å; F59-Y70 WeakPolarHBondContact CB-OH 3.42Å; T68-Y70 HydrophobicContact CG2-CE1 4.44Å; Y70-V79 HydrophobicContact CG-CG1 4.05Å; Y70-G80 WeakPolarHBondContact CD2-O 3.34Å; Y70-V102 HydrophobicContact CD1-CG1 4.23Å; Y70-T103 CarbonylContact C-O 3.5Å; Y70-T103 WeakPolarHBondContact CA-O 3.38Å; Y70-A104 HydrophobicContact CD1-CB 3.98Å; Y70-A104 HydrophobicContact CE1-CB 3.88Å
71	E	86.6	Confident	78.2	Confident	104 Å²	104	68.4 Å²	68.4	49%	0.486	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	159.6	173.3	-67.2	-175.3	167.3	0	0	109.6	V102 T103	E71-V102 CarbonylContact O-C 3.5Å; E71-V102 WeakPolarHBondContact O-CA 3.47Å; E71-T103 PolarHBondContact N-O 2.76Å; E71-T103 PolarHBondContact O-N 2.81Å
72	T	89.6	Confident	78.6	Confident	36 Å²	36	71 Å²	71	22%	0.221	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	147.5	175.1	171.5	0	0	0	0	109.5	S74 F77 V79 F100 T101	T72-S74 VanDerWaalsContact C-N 3.27Å; T72-S74 PolarHBondContact OG1-N 2.97Å; T72-F77 WeakPolarHBondContact CG2-O 3.27Å; T72-V79 HydrophobicContact CG2-CG2 4.09Å; T72-F100 WeakPolarHBondContact OG1-CD2 3.15Å; T72-T101 WeakPolarHBondContact CA-O 3.23Å; T72-T101 PolarHBondContact OG1-O 3Å
73	N	87.1	Confident	79.2	Confident	110 Å²	110	68 Å²	68	59%	0.588	39%	0.385	S	S	*	.	S	Bend	trans	-80.6	-6.5	177.1	70.3	-15.6	0	0	0	113.3	F100 T101	N73-F100 WeakPolarHBondContact OD1-CB 3.15Å; N73-T101 PolarHBondContact N-O 2.97Å; N73-T101 PolarHBondContact ND2-OG1 3.21Å; N73-T101 PolarHBondContact OD1-N 3.14Å; N73-T101 PolarHBondContact OD1-O 2.94Å; N73-T101 PolarHBondContact OD1-OG1 2.69Å
74	S	85.5	Confident	80.5	Confident	26 Å²	26	62.4 Å²	62.4	18%	0.182	35%	0.351	C	S	.	.			trans	-100	136.1	-179.8	-179.7	0	0	0	0	112.4	T72 D76 F77	T72-S74 VanDerWaalsContact C-N 3.27Å; T72-S74 PolarHBondContact OG1-N 2.97Å; S74-D76 VanDerWaalsContact C-N 3.26Å; S74-D76 PolarHBondContact O-N 2.8Å; S74-D76 PolarHBondContact OG-N 2.89Å; S74-F77 WeakPolarHBondContact OG-CD2 3.38Å
75	V	84.6	Confident	81.9	Confident	110 Å²	110	60.6 Å²	60.6	67%	0.667	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-15	175.4	-67.9	0	0	0	0	113.3	T88	V75-T88 PolarHBondContact O-OG1 2.87Å
76	D	86.6	Confident	83.4	Confident	43 Å²	43	58.4 Å²	58.4	23%	0.23	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-11.5	-174.6	-65.3	-34.4	0	0	0	113	S74 T88 R89 L91	S74-D76 VanDerWaalsContact C-N 3.26Å; S74-D76 PolarHBondContact O-N 2.8Å; S74-D76 PolarHBondContact OG-N 2.89Å; D76-T88 VanDerWaalsContact CA-OG1 3.31Å; D76-T88 WeakPolarHBondContact CA-OG1 3.41Å; D76-T88 PolarHBondContact O-N 2.97Å; D76-T88 PolarHBondContact O-OG1 2.85Å; D76-R89 IonicContact OD1-CZ 3.75Å; D76-R89 IonicContact OD1-NE 2.84Å; D76-R89 PolarHBondContact OD1-NE 2.88Å; D76-R89 IonicContact OD1-NH2 3.83Å; D76-R89 PolarHBondContact OD1-NH2 3.19Å; D76-L91 HydrophobicContact CB-CD1 3.76Å; D76-L91 HydrophobicContact CB-CD2 3.65Å; D76-L91 HydrophobicContact CB-CG 4.35Å; D76-L91 VanDerWaalsContact CG-CD2 3.45Å; D76-L91 WeakPolarHBondContact O-CD1 3.46Å
77	F	89.4	Confident	84.9	Confident	11 Å²	11	48.9 Å²	48.9	5%	0.048	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	149.5	-177.1	-54.9	-72.3	0	0	0	111.1	I48 L54 T72 S74 V85 F86 L91 V98 F100 L119	I48-F77 HydrophobicContact CD1-CE1 4.4Å; L54-F77 HydrophobicContact CD1-CD1 3.62Å; L54-F77 HydrophobicContact CD1-CE1 3.46Å; L54-F77 VanDerWaalsContact CD1-CE1 3.46Å; T72-F77 WeakPolarHBondContact CG2-O 3.27Å; S74-F77 WeakPolarHBondContact OG-CD2 3.38Å; F77-V85 HydrophobicContact CB-CG1 3.98Å; F77-V85 HydrophobicContact CG-CG1 4.49Å; F77-F86 CarbonylContact C-O 3.58Å; F77-F86 VanDerWaalsContact CA-O 3.27Å; F77-F86 WeakPolarHBondContact CA-O 3.37Å; F77-L91 HydrophobicContact CE1-CD1 4.12Å; F77-L91 HydrophobicContact CZ-CD1 4.34Å; F77-V98 HydrophobicContact CE2-CG1 3.92Å; F77-V98 HydrophobicContact CZ-CG1 4.18Å; F77-F100 HydrophobicContact CB-CE2 4.17Å; F77-F100 HydrophobicContact CB-CZ 4.13Å; F77-F100 HydrophobicContact CD1-CE1 4.32Å; F77-F100 HydrophobicContact CD1-CZ 4.34Å; F77-F100 AromaticContact CD2-CD1 3.48Å; F77-F100 HydrophobicContact CD2-CD1 3.48Å; F77-F100 VanDerWaalsContact CD2-CD1 3.48Å; F77-F100 HydrophobicContact CD2-CD2 4.34Å; F77-F100 AromaticContact CD2-CE1 3.36Å; F77-F100 HydrophobicContact CD2-CE1 3.36Å; F77-F100 HydrophobicContact CD2-CE2 4.25Å; F77-F100 AromaticContact CD2-CG 3.99Å; F77-F100 HydrophobicContact CD2-CG 3.99Å; F77-F100 AromaticContact CD2-CZ 3.78Å; F77-F100 HydrophobicContact CD2-CZ 3.78Å; F77-F100 HydrophobicContact CE1-CE1 4.41Å; F77-F100 AromaticContact CE2-CD1 3.57Å; F77-F100 HydrophobicContact CE2-CD1 3.57Å; F77-F100 AromaticContact CE2-CE1 3.48Å; F77-F100 HydrophobicContact CE2-CE1 3.48Å; F77-F100 VanDerWaalsContact CE2-CE1 3.48Å; F77-F100 HydrophobicContact CE2-CG 4.45Å; F77-F100 HydrophobicContact CE2-CZ 4.31Å; F77-F100 HydrophobicContact CG-CD1 4.33Å; F77-F100 AromaticContact CG-CE1 3.82Å; F77-F100 HydrophobicContact CG-CE1 3.82Å; F77-F100 HydrophobicContact CG-CE2 4.29Å; F77-F100 AromaticContact CG-CZ 3.8Å; F77-F100 HydrophobicContact CG-CZ 3.8Å; F77-F100 HydrophobicContact CZ-CD1 4.47Å; F77-F100 HydrophobicContact CZ-CE1 4.02Å; F77-L119 HydrophobicContact CE1-CD1 3.98Å; F77-L119 HydrophobicContact CZ-CD1 3.94Å
78	K	90.5	Very high	86	Confident	109 Å²	109	49.6 Å²	49.6	47%	0.474	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	144.1	172.8	64.5	-179.2	-179.7	-172.4	0	109.3	F86 T88	K78-F86 HydrophobicContact CD-CB 4.44Å; K78-F86 HydrophobicContact CG-CB 3.81Å; K78-F86 HydrophobicContact CG-CD2 4.43Å; K78-F86 PolarHBondContact N-O 2.99Å; K78-F86 PolarHBondContact O-N 3.48Å; K78-T88 HydrophobicContact CB-CG2 3.71Å; K78-T88 HydrophobicContact CD-CG2 4.23Å; K78-T88 HydrophobicContact CG-CG2 3.94Å
79	V	91	Very high	86.4	Confident	24 Å²	24	54.8 Å²	54.8	15%	0.145	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.6	178.6	-165.8	0	0	0	0	109.2	Y70 T72 T84 V85 V102	Y70-V79 HydrophobicContact CG-CG1 4.05Å; T72-V79 HydrophobicContact CG2-CG2 4.09Å; V79-T84 CarbonylContact C-O 3.58Å; V79-T84 WeakPolarHBondContact CA-O 3.39Å; V79-V85 HydrophobicContact CG1-CG2 4.39Å; V79-V85 HydrophobicContact CG2-CG2 4.19Å; V79-V102 HydrophobicContact CG1-CG1 4.2Å; V79-V102 HydrophobicContact CG2-CG1 4.01Å; V79-V102 HydrophobicContact CG2-CG2 3.97Å
80	G	84.3	Confident	86.6	Confident	19 Å²	19	55.8 Å²	55.8	20%	0.196	29%	0.294	C	S	.	.			trans	-71.9	163.9	174	0	0	0	0	0	111.9	Y70 D82 G83 T84	Y70-G80 WeakPolarHBondContact CD2-O 3.34Å; G80-D82 PolarHBondContact O-N 3.15Å; G80-D82 VanDerWaalsContact O-N 3.08Å; G80-G83 PolarHBondContact O-N 3Å; G80-T84 PolarHBondContact N-O 3.3Å
81	S	80.9	Confident	86.2	Confident	116 Å²	116	55.7 Å²	55.7	81%	0.811	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-11.5	177.5	52.6	0	0	0	0	114.2
82	D	81.7	Confident	85.8	Confident	76 Å²	76	58 Å²	58	41%	0.406	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	4.6	175.1	69.5	-29.6	0	0	0	113.3	Q56 G80 T84	Q56-D82 PolarHBondContact NE2-O 3.35Å; G80-D82 PolarHBondContact O-N 3.15Å; G80-D82 VanDerWaalsContact O-N 3.08Å; D82-T84 VanDerWaalsContact C-N 3.31Å; D82-T84 VanDerWaalsContact CG-OG1 3.25Å; D82-T84 VanDerWaalsContact OD1-CB 3.27Å; D82-T84 WeakPolarHBondContact OD1-CB 3.38Å; D82-T84 PolarHBondContact OD1-N 2.91Å; D82-T84 PolarHBondContact OD1-OG1 3.33Å; D82-T84 PolarHBondContact OD2-OG1 2.97Å
83	G	83	Confident	85	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.298	C	S	.	.	S	Bend	trans	79.8	6.9	-175	0	0	0	0	0	114.1	Q56 V57 G80	Q56-G83 WeakPolarHBondContact CA-O 3.4Å; V57-G83 VanDerWaalsContact CG2-O 3.31Å; V57-G83 WeakPolarHBondContact CG2-O 3.12Å; V57-G83 PolarHBondContact N-O 3.17Å; G80-G83 PolarHBondContact O-N 3Å
84	T	90.1	Very high	83.9	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	129.4	176.7	-65.1	0	0	0	0	111	K53 V79 G80 D82 F86	K53-T84 HydrophobicContact CB-CG2 4.39Å; K53-T84 HydrophobicContact CD-CG2 3.47Å; K53-T84 VanDerWaalsContact CD-CG2 3.47Å; K53-T84 VanDerWaalsContact CE-CG2 3.41Å; K53-T84 HydrophobicContact CG-CG2 3.49Å; K53-T84 VanDerWaalsContact CG-CG2 3.49Å; K53-T84 PolarHBondContact NZ-OG1 3Å; V79-T84 CarbonylContact C-O 3.58Å; V79-T84 WeakPolarHBondContact CA-O 3.39Å; G80-T84 PolarHBondContact N-O 3.3Å; D82-T84 VanDerWaalsContact C-N 3.31Å; D82-T84 VanDerWaalsContact CG-OG1 3.25Å; D82-T84 VanDerWaalsContact OD1-CB 3.27Å; D82-T84 WeakPolarHBondContact OD1-CB 3.38Å; D82-T84 PolarHBondContact OD1-N 2.91Å; D82-T84 PolarHBondContact OD1-OG1 3.33Å; D82-T84 PolarHBondContact OD2-OG1 2.97Å; T84-F86 HydrophobicContact CG2-CD1 4.43Å; T84-F86 HydrophobicContact CG2-CD2 4.17Å; T84-F86 HydrophobicContact CG2-CE1 3.85Å; T84-F86 HydrophobicContact CG2-CE2 3.54Å; T84-F86 HydrophobicContact CG2-CZ 3.36Å; T84-F86 WeakPolarHBondContact O-CD2 3.46Å; T84-F86 WeakPolarHBondContact O-CE2 3.43Å
85	V	90.9	Very high	82.7	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.006	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131	177	-170.4	0	0	0	0	111.1	L54 L55 F77 V79 F100 V102	L54-V85 PolarHBondContact N-O 3.29Å; L55-V85 HydrophobicContact CD1-CG2 4.01Å; L55-V85 PolarHBondContact O-N 3.34Å; F77-V85 HydrophobicContact CB-CG1 3.98Å; F77-V85 HydrophobicContact CG-CG1 4.49Å; V79-V85 HydrophobicContact CG1-CG2 4.39Å; V79-V85 HydrophobicContact CG2-CG2 4.19Å; V85-F100 HydrophobicContact CG1-CE2 3.93Å; V85-F100 HydrophobicContact CG1-CZ 3.76Å; V85-V102 HydrophobicContact CG2-CG2 4.3Å
86	F	90.6	Very high	82	Confident	55 Å²	55	61 Å²	61	24%	0.241	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	150.5	179.2	-54.3	-92.3	0	0	0	111.6	E52 K53 F77 K78 T84	E52-F86 VanDerWaalsContact O-CA 3.27Å; E52-F86 WeakPolarHBondContact O-CA 3.41Å; K53-F86 HydrophobicContact CB-CD1 4.12Å; K53-F86 HydrophobicContact CB-CE1 3.98Å; K53-F86 HydrophobicContact CG-CE1 4.48Å; F77-F86 CarbonylContact C-O 3.58Å; F77-F86 VanDerWaalsContact CA-O 3.27Å; F77-F86 WeakPolarHBondContact CA-O 3.37Å; K78-F86 HydrophobicContact CD-CB 4.44Å; K78-F86 HydrophobicContact CG-CB 3.81Å; K78-F86 HydrophobicContact CG-CD2 4.43Å; K78-F86 PolarHBondContact N-O 2.99Å; K78-F86 PolarHBondContact O-N 3.48Å; T84-F86 HydrophobicContact CG2-CD1 4.43Å; T84-F86 HydrophobicContact CG2-CD2 4.17Å; T84-F86 HydrophobicContact CG2-CE1 3.85Å; T84-F86 HydrophobicContact CG2-CE2 3.54Å; T84-F86 HydrophobicContact CG2-CZ 3.36Å; T84-F86 WeakPolarHBondContact O-CD2 3.46Å; T84-F86 WeakPolarHBondContact O-CE2 3.43Å
87	A	88.7	Confident	81.7	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	136.7	168.7	0	0	0	0	0	112	I48 G51 E52 L91	I48-A87 HydrophobicContact CG2-CB 3.51Å; G51-A87 WeakPolarHBondContact CA-O 3.45Å; G51-A87 PolarHBondContact N-O 3.1Å; E52-A87 PolarHBondContact O-N 2.99Å; A87-L91 HydrophobicContact CB-CD1 4.08Å
88	T	84.2	Confident	81.5	Confident	43 Å²	43	64.6 Å²	64.6	26%	0.264	34%	0.34	S	S	.	.	S	Bend	trans	-88.3	-17.4	179	56.8	0	0	0	0	113.6	V75 D76 K78	V75-T88 PolarHBondContact O-OG1 2.87Å; D76-T88 VanDerWaalsContact CA-OG1 3.31Å; D76-T88 WeakPolarHBondContact CA-OG1 3.41Å; D76-T88 PolarHBondContact O-N 2.97Å; D76-T88 PolarHBondContact O-OG1 2.85Å; K78-T88 HydrophobicContact CB-CG2 3.71Å; K78-T88 HydrophobicContact CD-CG2 4.23Å; K78-T88 HydrophobicContact CG-CG2 3.94Å
89	R	81.4	Confident	81.4	Confident	121 Å²	121	62.1 Å²	62.1	46%	0.457	34%	0.34	S	S	.	.	S	Bend	trans	-153.8	168.3	177.5	53.3	176.9	151.7	-155.6	-6.2	109.6	D76 L91	D76-R89 IonicContact OD1-CZ 3.75Å; D76-R89 IonicContact OD1-NE 2.84Å; D76-R89 PolarHBondContact OD1-NE 2.88Å; D76-R89 IonicContact OD1-NH2 3.83Å; D76-R89 PolarHBondContact OD1-NH2 3.19Å; R89-L91 HydrophobicContact CG-CD1 4.34Å; R89-L91 HydrophobicContact CG-CD2 4.21Å; R89-L91 HydrophobicContact CG-CG 4.06Å; R89-L91 VanDerWaalsContact O-CD1 3.31Å; R89-L91 WeakPolarHBondContact O-CD1 3.39Å; R89-L91 WeakPolarHBondContact O-CG 2.98Å; R89-L91 PolarHBondContact O-N 2.98Å
90	E	84.2	Confident	81.3	Confident	137 Å²	137	61.4 Å²	61.4	64%	0.64	34%	0.335	S	S	*	.			trans	-64.4	125.3	170.3	-168.6	174	-175.1	0	0	109.9	I48	I48-E90 WeakPolarHBondContact O-CA 3.2Å
91	L	78.7	Confident	81.6	Confident	28 Å²	28	62.4 Å²	62.4	15%	0.147	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	128.9	-171.4	-71	146.3	0	0	0	109.6	I48 D76 F77 A87 R89	I48-L91 HydrophobicContact CB-CB 4.47Å; I48-L91 PolarHBondContact N-O 2.88Å; I48-L91 PolarHBondContact O-N 2.87Å; D76-L91 HydrophobicContact CB-CD1 3.76Å; D76-L91 HydrophobicContact CB-CD2 3.65Å; D76-L91 HydrophobicContact CB-CG 4.35Å; D76-L91 VanDerWaalsContact CG-CD2 3.45Å; D76-L91 WeakPolarHBondContact O-CD1 3.46Å; F77-L91 HydrophobicContact CE1-CD1 4.12Å; F77-L91 HydrophobicContact CZ-CD1 4.34Å; A87-L91 HydrophobicContact CB-CD1 4.08Å; R89-L91 HydrophobicContact CG-CD1 4.34Å; R89-L91 HydrophobicContact CG-CD2 4.21Å; R89-L91 HydrophobicContact CG-CG 4.06Å; R89-L91 VanDerWaalsContact O-CD1 3.31Å; R89-L91 WeakPolarHBondContact O-CD1 3.39Å; R89-L91 WeakPolarHBondContact O-CG 2.98Å; R89-L91 PolarHBondContact O-N 2.98Å
92	Q	79.8	Confident	82.2	Confident	151 Å²	151	56.9 Å²	56.9	71%	0.706	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	111.3	170.7	-166.7	173.7	13.8	0	0	108.4
93	V	72.1	Confident	82.6	Confident	6 Å²	6	54.3 Å²	54.3	4%	0.036	29%	0.285	C	S	.	.			trans	-83.6	131.6	-172.6	-176.8	0	0	0	0	109.8	I44 Q46 I48 V98 V121	I44-V93 HydrophobicContact CD1-CB 4.37Å; I44-V93 HydrophobicContact CD1-CG1 4.22Å; I44-V93 HydrophobicContact CD1-CG2 3.8Å; Q46-V93 PolarHBondContact O-N 2.85Å; I48-V93 HydrophobicContact CD1-CG2 3.77Å; I48-V93 HydrophobicContact CG1-CG2 4.13Å; V93-V98 HydrophobicContact CG1-CB 4.17Å; V93-V98 HydrophobicContact CG1-CG2 3.59Å; V93-V121 HydrophobicContact CB-CG2 3.91Å; V93-V121 HydrophobicContact CG1-CG2 3.5Å; V93-V121 VanDerWaalsContact CG1-CG2 3.5Å
94	P	63.5	Low	82.8	Confident	83 Å²	83	54.3 Å²	54.3	54%	0.539	29%	0.285	S	S	.	.			trans	-59.9	152.4	175.1	20.5	-28.4	0	0	0	111.4	E96 V98	P94-E96 PolarHBondContact O-N 2.46Å; P94-V98 HydrophobicContact CG-CG2 4.27Å
95	S	61	Low	82.5	Confident	91 Å²	91	57.4 Å²	57.4	64%	0.636	30%	0.297	S	S	*	.	S	Bend	trans	-58.9	-1.6	-162.5	-28.2	0	0	0	0	117.7
96	E	69.1	Low	82	Confident	167 Å²	167	58.1 Å²	58.1	78%	0.78	30%	0.301	S	S	*	.	S	Bend	trans	-119.1	-61.2	-170.8	-67.9	-175.1	170.4	0	0	112.5	P94	P94-E96 PolarHBondContact O-N 2.46Å
97	Q	81.4	Confident	80.8	Confident	93 Å²	93	58.9 Å²	58.9	44%	0.435	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.9	162.4	179.4	57.2	-175	0.2	0	0	112.4	L119 L120	Q97-L119 VanDerWaalsContact CA-O 3.31Å; Q97-L119 WeakPolarHBondContact CA-O 3.44Å; Q97-L120 HydrophobicContact CB-CD2 3.86Å
98	V	84.5	Confident	79.8	Confident	36 Å²	36	66 Å²	66	22%	0.218	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	134.1	165.9	162.9	0	0	0	0	109.9	F77 V93 P94 F100 L119	F77-V98 HydrophobicContact CE2-CG1 3.92Å; F77-V98 HydrophobicContact CZ-CG1 4.18Å; V93-V98 HydrophobicContact CG1-CB 4.17Å; V93-V98 HydrophobicContact CG1-CG2 3.59Å; P94-V98 HydrophobicContact CG-CG2 4.27Å; V98-F100 HydrophobicContact CG1-CD1 4.33Å; V98-L119 PolarHBondContact N-O 3.17Å; V98-L119 PolarHBondContact O-N 3.05Å
99	A	87.8	Confident	79.2	Confident	56 Å²	56	67.6 Å²	67.6	46%	0.463	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	140.9	179.4	0	0	0	0	0	112.1	V117 R118	A99-V117 VanDerWaalsContact CA-O 3.23Å; A99-V117 WeakPolarHBondContact CA-O 3.34Å; A99-R118 HydrophobicContact CB-CG 4.08Å
100	F	89.2	Confident	78.5	Confident	9 Å²	9	64.8 Å²	64.8	4%	0.039	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	168.6	177.1	58.1	-87.3	0	0	0	110.3	T72 N73 F77 V85 V98 V102 V117 L119	T72-F100 WeakPolarHBondContact OG1-CD2 3.15Å; N73-F100 WeakPolarHBondContact OD1-CB 3.15Å; F77-F100 HydrophobicContact CB-CE2 4.17Å; F77-F100 HydrophobicContact CB-CZ 4.13Å; F77-F100 HydrophobicContact CD1-CE1 4.32Å; F77-F100 HydrophobicContact CD1-CZ 4.34Å; F77-F100 AromaticContact CD2-CD1 3.48Å; F77-F100 HydrophobicContact CD2-CD1 3.48Å; F77-F100 VanDerWaalsContact CD2-CD1 3.48Å; F77-F100 HydrophobicContact CD2-CD2 4.34Å; F77-F100 AromaticContact CD2-CE1 3.36Å; F77-F100 HydrophobicContact CD2-CE1 3.36Å; F77-F100 HydrophobicContact CD2-CE2 4.25Å; F77-F100 AromaticContact CD2-CG 3.99Å; F77-F100 HydrophobicContact CD2-CG 3.99Å; F77-F100 AromaticContact CD2-CZ 3.78Å; F77-F100 HydrophobicContact CD2-CZ 3.78Å; F77-F100 HydrophobicContact CE1-CE1 4.41Å; F77-F100 AromaticContact CE2-CD1 3.57Å; F77-F100 HydrophobicContact CE2-CD1 3.57Å; F77-F100 AromaticContact CE2-CE1 3.48Å; F77-F100 HydrophobicContact CE2-CE1 3.48Å; F77-F100 VanDerWaalsContact CE2-CE1 3.48Å; F77-F100 HydrophobicContact CE2-CG 4.45Å; F77-F100 HydrophobicContact CE2-CZ 4.31Å; F77-F100 HydrophobicContact CG-CD1 4.33Å; F77-F100 AromaticContact CG-CE1 3.82Å; F77-F100 HydrophobicContact CG-CE1 3.82Å; F77-F100 HydrophobicContact CG-CE2 4.29Å; F77-F100 AromaticContact CG-CZ 3.8Å; F77-F100 HydrophobicContact CG-CZ 3.8Å; F77-F100 HydrophobicContact CZ-CD1 4.47Å; F77-F100 HydrophobicContact CZ-CE1 4.02Å; V85-F100 HydrophobicContact CG1-CE2 3.93Å; V85-F100 HydrophobicContact CG1-CZ 3.76Å; V98-F100 HydrophobicContact CG1-CD1 4.33Å; F100-V102 HydrophobicContact CD2-CG2 4.33Å; F100-V102 HydrophobicContact CE2-CG2 4.01Å; F100-V117 HydrophobicContact CD2-CB 4.31Å; F100-V117 HydrophobicContact CE1-CB 4.33Å; F100-V117 HydrophobicContact CE1-CG1 3.82Å; F100-V117 HydrophobicContact CE2-CB 3.88Å; F100-V117 HydrophobicContact CE2-CG1 3.97Å; F100-V117 HydrophobicContact CE2-CG2 4.3Å; F100-V117 HydrophobicContact CZ-CB 3.89Å; F100-V117 HydrophobicContact CZ-CG1 3.45Å; F100-V117 VanDerWaalsContact CZ-CG1 3.45Å; F100-V117 PolarHBondContact N-O 2.95Å; F100-V117 PolarHBondContact O-N 3.39Å; F100-L119 HydrophobicContact CE1-CD1 3.85Å; F100-L119 HydrophobicContact CE1-CG 4.21Å; F100-L119 HydrophobicContact CZ-CD1 4.47Å
101	T	91.8	Very high	78.1	Confident	41 Å²	41	63.6 Å²	63.6	25%	0.252	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	139.8	-177.2	60.7	0	0	0	0	111.5	T72 N73 A115 V116	T72-T101 WeakPolarHBondContact CA-O 3.23Å; T72-T101 PolarHBondContact OG1-O 3Å; N73-T101 PolarHBondContact N-O 2.97Å; N73-T101 PolarHBondContact ND2-OG1 3.21Å; N73-T101 PolarHBondContact OD1-N 3.14Å; N73-T101 PolarHBondContact OD1-O 2.94Å; N73-T101 PolarHBondContact OD1-OG1 2.69Å; T101-A115 WeakPolarHBondContact CA-O 3.45Å; T101-V116 HydrophobicContact CG2-CG2 4.38Å
102	V	91.8	Very high	78.4	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.5	172.1	178.1	0	0	0	0	108.7	F35 V57 Y70 E71 V79 V85 F100 A115 V117	F35-V102 HydrophobicContact CZ-CG1 4.49Å; V57-V102 HydrophobicContact CG2-CG1 4.01Å; Y70-V102 HydrophobicContact CD1-CG1 4.23Å; E71-V102 CarbonylContact O-C 3.5Å; E71-V102 WeakPolarHBondContact O-CA 3.47Å; V79-V102 HydrophobicContact CG1-CG1 4.2Å; V79-V102 HydrophobicContact CG2-CG1 4.01Å; V79-V102 HydrophobicContact CG2-CG2 3.97Å; V85-V102 HydrophobicContact CG2-CG2 4.3Å; F100-V102 HydrophobicContact CD2-CG2 4.33Å; F100-V102 HydrophobicContact CE2-CG2 4.01Å; V102-A115 PolarHBondContact N-O 3.47Å; V102-A115 PolarHBondContact O-N 2.99Å; V102-V117 HydrophobicContact CG2-CG2 3.8Å
103	T	89.8	Confident	78.8	Confident	21 Å²	21	64.9 Å²	64.9	13%	0.129	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.9	-179.4	-56.8	0	0	0	0	109.4	Y70 E71 R112 W113 D114	Y70-T103 CarbonylContact C-O 3.5Å; Y70-T103 WeakPolarHBondContact CA-O 3.38Å; E71-T103 PolarHBondContact N-O 2.76Å; E71-T103 PolarHBondContact O-N 2.81Å; T103-R112 HydrophobicContact CG2-CB 4.18Å; T103-R112 HydrophobicContact CG2-CG 4.17Å; T103-W113 CarbonylContact C-O 3.57Å; T103-W113 VanDerWaalsContact CA-O 3.25Å; T103-W113 WeakPolarHBondContact CA-O 3.4Å; T103-D114 WeakPolarHBondContact CB-OD1 3.39Å; T103-D114 WeakPolarHBondContact CG2-OD1 3.2Å; T103-D114 PolarHBondContact OG1-OD1 2.93Å
104	A	88.6	Confident	79.6	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.5	166.3	0	0	0	0	0	109.2	F35 F59 T68 Q69 Y70 R112 W113	F35-A104 HydrophobicContact CE1-CB 4.31Å; F35-A104 HydrophobicContact CE2-CB 3.9Å; F35-A104 HydrophobicContact CZ-CB 3.53Å; F59-A104 HydrophobicContact CD2-CB 3.83Å; F59-A104 HydrophobicContact CE2-CB 3.92Å; F59-A104 HydrophobicContact CG-CB 4.15Å; F59-A104 HydrophobicContact CZ-CB 4.3Å; T68-A104 HydrophobicContact CG2-CB 3.9Å; Q69-A104 WeakPolarHBondContact O-CA 3.05Å; Y70-A104 HydrophobicContact CD1-CB 3.98Å; Y70-A104 HydrophobicContact CE1-CB 3.88Å; A104-R112 WeakPolarHBondContact O-CA 3.47Å; A104-W113 PolarHBondContact N-O 3.37Å; A104-W113 PolarHBondContact O-N 3.17Å
105	W	83.9	Confident	80.8	Confident	66 Å²	66	65.7 Å²	65.7	25%	0.25	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.3	176	168.8	-83.6	0	0	0	109.7	T68 Q69 A110 R112	T68-W105 WeakPolarHBondContact CA-O 3.27Å; Q69-W105 PolarHBondContact N-O 3.01Å; Q69-W105 PolarHBondContact O-N 2.65Å; W105-A110 HydrophobicContact CH2-CB 3.84Å; W105-A110 HydrophobicContact CZ2-CB 4.03Å; W105-R112 HydrophobicContact CD2-CG 4.48Å; W105-R112 HydrophobicContact CE3-CG 3.36Å; W105-R112 HydrophobicContact CZ3-CG 3.83Å; W105-R112 VanDerWaalsContact CZ3-NH2 3.27Å
106	D	79.1	Confident	82.2	Confident	17 Å²	17	63.6 Å²	63.6	9%	0.091	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	118.4	169.1	-171.1	-18.5	0	0	0	110.4	Q108 T109 A110 E111 W113	D106-Q108 PolarHBondContact O-N 3.48Å; D106-Q108 PolarHBondContact OD1-N 2.87Å; D106-T109 WeakPolarHBondContact CB-OG1 3.3Å; D106-T109 PolarHBondContact OD2-OG1 2.84Å; D106-A110 WeakPolarHBondContact O-CA 3.48Å; D106-A110 PolarHBondContact O-N 2.88Å; D106-E111 PolarHBondContact N-O 2.81Å; D106-E111 VanDerWaalsContact N-O 3.13Å; D106-W113 HydrophobicContact CB-CH2 4.16Å; D106-W113 HydrophobicContact CB-CZ3 3.81Å
107	S	66.8	Low	83.2	Confident	71 Å²	71	55.7 Å²	55.7	50%	0.497	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-16.9	-179.6	55.7	0	0	0	0	114.6	G67	G67-S107 PolarHBondContact O-OG 3.43Å; G67-S107 VanDerWaalsContact O-OG 3.06Å
108	Q	67.3	Low	83.6	Confident	148 Å²	148	55.5 Å²	55.5	69%	0.692	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-33.3	-178.2	-61.6	-171.1	12.6	0	0	113.3	D106	D106-Q108 PolarHBondContact O-N 3.48Å; D106-Q108 PolarHBondContact OD1-N 2.87Å
109	T	70.9	Confident	83.7	Confident	77 Å²	77	53.8 Å²	53.8	47%	0.472	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-12	-176.8	56	0	0	0	0	113.4	D106 E111	D106-T109 WeakPolarHBondContact CB-OG1 3.3Å; D106-T109 PolarHBondContact OD2-OG1 2.84Å; T109-E111 PolarHBondContact O-N 2.94Å
110	A	66.8	Low	83.5	Confident	62 Å²	62	54 Å²	54	51%	0.512	27%	0.274	S	S	.	.			trans	59.9	19	-175	0	0	0	0	0	114.5	W105 D106	W105-A110 HydrophobicContact CH2-CB 3.84Å; W105-A110 HydrophobicContact CZ2-CB 4.03Å; D106-A110 WeakPolarHBondContact O-CA 3.48Å; D106-A110 PolarHBondContact O-N 2.88Å
111	E	76.5	Confident	83.1	Confident	112 Å²	112	54.7 Å²	54.7	52%	0.523	28%	0.279	S	S	.	.			trans	-84.5	146.9	175.9	-69.2	-177.1	163.8	0	0	111.4	D106 T109 W113	D106-E111 PolarHBondContact N-O 2.81Å; D106-E111 VanDerWaalsContact N-O 3.13Å; T109-E111 PolarHBondContact O-N 2.94Å; E111-W113 HydrophobicContact CB-CH2 3.38Å; E111-W113 HydrophobicContact CB-CZ2 3.73Å; E111-W113 HydrophobicContact CB-CZ3 3.88Å; E111-W113 HydrophobicContact CG-CH2 4.49Å; E111-W113 WeakPolarHBondContact O-CZ3 3.28Å; E111-W113 VanDerWaalsContact OE2-CZ2 3.31Å; E111-W113 WeakPolarHBondContact OE2-CZ2 3.16Å
112	R	85.7	Confident	81.7	Confident	153 Å²	153	55.1 Å²	55.1	58%	0.577	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	138.5	-179	-74.1	-179.1	-172.2	-150.6	-8.7	110.5	T103 A104 W105	T103-R112 HydrophobicContact CG2-CB 4.18Å; T103-R112 HydrophobicContact CG2-CG 4.17Å; A104-R112 WeakPolarHBondContact O-CA 3.47Å; W105-R112 HydrophobicContact CD2-CG 4.48Å; W105-R112 HydrophobicContact CE3-CG 3.36Å; W105-R112 HydrophobicContact CZ3-CG 3.83Å; W105-R112 VanDerWaalsContact CZ3-NH2 3.27Å
113	W	87	Confident	79.8	Confident	53 Å²	53	63.6 Å²	63.6	20%	0.201	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139.8	170.3	-58.9	-92.3	0	0	0	108.8	A33 F35 F59 T103 A104 D106 E111	A33-W113 HydrophobicContact CB-CZ2 4.14Å; F35-W113 HydrophobicContact CD2-CB 4.15Å; F35-W113 HydrophobicContact CE2-CB 4.03Å; F35-W113 WeakPolarHBondContact CE2-O 3.37Å; F59-W113 HydrophobicContact CE2-CB 3.91Å; F59-W113 AromaticContact CE2-CD2 3.79Å; F59-W113 HydrophobicContact CE2-CD2 3.79Å; F59-W113 AromaticContact CE2-CE3 3.87Å; F59-W113 HydrophobicContact CE2-CE3 3.87Å; F59-W113 AromaticContact CE2-CG 3.81Å; F59-W113 HydrophobicContact CE2-CG 3.81Å; F59-W113 AromaticContact CZ-CD2 3.76Å; F59-W113 HydrophobicContact CZ-CD2 3.76Å; F59-W113 AromaticContact CZ-CE3 3.52Å; F59-W113 HydrophobicContact CZ-CE3 3.52Å; F59-W113 HydrophobicContact CZ-CG 4.29Å; F59-W113 HydrophobicContact CZ-CH2 4.45Å; F59-W113 AromaticContact CZ-CZ3 3.91Å; F59-W113 HydrophobicContact CZ-CZ3 3.91Å; T103-W113 CarbonylContact C-O 3.57Å; T103-W113 VanDerWaalsContact CA-O 3.25Å; T103-W113 WeakPolarHBondContact CA-O 3.4Å; A104-W113 PolarHBondContact N-O 3.37Å; A104-W113 PolarHBondContact O-N 3.17Å; D106-W113 HydrophobicContact CB-CH2 4.16Å; D106-W113 HydrophobicContact CB-CZ3 3.81Å; E111-W113 HydrophobicContact CB-CH2 3.38Å; E111-W113 HydrophobicContact CB-CZ2 3.73Å; E111-W113 HydrophobicContact CB-CZ3 3.88Å; E111-W113 HydrophobicContact CG-CH2 4.49Å; E111-W113 WeakPolarHBondContact O-CZ3 3.28Å; E111-W113 VanDerWaalsContact OE2-CZ2 3.31Å; E111-W113 WeakPolarHBondContact OE2-CZ2 3.16Å
114	D	89.9	Confident	77.4	Confident	104 Å²	104	69.3 Å²	69.3	56%	0.556	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	141.3	-178	-65.2	-33.7	0	0	0	110.5	T103	T103-D114 WeakPolarHBondContact CB-OD1 3.39Å; T103-D114 WeakPolarHBondContact CG2-OD1 3.2Å; T103-D114 PolarHBondContact OG1-OD1 2.93Å
115	A	87.9	Confident	74.7	Confident	2 Å²	2	74.9 Å²	74.9	2%	0.017	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	143.4	169.5	0	0	0	0	0	110.4	F35 Y40 T101 V102	F35-A115 HydrophobicContact CB-CB 4.29Å; F35-A115 HydrophobicContact CD1-CB 4.14Å; F35-A115 HydrophobicContact CD2-CB 3.63Å; F35-A115 HydrophobicContact CE1-CB 4.37Å; F35-A115 HydrophobicContact CE2-CB 3.86Å; F35-A115 HydrophobicContact CG-CB 3.77Å; F35-A115 HydrophobicContact CZ-CB 4.23Å; Y40-A115 HydrophobicContact CD2-CB 4.19Å; Y40-A115 HydrophobicContact CE2-CB 4.02Å; T101-A115 WeakPolarHBondContact CA-O 3.45Å; V102-A115 PolarHBondContact N-O 3.47Å; V102-A115 PolarHBondContact O-N 2.99Å
116	V	90.4	Very high	72.1	Confident	48 Å²	48	76.8 Å²	76.8	29%	0.291	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	138.4	177.5	-177.1	0	0	0	0	109.4	D38 D39 Y40 T101 R118	D38-V116 PolarHBondContact O-N 2.96Å; D38-V116 VanDerWaalsContact O-N 3.1Å; D39-V116 CarbonylContact C-O 3.59Å; D39-V116 WeakPolarHBondContact CA-O 3.37Å; Y40-V116 PolarHBondContact N-O 2.99Å; T101-V116 HydrophobicContact CG2-CG2 4.38Å; V116-R118 HydrophobicContact CG1-CG 4.21Å
117	V	90.4	Very high	69.7	Low	0 Å²	0	84.2 Å²	84.2	0%	0	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.3	173.1	169.4	0	0	0	0	108.9	Y40 L55 V57 A99 F100 V102 L119	Y40-V117 CarbonylContact O-C 3.56Å; Y40-V117 WeakPolarHBondContact O-CA 3.28Å; L55-V117 HydrophobicContact CD1-CG1 4.48Å; L55-V117 HydrophobicContact CD1-CG2 4.29Å; L55-V117 HydrophobicContact CD2-CG1 3.59Å; L55-V117 HydrophobicContact CG-CG1 4.28Å; V57-V117 HydrophobicContact CG1-CG2 3.98Å; A99-V117 VanDerWaalsContact CA-O 3.23Å; A99-V117 WeakPolarHBondContact CA-O 3.34Å; F100-V117 HydrophobicContact CD2-CB 4.31Å; F100-V117 HydrophobicContact CE1-CB 4.33Å; F100-V117 HydrophobicContact CE1-CG1 3.82Å; F100-V117 HydrophobicContact CE2-CB 3.88Å; F100-V117 HydrophobicContact CE2-CG1 3.97Å; F100-V117 HydrophobicContact CE2-CG2 4.3Å; F100-V117 HydrophobicContact CZ-CB 3.89Å; F100-V117 HydrophobicContact CZ-CG1 3.45Å; F100-V117 VanDerWaalsContact CZ-CG1 3.45Å; F100-V117 PolarHBondContact N-O 2.95Å; F100-V117 PolarHBondContact O-N 3.39Å; V102-V117 HydrophobicContact CG2-CG2 3.8Å; V117-L119 HydrophobicContact CG1-CD2 4.12Å; V117-L119 HydrophobicContact CG1-CG 4.33Å
118	R	89.2	Confident	67.9	Low	89 Å²	89	89.6 Å²	89.6	34%	0.336	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.6	176.6	-63	-178.8	-170.1	-88.8	-3.3	111.2	D39 Y40 T41 A42 A99 V116	D39-R118 IonicContact OD1-NE 3.26Å; D39-R118 WeakPolarHBondContact OD2-CD 3.36Å; D39-R118 IonicContact OD2-CZ 3.28Å; D39-R118 IonicContact OD2-NE 2.9Å; D39-R118 PolarHBondContact OD2-NE 3.34Å; D39-R118 IonicContact OD2-NH2 3.99Å; Y40-R118 PolarHBondContact O-N 3.13Å; T41-R118 CarbonylContact C-O 3.53Å; T41-R118 VanDerWaalsContact CA-O 3.29Å; T41-R118 WeakPolarHBondContact CA-O 3.44Å; T41-R118 HydrophobicContact CG2-CB 4.12Å; A42-R118 PolarHBondContact N-O 3Å; A99-R118 HydrophobicContact CB-CG 4.08Å; V116-R118 HydrophobicContact CG1-CG 4.21Å
119	L	87.3	Confident	66	Low	0 Å²	0	88.3 Å²	88.3	0%	0	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	116.6	177.1	-56.8	179.5	0	0	0	109.6	A42 I44 L54 L55 F77 Q97 V98 F100 V117	A42-L119 HydrophobicContact CB-CD2 4.04Å; A42-L119 WeakPolarHBondContact O-CA 3.41Å; I44-L119 HydrophobicContact CD1-CB 3.62Å; I44-L119 HydrophobicContact CD1-CD1 4.17Å; I44-L119 HydrophobicContact CD1-CG 4.48Å; I44-L119 HydrophobicContact CG1-CB 3.95Å; I44-L119 HydrophobicContact CG2-CB 4.37Å; I44-L119 HydrophobicContact CG2-CD2 4.06Å; L54-L119 HydrophobicContact CB-CD2 4.42Å; L54-L119 HydrophobicContact CD1-CD1 3.75Å; L55-L119 HydrophobicContact CD2-CD2 4.04Å; F77-L119 HydrophobicContact CE1-CD1 3.98Å; F77-L119 HydrophobicContact CZ-CD1 3.94Å; Q97-L119 VanDerWaalsContact CA-O 3.31Å; Q97-L119 WeakPolarHBondContact CA-O 3.44Å; V98-L119 PolarHBondContact N-O 3.17Å; V98-L119 PolarHBondContact O-N 3.05Å; F100-L119 HydrophobicContact CE1-CD1 3.85Å; F100-L119 HydrophobicContact CE1-CG 4.21Å; F100-L119 HydrophobicContact CZ-CD1 4.47Å; V117-L119 HydrophobicContact CG1-CD2 4.12Å; V117-L119 HydrophobicContact CG1-CG 4.33Å
120	L	82.9	Confident	64	Low	61 Å²	61	87.5 Å²	87.5	32%	0.319	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130.6	-177.5	-60.4	174.4	0	0	0	109.7	A42 L43 I44 Q97 A122	A42-L120 PolarHBondContact O-N 3.25Å; L43-L120 CarbonylContact C-O 3.5Å; L43-L120 WeakPolarHBondContact CA-O 3.39Å; L43-L120 HydrophobicContact CD2-CB 3.98Å; I44-L120 WeakPolarHBondContact CG1-O 3.14Å; I44-L120 PolarHBondContact N-O 2.74Å; Q97-L120 HydrophobicContact CB-CD2 3.86Å; L120-A122 PolarHBondContact O-N 2.86Å
121	V	80.4	Confident	62.2	Low	23 Å²	23	94 Å²	94	14%	0.139	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	120.7	179.3	-178.4	0	0	0	0	109.6	I44 Q46 V93 Q123	I44-V121 WeakPolarHBondContact O-CA 3.44Å; Q46-V121 HydrophobicContact CB-CG1 3.87Å; Q46-V121 HydrophobicContact CG-CG1 4.3Å; V93-V121 HydrophobicContact CB-CG2 3.91Å; V93-V121 HydrophobicContact CG1-CG2 3.5Å; V93-V121 VanDerWaalsContact CG1-CG2 3.5Å; V121-Q123 PolarHBondContact O-N 2.81Å
122	A	63.6	Low	60.1	Low	50 Å²	50	98 Å²	98	41%	0.413	53%	0.528	S	S	.	.			trans	-67.3	115.2	176.8	0	0	0	0	0	110.8	L43 I44 L120 T124	L43-A122 HydrophobicContact CD2-CB 4.43Å; I44-A122 PolarHBondContact O-N 3.48Å; L120-A122 PolarHBondContact O-N 2.86Å; A122-T124 PolarHBondContact O-N 2.68Å
123	Q	52	Low	57.7	Low	179 Å²	179	96 Å²	96	84%	0.836	54%	0.536	S	S	*	.			trans	-68.9	118.8	171.8	-73.4	-174.9	-4.8	0	0	109.8	V121 S125	V121-Q123 PolarHBondContact O-N 2.81Å; Q123-S125 PolarHBondContact O-N 2.77Å
124	T	38.9	Very low	54.9	Low	140 Å²	140	102.1 Å²	102.1	86%	0.859	57%	0.566	S	S	*	*			trans	-84.4	98.9	176.5	45.5	0	0	0	0	110.4	A122 S126	A122-T124 PolarHBondContact O-N 2.68Å; T124-S126 PolarHBondContact O-N 2.98Å
125	S	32	Very low	51.9	Low	117 Å²	117	107.3 Å²	107.3	82%	0.818	58%	0.584	S	S	*	*			trans	-72.9	109.7	155.1	55.1	0	0	0	0	108.3	Q123 L127	Q123-S125 PolarHBondContact O-N 2.77Å; S125-L127 PolarHBondContact O-N 3.15Å
126	S	30	Very low	49	Very low	106 Å²	106	110.4 Å²	110.4	74%	0.741	62%	0.616	S	S	*	*			trans	-68.7	120.1	171.2	58.3	0	0	0	0	110.3	T124	T124-S126 PolarHBondContact O-N 2.98Å
127	L	27.6	Very low	46.1	Very low	173 Å²	173	118.4 Å²	118.4	91%	0.906	65%	0.647	S	S	*	*			trans	-156.1	136.9	141	-131.5	88.3	0	0	0	111.8	S125	S125-L127 PolarHBondContact O-N 3.15Å
128	H	29.1	Very low	43.2	Very low	185 Å²	185	127.5 Å²	127.5	86%	0.856	69%	0.686	S	S	*	*			trans	-63.4	142.7	173.9	-78.8	12.9	0	0	0	112.6
129	S	27.3	Very low	40.3	Very low	120 Å²	120	129.8 Å²	129.8	84%	0.839	70%	0.704	S	S	*	*				161.8	141.6	107.3	-168.9	0	0	0	0	110.1
130	G	28.4	Very low	37.5	Very low	60 Å²	60	136.5 Å²	136.5	62%	0.619	75%	0.745	S	S	*	*			trans	-79.8	152.9	-178.7	0	0	0	0	0	113.7
131	H	29	Very low	34.9	Very low	198 Å²	198	137.6 Å²	137.6	92%	0.917	76%	0.762	S	S	*	*				-172.8	130.3	127.3	-105.6	-66.6	0	0	0	109.8
132	K	33.4	Very low	32.4	Very low	197 Å²	197	144.9 Å²	144.9	86%	0.857	80%	0.8	S	S	*	*			trans	-79.4	152.7	164.3	-86.6	-175.6	176.8	178.1	0	108.9
133	P	34.6	Very low	30.8	Very low	112 Å²	112	150.1 Å²	150.1	73%	0.727	82%	0.821	S	S	*	*				-154	151.5	84.7	34.6	-12.4	0	0	0	119.7
134	Q	28.5	Very low	30.7	Very low	180 Å²	180	146.6 Å²	146.6	84%	0.841	81%	0.813	S	S	*	*			trans	72.8	119	137.9	-74.3	-174.9	5.6	0	0	123.9
135	K	27.8	Very low	30.1	Very low	213 Å²	213	145.5 Å²	145.5	93%	0.926	81%	0.811	S	S	*	*				176.4	140.3	113.1	-92.2	167.9	-176.1	175.4	0	106.4
136	G	26.7	Very low	30.2	Very low	67 Å²	67	145.2 Å²	145.2	69%	0.691	81%	0.807	S	S	*	*			cis	149.7	124.9	3.9	0	0	0	0	0	107.5
137	K	29.8	Very low	30.4	Very low	217 Å²	217	146.3 Å²	146.3	94%	0.943	81%	0.811	S	S	*	*			trans	170.7	141	141.5	-99.6	171.5	178.6	175.3	0	113.9
138	K	28	Very low	30.7	Very low	190 Å²	190	143.7 Å²	143.7	83%	0.826	80%	0.804	S	S	*	*			trans	-49.9	164.1	169.1	-71.3	176.5	168.3	179.4	0	114.1
139	I	28.3	Very low	30.7	Very low	138 Å²	138	143.9 Å²	143.9	71%	0.708	80%	0.803	S	S	*	*			cis	-172.1	146	-9.2	-94.2	162.3	0	0	0	103.3
140	V	29.5	Very low	31.2	Very low	141 Å²	141	145.1 Å²	145.1	86%	0.855	80%	0.8	S	S	*	*				-176.3	137.5	123.4	162.8	0	0	0	0	107.7
141	A	28.3	Very low	31.4	Very low	84 Å²	84	149.1 Å²	149.1	69%	0.694	81%	0.813	S	S	*	*			trans	-101	158.3	-157.1	0	0	0	0	0	114.8
142	L	27.3	Very low	32	Very low	176 Å²	176	147.6 Å²	147.6	92%	0.921	81%	0.81	S	S	*	*			trans	-161.8	116.8	140.2	-107.7	135.3	0	0	0	112.3
143	D	30.7	Very low	31.7	Very low	160 Å²	160	146 Å²	146	86%	0.856	81%	0.81	S	S	*	*			trans	15.4	157	162.1	-103.3	4.3	0	0	0	126.5
144	P	48.4	Very low	31.7	Very low	105 Å²	105	145.8 Å²	145.8	68%	0.682	81%	0.809	S	S	*	*			trans	-112.1	162.6	-158.9	43.1	-34.9	0	0	0	115.3
145	S	27.1	Very low	31.7	Very low	117 Å²	117	148.8 Å²	148.8	82%	0.818	81%	0.813	S	S	*	*			trans	167.3	170.5	136.5	63.7	0	0	0	0	111.2
146	P	35.3	Very low	32.3	Very low	110 Å²	110	144.1 Å²	144.1	71%	0.714	80%	0.804	S	S	*	*				-101.8	171.6	-111.7	31.1	-10.7	0	0	0	114.6
147	P	33.8	Very low	32.7	Very low	130 Å²	130	152 Å²	152	84%	0.844	81%	0.813	S	S	*	*			trans	-86.8	145.8	176.5	34.7	-30.8	0	0	0	111.8
148	P	32.7	Very low	33.1	Very low	117 Å²	117	150.7 Å²	150.7	76%	0.76	81%	0.81	S	S	*	*			trans	-117.2	124.6	152.2	32.4	-19.3	0	0	0	112.1
149	K	29.7	Very low	33.9	Very low	189 Å²	189	150 Å²	150	82%	0.822	81%	0.81	S	S	*	*			trans	41.6	123.9	133	-69.4	-178.9	175.1	179.9	0	121
150	D	38	Very low	34.4	Very low	147 Å²	147	151.3 Å²	151.3	79%	0.786	82%	0.818	S	S	*	*				35.7	115.9	128.9	-64.2	-24	0	0	0	118.9
151	T	31.9	Very low	35.2	Very low	144 Å²	144	149.5 Å²	149.5	88%	0.883	82%	0.818	S	S	*	*			trans	-137.8	104.6	142.2	8.9	0	0	0	0	109.7
152	L	41.3	Very low	36.2	Very low	165 Å²	165	152.9 Å²	152.9	86%	0.864	82%	0.824	S	S	*	*			trans	-54.2	149.7	162.7	-71	156.2	0	0	0	111.1
153	L	27.8	Very low	37	Very low	163 Å²	163	148.1 Å²	148.1	85%	0.853	82%	0.817	S	S	*	*			trans	-170.9	159	152.1	-102.8	162.3	0	0	0	109.5
154	P	35.4	Very low	37.7	Very low	108 Å²	108	149 Å²	149	70%	0.701	82%	0.822	S	S	*	*				-118.9	163.2	-94.5	39	-27.3	0	0	0	114.4
155	W	28.8	Very low	38	Very low	244 Å²	244	155.5 Å²	155.5	92%	0.924	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-86.5	136.5	171.3	-82.3	77.8	0	0	0	112.1
156	P	38.9	Very low	38.8	Very low	114 Å²	114	162.2 Å²	162.2	74%	0.74	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-77.7	132.1	173.4	-5.1	22.2	0	0	0	111.2
157	R	36.1	Very low	39.4	Very low	233 Å²	233	168.5 Å²	168.5	88%	0.879	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-76.5	121.3	166.7	-78	178.5	169.5	176.1	-2.7	109.4
158	H	38.5	Very low	40.1	Very low	189 Å²	189	171 Å²	171	88%	0.875	85%	0.847	S	S	*	*			trans	-115.4	116.3	149.3	-98.6	-72.6	0	0	0	109.4
159	Q	44.8	Very low	41.2	Very low	176 Å²	176	176.5 Å²	176.5	82%	0.822	85%	0.852	S	S	*	*			trans	-72.4	117.7	165.2	-74.4	173.3	-32.1	0	0	107.9
160	N	37.5	Very low	42.9	Very low	166 Å²	166	174.4 Å²	174.4	89%	0.888	85%	0.85	S	S	*	*			trans	-131.6	120.8	148.1	-102.1	-12.2	0	0	0	107.5	D162	N160-D162 PolarHBondContact O-N 2.81Å
161	A	47.8	Very low	44.4	Very low	103 Å²	103	178.6 Å²	178.6	85%	0.851	86%	0.855	S	S	*	*			trans	-80.9	91.6	178.4	0	0	0	0	0	108.7
162	D	47.6	Very low	46.6	Very low	155 Å²	155	177.3 Å²	177.3	83%	0.829	85%	0.847	S	S	*	*			trans	-142	123	152.7	-99.6	-32.4	0	0	0	107.7	N160 L164	N160-D162 PolarHBondContact O-N 2.81Å; D162-L164 PolarHBondContact O-N 3.13Å
163	G	45.8	Very low	48.6	Very low	75 Å²	75	171.7 Å²	171.7	77%	0.773	82%	0.817	S	S	*	*			trans	-60.9	119.8	-172.9	0	0	0	0	0	112.3	R165	G163-R165 PolarHBondContact O-N 2.89Å
164	L	45.5	Very low	51.4	Low	180 Å²	180	168.7 Å²	168.7	94%	0.942	81%	0.808	S	S	*	*			trans	-60.4	102.2	168.2	-77.5	158.4	0	0	0	109.9	D162	D162-L164 PolarHBondContact O-N 3.13Å
165	R	53.1	Low	54	Low	240 Å²	240	167 Å²	167	91%	0.906	80%	0.796	S	S	*	*			trans	-75.6	126	162.6	-79.8	-177.6	173.1	-177.5	-1.3	108.8	G163 R167	G163-R165 PolarHBondContact O-N 2.89Å; R165-R167 PolarHBondContact O-N 2.96Å; R165-R167 VanDerWaalsContact O-N 3.11Å
166	R	45	Very low	57.1	Low	258 Å²	258	156.1 Å²	156.1	97%	0.974	76%	0.756	S	S	*	*			trans	-56.3	114.7	166.4	-111.2	-175.9	-179.6	-152.2	1	109
167	R	48.2	Very low	59.6	Low	242 Å²	242	155.2 Å²	155.2	91%	0.913	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-86.1	124.6	165.1	-124	-176.5	161	-164.4	-7.7	108.1	R165 R169	R165-R167 PolarHBondContact O-N 2.96Å; R165-R167 VanDerWaalsContact O-N 3.11Å; R167-R169 PolarHBondContact O-N 3.19Å
168	K	46.9	Very low	62.2	Low	183 Å²	183	144.5 Å²	144.5	80%	0.796	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-61.9	127	171.7	-163.6	-179.2	-179	-171.1	0	107.2
169	R	57.3	Low	64.7	Low	233 Å²	233	138.1 Å²	138.1	88%	0.879	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-71.5	127.1	167.6	-82.2	176.9	168.8	165.8	-5.4	106.9	R167	R167-R169 PolarHBondContact O-N 3.19Å
170	D	65.1	Low	67	Low	144 Å²	144	129.9 Å²	129.9	77%	0.77	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-70.3	135.7	171.6	-66	-33.5	0	0	0	108.7
171	W	69.1	Low	69.4	Low	235 Å²	235	125.5 Å²	125.5	89%	0.89	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-75.6	123.7	176.4	-70.7	92.4	0	0	0	108.6
172	V	77.8	Confident	71.4	Confident	117 Å²	117	121.9 Å²	121.9	71%	0.709	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-86	135.5	174.2	-176.7	0	0	0	0	108.5
173	I	83.1	Confident	73.1	Confident	48 Å²	48	126.4 Å²	126.4	25%	0.246	59%	0.593	C	S	.	*	P	Polyproline II helix	trans	-65.9	127.6	174	-64.8	174.1	0	0	0	108	I261 L263	I173-I261 HydrophobicContact CD1-CB 4.47Å; I173-I261 HydrophobicContact CD1-CD1 3.63Å; I173-I261 HydrophobicContact CD1-CG1 3.89Å; I173-I261 HydrophobicContact CD1-CG2 3.76Å; I173-I261 HydrophobicContact CG1-CD1 3.73Å; I173-I261 HydrophobicContact CG1-CG1 4.27Å; I173-L263 HydrophobicContact CB-CD2 4.25Å; I173-L263 HydrophobicContact CD1-CD2 3.59Å; I173-L263 HydrophobicContact CG2-CD2 3.9Å
174	P	87.4	Confident	74.9	Confident	100 Å²	100	124.3 Å²	124.3	65%	0.649	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-56	145	175.4	-24	33.4	0	0	0	111.4
175	P	90.6	Very high	77	Confident	71 Å²	71	121.6 Å²	121.6	46%	0.461	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-62.2	149.4	176.4	27.6	-34.3	0	0	0	111.1	Y264 Y266	P175-Y264 CarbonylContact C-O 3.57Å; P175-Y264 VanDerWaalsContact CA-O 3.29Å; P175-Y264 WeakPolarHBondContact CA-O 3.13Å; P175-Y266 HydrophobicContact CB-CD2 3.62Å; P175-Y266 HydrophobicContact CB-CE2 3.51Å; P175-Y266 HydrophobicContact CG-CD2 4.35Å; P175-Y266 HydrophobicContact CG-CE2 4.14Å
176	I	92.2	Very high	78.6	Confident	17 Å²	17	113.2 Å²	113.2	9%	0.087	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.9	179.9	-56.2	166.3	0	0	0	107.1	V178 L190 V191 M229 Y264 I265 Y266	I176-V178 HydrophobicContact CG2-CG2 4.04Å; I176-L190 HydrophobicContact CG2-CB 4.31Å; I176-L190 HydrophobicContact CG2-CD1 4.44Å; I176-V191 HydrophobicContact CD1-CB 4.3Å; I176-V191 HydrophobicContact CD1-CG1 3.81Å; I176-V191 HydrophobicContact CD1-CG2 3.49Å; I176-V191 VanDerWaalsContact CD1-CG2 3.49Å; I176-V191 HydrophobicContact CG1-CG1 3.87Å; I176-V191 HydrophobicContact CG1-CG2 4.46Å; I176-V191 HydrophobicContact CG2-CG1 4.44Å; I176-M229 HydrophobicContact CD1-SD 4.49Å; I176-Y264 PolarHBondContact N-O 3.3Å; I176-I265 HydrophobicContact CB-CG1 4.24Å; I176-I265 HydrophobicContact CB-CG2 4.46Å; I176-I265 HydrophobicContact CD1-CG1 4.21Å; I176-I265 CarbonylContact O-C 3.59Å; I176-I265 VanDerWaalsContact O-CA 3.25Å; I176-I265 WeakPolarHBondContact O-CA 3.44Å; I176-Y266 PolarHBondContact O-N 2.97Å
177	N	91.6	Very high	80.7	Confident	94 Å²	94	105 Å²	105	50%	0.503	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	125.4	179	-56.3	-16.9	0	0	0	109.3	Y266 I268	N177-Y266 CarbonylContact C-O 3.58Å; N177-Y266 WeakPolarHBondContact CA-O 3.42Å; N177-I268 HydrophobicContact CB-CD1 3.6Å; N177-I268 HydrophobicContact CB-CG1 3.8Å
178	V	91.1	Very high	82.7	Confident	8 Å²	8	96.8 Å²	96.8	5%	0.048	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	121.8	-177.8	-175.4	0	0	0	0	108.3	I176 L190 M235 I265 Y266 V267 I268	I176-V178 HydrophobicContact CG2-CG2 4.04Å; V178-L190 HydrophobicContact CG1-CD2 4.45Å; V178-L190 HydrophobicContact CG2-CD1 4.2Å; V178-L190 HydrophobicContact CG2-CD2 3.63Å; V178-M235 HydrophobicContact CB-SD 4.12Å; V178-M235 HydrophobicContact CG1-SD 3.9Å; V178-I265 HydrophobicContact CG2-CG2 4.07Å; V178-Y266 PolarHBondContact N-O 2.95Å; V178-V267 CarbonylContact O-C 3.28Å; V178-V267 VanDerWaalsContact O-CA 3.28Å; V178-V267 WeakPolarHBondContact O-CA 3.09Å; V178-I268 PolarHBondContact O-N 2.97Å
179	P	91.3	Very high	84.8	Confident	56 Å²	56	92.6 Å²	92.6	36%	0.364	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	138.4	173.9	29.2	-33.7	0	0	0	110.4	M270	P179-M270 HydrophobicContact CB-SD 4.48Å
180	E	92.7	Very high	86.4	Confident	3 Å²	3	83.3 Å²	83.3	1%	0.014	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	168.6	169.9	74.3	-170.9	130.2	0	0	112.1	S182 M235 R237 V267 I268 D269 M270	E180-S182 PolarHBondContact O-N 2.92Å; E180-M235 WeakPolarHBondContact CA-O 3.49Å; E180-M235 VanDerWaalsContact CB-O 3.32Å; E180-M235 WeakPolarHBondContact CB-O 3.2Å; E180-R237 WeakPolarHBondContact OE2-CB 3.46Å; E180-R237 PolarHBondContact OE2-N 2.96Å; E180-V267 HydrophobicContact CB-CG1 3.67Å; E180-I268 PolarHBondContact N-O 2.92Å; E180-D269 WeakPolarHBondContact OE1-CA 3.29Å; E180-M270 HydrophobicContact CG-CB 3.72Å; E180-M270 HydrophobicContact CG-CG 3.69Å; E180-M270 PolarHBondContact OE1-N 2.63Å
181	N	89.3	Confident	87.6	Confident	74 Å²	74	78.5 Å²	78.5	40%	0.396	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	25	177.4	-68.4	-46.1	0	0	0	114.9	R183 M235 D272	N181-R183 PolarHBondContact O-N 3.25Å; N181-M235 PolarHBondContact N-O 3.38Å; N181-D272 VanDerWaalsContact ND2-CG 3.27Å; N181-D272 PolarHBondContact ND2-OD2 2.86Å
182	S	88.2	Confident	88.7	Confident	27 Å²	27	73.4 Å²	73.4	19%	0.189	39%	0.394	C	S	.	.			trans	-55.7	128.9	176	177.5	0	0	0	0	110.8	E180 G184 F186 Q188	E180-S182 PolarHBondContact O-N 2.92Å; S182-G184 PolarHBondContact O-N 3.17Å; S182-F186 WeakPolarHBondContact O-CE2 3.48Å; S182-F186 VanDerWaalsContact O-CZ 3.24Å; S182-F186 WeakPolarHBondContact O-CZ 3.24Å; S182-Q188 PolarHBondContact OG-OE1 2.86Å
183	R	84.7	Confident	89.3	Confident	250 Å²	250	69 Å²	69	94%	0.943	37%	0.366	S	S	*	.			trans	-80.9	4.4	-174.4	-64.4	-175.2	176.3	-177.9	-0.9	114.4	N181	N181-R183 PolarHBondContact O-N 3.25Å
184	G	83.2	Confident	89.6	Confident	31 Å²	31	72.9 Å²	72.9	32%	0.32	38%	0.378	S	S	.	.			trans	75.9	-169.2	179	0	0	0	0	0	114.5	S182	S182-G184 PolarHBondContact O-N 3.17Å
185	P	88.6	Confident	89.6	Confident	122 Å²	122	68.5 Å²	68.5	79%	0.792	35%	0.349	S	S	*	.	P	Polyproline II helix	cis	-78.6	141.8	15.9	30.8	-35.7	0	0	0	114.3
186	F	87.8	Confident	89.4	Confident	64 Å²	64	71 Å²	71	28%	0.281	36%	0.359	S	S	.	.	S	Bend	trans	-95.3	146.9	172.7	-61.5	-79.1	0	0	0	111.1	S182 Q188 V231 T232 R233 P234	S182-F186 WeakPolarHBondContact O-CE2 3.48Å; S182-F186 VanDerWaalsContact O-CZ 3.24Å; S182-F186 WeakPolarHBondContact O-CZ 3.24Å; F186-Q188 HydrophobicContact CD1-CB 4.25Å; F186-V231 HydrophobicContact CD1-CG1 4.3Å; F186-V231 HydrophobicContact CE1-CG1 4.11Å; F186-V231 HydrophobicContact CE1-CG2 4.3Å; F186-T232 VanDerWaalsContact CB-O 3.29Å; F186-T232 WeakPolarHBondContact CB-O 3.28Å; F186-R233 VanDerWaalsContact CE1-C 3.47Å; F186-R233 WeakPolarHBondContact CE1-O 3.36Å; F186-P234 HydrophobicContact CE2-CB 4.32Å; F186-P234 HydrophobicContact CE2-CG 4.45Å; F186-P234 HydrophobicContact CZ-CB 4.05Å; F186-P234 VanDerWaalsContact CZ-N 3.33Å
187	P	89.5	Confident	88.9	Confident	86 Å²	86	74.1 Å²	74.1	56%	0.558	37%	0.372	S	S	*	.	S	Bend	cis	-74.1	128.7	0.9	29.3	-34	0	0	0	112.9	Y230 V231	P187-Y230 HydrophobicContact CB-CD1 4.29Å; P187-Y230 HydrophobicContact CB-CG 4.26Å; P187-V231 CarbonylContact C-O 3.52Å; P187-V231 VanDerWaalsContact CA-O 3.25Å; P187-V231 WeakPolarHBondContact CA-O 3.19Å
188	Q	89.8	Confident	88.4	Confident	70 Å²	70	71.4 Å²	71.4	33%	0.327	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	124.5	-178.2	177	-179.8	7.1	0	0	109.8	S182 F186 L190 Y230 V231	S182-Q188 PolarHBondContact OG-OE1 2.86Å; F186-Q188 HydrophobicContact CD1-CB 4.25Å; Q188-L190 PolarHBondContact O-N 2.92Å; Q188-Y230 CarbonylContact O-C 3.58Å; Q188-Y230 WeakPolarHBondContact O-CA 3.3Å; Q188-V231 HydrophobicContact CB-CG1 3.72Å; Q188-V231 HydrophobicContact CG-CG1 4.36Å; Q188-V231 PolarHBondContact N-O 2.79Å; Q188-V231 PolarHBondContact O-N 2.91Å
189	Q	91.3	Very high	87.9	Confident	95 Å²	95	76.7 Å²	76.7	44%	0.444	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	126.1	-178.9	-163.8	-169	-71.9	0	0	110.7	R228 Y230	Q189-R228 HydrophobicContact CG-CB 4.4Å; Q189-Y230 VanDerWaalsContact CA-CD1 3.43Å; Q189-Y230 HydrophobicContact CB-CD1 3.68Å; Q189-Y230 HydrophobicContact CB-CE1 3.57Å; Q189-Y230 HydrophobicContact CG-CD1 4.05Å; Q189-Y230 HydrophobicContact CG-CE1 3.7Å
190	L	90.1	Very high	87.4	Confident	37 Å²	37	80.9 Å²	80.9	19%	0.194	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-67.2	177.8	-61.4	-178.2	0	0	0	111.1	I176 V178 Q188 F220 M229 V231	I176-L190 HydrophobicContact CG2-CB 4.31Å; I176-L190 HydrophobicContact CG2-CD1 4.44Å; V178-L190 HydrophobicContact CG1-CD2 4.45Å; V178-L190 HydrophobicContact CG2-CD1 4.2Å; V178-L190 HydrophobicContact CG2-CD2 3.63Å; Q188-L190 PolarHBondContact O-N 2.92Å; L190-F220 HydrophobicContact CD1-CD1 3.85Å; L190-F220 HydrophobicContact CD1-CE1 3.76Å; L190-M229 PolarHBondContact N-O 2.78Å; L190-V231 HydrophobicContact CD1-CB 4.24Å; L190-V231 HydrophobicContact CD2-CB 4.38Å; L190-V231 HydrophobicContact CD2-CG1 3.86Å; L190-V231 HydrophobicContact CG-CB 4.37Å; L190-V231 HydrophobicContact CG-CG1 4.25Å
191	V	91.1	Very high	86.9	Confident	44 Å²	44	84.6 Å²	84.6	27%	0.267	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	168.2	-174.9	-63.8	0	0	0	0	110.8	I176 I193 M229	I176-V191 HydrophobicContact CD1-CB 4.3Å; I176-V191 HydrophobicContact CD1-CG1 3.81Å; I176-V191 HydrophobicContact CD1-CG2 3.49Å; I176-V191 VanDerWaalsContact CD1-CG2 3.49Å; I176-V191 HydrophobicContact CG1-CG1 3.87Å; I176-V191 HydrophobicContact CG1-CG2 4.46Å; I176-V191 HydrophobicContact CG2-CG1 4.44Å; V191-I193 HydrophobicContact CG2-CG1 4.36Å; V191-M229 HydrophobicContact CG2-CB 4.15Å; V191-M229 HydrophobicContact CG2-SD 4.4Å; V191-M229 PolarHBondContact O-N 3.39Å
192	R	91.9	Very high	86.7	Confident	128 Å²	128	84.8 Å²	84.8	48%	0.483	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	119.3	170.5	-175.4	-178.2	179.7	-164.6	-5.3	109.6	S226 G227 R228	R192-S226 PolarHBondContact NE-O 3.21Å; R192-G227 CarbonylContact C-O 3.57Å; R192-G227 WeakPolarHBondContact CA-O 3.32Å; R192-R228 HydrophobicContact CB-CG 4.15Å; R192-R228 HydrophobicContact CG-CG 3.93Å
193	I	89.8	Confident	86.8	Confident	24 Å²	24	83.8 Å²	83.8	12%	0.123	42%	0.422	C	S	.	.			trans	-98.8	134.9	176.2	-57	168.8	0	0	0	107.6	V191 G227 M229 A247 L263	V191-I193 HydrophobicContact CG2-CG1 4.36Å; I193-G227 PolarHBondContact N-O 3.47Å; I193-G227 WeakPolarHBondContact O-CA 3.36Å; I193-M229 HydrophobicContact CD1-CE 4.5Å; I193-A247 HydrophobicContact CD1-CB 3.92Å; I193-L263 HydrophobicContact CD1-CD1 3.4Å; I193-L263 HydrophobicContact CD1-CD2 3.69Å; I193-L263 HydrophobicContact CD1-CG 4.12Å
194	R	89.1	Confident	87.1	Confident	129 Å²	129	77.4 Å²	77.4	49%	0.487	40%	0.397	S	S	.	.			trans	-147.2	143.2	178.2	64.4	-175.7	-59.7	-148.7	-3.6	111.2	D198 N199 Y205	R194-D198 IonicContact CZ-OD1 3.11Å; R194-D198 IonicContact CZ-OD2 3.26Å; R194-D198 IonicContact NE-OD1 2.76Å; R194-D198 IonicContact NE-OD2 3.46Å; R194-D198 PolarHBondContact NE-OD2 3.21Å; R194-D198 IonicContact NH2-OD1 2.97Å; R194-D198 PolarHBondContact NH2-OD1 2.69Å; R194-D198 IonicContact NH2-OD2 2.64Å; R194-D198 PolarHBondContact NH2-OD2 3.02Å; R194-D198 VanDerWaalsContact NH2-OD2 3.11Å; R194-N199 PolarHBondContact NH2-OD1 3.39Å; R194-Y205 WeakPolarHBondContact CA-OH 3.19Å
195	S	88.3	Confident	87.5	Confident	8 Å²	8	76.5 Å²	76.5	6%	0.056	38%	0.384	C	S	.	.			trans	-84.5	144.7	166.9	166.7	0	0	0	0	108.8	K197 D198 Y205 E258	S195-K197 PolarHBondContact O-N 2.88Å; S195-K197 WeakPolarHBondContact OG-CB 3.47Å; S195-K197 PolarHBondContact OG-N 3.47Å; S195-D198 WeakPolarHBondContact O-CB 3.09Å; S195-D198 PolarHBondContact O-N 2.98Å; S195-D198 VanDerWaalsContact O-N 3.14Å; S195-D198 VanDerWaalsContact O-OD1 3.08Å; S195-Y205 PolarHBondContact N-OH 2.76Å; S195-E258 PolarHBondContact OG-OE1 2.91Å
196	D	85.1	Confident	87.7	Confident	123 Å²	123	73 Å²	73	66%	0.658	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-66	-20.9	174	58	-14.1	0	0	0	112.9	D198 N199	D196-D198 PolarHBondContact O-N 3.3Å; D196-N199 PolarHBondContact O-ND2 3.38Å
197	K	82.9	Confident	87.9	Confident	83 Å²	83	70.8 Å²	70.8	36%	0.361	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-74.9	-4.6	172.9	-58.8	178.2	-172.9	126.2	0	113.6	S195 N199 D200 I201 I203 V257 E258	S195-K197 PolarHBondContact O-N 2.88Å; S195-K197 WeakPolarHBondContact OG-CB 3.47Å; S195-K197 PolarHBondContact OG-N 3.47Å; K197-N199 PolarHBondContact O-N 2.74Å; K197-D200 PolarHBondContact O-N 3.46Å; K197-I201 PolarHBondContact O-N 2.8Å; K197-I201 VanDerWaalsContact O-N 3.13Å; K197-I203 HydrophobicContact CB-CD1 4.05Å; K197-V257 HydrophobicContact CB-CG1 4.06Å; K197-V257 HydrophobicContact CD-CG1 3.56Å; K197-V257 HydrophobicContact CG-CG1 4.44Å; K197-V257 PolarHBondContact NZ-O 2.78Å; K197-E258 WeakPolarHBondContact CD-OE1 3.34Å; K197-E258 WeakPolarHBondContact CE-OE1 3.49Å; K197-E258 VanDerWaalsContact NZ-CD 3.29Å; K197-E258 IonicContact NZ-OE1 3.29Å; K197-E258 PolarHBondContact NZ-OE1 3.23Å; K197-E258 IonicContact NZ-OE2 2.63Å; K197-E258 PolarHBondContact NZ-OE2 2.63Å
198	D	81.3	Confident	88	Confident	37 Å²	37	68.7 Å²	68.7	20%	0.198	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-66.3	-15.8	179.4	75.5	-7.1	0	0	0	114.2	R194 S195 D196 I203 Y205	R194-D198 IonicContact CZ-OD1 3.11Å; R194-D198 IonicContact CZ-OD2 3.26Å; R194-D198 IonicContact NE-OD1 2.76Å; R194-D198 IonicContact NE-OD2 3.46Å; R194-D198 PolarHBondContact NE-OD2 3.21Å; R194-D198 IonicContact NH2-OD1 2.97Å; R194-D198 PolarHBondContact NH2-OD1 2.69Å; R194-D198 IonicContact NH2-OD2 2.64Å; R194-D198 PolarHBondContact NH2-OD2 3.02Å; R194-D198 VanDerWaalsContact NH2-OD2 3.11Å; S195-D198 WeakPolarHBondContact O-CB 3.09Å; S195-D198 PolarHBondContact O-N 2.98Å; S195-D198 VanDerWaalsContact O-N 3.14Å; S195-D198 VanDerWaalsContact O-OD1 3.08Å; D196-D198 PolarHBondContact O-N 3.3Å; D198-I203 HydrophobicContact CB-CD1 4.12Å; D198-Y205 WeakPolarHBondContact CB-OH 3.5Å
199	N	79.6	Confident	88	Confident	120 Å²	120	65.9 Å²	65.9	64%	0.642	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-81.7	-24.7	176.9	-56.3	-65.1	0	0	0	112.6	R194 D196 K197	R194-N199 PolarHBondContact NH2-OD1 3.39Å; D196-N199 PolarHBondContact O-ND2 3.38Å; K197-N199 PolarHBondContact O-N 2.74Å
200	D	80.8	Confident	87.9	Confident	144 Å²	144	63.8 Å²	63.8	77%	0.77	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-31.7	-174.8	-63.2	-38.7	0	0	0	112.4	K197	K197-D200 PolarHBondContact O-N 3.46Å
201	I	83.7	Confident	87.8	Confident	81 Å²	81	62 Å²	62	42%	0.415	32%	0.315	S	S	.	.	S	Bend	trans	-133	136.5	-177.7	-54.4	175.1	0	0	0	108.7	K197 I203 D251	K197-I201 PolarHBondContact O-N 2.8Å; K197-I201 VanDerWaalsContact O-N 3.13Å; I201-I203 PolarHBondContact O-N 2.86Å; I201-D251 HydrophobicContact CG2-CB 4.23Å
202	P	84.4	Confident	87.7	Confident	77 Å²	77	60.7 Å²	60.7	50%	0.5	31%	0.308	S	S	.	.			trans	-66.4	120.2	171.2	27.5	-33.7	0	0	0	110.4	M252	P202-M252 HydrophobicContact CB-CE 3.81Å; P202-M252 HydrophobicContact CB-CG 3.89Å; P202-M252 HydrophobicContact CG-CG 3.7Å
203	I	89.5	Confident	87.5	Confident	7 Å²	7	58.4 Å²	58.4	4%	0.036	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	138.9	-177.1	-66.2	173.3	0	0	0	110	K197 D198 I201 Y205 A249 V250 V257	K197-I203 HydrophobicContact CB-CD1 4.05Å; D198-I203 HydrophobicContact CB-CD1 4.12Å; I201-I203 PolarHBondContact O-N 2.86Å; I203-Y205 HydrophobicContact CG2-CD1 4.25Å; I203-Y205 HydrophobicContact CG2-CE1 3.8Å; I203-Y205 HydrophobicContact CG2-CE2 4.21Å; I203-A249 HydrophobicContact CG2-CB 3.8Å; I203-V250 CarbonylContact C-O 3.55Å; I203-V250 WeakPolarHBondContact CA-O 3.19Å; I203-V257 HydrophobicContact CD1-CB 4.42Å; I203-V257 HydrophobicContact CD1-CG1 3.74Å; I203-V257 HydrophobicContact CG1-CG1 4.32Å; I203-V257 HydrophobicContact CG1-CG2 4.43Å
204	R	90.7	Very high	87.4	Confident	115 Å²	115	62 Å²	62	43%	0.434	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.9	170	-168.1	-177	-68.1	-91	1.6	110.4	S224 V250	R204-S224 CarbonylContact C-O 3.6Å; R204-S224 VanDerWaalsContact CA-O 3.25Å; R204-S224 WeakPolarHBondContact CA-O 3.31Å; R204-S224 PolarHBondContact NH1-OG 2.79Å; R204-V250 HydrophobicContact CB-CG2 4Å; R204-V250 PolarHBondContact N-O 2.8Å; R204-V250 PolarHBondContact O-N 3.22Å
205	Y	92.1	Very high	87.2	Confident	12 Å²	12	60.4 Å²	60.4	5%	0.047	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	142	177.4	-57.8	-78.2	0	0	0	111.5	R194 S195 D198 I203 S224 H248 A249	R194-Y205 WeakPolarHBondContact CA-OH 3.19Å; S195-Y205 PolarHBondContact N-OH 2.76Å; D198-Y205 WeakPolarHBondContact CB-OH 3.5Å; I203-Y205 HydrophobicContact CG2-CD1 4.25Å; I203-Y205 HydrophobicContact CG2-CE1 3.8Å; I203-Y205 HydrophobicContact CG2-CE2 4.21Å; Y205-S224 PolarHBondContact N-O 3.41Å; Y205-S224 WeakPolarHBondContact O-CA 3.48Å; Y205-H248 WeakPolarHBondContact CA-O 3.35Å; Y205-A249 HydrophobicContact CD1-CB 4.07Å; Y205-A249 HydrophobicContact CE1-CB 4Å
206	S	92	Very high	87.1	Confident	50 Å²	50	61 Å²	61	35%	0.35	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	157.7	170.8	61.9	0	0	0	0	110.9	A247 H248	S206-A247 WeakPolarHBondContact O-CA 3.3Å; S206-H248 PolarHBondContact N-O 3.06Å; S206-H248 VanDerWaalsContact N-O 3.08Å; S206-H248 PolarHBondContact O-N 3.13Å
207	V	93.2	Very high	87.1	Confident	17 Å²	17	60.6 Å²	60.6	10%	0.103	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143.6	174.8	-65.7	0	0	0	0	110.6	A212 I222 M229 R246 A247 L263	V207-A212 HydrophobicContact CG2-CB 3.93Å; V207-I222 HydrophobicContact CB-CG2 4.33Å; V207-I222 HydrophobicContact CG1-CB 4.15Å; V207-I222 HydrophobicContact CG1-CD1 3.91Å; V207-I222 HydrophobicContact CG1-CG2 3.95Å; V207-I222 HydrophobicContact CG2-CB 4.25Å; V207-I222 HydrophobicContact CG2-CG2 3.86Å; V207-M229 HydrophobicContact CB-CE 4.28Å; V207-M229 HydrophobicContact CG1-CE 3.42Å; V207-M229 VanDerWaalsContact CG1-CE 3.42Å; V207-M229 HydrophobicContact CG2-CE 4.38Å; V207-R246 WeakPolarHBondContact CA-O 2.9Å; V207-A247 HydrophobicContact CG1-CB 4.14Å; V207-L263 HydrophobicContact CG1-CD1 4.48Å
208	T	91.6	Very high	87.1	Confident	42 Å²	42	64 Å²	64	26%	0.258	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	146.3	178.2	59.6	0	0	0	0	109.3	D213 L245 R246 H248	T208-D213 VanDerWaalsContact CA-OD1 3.24Å; T208-D213 WeakPolarHBondContact CA-OD1 2.99Å; T208-D213 WeakPolarHBondContact CB-OD2 3.41Å; T208-D213 WeakPolarHBondContact CG2-OD2 3.42Å; T208-L245 CarbonylContact O-C 3.56Å; T208-R246 PolarHBondContact N-O 3.03Å; T208-R246 PolarHBondContact O-N 2.85Å; T208-R246 PolarHBondContact OG1-O 3.47Å; T208-H248 PolarHBondContact OG1-NE2 3.42Å
209	G	90.4	Very high	87.6	Confident	10 Å²	10	62.3 Å²	62.3	10%	0.103	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	139.6	178	-178.5	0	0	0	0	0	111.9	G211 A212 D213 Q214	G209-G211 PolarHBondContact O-N 3.24Å; G209-A212 PolarHBondContact O-N 2.97Å; G209-D213 PolarHBondContact N-OD1 2.81Å; G209-D213 PolarHBondContact O-N 2.83Å; G209-Q214 PolarHBondContact O-N 2.89Å
210	V	88.8	Confident	88.2	Confident	52 Å²	52	56.9 Å²	56.9	32%	0.315	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-59.6	122.6	173.1	178.8	0	0	0	0	108.6	Q214 P215 Y243 L245	V210-Q214 HydrophobicContact CG2-CB 4.45Å; V210-P215 WeakPolarHBondContact CG1-O 3.44Å; V210-Y243 HydrophobicContact CG1-CD1 4.15Å; V210-Y243 HydrophobicContact CG1-CE1 4.42Å; V210-Y243 WeakPolarHBondContact O-CD1 3.44Å; V210-L245 WeakPolarHBondContact O-CD2 3.37Å
211	G	87.4	Confident	88.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	102.6	-13.9	-173.3	0	0	0	0	0	114.6	G209 Q214 P216 V219 F220	G209-G211 PolarHBondContact O-N 3.24Å; G211-Q214 PolarHBondContact N-O 2.82Å; G211-Q214 VanDerWaalsContact N-O 3.15Å; G211-P216 CarbonylContact C-O 3.51Å; G211-P216 WeakPolarHBondContact CA-O 3.24Å; G211-P216 PolarHBondContact N-O 2.84Å; G211-V219 CarbonylContact O-C 3.55Å; G211-V219 WeakPolarHBondContact O-CA 3.42Å; G211-V219 WeakPolarHBondContact O-CB 3.34Å; G211-V219 PolarHBondContact O-N 2.9Å; G211-F220 PolarHBondContact O-N 3.11Å
212	A	89.3	Confident	89.2	Confident	16 Å²	16	49.7 Å²	49.7	13%	0.132	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-82.1	-179.3	0	0	0	0	0	111.5	V207 G209 E218 L245	V207-A212 HydrophobicContact CG2-CB 3.93Å; G209-A212 PolarHBondContact O-N 2.97Å; A212-E218 PolarHBondContact O-N 3.39Å; A212-L245 HydrophobicContact CB-CD2 3.91Å
213	D	87.4	Confident	89.6	Confident	80 Å²	80	49.1 Å²	49.1	43%	0.428	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-8.3	178.4	66.7	-24.7	0	0	0	113	T208 G209 M217	T208-D213 VanDerWaalsContact CA-OD1 3.24Å; T208-D213 WeakPolarHBondContact CA-OD1 2.99Å; T208-D213 WeakPolarHBondContact CB-OD2 3.41Å; T208-D213 WeakPolarHBondContact CG2-OD2 3.42Å; G209-D213 PolarHBondContact N-OD1 2.81Å; G209-D213 PolarHBondContact O-N 2.83Å; D213-M217 WeakPolarHBondContact O-CE 3.24Å
214	Q	88.4	Confident	89.7	Confident	98 Å²	98	50.4 Å²	50.4	46%	0.458	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-112.7	150.3	172.6	-59.7	177.8	12.8	0	0	111.1	G209 V210 G211 P216	G209-Q214 PolarHBondContact O-N 2.89Å; V210-Q214 HydrophobicContact CG2-CB 4.45Å; G211-Q214 PolarHBondContact N-O 2.82Å; G211-Q214 VanDerWaalsContact N-O 3.15Å; Q214-P216 CarbonylContact O-C 3.51Å; Q214-P216 VanDerWaalsContact O-C 3.28Å; Q214-P216 VanDerWaalsContact O-O 3.05Å
215	P	84.4	Confident	89.5	Confident	97 Å²	97	50 Å²	50	63%	0.63	28%	0.278	S	S	*	.	S	Bend	trans	-57.9	138.2	179.3	-23.5	34.1	0	0	0	113	V210 M217	V210-P215 WeakPolarHBondContact CG1-O 3.44Å; P215-M217 HydrophobicContact CG-CE 4.47Å
216	P	86.7	Confident	89.3	Confident	21 Å²	21	50.5 Å²	50.5	14%	0.136	28%	0.284	C	S	.	.	S	Bend	cis	-67.4	125.5	-6.6	27.5	-33.9	0	0	0	111.3	G211 Q214 V219 Y243	G211-P216 CarbonylContact C-O 3.51Å; G211-P216 WeakPolarHBondContact CA-O 3.24Å; G211-P216 PolarHBondContact N-O 2.84Å; Q214-P216 CarbonylContact O-C 3.51Å; Q214-P216 VanDerWaalsContact O-C 3.28Å; Q214-P216 VanDerWaalsContact O-O 3.05Å; P216-V219 HydrophobicContact CB-CG2 3.92Å; P216-V219 HydrophobicContact CG-CG2 3.92Å; P216-Y243 HydrophobicContact CG-CE1 3.98Å
217	M	84.8	Confident	89.1	Confident	114 Å²	114	48.1 Å²	48.1	56%	0.562	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	157.3	-176	-69.5	173.2	165.8	0	0	111.2	D213 P215 V219	D213-M217 WeakPolarHBondContact O-CE 3.24Å; P215-M217 HydrophobicContact CG-CE 4.47Å; M217-V219 PolarHBondContact O-N 2.76Å
218	E	83.4	Confident	89.1	Confident	154 Å²	154	52.1 Å²	52.1	72%	0.72	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	16.2	172.4	-54.2	-173.2	163.5	0	0	116.4	A212 T232	A212-E218 PolarHBondContact O-N 3.39Å; E218-T232 WeakPolarHBondContact O-CB 3.26Å; E218-T232 WeakPolarHBondContact O-CG2 3.29Å; E218-T232 PolarHBondContact O-OG1 3.35Å
219	V	90.4	Very high	89.2	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.006	27%	0.268	C	S	.	.	S	Bend	trans	-69.7	-39.9	174.2	-175.1	0	0	0	0	111.2	G211 P216 M217 V231 T232 M235	G211-V219 CarbonylContact O-C 3.55Å; G211-V219 WeakPolarHBondContact O-CA 3.42Å; G211-V219 WeakPolarHBondContact O-CB 3.34Å; G211-V219 PolarHBondContact O-N 2.9Å; P216-V219 HydrophobicContact CB-CG2 3.92Å; P216-V219 HydrophobicContact CG-CG2 3.92Å; M217-V219 PolarHBondContact O-N 2.76Å; V219-V231 WeakPolarHBondContact O-CA 3.47Å; V219-T232 PolarHBondContact O-N 2.75Å; V219-T232 PolarHBondContact O-OG1 3.49Å; V219-T232 VanDerWaalsContact O-OG1 3.13Å; V219-M235 HydrophobicContact CG1-CE 3.63Å
220	F	93.3	Very high	89.3	Confident	6 Å²	6	51.9 Å²	51.9	3%	0.026	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	133.2	177.5	-57.5	-83.1	0	0	0	110.8	L190 G211 Y230 M235 Y243 L245 I265	L190-F220 HydrophobicContact CD1-CD1 3.85Å; L190-F220 HydrophobicContact CD1-CE1 3.76Å; G211-F220 PolarHBondContact O-N 3.11Å; F220-Y230 WeakPolarHBondContact CA-O 3.33Å; F220-M235 HydrophobicContact CD1-CE 4.18Å; F220-M235 HydrophobicContact CE1-CE 3.23Å; F220-M235 HydrophobicContact CE2-CE 3.97Å; F220-M235 HydrophobicContact CZ-CE 3.13Å; F220-M235 HydrophobicContact CZ-SD 4.35Å; F220-Y243 AromaticContact CE2-CD1 3.85Å; F220-Y243 HydrophobicContact CE2-CD1 3.85Å; F220-Y243 AromaticContact CE2-CD2 3.64Å; F220-Y243 HydrophobicContact CE2-CD2 3.64Å; F220-Y243 HydrophobicContact CE2-CE1 4.33Å; F220-Y243 HydrophobicContact CE2-CE2 4.13Å; F220-Y243 AromaticContact CE2-CG 3.47Å; F220-Y243 HydrophobicContact CE2-CG 3.47Å; F220-Y243 VanDerWaalsContact CE2-CG 3.47Å; F220-Y243 AromaticContact CZ-CD2 3.68Å; F220-Y243 HydrophobicContact CZ-CD2 3.68Å; F220-Y243 HydrophobicContact CZ-CE2 4.21Å; F220-Y243 AromaticContact CZ-CG 3.94Å; F220-Y243 HydrophobicContact CZ-CG 3.94Å; F220-L245 HydrophobicContact CB-CD1 3.82Å; F220-L245 HydrophobicContact CD1-CD1 4.43Å; F220-L245 HydrophobicContact CD2-CD1 3.73Å; F220-L245 HydrophobicContact CE2-CD1 4.38Å; F220-L245 HydrophobicContact CG-CD1 3.74Å; F220-I265 HydrophobicContact CD1-CD1 3.66Å; F220-I265 HydrophobicContact CD2-CD1 4.39Å; F220-I265 HydrophobicContact CE1-CB 4.49Å; F220-I265 HydrophobicContact CE1-CD1 3.27Å; F220-I265 HydrophobicContact CE1-CG1 4.4Å; F220-I265 HydrophobicContact CE1-CG2 3.93Å; F220-I265 HydrophobicContact CE2-CD1 4.08Å; F220-I265 HydrophobicContact CG-CD1 4.18Å; F220-I265 HydrophobicContact CZ-CB 4.17Å; F220-I265 HydrophobicContact CZ-CD1 3.48Å; F220-I265 VanDerWaalsContact CZ-CD1 3.48Å; F220-I265 HydrophobicContact CZ-CG1 4.41Å; F220-I265 HydrophobicContact CZ-CG2 3.79Å
221	S	91.9	Very high	89.5	Confident	44 Å²	44	49.5 Å²	49.5	31%	0.308	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	146.4	174	62.5	0	0	0	0	110.3	M229 Y230	S221-M229 CarbonylContact O-C 3.58Å; S221-M229 VanDerWaalsContact O-CA 3.32Å; S221-M229 WeakPolarHBondContact O-CA 3.33Å; S221-Y230 PolarHBondContact N-O 3Å; S221-Y230 PolarHBondContact O-N 3.4Å
222	I	93.2	Very high	89.6	Confident	30 Å²	30	52 Å²	52	15%	0.154	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.1	173.8	-166.9	168.3	0	0	0	109.7	V207 S224 R228	V207-I222 HydrophobicContact CB-CG2 4.33Å; V207-I222 HydrophobicContact CG1-CB 4.15Å; V207-I222 HydrophobicContact CG1-CD1 3.91Å; V207-I222 HydrophobicContact CG1-CG2 3.95Å; V207-I222 HydrophobicContact CG2-CB 4.25Å; V207-I222 HydrophobicContact CG2-CG2 3.86Å; I222-S224 PolarHBondContact O-N 3.03Å; I222-R228 CarbonylContact C-O 3.58Å; I222-R228 WeakPolarHBondContact CA-O 3.35Å
223	D	93.3	Very high	89.7	Confident	65 Å²	65	56.1 Å²	56.1	35%	0.348	29%	0.285	S	S	.	.			trans	-66.8	115.5	169.9	179.6	-14.3	0	0	0	108.8	M225 S226 G227 R228 Y230	D223-M225 PolarHBondContact O-N 2.96Å; D223-M225 VanDerWaalsContact O-N 3.14Å; D223-M225 PolarHBondContact OD1-N 3.16Å; D223-S226 WeakPolarHBondContact CB-OG 3.43Å; D223-S226 PolarHBondContact O-N 2.9Å; D223-S226 PolarHBondContact OD1-N 3.16Å; D223-S226 WeakPolarHBondContact OD2-CB 3.47Å; D223-S226 PolarHBondContact OD2-OG 2.93Å; D223-S226 VanDerWaalsContact OD2-OG 3.12Å; D223-G227 WeakPolarHBondContact O-CA 3.48Å; D223-G227 PolarHBondContact O-N 2.84Å; D223-R228 PolarHBondContact N-O 2.72Å; D223-Y230 HydrophobicContact CB-CE2 4.33Å
224	S	90.1	Very high	89.8	Confident	35 Å²	35	55.8 Å²	55.8	25%	0.245	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.7	-175	74.1	0	0	0	0	114.4	R204 Y205 I222	R204-S224 CarbonylContact C-O 3.6Å; R204-S224 VanDerWaalsContact CA-O 3.25Å; R204-S224 WeakPolarHBondContact CA-O 3.31Å; R204-S224 PolarHBondContact NH1-OG 2.79Å; Y205-S224 PolarHBondContact N-O 3.41Å; Y205-S224 WeakPolarHBondContact O-CA 3.48Å; I222-S224 PolarHBondContact O-N 3.03Å
225	M	87.1	Confident	89.9	Confident	105 Å²	105	51.5 Å²	51.5	52%	0.517	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-40.5	180	-64.8	-58.9	-59.1	0	0	112.3	D223 M252	D223-M225 PolarHBondContact O-N 2.96Å; D223-M225 VanDerWaalsContact O-N 3.14Å; D223-M225 PolarHBondContact OD1-N 3.16Å; M225-M252 HydrophobicContact CE-CE 3.59Å; M225-M252 HydrophobicContact SD-CE 3.74Å
226	S	88	Confident	90.3	Very high	23 Å²	23	49.8 Å²	49.8	16%	0.161	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-18	-175.7	88.5	0	0	0	0	113.7	R192 D223 R228	R192-S226 PolarHBondContact NE-O 3.21Å; D223-S226 WeakPolarHBondContact CB-OG 3.43Å; D223-S226 PolarHBondContact O-N 2.9Å; D223-S226 PolarHBondContact OD1-N 3.16Å; D223-S226 WeakPolarHBondContact OD2-CB 3.47Å; D223-S226 PolarHBondContact OD2-OG 2.93Å; D223-S226 VanDerWaalsContact OD2-OG 3.12Å; S226-R228 PolarHBondContact O-N 2.86Å; S226-R228 WeakPolarHBondContact OG-CB 3.43Å; S226-R228 WeakPolarHBondContact OG-CD 3.41Å; S226-R228 VanDerWaalsContact OG-CG 3.23Å; S226-R228 WeakPolarHBondContact OG-CG 3.43Å; S226-R228 PolarHBondContact OG-N 2.8Å
227	G	88.7	Confident	90.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.254	C	S	.	.			trans	68.1	18.7	-173.5	0	0	0	0	0	113.9	R192 I193 D223	R192-G227 CarbonylContact C-O 3.57Å; R192-G227 WeakPolarHBondContact CA-O 3.32Å; I193-G227 PolarHBondContact N-O 3.47Å; I193-G227 WeakPolarHBondContact O-CA 3.36Å; D223-G227 WeakPolarHBondContact O-CA 3.48Å; D223-G227 PolarHBondContact O-N 2.84Å
228	R	92.9	Very high	91.1	Very high	101 Å²	101	48.1 Å²	48.1	38%	0.381	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	124.6	178.1	-72.3	171.8	-174.4	-168.8	7.6	108.8	Q189 R192 I222 D223 S226 Y230	Q189-R228 HydrophobicContact CG-CB 4.4Å; R192-R228 HydrophobicContact CB-CG 4.15Å; R192-R228 HydrophobicContact CG-CG 3.93Å; I222-R228 CarbonylContact C-O 3.58Å; I222-R228 WeakPolarHBondContact CA-O 3.35Å; D223-R228 PolarHBondContact N-O 2.72Å; S226-R228 PolarHBondContact O-N 2.86Å; S226-R228 WeakPolarHBondContact OG-CB 3.43Å; S226-R228 WeakPolarHBondContact OG-CD 3.41Å; S226-R228 VanDerWaalsContact OG-CG 3.23Å; S226-R228 WeakPolarHBondContact OG-CG 3.43Å; S226-R228 PolarHBondContact OG-N 2.8Å; R228-Y230 HydrophobicContact CB-CE2 3.7Å; R228-Y230 WeakPolarHBondContact CD-OH 3.36Å; R228-Y230 WeakPolarHBondContact O-CD2 3.48Å; R228-Y230 VanDerWaalsContact O-CE2 3.31Å; R228-Y230 WeakPolarHBondContact O-CE2 3.33Å
229	M	92.8	Very high	91.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	138.3	176.6	179.9	178.6	-83.3	0	0	110	I176 L190 V191 I193 V207 S221 L245 L263 I265	I176-M229 HydrophobicContact CD1-SD 4.49Å; L190-M229 PolarHBondContact N-O 2.78Å; V191-M229 HydrophobicContact CG2-CB 4.15Å; V191-M229 HydrophobicContact CG2-SD 4.4Å; V191-M229 PolarHBondContact O-N 3.39Å; I193-M229 HydrophobicContact CD1-CE 4.5Å; V207-M229 HydrophobicContact CB-CE 4.28Å; V207-M229 HydrophobicContact CG1-CE 3.42Å; V207-M229 VanDerWaalsContact CG1-CE 3.42Å; V207-M229 HydrophobicContact CG2-CE 4.38Å; S221-M229 CarbonylContact O-C 3.58Å; S221-M229 VanDerWaalsContact O-CA 3.32Å; S221-M229 WeakPolarHBondContact O-CA 3.33Å; M229-L245 HydrophobicContact CE-CD1 4.07Å; M229-L263 HydrophobicContact CE-CD1 3.52Å; M229-L263 HydrophobicContact SD-CD1 4.46Å; M229-I265 HydrophobicContact SD-CD1 4.18Å
230	Y	92.1	Very high	91.4	Very high	48 Å²	48	49.4 Å²	49.4	19%	0.188	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	145.4	179.1	-53.2	-96.4	0	0	0	111.1	P187 Q188 Q189 F220 S221 D223 R228	P187-Y230 HydrophobicContact CB-CD1 4.29Å; P187-Y230 HydrophobicContact CB-CG 4.26Å; Q188-Y230 CarbonylContact O-C 3.58Å; Q188-Y230 WeakPolarHBondContact O-CA 3.3Å; Q189-Y230 VanDerWaalsContact CA-CD1 3.43Å; Q189-Y230 HydrophobicContact CB-CD1 3.68Å; Q189-Y230 HydrophobicContact CB-CE1 3.57Å; Q189-Y230 HydrophobicContact CG-CD1 4.05Å; Q189-Y230 HydrophobicContact CG-CE1 3.7Å; F220-Y230 WeakPolarHBondContact CA-O 3.33Å; S221-Y230 PolarHBondContact N-O 3Å; S221-Y230 PolarHBondContact O-N 3.4Å; D223-Y230 HydrophobicContact CB-CE2 4.33Å; R228-Y230 HydrophobicContact CB-CE2 3.7Å; R228-Y230 WeakPolarHBondContact CD-OH 3.36Å; R228-Y230 WeakPolarHBondContact O-CD2 3.48Å; R228-Y230 VanDerWaalsContact O-CE2 3.31Å; R228-Y230 WeakPolarHBondContact O-CE2 3.33Å
231	V	93.3	Very high	91.3	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	135.4	161.2	57.2	0	0	0	0	109	F186 P187 Q188 L190 V219 R233 M235	F186-V231 HydrophobicContact CD1-CG1 4.3Å; F186-V231 HydrophobicContact CE1-CG1 4.11Å; F186-V231 HydrophobicContact CE1-CG2 4.3Å; P187-V231 CarbonylContact C-O 3.52Å; P187-V231 VanDerWaalsContact CA-O 3.25Å; P187-V231 WeakPolarHBondContact CA-O 3.19Å; Q188-V231 HydrophobicContact CB-CG1 3.72Å; Q188-V231 HydrophobicContact CG-CG1 4.36Å; Q188-V231 PolarHBondContact N-O 2.79Å; Q188-V231 PolarHBondContact O-N 2.91Å; L190-V231 HydrophobicContact CD1-CB 4.24Å; L190-V231 HydrophobicContact CD2-CB 4.38Å; L190-V231 HydrophobicContact CD2-CG1 3.86Å; L190-V231 HydrophobicContact CG-CB 4.37Å; L190-V231 HydrophobicContact CG-CG1 4.25Å; V219-V231 WeakPolarHBondContact O-CA 3.47Å; V231-R233 WeakPolarHBondContact CG2-O 3.34Å; V231-M235 HydrophobicContact CB-CE 4.05Å; V231-M235 HydrophobicContact CG2-CE 3.32Å; V231-M235 HydrophobicContact CG2-CG 4.46Å; V231-M235 HydrophobicContact CG2-SD 4.32Å
232	T	91.1	Very high	91.4	Very high	52 Å²	52	52.5 Å²	52.5	32%	0.319	27%	0.271	S	S	.	.			trans	-99	-20.1	-170.7	58.9	0	0	0	0	114.1	F186 E218 V219	F186-T232 VanDerWaalsContact CB-O 3.29Å; F186-T232 WeakPolarHBondContact CB-O 3.28Å; E218-T232 WeakPolarHBondContact O-CB 3.26Å; E218-T232 WeakPolarHBondContact O-CG2 3.29Å; E218-T232 PolarHBondContact O-OG1 3.35Å; V219-T232 PolarHBondContact O-N 2.75Å; V219-T232 PolarHBondContact O-OG1 3.49Å; V219-T232 VanDerWaalsContact O-OG1 3.13Å
233	R	89.5	Confident	91.3	Very high	104 Å²	104	51.4 Å²	51.4	39%	0.392	27%	0.265	S	S	.	.	S	Bend	trans	-148.2	160.1	-175.1	66.7	179.9	-167.7	171.8	7.7	110.7	F186 V231	F186-R233 VanDerWaalsContact CE1-C 3.47Å; F186-R233 WeakPolarHBondContact CE1-O 3.36Å; V231-R233 WeakPolarHBondContact CG2-O 3.34Å
234	P	90.4	Very high	91.3	Very high	72 Å²	72	52.2 Å²	52.2	47%	0.468	27%	0.267	S	S	.	.			trans	-58.8	150.4	172.4	26.3	-34.6	0	0	0	110.8	F186	F186-P234 HydrophobicContact CE2-CB 4.32Å; F186-P234 HydrophobicContact CE2-CG 4.45Å; F186-P234 HydrophobicContact CZ-CB 4.05Å; F186-P234 VanDerWaalsContact CZ-N 3.33Å
235	M	90.5	Very high	91.4	Very high	8 Å²	8	50.6 Å²	50.6	4%	0.039	26%	0.255	C	S	.	.			trans	-104.3	156.2	177.2	-68.9	170.6	173.2	0	0	109.4	V178 E180 N181 V219 F220 V231 V267	V178-M235 HydrophobicContact CB-SD 4.12Å; V178-M235 HydrophobicContact CG1-SD 3.9Å; E180-M235 WeakPolarHBondContact CA-O 3.49Å; E180-M235 VanDerWaalsContact CB-O 3.32Å; E180-M235 WeakPolarHBondContact CB-O 3.2Å; N181-M235 PolarHBondContact N-O 3.38Å; V219-M235 HydrophobicContact CG1-CE 3.63Å; F220-M235 HydrophobicContact CD1-CE 4.18Å; F220-M235 HydrophobicContact CE1-CE 3.23Å; F220-M235 HydrophobicContact CE2-CE 3.97Å; F220-M235 HydrophobicContact CZ-CE 3.13Å; F220-M235 HydrophobicContact CZ-SD 4.35Å; V231-M235 HydrophobicContact CB-CE 4.05Å; V231-M235 HydrophobicContact CG2-CE 3.32Å; V231-M235 HydrophobicContact CG2-CG 4.46Å; V231-M235 HydrophobicContact CG2-SD 4.32Å; M235-V267 HydrophobicContact CB-CG1 4.08Å; M235-V267 HydrophobicContact CB-CG2 4.35Å; M235-V267 HydrophobicContact SD-CG2 4.12Å
236	D	92.5	Very high	91.7	Very high	62 Å²	62	50.9 Å²	50.9	33%	0.332	25%	0.25	S	S	.	.			trans	-131.7	119.8	176.3	171.9	-22.3	0	0	0	105.5	E238 E239 H240	D236-E238 WeakPolarHBondContact OD1-CA 3.13Å; D236-E238 WeakPolarHBondContact OD1-CB 3.43Å; D236-E238 PolarHBondContact OD1-N 3.23Å; D236-E239 HydrophobicContact CB-CB 4.17Å; D236-E239 PolarHBondContact OD1-N 3.05Å; D236-H240 PolarHBondContact O-N 2.98Å; D236-H240 VanDerWaalsContact O-N 3.12Å
237	R	94.1	Very high	91.8	Very high	41 Å²	41	50 Å²	50	16%	0.155	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-35	-175.9	-172.5	-143.2	65.5	104.5	1.5	110.5	E180 E239 H240 A241 V267 D269 A304	E180-R237 WeakPolarHBondContact OE2-CB 3.46Å; E180-R237 PolarHBondContact OE2-N 2.96Å; R237-E239 PolarHBondContact O-N 3.5Å; R237-H240 CarbonylContact O-C 3.4Å; R237-H240 VanDerWaalsContact O-C 3.28Å; R237-H240 PolarHBondContact O-N 3.41Å; R237-A241 HydrophobicContact CG-CB 3.99Å; R237-A241 WeakPolarHBondContact O-CA 3.49Å; R237-A241 PolarHBondContact O-N 2.94Å; R237-V267 HydrophobicContact CB-CB 4.17Å; R237-V267 HydrophobicContact CB-CG1 3.77Å; R237-V267 HydrophobicContact CG-CB 4.17Å; R237-V267 HydrophobicContact CG-CG1 4.27Å; R237-D269 VanDerWaalsContact CD-OD1 3.24Å; R237-D269 WeakPolarHBondContact CD-OD1 3.17Å; R237-D269 IonicContact CZ-OD1 3.18Å; R237-D269 IonicContact NE-OD1 3.68Å; R237-D269 PolarHBondContact NE-OD1 2.99Å; R237-D269 IonicContact NH2-OD1 3.25Å; R237-A304 PolarHBondContact NH2-O 3.37Å
238	E	93.7	Very high	92	Very high	59 Å²	59	52 Å²	52	28%	0.276	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-33.2	176.8	-69.2	61.1	-113.4	0	0	110.9	D236 N273 A304	D236-E238 WeakPolarHBondContact OD1-CA 3.13Å; D236-E238 WeakPolarHBondContact OD1-CB 3.43Å; D236-E238 PolarHBondContact OD1-N 3.23Å; E238-N273 PolarHBondContact OE2-ND2 2.82Å; E238-A304 HydrophobicContact CG-CB 4.01Å
239	E	90.8	Very high	91.9	Very high	117 Å²	117	47.6 Å²	47.6	55%	0.547	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-51	170.3	-163.2	-172.5	-179.6	0	0	111.5	D236 R237	D236-E239 HydrophobicContact CB-CB 4.17Å; D236-E239 PolarHBondContact OD1-N 3.05Å; R237-E239 PolarHBondContact O-N 3.5Å
240	H	90.6	Very high	91.8	Very high	64 Å²	64	49.1 Å²	49.1	30%	0.296	25%	0.249	S	C	.	.			trans	-149	97.2	-176.8	-70.9	-66.4	0	0	0	113.7	D236 R237 S242 Y243 V267	D236-H240 PolarHBondContact O-N 2.98Å; D236-H240 VanDerWaalsContact O-N 3.12Å; R237-H240 CarbonylContact O-C 3.4Å; R237-H240 VanDerWaalsContact O-C 3.28Å; R237-H240 PolarHBondContact O-N 3.41Å; H240-S242 VanDerWaalsContact C-N 3.31Å; H240-S242 PolarHBondContact O-N 3.4Å; H240-Y243 HydrophobicContact CB-CE1 4.17Å; H240-Y243 HydrophobicContact CB-CE2 4.19Å; H240-Y243 WeakPolarHBondContact CB-OH 3.33Å; H240-V267 WeakPolarHBondContact O-CG2 3.4Å
241	A	91.1	Very high	91.6	Very high	49 Å²	49	48 Å²	48	41%	0.405	25%	0.246	S	C	.	.	S	Bend	trans	-67.3	-22.1	-177.9	0	0	0	0	0	115.8	R237 V267	R237-A241 HydrophobicContact CG-CB 3.99Å; R237-A241 WeakPolarHBondContact O-CA 3.49Å; R237-A241 PolarHBondContact O-N 2.94Å; A241-V267 PolarHBondContact O-N 3.07Å
242	S	93.1	Very high	91.1	Very high	67 Å²	67	52 Å²	52	47%	0.469	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	151.8	178.1	69.6	0	0	0	0	113.3	H240 I265	H240-S242 VanDerWaalsContact C-N 3.31Å; H240-S242 PolarHBondContact O-N 3.4Å; S242-I265 CarbonylContact C-O 3.58Å; S242-I265 VanDerWaalsContact CA-O 3.27Å; S242-I265 WeakPolarHBondContact CA-O 3.41Å
243	Y	92.3	Very high	90.7	Very high	6 Å²	6	56.2 Å²	56.2	2%	0.024	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134.4	174.9	-61.9	-89.2	0	0	0	110.6	V210 P216 F220 H240 I265 V267	V210-Y243 HydrophobicContact CG1-CD1 4.15Å; V210-Y243 HydrophobicContact CG1-CE1 4.42Å; V210-Y243 WeakPolarHBondContact O-CD1 3.44Å; P216-Y243 HydrophobicContact CG-CE1 3.98Å; F220-Y243 AromaticContact CE2-CD1 3.85Å; F220-Y243 HydrophobicContact CE2-CD1 3.85Å; F220-Y243 AromaticContact CE2-CD2 3.64Å; F220-Y243 HydrophobicContact CE2-CD2 3.64Å; F220-Y243 HydrophobicContact CE2-CE1 4.33Å; F220-Y243 HydrophobicContact CE2-CE2 4.13Å; F220-Y243 AromaticContact CE2-CG 3.47Å; F220-Y243 HydrophobicContact CE2-CG 3.47Å; F220-Y243 VanDerWaalsContact CE2-CG 3.47Å; F220-Y243 AromaticContact CZ-CD2 3.68Å; F220-Y243 HydrophobicContact CZ-CD2 3.68Å; F220-Y243 HydrophobicContact CZ-CE2 4.21Å; F220-Y243 AromaticContact CZ-CG 3.94Å; F220-Y243 HydrophobicContact CZ-CG 3.94Å; H240-Y243 HydrophobicContact CB-CE1 4.17Å; H240-Y243 HydrophobicContact CB-CE2 4.19Å; H240-Y243 WeakPolarHBondContact CB-OH 3.33Å; Y243-I265 PolarHBondContact N-O 3.27Å; Y243-I265 PolarHBondContact O-N 3.07Å; Y243-V267 HydrophobicContact CD2-CG2 4.28Å; Y243-V267 HydrophobicContact CE2-CG2 3.99Å
244	H	92.6	Very high	90.2	Very high	82 Å²	82	53.7 Å²	53.7	38%	0.38	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	105.9	174.3	-177.3	-161.9	0	0	0	109.2	D262 Y264	H244-D262 IonicContact CE1-OD1 3.08Å; H244-D262 IonicContact NE2-OD1 3Å; H244-D262 PolarHBondContact NE2-OD1 2.72Å; H244-Y264 HydrophobicContact CB-CE1 4.45Å; H244-Y264 AromaticContact CD2-CE1 3.76Å; H244-Y264 AromaticContact CG-CE1 3.92Å; H244-Y264 AromaticContact NE2-CZ 3.91Å
245	L	92.3	Very high	90	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	160.1	177.3	-60.1	-179	0	0	0	110.5	T208 V210 A212 F220 M229 L263 I265	T208-L245 CarbonylContact O-C 3.56Å; V210-L245 WeakPolarHBondContact O-CD2 3.37Å; A212-L245 HydrophobicContact CB-CD2 3.91Å; F220-L245 HydrophobicContact CB-CD1 3.82Å; F220-L245 HydrophobicContact CD1-CD1 4.43Å; F220-L245 HydrophobicContact CD2-CD1 3.73Å; F220-L245 HydrophobicContact CE2-CD1 4.38Å; F220-L245 HydrophobicContact CG-CD1 3.74Å; M229-L245 HydrophobicContact CE-CD1 4.07Å; L245-L263 HydrophobicContact CB-CB 4.19Å; L245-L263 HydrophobicContact CB-CD1 4.46Å; L245-L263 PolarHBondContact N-O 3Å; L245-L263 PolarHBondContact O-N 2.91Å; L245-I265 HydrophobicContact CD1-CD1 3.7Å; L245-I265 HydrophobicContact CG-CD1 4.38Å
246	R	92.5	Very high	89.7	Confident	111 Å²	111	62.1 Å²	62.1	42%	0.419	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	121.5	173.6	-178.8	174.4	-74.2	165.5	4.4	109.4	V207 T208 H248 P260 I261 D262	V207-R246 WeakPolarHBondContact CA-O 2.9Å; T208-R246 PolarHBondContact N-O 3.03Å; T208-R246 PolarHBondContact O-N 2.85Å; T208-R246 PolarHBondContact OG1-O 3.47Å; R246-H248 PolarHBondContact O-CD2 2.92Å; R246-P260 VanDerWaalsContact CD-CB 3.46Å; R246-P260 HydrophobicContact CG-CB 3.49Å; R246-P260 VanDerWaalsContact CG-CB 3.49Å; R246-I261 CarbonylContact C-O 3.55Å; R246-I261 WeakPolarHBondContact CA-O 3.41Å; R246-D262 IonicContact CZ-OD1 3.91Å; R246-D262 IonicContact NE-OD1 2.65Å; R246-D262 PolarHBondContact NE-OD1 2.82Å; R246-D262 IonicContact NH2-OD1 3.49Å; R246-D262 PolarHBondContact NH2-OD1 2.97Å
247	A	91.8	Very high	89.4	Confident	6 Å²	6	60.4 Å²	60.4	5%	0.05	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	140.1	176.5	0	0	0	0	0	111.2	I193 S206 V207 P260 I261 L263	I193-A247 HydrophobicContact CD1-CB 3.92Å; S206-A247 WeakPolarHBondContact O-CA 3.3Å; V207-A247 HydrophobicContact CG1-CB 4.14Å; A247-P260 VanDerWaalsContact O-CA 3.27Å; A247-P260 WeakPolarHBondContact O-CA 3.45Å; A247-I261 HydrophobicContact CB-CG2 4Å; A247-I261 PolarHBondContact N-O 3.04Å; A247-I261 PolarHBondContact O-N 3.32Å; A247-L263 HydrophobicContact CB-CD1 3.89Å; A247-L263 HydrophobicContact CB-CG 4.41Å
248	H	91.9	Very high	89.1	Confident	40 Å²	40	61.4 Å²	61.4	19%	0.185	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	143.7	178.7	-55	-97.8	0	0	0	109.8	Y205 S206 T208 R246 P260	Y205-H248 WeakPolarHBondContact CA-O 3.35Å; S206-H248 PolarHBondContact N-O 3.06Å; S206-H248 VanDerWaalsContact N-O 3.08Å; S206-H248 PolarHBondContact O-N 3.13Å; T208-H248 PolarHBondContact OG1-NE2 3.42Å; R246-H248 PolarHBondContact O-CD2 2.92Å; H248-P260 WeakPolarHBondContact ND1-CG 3.49Å
249	A	91.6	Very high	88.8	Confident	9 Å²	9	65.4 Å²	65.4	7%	0.074	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	115.3	174.3	0	0	0	0	0	108.9	I203 Y205 V257 E258	I203-A249 HydrophobicContact CG2-CB 3.8Å; Y205-A249 HydrophobicContact CD1-CB 4.07Å; Y205-A249 HydrophobicContact CE1-CB 4Å; A249-V257 PolarHBondContact O-N 2.88Å; A249-E258 HydrophobicContact CB-CB 4.17Å; A249-E258 HydrophobicContact CB-CG 4.24Å; A249-E258 PolarHBondContact O-N 2.94Å
250	V	90.5	Very high	88.8	Confident	33 Å²	33	62.1 Å²	62.1	20%	0.2	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	150.7	-178.2	-58.6	0	0	0	0	110.7	I203 R204 N255	I203-V250 CarbonylContact C-O 3.55Å; I203-V250 WeakPolarHBondContact CA-O 3.19Å; R204-V250 HydrophobicContact CB-CG2 4Å; R204-V250 PolarHBondContact N-O 2.8Å; R204-V250 PolarHBondContact O-N 3.22Å; V250-N255 CarbonylContact C-O 3.51Å; V250-N255 VanDerWaalsContact CA-O 3.24Å; V250-N255 WeakPolarHBondContact CA-O 3.44Å
251	D	87.3	Confident	88.7	Confident	25 Å²	25	62.1 Å²	62.1	13%	0.134	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	173.6	173.5	71.5	10.9	0	0	0	110.9	I201 N253 G254 N255 V257	I201-D251 HydrophobicContact CG2-CB 4.23Å; D251-N253 PolarHBondContact O-N 2.79Å; D251-N253 VanDerWaalsContact O-N 3.14Å; D251-N253 VanDerWaalsContact OD1-CA 3.25Å; D251-N253 WeakPolarHBondContact OD1-CA 3.33Å; D251-N253 WeakPolarHBondContact OD1-CB 3.35Å; D251-N253 PolarHBondContact OD1-N 3.09Å; D251-G254 PolarHBondContact O-N 2.84Å; D251-G254 PolarHBondContact OD1-N 2.82Å; D251-N255 PolarHBondContact N-O 3.45Å; D251-N255 PolarHBondContact OD1-N 2.87Å; D251-N255 WeakPolarHBondContact OD2-CB 3.18Å; D251-N255 PolarHBondContact OD2-ND2 3Å; D251-V257 HydrophobicContact CB-CG2 3.69Å; D251-V257 VanDerWaalsContact N-CG2 3.33Å
252	M	82.3	Confident	88.7	Confident	84 Å²	84	62.4 Å²	62.4	41%	0.414	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-15.6	175.9	-71.9	-64.6	179.9	0	0	114.1	P202 M225	P202-M252 HydrophobicContact CB-CE 3.81Å; P202-M252 HydrophobicContact CB-CG 3.89Å; P202-M252 HydrophobicContact CG-CG 3.7Å; M225-M252 HydrophobicContact CE-CE 3.59Å; M225-M252 HydrophobicContact SD-CE 3.74Å
253	N	83.3	Confident	88.6	Confident	140 Å²	140	59.3 Å²	59.3	75%	0.749	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-0.2	177.5	-59.8	-25.8	0	0	0	112.3	D251	D251-N253 PolarHBondContact O-N 2.79Å; D251-N253 VanDerWaalsContact O-N 3.14Å; D251-N253 VanDerWaalsContact OD1-CA 3.25Å; D251-N253 WeakPolarHBondContact OD1-CA 3.33Å; D251-N253 WeakPolarHBondContact OD1-CB 3.35Å; D251-N253 PolarHBondContact OD1-N 3.09Å
254	G	78.8	Confident	88.6	Confident	51 Å²	51	63.3 Å²	63.3	53%	0.526	33%	0.327	S	S	.	.	S	Bend	trans	86	5.3	179.5	0	0	0	0	0	115.7	D251	D251-G254 PolarHBondContact O-N 2.84Å; D251-G254 PolarHBondContact OD1-N 2.82Å
255	N	85.8	Confident	88.6	Confident	97 Å²	97	59.4 Å²	59.4	52%	0.519	31%	0.309	S	S	.	.			trans	-77.5	140	176.1	-53	-59.8	0	0	0	110.7	V250 D251 V257	V250-N255 CarbonylContact C-O 3.51Å; V250-N255 VanDerWaalsContact CA-O 3.24Å; V250-N255 WeakPolarHBondContact CA-O 3.44Å; D251-N255 PolarHBondContact N-O 3.45Å; D251-N255 PolarHBondContact OD1-N 2.87Å; D251-N255 WeakPolarHBondContact OD2-CB 3.18Å; D251-N255 PolarHBondContact OD2-ND2 3Å; N255-V257 PolarHBondContact O-N 2.93Å
256	K	85.1	Confident	88.7	Confident	161 Å²	161	64.4 Å²	64.4	70%	0.7	33%	0.328	S	S	*	.	B	Isolated β-bridge	trans	-67.6	119	176.9	-62.3	179.3	-177.6	-179.9	0	110
257	V	86.5	Confident	88.7	Confident	25 Å²	25	59.6 Å²	59.6	15%	0.152	31%	0.311	C	S	.	.	S	Bend	trans	-92.4	-35.7	-178.9	175.9	0	0	0	0	111.2	K197 I203 A249 D251 N255	K197-V257 HydrophobicContact CB-CG1 4.06Å; K197-V257 HydrophobicContact CD-CG1 3.56Å; K197-V257 HydrophobicContact CG-CG1 4.44Å; K197-V257 PolarHBondContact NZ-O 2.78Å; I203-V257 HydrophobicContact CD1-CB 4.42Å; I203-V257 HydrophobicContact CD1-CG1 3.74Å; I203-V257 HydrophobicContact CG1-CG1 4.32Å; I203-V257 HydrophobicContact CG1-CG2 4.43Å; A249-V257 PolarHBondContact O-N 2.88Å; D251-V257 HydrophobicContact CB-CG2 3.69Å; D251-V257 VanDerWaalsContact N-CG2 3.33Å; N255-V257 PolarHBondContact O-N 2.93Å
258	E	88.2	Confident	88.8	Confident	62 Å²	62	63 Å²	63	29%	0.29	33%	0.328	S	S	.	.	S	Bend	trans	-124.5	156.4	170.5	-60.1	-58	159.7	0	0	111.1	S195 K197 A249	S195-E258 PolarHBondContact OG-OE1 2.91Å; K197-E258 WeakPolarHBondContact CD-OE1 3.34Å; K197-E258 WeakPolarHBondContact CE-OE1 3.49Å; K197-E258 VanDerWaalsContact NZ-CD 3.29Å; K197-E258 IonicContact NZ-OE1 3.29Å; K197-E258 PolarHBondContact NZ-OE1 3.23Å; K197-E258 IonicContact NZ-OE2 2.63Å; K197-E258 PolarHBondContact NZ-OE2 2.63Å; A249-E258 HydrophobicContact CB-CB 4.17Å; A249-E258 HydrophobicContact CB-CG 4.24Å; A249-E258 PolarHBondContact O-N 2.94Å
259	N	87.5	Confident	88.9	Confident	143 Å²	143	61.8 Å²	61.8	77%	0.765	32%	0.322	S	S	*	.			trans	-66	143.7	166.3	-69.9	-32.7	0	0	0	109.4	I261	N259-I261 PolarHBondContact O-N 3.18Å
260	P	89.9	Confident	88.9	Confident	49 Å²	49	65.7 Å²	65.7	32%	0.318	34%	0.341	S	S	.	.			trans	-58.1	138.6	176.3	-22.8	33.4	0	0	0	111.4	R246 A247 H248	R246-P260 VanDerWaalsContact CD-CB 3.46Å; R246-P260 HydrophobicContact CG-CB 3.49Å; R246-P260 VanDerWaalsContact CG-CB 3.49Å; A247-P260 VanDerWaalsContact O-CA 3.27Å; A247-P260 WeakPolarHBondContact O-CA 3.45Å; H248-P260 WeakPolarHBondContact ND1-CG 3.49Å
261	I	89.2	Confident	89.1	Confident	63 Å²	63	65.7 Å²	65.7	32%	0.323	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	138.3	-178.4	-166.7	156.9	0	0	0	110.7	I173 R246 A247 N259	I173-I261 HydrophobicContact CD1-CB 4.47Å; I173-I261 HydrophobicContact CD1-CD1 3.63Å; I173-I261 HydrophobicContact CD1-CG1 3.89Å; I173-I261 HydrophobicContact CD1-CG2 3.76Å; I173-I261 HydrophobicContact CG1-CD1 3.73Å; I173-I261 HydrophobicContact CG1-CG1 4.27Å; R246-I261 CarbonylContact C-O 3.55Å; R246-I261 WeakPolarHBondContact CA-O 3.41Å; A247-I261 HydrophobicContact CB-CG2 4Å; A247-I261 PolarHBondContact N-O 3.04Å; A247-I261 PolarHBondContact O-N 3.32Å; N259-I261 PolarHBondContact O-N 3.18Å
262	D	90.9	Very high	89.3	Confident	56 Å²	56	67.7 Å²	67.7	30%	0.299	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	140.2	-180	-62.5	-44.2	0	0	0	111	H244 R246 Y264	H244-D262 IonicContact CE1-OD1 3.08Å; H244-D262 IonicContact NE2-OD1 3Å; H244-D262 PolarHBondContact NE2-OD1 2.72Å; R246-D262 IonicContact CZ-OD1 3.91Å; R246-D262 IonicContact NE-OD1 2.65Å; R246-D262 PolarHBondContact NE-OD1 2.82Å; R246-D262 IonicContact NH2-OD1 3.49Å; R246-D262 PolarHBondContact NH2-OD1 2.97Å; D262-Y264 HydrophobicContact CB-CE2 4.17Å
263	L	91	Very high	89.9	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.005	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	121.1	177.1	-60.4	172.8	0	0	0	108.2	I173 I193 V207 M229 L245 A247	I173-L263 HydrophobicContact CB-CD2 4.25Å; I173-L263 HydrophobicContact CD1-CD2 3.59Å; I173-L263 HydrophobicContact CG2-CD2 3.9Å; I193-L263 HydrophobicContact CD1-CD1 3.4Å; I193-L263 HydrophobicContact CD1-CD2 3.69Å; I193-L263 HydrophobicContact CD1-CG 4.12Å; V207-L263 HydrophobicContact CG1-CD1 4.48Å; M229-L263 HydrophobicContact CE-CD1 3.52Å; M229-L263 HydrophobicContact SD-CD1 4.46Å; L245-L263 HydrophobicContact CB-CB 4.19Å; L245-L263 HydrophobicContact CB-CD1 4.46Å; L245-L263 PolarHBondContact N-O 3Å; L245-L263 PolarHBondContact O-N 2.91Å; A247-L263 HydrophobicContact CB-CD1 3.89Å; A247-L263 HydrophobicContact CB-CG 4.41Å
264	Y	92.1	Very high	90.5	Very high	91 Å²	91	66 Å²	66	36%	0.357	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.7	173.8	-65.7	-80.4	0	0	0	108.7	P175 I176 H244 D262	P175-Y264 CarbonylContact C-O 3.57Å; P175-Y264 VanDerWaalsContact CA-O 3.29Å; P175-Y264 WeakPolarHBondContact CA-O 3.13Å; I176-Y264 PolarHBondContact N-O 3.3Å; H244-Y264 HydrophobicContact CB-CE1 4.45Å; H244-Y264 AromaticContact CD2-CE1 3.76Å; H244-Y264 AromaticContact CG-CE1 3.92Å; H244-Y264 AromaticContact NE2-CZ 3.91Å; D262-Y264 HydrophobicContact CB-CE2 4.17Å
265	I	93.1	Very high	91.3	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	117	176.9	-53	176.5	0	0	0	107	I176 V178 F220 M229 S242 Y243 L245	I176-I265 HydrophobicContact CB-CG1 4.24Å; I176-I265 HydrophobicContact CB-CG2 4.46Å; I176-I265 HydrophobicContact CD1-CG1 4.21Å; I176-I265 CarbonylContact O-C 3.59Å; I176-I265 VanDerWaalsContact O-CA 3.25Å; I176-I265 WeakPolarHBondContact O-CA 3.44Å; V178-I265 HydrophobicContact CG2-CG2 4.07Å; F220-I265 HydrophobicContact CD1-CD1 3.66Å; F220-I265 HydrophobicContact CD2-CD1 4.39Å; F220-I265 HydrophobicContact CE1-CB 4.49Å; F220-I265 HydrophobicContact CE1-CD1 3.27Å; F220-I265 HydrophobicContact CE1-CG1 4.4Å; F220-I265 HydrophobicContact CE1-CG2 3.93Å; F220-I265 HydrophobicContact CE2-CD1 4.08Å; F220-I265 HydrophobicContact CG-CD1 4.18Å; F220-I265 HydrophobicContact CZ-CB 4.17Å; F220-I265 HydrophobicContact CZ-CD1 3.48Å; F220-I265 VanDerWaalsContact CZ-CD1 3.48Å; F220-I265 HydrophobicContact CZ-CG1 4.41Å; F220-I265 HydrophobicContact CZ-CG2 3.79Å; M229-I265 HydrophobicContact SD-CD1 4.18Å; S242-I265 CarbonylContact C-O 3.58Å; S242-I265 VanDerWaalsContact CA-O 3.27Å; S242-I265 WeakPolarHBondContact CA-O 3.41Å; Y243-I265 PolarHBondContact N-O 3.27Å; Y243-I265 PolarHBondContact O-N 3.07Å; L245-I265 HydrophobicContact CD1-CD1 3.7Å; L245-I265 HydrophobicContact CG-CD1 4.38Å
266	Y	93.2	Very high	91.8	Very high	105 Å²	105	64.4 Å²	64.4	41%	0.412	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.1	176.1	-64.5	-65.9	0	0	0	109.5	P175 I176 N177 V178	P175-Y266 HydrophobicContact CB-CD2 3.62Å; P175-Y266 HydrophobicContact CB-CE2 3.51Å; P175-Y266 HydrophobicContact CG-CD2 4.35Å; P175-Y266 HydrophobicContact CG-CE2 4.14Å; I176-Y266 PolarHBondContact O-N 2.97Å; N177-Y266 CarbonylContact C-O 3.58Å; N177-Y266 WeakPolarHBondContact CA-O 3.42Å; V178-Y266 PolarHBondContact N-O 2.95Å
267	V	93.5	Very high	92.4	Very high	11 Å²	11	57.3 Å²	57.3	7%	0.067	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	123.1	172.1	-172	0	0	0	0	107.3	V178 E180 M235 R237 H240 A241 Y243	V178-V267 CarbonylContact O-C 3.28Å; V178-V267 VanDerWaalsContact O-CA 3.28Å; V178-V267 WeakPolarHBondContact O-CA 3.09Å; E180-V267 HydrophobicContact CB-CG1 3.67Å; M235-V267 HydrophobicContact CB-CG1 4.08Å; M235-V267 HydrophobicContact CB-CG2 4.35Å; M235-V267 HydrophobicContact SD-CG2 4.12Å; R237-V267 HydrophobicContact CB-CB 4.17Å; R237-V267 HydrophobicContact CB-CG1 3.77Å; R237-V267 HydrophobicContact CG-CB 4.17Å; R237-V267 HydrophobicContact CG-CG1 4.27Å; H240-V267 WeakPolarHBondContact O-CG2 3.4Å; A241-V267 PolarHBondContact O-N 3.07Å; Y243-V267 HydrophobicContact CD2-CG2 4.28Å; Y243-V267 HydrophobicContact CE2-CG2 3.99Å
268	I	93.2	Very high	92.8	Very high	78 Å²	78	61.7 Å²	61.7	40%	0.4	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	126.9	177.1	-57	163.3	0	0	0	107.9	N177 V178 E180	N177-I268 HydrophobicContact CB-CD1 3.6Å; N177-I268 HydrophobicContact CB-CG1 3.8Å; V178-I268 PolarHBondContact O-N 2.97Å; E180-I268 PolarHBondContact N-O 2.92Å
269	D	93.6	Very high	93.2	Very high	13 Å²	13	62.6 Å²	62.6	7%	0.07	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-59.4	138.5	176.1	-168.1	75.5	0	0	0	113.5	E180 R237 D306 T309 N311	E180-D269 WeakPolarHBondContact OE1-CA 3.29Å; R237-D269 VanDerWaalsContact CD-OD1 3.24Å; R237-D269 WeakPolarHBondContact CD-OD1 3.17Å; R237-D269 IonicContact CZ-OD1 3.18Å; R237-D269 IonicContact NE-OD1 3.68Å; R237-D269 PolarHBondContact NE-OD1 2.99Å; R237-D269 IonicContact NH2-OD1 3.25Å; D269-D306 HydrophobicContact CB-CB 3.86Å; D269-D306 VanDerWaalsContact CG-CB 3.45Å; D269-D306 VanDerWaalsContact CG-N 3.33Å; D269-D306 PolarHBondContact OD1-N 3.5Å; D269-D306 PolarHBondContact OD2-N 3.4Å; D269-T309 PolarHBondContact OD2-OG1 2.99Å; D269-N311 VanDerWaalsContact OD2-CB 3.23Å; D269-N311 WeakPolarHBondContact OD2-CB 3.02Å; D269-N311 PolarHBondContact OD2-ND2 2.71Å
270	M	93.1	Very high	93.5	Very high	92 Å²	92	61.5 Å²	61.5	45%	0.453	30%	0.296	S	S	.	.			trans	-130	145.8	175	-65.6	-70.2	-66.1	0	0	108.8	P179 E180 D272	P179-M270 HydrophobicContact CB-SD 4.48Å; E180-M270 HydrophobicContact CG-CB 3.72Å; E180-M270 HydrophobicContact CG-CG 3.69Å; E180-M270 PolarHBondContact OE1-N 2.63Å; M270-D272 VanDerWaalsContact C-N 3.3Å; M270-D272 PolarHBondContact O-N 3.27Å; M270-D272 VanDerWaalsContact O-OD1 3.14Å
271	N	93.6	Very high	93.8	Very high	33 Å²	33	62.7 Å²	62.7	18%	0.176	30%	0.302	C	S	.	.	S	Bend	trans	-74.7	75.6	-178.5	-159.5	70.1	0	0	0	112.5	D305 N311 D363 M364	N271-D305 VanDerWaalsContact CA-OD2 3.29Å; N271-D305 WeakPolarHBondContact CA-OD2 3.2Å; N271-D305 PolarHBondContact OD1-OD2 2.9Å; N271-N311 HydrophobicContact CB-CB 4.1Å; N271-N311 VanDerWaalsContact OD1-CA 3.23Å; N271-N311 WeakPolarHBondContact OD1-CA 3.16Å; N271-N311 WeakPolarHBondContact OD1-CB 3.32Å; N271-N311 PolarHBondContact OD1-O 2.84Å; N271-D363 PolarHBondContact ND2-OD1 2.97Å; N271-D363 PolarHBondContact ND2-OD2 3.27Å; N271-D363 PolarHBondContact OD1-OD2 3.49Å; N271-M364 HydrophobicContact CB-CE 3.99Å
272	D	92.6	Very high	94.2	Very high	67 Å²	67	60.9 Å²	60.9	36%	0.358	29%	0.291	S	S	.	.			trans	-113.7	-11.1	-178.9	75.7	-39.5	0	0	0	114.1	N181 M270 D305	N181-D272 VanDerWaalsContact ND2-CG 3.27Å; N181-D272 PolarHBondContact ND2-OD2 2.86Å; M270-D272 VanDerWaalsContact C-N 3.3Å; M270-D272 PolarHBondContact O-N 3.27Å; M270-D272 VanDerWaalsContact O-OD1 3.14Å; D272-D305 PolarHBondContact N-OD2 2.87Å
273	N	94.1	Very high	94.5	Very high	51 Å²	51	64.2 Å²	64.2	27%	0.273	31%	0.309	S	S	.	.	S	Bend	trans	-98.8	151.4	165.6	-59.3	-82.1	0	0	0	110.3	E238 A304 D305 L372	E238-N273 PolarHBondContact OE2-ND2 2.82Å; N273-A304 HydrophobicContact CB-CB 3.94Å; N273-D305 VanDerWaalsContact CB-OD1 3.23Å; N273-D305 WeakPolarHBondContact CB-OD1 3.16Å; N273-D305 PolarHBondContact N-OD1 2.77Å; N273-D305 PolarHBondContact N-OD2 2.84Å; N273-D305 PolarHBondContact ND2-OD1 2.87Å; N273-L372 WeakPolarHBondContact O-CD1 3.38Å
274	R	95	Very high	94.7	Very high	136 Å²	136	65 Å²	65	51%	0.513	32%	0.318	S	S	.	.			trans	-110.6	157.2	175.5	68.5	177	177.8	-119.2	-10.4	108.8	E276 D303 L372	R274-E276 PolarHBondContact O-N 3.05Å; R274-D303 VanDerWaalsContact C-OD2 3.26Å; R274-L372 HydrophobicContact CB-CB 3.54Å; R274-L372 HydrophobicContact CB-CD1 4.14Å; R274-L372 HydrophobicContact CB-CG 4.48Å
275	P	96.6	Very high	95	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.323	C	S	.	.			trans	-61.6	135.1	177.4	-23.3	31.7	0	0	0	112.1	A301 D303 V314 A361 D363 L372 N374	P275-A301 HydrophobicContact CB-CB 4.24Å; P275-D303 WeakPolarHBondContact CA-OD2 3.48Å; P275-D303 WeakPolarHBondContact CD-OD2 3.41Å; P275-D303 VanDerWaalsContact CG-OD2 3.28Å; P275-D303 WeakPolarHBondContact CG-OD2 3.49Å; P275-V314 HydrophobicContact CB-CG1 4.16Å; P275-V314 HydrophobicContact CB-CG2 4.02Å; P275-V314 HydrophobicContact CG-CG1 4.26Å; P275-V314 HydrophobicContact CG-CG2 3.95Å; P275-A361 HydrophobicContact CB-CB 3.9Å; P275-D363 HydrophobicContact CG-CB 3.95Å; P275-L372 WeakPolarHBondContact CD-O 3.34Å; P275-N374 WeakPolarHBondContact O-CB 3.24Å; P275-N374 PolarHBondContact O-ND2 3.44Å
276	E	96.4	Very high	95.1	Very high	115 Å²	115	64.2 Å²	64.2	54%	0.537	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.2	175.2	-63.2	-154.6	148.5	0	0	111.4	R274 A301 N302	R274-E276 PolarHBondContact O-N 3.05Å; E276-A301 CarbonylContact O-C 3.55Å; E276-A301 VanDerWaalsContact O-CA 3.22Å; E276-A301 WeakPolarHBondContact O-CA 3.06Å; E276-N302 PolarHBondContact N-O 2.91Å; E276-N302 PolarHBondContact O-N 2.95Å
277	F	97.1	Very high	95.2	Very high	12 Å²	12	63.5 Å²	63.5	5%	0.053	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	140.3	173	-75.6	-84.5	0	0	0	110.9	N279 Y282 V299 A301 Y316 V359 A361 N374 A376	F277-N279 VanDerWaalsContact CB-O 3.31Å; F277-N279 WeakPolarHBondContact CB-O 3.36Å; F277-N279 PolarHBondContact O-N 2.79Å; F277-Y282 HydrophobicContact CB-CE2 4.42Å; F277-Y282 HydrophobicContact CD1-CE2 4.02Å; F277-V299 HydrophobicContact CE1-CB 4.23Å; F277-V299 HydrophobicContact CE1-CG2 4.2Å; F277-A301 HydrophobicContact CD1-CB 3.88Å; F277-A301 HydrophobicContact CD2-CB 4.36Å; F277-A301 HydrophobicContact CE1-CB 4.07Å; F277-A301 HydrophobicContact CG-CB 4.03Å; F277-A301 HydrophobicContact CZ-CB 4.4Å; F277-Y316 HydrophobicContact CE1-CD1 4.19Å; F277-Y316 AromaticContact CE1-CE1 4Å; F277-Y316 HydrophobicContact CE1-CE1 4Å; F277-Y316 HydrophobicContact CZ-CD1 4.36Å; F277-Y316 HydrophobicContact CZ-CE1 4.45Å; F277-V359 HydrophobicContact CE1-CG2 3.94Å; F277-V359 HydrophobicContact CZ-CB 4.47Å; F277-V359 HydrophobicContact CZ-CG2 3.84Å; F277-A361 HydrophobicContact CD2-CB 4.47Å; F277-A361 HydrophobicContact CE1-CB 4.27Å; F277-A361 HydrophobicContact CE2-CB 3.63Å; F277-A361 HydrophobicContact CZ-CB 3.51Å; F277-N374 WeakPolarHBondContact CE2-O 3.32Å; F277-A376 HydrophobicContact CB-CB 3.95Å; F277-A376 HydrophobicContact CD1-CB 3.82Å; F277-A376 HydrophobicContact CD2-CB 3.52Å; F277-A376 HydrophobicContact CE1-CB 4.15Å; F277-A376 HydrophobicContact CE2-CB 3.86Å; F277-A376 HydrophobicContact CG-CB 3.48Å; F277-A376 VanDerWaalsContact CG-CB 3.48Å; F277-A376 HydrophobicContact CZ-CB 4.16Å
278	I	95.6	Very high	95.3	Very high	117 Å²	117	63.3 Å²	63.3	60%	0.6	33%	0.327	S	S	*	.	S	Bend	trans	-58.2	-41.1	175.8	-60.6	176.3	0	0	0	110.3	Y282 T300	I278-Y282 PolarHBondContact N-OH 3.19Å; I278-T300 HydrophobicContact CD1-CG2 3.94Å; I278-T300 PolarHBondContact N-O 3.49Å; I278-T300 VanDerWaalsContact N-O 3.1Å
279	N	95.2	Very high	95.1	Very high	82 Å²	82	62.5 Å²	62.5	44%	0.439	34%	0.338	S	S	.	.			trans	-125.1	145.9	176.3	-59.9	-40.3	0	0	0	110.4	F277 V281 Y282	F277-N279 VanDerWaalsContact CB-O 3.31Å; F277-N279 WeakPolarHBondContact CB-O 3.36Å; F277-N279 PolarHBondContact O-N 2.79Å; N279-V281 VanDerWaalsContact C-N 3.34Å; N279-V281 WeakPolarHBondContact CB-O 3.47Å; N279-Y282 HydrophobicContact CB-CD2 4.42Å; N279-Y282 HydrophobicContact CB-CE1 4.18Å; N279-Y282 HydrophobicContact CB-CE2 4Å; N279-Y282 PolarHBondContact N-OH 3.27Å; N279-Y282 WeakPolarHBondContact O-CE2 3.36Å
280	Q	94.8	Very high	95.1	Very high	119 Å²	119	62.8 Å²	62.8	56%	0.556	34%	0.34	S	S	*	.	S	Bend	trans	-75.7	-26.5	171.9	-69.7	-64.2	-41.4	0	0	112.5	T377	Q280-T377 PolarHBondContact O-N 3.3Å
281	V	97	Very high	95.1	Very high	74 Å²	74	66.4 Å²	66.4	45%	0.448	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.7	178.4	-175.4	0	0	0	0	109.7	N279 T377 I379	N279-V281 VanDerWaalsContact C-N 3.34Å; N279-V281 WeakPolarHBondContact CB-O 3.47Å; V281-T377 CarbonylContact C-O 3.53Å; V281-T377 VanDerWaalsContact CA-O 3.25Å; V281-T377 WeakPolarHBondContact CA-O 3.48Å; V281-I379 HydrophobicContact CG1-CD1 3.72Å; V281-I379 HydrophobicContact CG1-CG1 4.09Å
282	Y	97.1	Very high	95.1	Very high	25 Å²	25	68.6 Å²	68.6	10%	0.098	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	132.1	173.8	-68.4	-95.8	0	0	0	109.2	F277 I278 N279 V299 T300 A376 T377 A378 I379	F277-Y282 HydrophobicContact CB-CE2 4.42Å; F277-Y282 HydrophobicContact CD1-CE2 4.02Å; I278-Y282 PolarHBondContact N-OH 3.19Å; N279-Y282 HydrophobicContact CB-CD2 4.42Å; N279-Y282 HydrophobicContact CB-CE1 4.18Å; N279-Y282 HydrophobicContact CB-CE2 4Å; N279-Y282 PolarHBondContact N-OH 3.27Å; N279-Y282 WeakPolarHBondContact O-CE2 3.36Å; Y282-V299 HydrophobicContact CD1-CG1 4.07Å; Y282-V299 HydrophobicContact CD2-CB 4.36Å; Y282-V299 HydrophobicContact CD2-CG1 3.81Å; Y282-V299 HydrophobicContact CE1-CB 4.46Å; Y282-V299 HydrophobicContact CE1-CG1 4.44Å; Y282-V299 HydrophobicContact CE2-CB 4.24Å; Y282-V299 HydrophobicContact CE2-CG1 4.19Å; Y282-V299 HydrophobicContact CG-CG1 3.75Å; Y282-T300 PolarHBondContact OH-O 2.78Å; Y282-A376 HydrophobicContact CD2-CB 4.38Å; Y282-A376 HydrophobicContact CE2-CB 4.14Å; Y282-T377 PolarHBondContact N-O 3.12Å; Y282-A378 CarbonylContact O-C 3.55Å; Y282-A378 WeakPolarHBondContact O-CA 3.32Å; Y282-I379 PolarHBondContact O-N 2.8Å
283	N	97.4	Very high	95.2	Very high	127 Å²	127	68 Å²	68	68%	0.679	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	133.4	174.6	-65.9	-19.9	0	0	0	108.8	I379	N283-I379 WeakPolarHBondContact CA-O 3.23Å
284	G	95.6	Very high	95.3	Very high	18 Å²	18	67.9 Å²	67.9	19%	0.186	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	179.5	166.8	0	0	0	0	0	111.5	M297 I379 I380 T381	G284-M297 VanDerWaalsContact CA-CE 3.46Å; G284-I379 PolarHBondContact N-O 3.23Å; G284-I380 CarbonylContact O-C 3.58Å; G284-I380 WeakPolarHBondContact O-CA 3.37Å; G284-T381 PolarHBondContact O-N 3.16Å
285	S	96.6	Very high	95.4	Very high	67 Å²	67	67.8 Å²	67.8	47%	0.469	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	154.6	-171.4	55.8	0	0	0	0	111.7	T381	S285-T381 CarbonylContact C-O 3.57Å; S285-T381 WeakPolarHBondContact CA-O 3.42Å
286	V	96.7	Very high	95.4	Very high	6 Å²	6	68.4 Å²	68.4	4%	0.036	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	134.5	176.3	59.6	0	0	0	0	109.3	T294 V296 F331 T342 L347 I380 T381 V382 T383	V286-T294 HydrophobicContact CG2-CG2 4.28Å; V286-V296 HydrophobicContact CB-CG1 4.24Å; V286-V296 HydrophobicContact CB-CG2 4.08Å; V286-V296 HydrophobicContact CG2-CG2 4.15Å; V286-F331 HydrophobicContact CG1-CE1 4.27Å; V286-T342 HydrophobicContact CG2-CG2 3.95Å; V286-L347 HydrophobicContact CG1-CD1 3.83Å; V286-L347 HydrophobicContact CG2-CD1 3.95Å; V286-I380 HydrophobicContact CG1-CG2 3.79Å; V286-T381 PolarHBondContact N-O 2.75Å; V286-V382 CarbonylContact O-C 3.6Å; V286-V382 VanDerWaalsContact O-CA 3.29Å; V286-V382 WeakPolarHBondContact O-CA 3.21Å; V286-T383 PolarHBondContact O-N 3.18Å; V286-T383 PolarHBondContact O-OG1 2.89Å
287	D	94.8	Very high	95.4	Very high	91 Å²	91	63.6 Å²	63.6	49%	0.487	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	140.2	177.6	-60.7	-26.4	0	0	0	110.1	S290 T383 V385	D287-S290 WeakPolarHBondContact O-CB 3.19Å; D287-S290 PolarHBondContact O-N 3.38Å; D287-S290 PolarHBondContact O-OG 2.86Å; D287-T383 WeakPolarHBondContact CA-OG1 3.2Å; D287-T383 PolarHBondContact N-OG1 2.76Å; D287-T383 VanDerWaalsContact N-OG1 3.13Å; D287-T383 WeakPolarHBondContact OD1-CB 3.44Å; D287-T383 PolarHBondContact OD1-OG1 2.77Å; D287-V385 HydrophobicContact CB-CG2 3.96Å
288	E	94.9	Very high	95.4	Very high	7 Å²	7	65.2 Å²	65.2	3%	0.033	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	161.2	168.9	74.5	-168.4	133.9	0	0	112.2	S290 R349 V382 T383 D384 V385	E288-S290 PolarHBondContact O-N 3.31Å; E288-R349 WeakPolarHBondContact OE2-CB 3.13Å; E288-R349 PolarHBondContact OE2-N 2.9Å; E288-V382 HydrophobicContact CB-CG1 3.62Å; E288-T383 PolarHBondContact N-O 3.28Å; E288-D384 WeakPolarHBondContact OE1-CA 3.35Å; E288-V385 HydrophobicContact CG-CB 3.77Å; E288-V385 HydrophobicContact CG-CG2 3.98Å; E288-V385 PolarHBondContact OE1-N 3.33Å
289	G	89.9	Confident	95.5	Very high	61 Å²	61	59.6 Å²	59.6	63%	0.629	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	3.8	-173.1	0	0	0	0	0	114.7	K291 L347	G289-K291 PolarHBondContact O-N 2.73Å; G289-L347 PolarHBondContact N-O 3.24Å
290	S	93.1	Very high	95.5	Very high	18 Å²	18	58.6 Å²	58.6	13%	0.126	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-54.1	134.8	176.3	-82.8	0	0	0	0	111.8	D287 E288	D287-S290 WeakPolarHBondContact O-CB 3.19Å; D287-S290 PolarHBondContact O-N 3.38Å; D287-S290 PolarHBondContact O-OG 2.86Å; E288-S290 PolarHBondContact O-N 3.31Å
291	K	92.7	Very high	95.5	Very high	169 Å²	169	53.4 Å²	53.4	74%	0.735	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-68.2	150	178	-65.1	176.9	-175.9	170.2	0	110.3	G289 G293 T294 T342	G289-K291 PolarHBondContact O-N 2.73Å; K291-G293 PolarHBondContact O-N 3.47Å; K291-T294 PolarHBondContact O-N 2.85Å; K291-T294 PolarHBondContact O-OG1 3.5Å; K291-T342 PolarHBondContact O-OG1 3.2Å
292	P	94.3	Very high	95.4	Very high	78 Å²	78	55.3 Å²	55.3	51%	0.506	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	133.8	169.7	-26.1	35.5	0	0	0	111.4	A345	P292-A345 HydrophobicContact CG-CB 4.5Å
293	G	93.8	Very high	95.4	Very high	55 Å²	55	54.7 Å²	54.7	57%	0.567	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	99	-1.2	-175.8	0	0	0	0	0	114.3	K291 Y295 T342	K291-G293 PolarHBondContact O-N 3.47Å; G293-Y295 PolarHBondContact O-N 2.87Å; G293-T342 WeakPolarHBondContact CA-O 3.13Å; G293-T342 PolarHBondContact N-O 3.4Å; G293-T342 PolarHBondContact N-OG1 2.77Å
294	T	96.3	Very high	95.3	Very high	48 Å²	48	50.9 Å²	50.9	29%	0.294	31%	0.312	S	S	.	.			trans	-66	130.4	174.1	-63.9	0	0	0	0	110.2	V286 K291 V341 T342	V286-T294 HydrophobicContact CG2-CG2 4.28Å; K291-T294 PolarHBondContact O-N 2.85Å; K291-T294 PolarHBondContact O-OG1 3.5Å; T294-V341 CarbonylContact O-C 3.56Å; T294-V341 VanDerWaalsContact O-CA 3.24Å; T294-V341 WeakPolarHBondContact O-CA 3.17Å; T294-V341 WeakPolarHBondContact O-CB 3.27Å; T294-T342 PolarHBondContact N-OG1 3.32Å; T294-T342 VanDerWaalsContact N-OG1 3.09Å; T294-T342 PolarHBondContact O-N 2.88Å
295	Y	96.9	Very high	95.2	Very high	135 Å²	135	50.2 Å²	50.2	53%	0.529	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	137	173.6	169.9	-93	0	0	0	111.2	G293 M297 T298 D339	G293-Y295 PolarHBondContact O-N 2.87Å; Y295-M297 WeakPolarHBondContact OH-CA 3.22Å; Y295-T298 WeakPolarHBondContact CE2-OG1 3.22Å; Y295-T298 PolarHBondContact OH-N 2.81Å; Y295-T298 PolarHBondContact OH-OG1 3.48Å; Y295-D339 HydrophobicContact CD2-CB 4.4Å; Y295-D339 HydrophobicContact CE2-CB 4.28Å
296	V	97.1	Very high	95	Very high	13 Å²	13	49.2 Å²	49.2	8%	0.079	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	-59	-178.6	-177.1	0	0	0	0	111.2	V286 F331 I340 T342 I380	V286-V296 HydrophobicContact CB-CG1 4.24Å; V286-V296 HydrophobicContact CB-CG2 4.08Å; V286-V296 HydrophobicContact CG2-CG2 4.15Å; V296-F331 HydrophobicContact CG2-CD1 4.11Å; V296-F331 HydrophobicContact CG2-CE1 4.09Å; V296-I340 HydrophobicContact CB-CG2 4.47Å; V296-I340 WeakPolarHBondContact CB-O 3.45Å; V296-I340 PolarHBondContact N-O 3.45Å; V296-T342 HydrophobicContact CG2-CG2 3.88Å; V296-I380 HydrophobicContact CG1-CD1 4.26Å; V296-I380 HydrophobicContact CG1-CG2 3.62Å
297	M	96.6	Very high	94.6	Very high	14 Å²	14	53 Å²	53	7%	0.069	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	171.1	-179.9	71.2	-176.8	80.8	0	0	110.7	G284 Y295 I340 A378 I380	G284-M297 VanDerWaalsContact CA-CE 3.46Å; Y295-M297 WeakPolarHBondContact OH-CA 3.22Å; M297-I340 HydrophobicContact CG-CB 4.23Å; M297-I340 HydrophobicContact CG-CD1 3.95Å; M297-I340 HydrophobicContact CG-CG1 4.35Å; M297-I340 PolarHBondContact O-N 3.4Å; M297-I340 HydrophobicContact SD-CD1 4.33Å; M297-A378 HydrophobicContact SD-CB 3.95Å; M297-I380 HydrophobicContact CE-CB 4.3Å; M297-I380 HydrophobicContact CE-CD1 4.13Å; M297-I380 HydrophobicContact CE-CG1 3.61Å; M297-I380 HydrophobicContact CE-CG2 4.44Å
298	T	97.1	Very high	94.3	Very high	45 Å²	45	53.8 Å²	53.8	28%	0.276	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134.7	172.1	-53.1	0	0	0	0	109.9	Y295 T337 D339	Y295-T298 WeakPolarHBondContact CE2-OG1 3.22Å; Y295-T298 PolarHBondContact OH-N 2.81Å; Y295-T298 PolarHBondContact OH-OG1 3.48Å; T298-T337 WeakPolarHBondContact CG2-O 3.47Å; T298-D339 WeakPolarHBondContact CB-OD1 3.21Å; T298-D339 VanDerWaalsContact CG2-OD1 3.27Å; T298-D339 WeakPolarHBondContact CG2-OD1 3.49Å; T298-D339 PolarHBondContact OG1-OD1 3.41Å
299	V	96.9	Very high	94.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	34%	0.339	C	S	.	.			trans	-107.2	145	170.9	-61.2	0	0	0	0	109.8	F277 Y282 Y316 I333 G338 I340 V359	F277-V299 HydrophobicContact CE1-CB 4.23Å; F277-V299 HydrophobicContact CE1-CG2 4.2Å; Y282-V299 HydrophobicContact CD1-CG1 4.07Å; Y282-V299 HydrophobicContact CD2-CB 4.36Å; Y282-V299 HydrophobicContact CD2-CG1 3.81Å; Y282-V299 HydrophobicContact CE1-CB 4.46Å; Y282-V299 HydrophobicContact CE1-CG1 4.44Å; Y282-V299 HydrophobicContact CE2-CB 4.24Å; Y282-V299 HydrophobicContact CE2-CG1 4.19Å; Y282-V299 HydrophobicContact CG-CG1 3.75Å; V299-Y316 HydrophobicContact CG2-CD1 4.24Å; V299-I333 HydrophobicContact CG2-CD1 3.43Å; V299-I333 VanDerWaalsContact CG2-CD1 3.43Å; V299-G338 PolarHBondContact N-O 3.04Å; V299-I340 HydrophobicContact CG1-CD1 4.06Å; V299-V359 HydrophobicContact CG1-CG2 4.36Å; V299-V359 HydrophobicContact CG2-CB 4.44Å; V299-V359 HydrophobicContact CG2-CG1 4.4Å; V299-V359 HydrophobicContact CG2-CG2 4.21Å
300	T	96.2	Very high	94.2	Very high	60 Å²	60	54.4 Å²	54.4	37%	0.368	32%	0.324	S	S	.	.			trans	-136.7	128.5	-174.2	-47.7	0	0	0	0	110.7	I278 Y282	I278-T300 HydrophobicContact CD1-CG2 3.94Å; I278-T300 PolarHBondContact N-O 3.49Å; I278-T300 VanDerWaalsContact N-O 3.1Å; Y282-T300 PolarHBondContact OH-O 2.78Å
301	A	95.6	Very high	94.1	Very high	10 Å²	10	54.8 Å²	54.8	8%	0.083	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144.9	170.4	0	0	0	0	0	110.1	P275 E276 F277 V314 Y316 A361	P275-A301 HydrophobicContact CB-CB 4.24Å; E276-A301 CarbonylContact O-C 3.55Å; E276-A301 VanDerWaalsContact O-CA 3.22Å; E276-A301 WeakPolarHBondContact O-CA 3.06Å; F277-A301 HydrophobicContact CD1-CB 3.88Å; F277-A301 HydrophobicContact CD2-CB 4.36Å; F277-A301 HydrophobicContact CE1-CB 4.07Å; F277-A301 HydrophobicContact CG-CB 4.03Å; F277-A301 HydrophobicContact CZ-CB 4.4Å; A301-V314 HydrophobicContact CB-CG1 4.43Å; A301-Y316 HydrophobicContact CB-CE1 3.95Å; A301-Y316 PolarHBondContact N-OH 3.31Å; A301-Y316 PolarHBondContact O-OH 2.73Å; A301-A361 HydrophobicContact CB-CB 3.59Å
302	N	94.5	Very high	94	Very high	114 Å²	114	47.2 Å²	47.2	61%	0.61	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.2	176.9	-175.5	64.7	0	0	0	109.7	E276	E276-N302 PolarHBondContact N-O 2.91Å; E276-N302 PolarHBondContact O-N 2.95Å
303	D	96.3	Very high	93.9	Very high	12 Å²	12	46.8 Å²	46.8	6%	0.064	29%	0.287	C	S	.	.			trans	-104.6	142.7	168.4	-150.2	-56	0	0	0	109.3	R274 P275 D305 V314	R274-D303 VanDerWaalsContact C-OD2 3.26Å; P275-D303 WeakPolarHBondContact CA-OD2 3.48Å; P275-D303 WeakPolarHBondContact CD-OD2 3.41Å; P275-D303 VanDerWaalsContact CG-OD2 3.28Å; P275-D303 WeakPolarHBondContact CG-OD2 3.49Å; D303-D305 PolarHBondContact OD1-N 2.72Å; D303-D305 VanDerWaalsContact OD1-N 3.12Å; D303-V314 HydrophobicContact CB-CG2 3.9Å
304	A	95.2	Very high	94	Very high	48 Å²	48	45.2 Å²	45.2	40%	0.397	27%	0.266	S	S	.	.	S	Bend	trans	-82.3	-22.8	-179.9	0	0	0	0	0	112.1	R237 E238 N273	R237-A304 PolarHBondContact NH2-O 3.37Å; E238-A304 HydrophobicContact CG-CB 4.01Å; N273-A304 HydrophobicContact CB-CB 3.94Å
305	D	94.8	Very high	93.9	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.021	26%	0.264	C	S	.	.	S	Bend	trans	-64.2	168.8	178.9	-64	-11.1	0	0	0	111.6	N271 D272 N273 D303 S307 N311	N271-D305 VanDerWaalsContact CA-OD2 3.29Å; N271-D305 WeakPolarHBondContact CA-OD2 3.2Å; N271-D305 PolarHBondContact OD1-OD2 2.9Å; D272-D305 PolarHBondContact N-OD2 2.87Å; N273-D305 VanDerWaalsContact CB-OD1 3.23Å; N273-D305 WeakPolarHBondContact CB-OD1 3.16Å; N273-D305 PolarHBondContact N-OD1 2.77Å; N273-D305 PolarHBondContact N-OD2 2.84Å; N273-D305 PolarHBondContact ND2-OD1 2.87Å; D303-D305 PolarHBondContact OD1-N 2.72Å; D303-D305 VanDerWaalsContact OD1-N 3.12Å; D305-S307 PolarHBondContact O-N 3.25Å; D305-N311 HydrophobicContact CB-CB 3.87Å
306	D	92.3	Very high	94	Very high	45 Å²	45	40.7 Å²	40.7	24%	0.241	24%	0.243	C	C	.	.			trans	-62.3	106.3	-177.4	-171.9	-13	0	0	0	112.1	D269 T308 T309 G312	D269-D306 HydrophobicContact CB-CB 3.86Å; D269-D306 VanDerWaalsContact CG-CB 3.45Å; D269-D306 VanDerWaalsContact CG-N 3.33Å; D269-D306 PolarHBondContact OD1-N 3.5Å; D269-D306 PolarHBondContact OD2-N 3.4Å; D306-T308 VanDerWaalsContact CG-OG1 3.23Å; D306-T308 PolarHBondContact O-N 2.68Å; D306-T308 WeakPolarHBondContact OD1-CB 3.41Å; D306-T308 PolarHBondContact OD1-N 3.47Å; D306-T308 PolarHBondContact OD1-OG1 2.81Å; D306-T308 PolarHBondContact OD2-OG1 2.77Å; D306-T309 HydrophobicContact CB-CG2 4.03Å; D306-T309 PolarHBondContact O-N 3.46Å; D306-T309 PolarHBondContact O-OG1 3.34Å; D306-G312 PolarHBondContact O-N 2.74Å
307	S	88.4	Confident	93.9	Very high	87 Å²	87	44.1 Å²	44.1	61%	0.608	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-14.5	178.3	60.9	0	0	0	0	115.2	D305 T309	D305-S307 PolarHBondContact O-N 3.25Å; S307-T309 VanDerWaalsContact C-N 3.32Å
308	T	88.4	Confident	93.9	Very high	106 Å²	106	45.6 Å²	45.6	65%	0.65	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-12.3	173.2	70.3	0	0	0	0	113	D306 M313	D306-T308 VanDerWaalsContact CG-OG1 3.23Å; D306-T308 PolarHBondContact O-N 2.68Å; D306-T308 WeakPolarHBondContact OD1-CB 3.41Å; D306-T308 PolarHBondContact OD1-N 3.47Å; D306-T308 PolarHBondContact OD1-OG1 2.81Å; D306-T308 PolarHBondContact OD2-OG1 2.77Å; T308-M313 WeakPolarHBondContact O-CE 3.28Å
309	T	90.2	Very high	93.8	Very high	45 Å²	45	46.9 Å²	46.9	28%	0.276	27%	0.27	S	S	.	.	S	Bend	trans	-109.6	169.8	178.8	79.3	0	0	0	0	111.3	D269 D306 S307 N311 G312 M313	D269-T309 PolarHBondContact OD2-OG1 2.99Å; D306-T309 HydrophobicContact CB-CG2 4.03Å; D306-T309 PolarHBondContact O-N 3.46Å; D306-T309 PolarHBondContact O-OG1 3.34Å; S307-T309 VanDerWaalsContact C-N 3.32Å; T309-N311 PolarHBondContact O-N 2.72Å; T309-N311 PolarHBondContact OG1-N 3.43Å; T309-G312 PolarHBondContact O-N 3.44Å; T309-M313 WeakPolarHBondContact O-CG 3.32Å; T309-M313 PolarHBondContact O-N 2.8Å
310	A	90.9	Very high	93.7	Very high	37 Å²	37	50.2 Å²	50.2	31%	0.306	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.5	176.4	0	0	0	0	0	112.5	M313 M364	A310-M313 PolarHBondContact O-N 3.29Å; A310-M364 HydrophobicContact CB-SD 3.76Å; A310-M364 WeakPolarHBondContact O-CA 3.35Å; A310-M364 PolarHBondContact O-N 2.87Å
311	N	91.9	Very high	93.7	Very high	25 Å²	25	47.9 Å²	47.9	13%	0.134	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-44.4	-178.4	-54.2	-21.9	0	0	0	111.3	D269 N271 D305 T309 D363 M364	D269-N311 VanDerWaalsContact OD2-CB 3.23Å; D269-N311 WeakPolarHBondContact OD2-CB 3.02Å; D269-N311 PolarHBondContact OD2-ND2 2.71Å; N271-N311 HydrophobicContact CB-CB 4.1Å; N271-N311 VanDerWaalsContact OD1-CA 3.23Å; N271-N311 WeakPolarHBondContact OD1-CA 3.16Å; N271-N311 WeakPolarHBondContact OD1-CB 3.32Å; N271-N311 PolarHBondContact OD1-O 2.84Å; D305-N311 HydrophobicContact CB-CB 3.87Å; T309-N311 PolarHBondContact O-N 2.72Å; T309-N311 PolarHBondContact OG1-N 3.43Å; N311-D363 VanDerWaalsContact O-CB 3.26Å; N311-D363 WeakPolarHBondContact O-CB 3.27Å; N311-M364 WeakPolarHBondContact OD1-CE 3.36Å
312	G	90.1	Very high	93.6	Very high	11 Å²	11	51.1 Å²	51.1	11%	0.113	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	0.1	175.1	0	0	0	0	0	115.4	D306 T309 V314	D306-G312 PolarHBondContact O-N 2.74Å; T309-G312 PolarHBondContact O-N 3.44Å; G312-V314 PolarHBondContact O-N 2.73Å
313	M	93.1	Very high	93.6	Very high	68 Å²	68	47.9 Å²	47.9	34%	0.335	28%	0.279	S	S	.	.			trans	-89.6	100	-176.7	-80.8	-179.2	-164.5	0	0	112.4	T308 T309 A310 D363 M364 E365	T308-M313 WeakPolarHBondContact O-CE 3.28Å; T309-M313 WeakPolarHBondContact O-CG 3.32Å; T309-M313 PolarHBondContact O-N 2.8Å; A310-M313 PolarHBondContact O-N 3.29Å; M313-D363 CarbonylContact O-C 3.49Å; M313-M364 PolarHBondContact O-N 3.31Å; M313-E365 HydrophobicContact CB-CG 4.28Å; M313-E365 PolarHBondContact O-N 3.38Å; M313-E365 VanDerWaalsContact O-N 3.13Å; M313-E365 HydrophobicContact SD-CG 4.31Å
314	V	94.6	Very high	93.3	Very high	22 Å²	22	53.2 Å²	53.2	13%	0.133	30%	0.304	C	S	.	.			trans	-83.5	139.3	-177.8	-174.6	0	0	0	0	112.4	P275 A301 D303 G312 Y316 A361	P275-V314 HydrophobicContact CB-CG1 4.16Å; P275-V314 HydrophobicContact CB-CG2 4.02Å; P275-V314 HydrophobicContact CG-CG1 4.26Å; P275-V314 HydrophobicContact CG-CG2 3.95Å; A301-V314 HydrophobicContact CB-CG1 4.43Å; D303-V314 HydrophobicContact CB-CG2 3.9Å; G312-V314 PolarHBondContact O-N 2.73Å; V314-Y316 HydrophobicContact CG1-CE1 4.32Å; V314-A361 HydrophobicContact CG1-CB 3.68Å
315	R	95.8	Very high	92.9	Very high	67 Å²	67	54 Å²	54	25%	0.253	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	144.3	166.4	-63.1	-64	-178.1	141	-16.4	112.6	S335 E336 A361 T362 E365	R315-S335 CarbonylContact C-O 3.49Å; R315-S335 WeakPolarHBondContact CA-O 3.38Å; R315-S335 WeakPolarHBondContact CD-O 3.22Å; R315-S335 PolarHBondContact NH1-OG 2.79Å; R315-E336 IonicContact CZ-OE1 3.1Å; R315-E336 VanDerWaalsContact NH1-CD 3.31Å; R315-E336 IonicContact NH1-OE1 3.83Å; R315-E336 PolarHBondContact NH1-OE1 2.77Å; R315-E336 IonicContact NH2-OE1 2.69Å; R315-E336 PolarHBondContact NH2-OE1 2.78Å; R315-A361 WeakPolarHBondContact O-CA 3.26Å; R315-T362 PolarHBondContact N-O 3.02Å; R315-T362 PolarHBondContact O-N 3.09Å; R315-E365 WeakPolarHBondContact CG-O 3.13Å
316	Y	97	Very high	92.5	Very high	21 Å²	21	57.7 Å²	57.7	8%	0.082	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	147.6	-178.6	-55	-84.6	0	0	0	112.9	F277 V299 A301 V314 I333 S335 Q360 A361	F277-Y316 HydrophobicContact CE1-CD1 4.19Å; F277-Y316 AromaticContact CE1-CE1 4Å; F277-Y316 HydrophobicContact CE1-CE1 4Å; F277-Y316 HydrophobicContact CZ-CD1 4.36Å; F277-Y316 HydrophobicContact CZ-CE1 4.45Å; V299-Y316 HydrophobicContact CG2-CD1 4.24Å; A301-Y316 HydrophobicContact CB-CE1 3.95Å; A301-Y316 PolarHBondContact N-OH 3.31Å; A301-Y316 PolarHBondContact O-OH 2.73Å; V314-Y316 HydrophobicContact CG1-CE1 4.32Å; Y316-I333 HydrophobicContact CG-CD1 4.27Å; Y316-S335 PolarHBondContact N-O 3.41Å; Y316-S335 WeakPolarHBondContact O-CA 3.29Å; Y316-Q360 CarbonylContact C-O 3.58Å; Y316-Q360 WeakPolarHBondContact CA-O 3.26Å; Y316-A361 HydrophobicContact CD1-CB 4.15Å; Y316-A361 HydrophobicContact CE1-CB 4.1Å
317	R	96.4	Very high	92.3	Very high	86 Å²	86	57.7 Å²	57.7	33%	0.325	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	159.7	166.3	65.5	164.2	179.5	-123.5	11.6	112.4	I333 V359 Q360 L368	R317-I333 VanDerWaalsContact CA-CG2 3.41Å; R317-V359 CarbonylContact O-C 3.58Å; R317-V359 WeakPolarHBondContact O-CA 3.27Å; R317-Q360 HydrophobicContact CG-CB 4.14Å; R317-Q360 PolarHBondContact N-O 2.92Å; R317-Q360 PolarHBondContact O-N 3.15Å; R317-L368 VanDerWaalsContact CZ-CD2 3.45Å; R317-L368 VanDerWaalsContact NH1-CG 3.28Å; R317-L368 VanDerWaalsContact NH2-CD1 3.33Å
318	I	96.5	Very high	92.3	Very high	44 Å²	44	59.6 Å²	59.6	23%	0.226	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	129.1	169.1	-66.6	168.7	0	0	0	108.6	F331 I333 V357 V359	I318-F331 HydrophobicContact CD1-CB 4.01Å; I318-F331 WeakPolarHBondContact CD1-O 3.33Å; I318-I333 HydrophobicContact CD1-CB 4.22Å; I318-I333 HydrophobicContact CD1-CG2 4.34Å; I318-I333 HydrophobicContact CG1-CB 4.07Å; I318-I333 HydrophobicContact CG1-CG2 3.81Å; I318-V357 HydrophobicContact CB-CG1 4.28Å; I318-V357 HydrophobicContact CD1-CG1 3.94Å; I318-V357 HydrophobicContact CG1-CG1 3.76Å; I318-V357 HydrophobicContact CG2-CG1 3.61Å; I318-V359 HydrophobicContact CG1-CG1 4.35Å
319	V	95	Very high	92.4	Very high	72 Å²	72	59.8 Å²	59.8	44%	0.436	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-48.2	178.3	-176	0	0	0	0	110.3	I358 Q360	V319-I358 HydrophobicContact CB-CB 4.47Å; V319-I358 HydrophobicContact CB-CG2 4.32Å; V319-I358 PolarHBondContact N-O 3.04Å; V319-Q360 HydrophobicContact CG2-CB 3.48Å; V319-Q360 VanDerWaalsContact CG2-CB 3.48Å; V319-Q360 HydrophobicContact CG2-CG 4.44Å
320	T	95.1	Very high	92.6	Very high	71 Å²	71	57.7 Å²	57.7	44%	0.436	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	149.3	-179.3	51.3	0	0	0	0	111.3	V357 I358	T320-V357 WeakPolarHBondContact O-CA 3.32Å; T320-I358 PolarHBondContact O-N 2.74Å; T320-I358 WeakPolarHBondContact OG1-CB 3.38Å; T320-I358 WeakPolarHBondContact OG1-CG1 3.22Å
321	Q	94.8	Very high	92.8	Very high	11 Å²	11	56.3 Å²	56.3	5%	0.051	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.2	169.6	179.6	-166.7	-66.3	0	0	108.8	P323 S327 F331 Y355 T356 V357	Q321-P323 PolarHBondContact NE2-O 3.18Å; Q321-P323 VanDerWaalsContact NE2-O 3.15Å; Q321-S327 PolarHBondContact NE2-O 3.09Å; Q321-F331 HydrophobicContact CG-CD2 4.45Å; Q321-Y355 HydrophobicContact CG-CD1 3.95Å; Q321-T356 WeakPolarHBondContact CA-O 3.31Å; Q321-V357 HydrophobicContact CG-CG2 4.19Å
322	T	94.4	Very high	93	Very high	77 Å²	77	58.1 Å²	58.1	47%	0.472	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.1	173.5	50.5	0	0	0	0	110.1	Y355 T356	T322-Y355 CarbonylContact O-C 3.58Å; T322-Y355 WeakPolarHBondContact O-CA 3.21Å; T322-T356 PolarHBondContact N-O 2.9Å; T322-T356 PolarHBondContact O-N 2.76Å; T322-T356 PolarHBondContact OG1-O 2.84Å
323	P	94.5	Very high	93.4	Very high	46 Å²	46	58.3 Å²	58.3	30%	0.299	32%	0.315	S	S	.	.	S	Bend	cis	-74.2	165.3	-0.8	31.6	-35.5	0	0	0	113.8	Q321 V352 Q354 Y355	Q321-P323 PolarHBondContact NE2-O 3.18Å; Q321-P323 VanDerWaalsContact NE2-O 3.15Å; P323-V352 HydrophobicContact CG-CB 4.42Å; P323-V352 HydrophobicContact CG-CG1 3.42Å; P323-V352 VanDerWaalsContact CG-CG1 3.42Å; P323-V352 HydrophobicContact CG-CG2 4.05Å; P323-Q354 WeakPolarHBondContact CD-O 3.21Å; P323-Y355 HydrophobicContact CG-CD1 4.26Å; P323-Y355 HydrophobicContact CG-CE1 4.1Å
324	Q	89.3	Confident	93.6	Very high	124 Å²	124	58.4 Å²	58.4	58%	0.579	32%	0.317	S	S	*	.			trans	-88.6	-3.1	176.4	-66.5	-174.4	-4.8	0	0	113.4	S327 Q328	Q324-S327 CarbonylContact C-O 3.49Å; Q324-S327 CarbonylContact O-C 3.56Å; Q324-S327 PolarHBondContact O-N 3Å; Q324-Q328 HydrophobicContact CB-CG 4.36Å; Q324-Q328 PolarHBondContact O-N 3.35Å
325	S	86.4	Confident	93.6	Very high	64 Å²	64	59.7 Å²	59.7	45%	0.448	33%	0.326	S	S	.	.			trans	-96.9	144.2	173.7	54.6	0	0	0	0	109.8	Y355	S325-Y355 PolarHBondContact O-OH 3.24Å
326	P	87.6	Confident	93.5	Very high	82 Å²	82	62.2 Å²	62.2	53%	0.532	34%	0.341	S	S	.	.	S	Bend	cis	-81	-16.5	1	31.7	-33.9	0	0	0	114.2	M330 G346 Y355	P326-M330 HydrophobicContact CG-CE 4.18Å; P326-M330 HydrophobicContact CG-SD 3.89Å; P326-G346 VanDerWaalsContact CG-O 3.32Å; P326-G346 WeakPolarHBondContact CG-O 3.48Å; P326-Y355 WeakPolarHBondContact CD-OH 3.36Å
327	S	88.6	Confident	93.4	Very high	45 Å²	45	64.3 Å²	64.3	32%	0.315	36%	0.356	S	S	.	.			trans	-132.5	146.2	175.2	177.7	0	0	0	0	110.8	Q321 Q324 N329	Q321-S327 PolarHBondContact NE2-O 3.09Å; Q324-S327 CarbonylContact C-O 3.49Å; Q324-S327 CarbonylContact O-C 3.56Å; Q324-S327 PolarHBondContact O-N 3Å; S327-N329 PolarHBondContact O-N 2.8Å; S327-N329 PolarHBondContact OG-N 2.88Å; S327-N329 PolarHBondContact OG-O 3.39Å
328	Q	86.7	Confident	93.4	Very high	128 Å²	128	60.2 Å²	60.2	60%	0.598	34%	0.341	S	S	*	.	S	Bend	trans	-62	-26.9	177.2	-70.5	-178	-18.1	0	0	112.7	Q324	Q324-Q328 HydrophobicContact CB-CG 4.36Å; Q324-Q328 PolarHBondContact O-N 3.35Å
329	N	90.4	Very high	93.4	Very high	110 Å²	110	60.2 Å²	60.2	59%	0.588	34%	0.341	S	S	*	.			trans	-126.6	88.4	178.8	-57.2	-40.9	0	0	0	108.5	S327 V343	S327-N329 PolarHBondContact O-N 2.8Å; S327-N329 PolarHBondContact OG-N 2.88Å; S327-N329 PolarHBondContact OG-O 3.39Å; N329-V343 WeakPolarHBondContact O-CG2 3.45Å
330	M	94.4	Very high	93.6	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	32%	0.321	C	S	.	.	S	Bend	trans	-84	-31.1	171.5	-67.6	-61.4	-67.9	0	0	111.1	P326 T342 V343 A344 L347 Y355	P326-M330 HydrophobicContact CG-CE 4.18Å; P326-M330 HydrophobicContact CG-SD 3.89Å; M330-T342 WeakPolarHBondContact O-CA 3.38Å; M330-V343 WeakPolarHBondContact O-CG2 3.31Å; M330-V343 PolarHBondContact O-N 2.9Å; M330-A344 HydrophobicContact CE-CB 4.47Å; M330-A344 HydrophobicContact SD-CB 3.82Å; M330-L347 HydrophobicContact CE-CB 4.46Å; M330-L347 HydrophobicContact CE-CD2 3.55Å; M330-L347 HydrophobicContact CE-CG 3.63Å; M330-Y355 HydrophobicContact CG-CE1 3.95Å
331	F	96.6	Very high	93.6	Very high	7 Å²	7	55.2 Å²	55.2	3%	0.031	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	149.1	-177.6	-51.2	-77.7	0	0	0	111.6	V286 V296 I318 Q321 I340 V341 T342 L347 Y355 V357 I380	V286-F331 HydrophobicContact CG1-CE1 4.27Å; V296-F331 HydrophobicContact CG2-CD1 4.11Å; V296-F331 HydrophobicContact CG2-CE1 4.09Å; I318-F331 HydrophobicContact CD1-CB 4.01Å; I318-F331 WeakPolarHBondContact CD1-O 3.33Å; Q321-F331 HydrophobicContact CG-CD2 4.45Å; F331-I340 HydrophobicContact CB-CG2 3.86Å; F331-I340 HydrophobicContact CD1-CG2 4.26Å; F331-I340 HydrophobicContact CG-CG2 4.3Å; F331-V341 CarbonylContact C-O 3.58Å; F331-V341 WeakPolarHBondContact CA-O 3.18Å; F331-T342 HydrophobicContact CD1-CG2 4.35Å; F331-T342 HydrophobicContact CE1-CG2 4.19Å; F331-L347 HydrophobicContact CZ-CD2 4.05Å; F331-Y355 HydrophobicContact CE2-CD1 4.06Å; F331-Y355 AromaticContact CE2-CD2 3.94Å; F331-Y355 HydrophobicContact CE2-CD2 3.94Å; F331-Y355 AromaticContact CE2-CG 3.65Å; F331-Y355 HydrophobicContact CE2-CG 3.65Å; F331-Y355 HydrophobicContact CZ-CD2 4.03Å; F331-Y355 HydrophobicContact CZ-CG 4.21Å; F331-V357 HydrophobicContact CD2-CG2 3.93Å; F331-V357 HydrophobicContact CE2-CG2 4.44Å; F331-I380 HydrophobicContact CD1-CD1 3.82Å; F331-I380 HydrophobicContact CD2-CD1 3.79Å; F331-I380 HydrophobicContact CE1-CD1 3.8Å; F331-I380 HydrophobicContact CE1-CG2 4.04Å; F331-I380 HydrophobicContact CE2-CD1 3.79Å; F331-I380 HydrophobicContact CG-CD1 3.82Å; F331-I380 HydrophobicContact CZ-CB 4.25Å; F331-I380 HydrophobicContact CZ-CD1 3.79Å; F331-I380 HydrophobicContact CZ-CG2 3.87Å
332	T	96.3	Very high	93.7	Very high	63 Å²	63	54.8 Å²	54.8	39%	0.387	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	157.7	163.4	-166	0	0	0	0	108.9	I340 V341 V343	T332-I340 CarbonylContact O-C 3.51Å; T332-I340 WeakPolarHBondContact O-CA 3.37Å; T332-V341 HydrophobicContact CG2-CG2 3.41Å; T332-V341 VanDerWaalsContact CG2-CG2 3.41Å; T332-V341 PolarHBondContact N-O 2.82Å; T332-V341 PolarHBondContact O-N 2.94Å; T332-V343 VanDerWaalsContact CB-CG1 3.5Å; T332-V343 HydrophobicContact CG2-CG1 3.22Å
333	I	97.5	Very high	93.7	Very high	16 Å²	16	54.2 Å²	54.2	8%	0.082	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	137.9	174.3	-171.6	164.6	0	0	0	109.9	V299 Y316 R317 I318 S335 D339 I340 V359	V299-I333 HydrophobicContact CG2-CD1 3.43Å; V299-I333 VanDerWaalsContact CG2-CD1 3.43Å; Y316-I333 HydrophobicContact CG-CD1 4.27Å; R317-I333 VanDerWaalsContact CA-CG2 3.41Å; I318-I333 HydrophobicContact CD1-CB 4.22Å; I318-I333 HydrophobicContact CD1-CG2 4.34Å; I318-I333 HydrophobicContact CG1-CB 4.07Å; I318-I333 HydrophobicContact CG1-CG2 3.81Å; I333-S335 PolarHBondContact O-N 2.86Å; I333-D339 CarbonylContact C-O 3.51Å; I333-D339 VanDerWaalsContact CA-O 3.28Å; I333-D339 WeakPolarHBondContact CA-O 3.33Å; I333-I340 HydrophobicContact CB-CG1 4.25Å; I333-I340 HydrophobicContact CD1-CD1 4.45Å; I333-I340 HydrophobicContact CD1-CG1 3.91Å; I333-I340 HydrophobicContact CG1-CG1 4.03Å; I333-V359 HydrophobicContact CD1-CG1 4.11Å
334	N	97	Very high	93.4	Very high	70 Å²	70	53 Å²	53	37%	0.374	30%	0.299	S	S	.	.			trans	-69.2	122.6	169.4	-176.7	-34.2	0	0	0	109	E336 T337 G338 D339	N334-E336 PolarHBondContact O-N 2.8Å; N334-E336 PolarHBondContact OD1-N 2.8Å; N334-T337 VanDerWaalsContact CB-OG1 3.24Å; N334-T337 WeakPolarHBondContact CB-OG1 3.33Å; N334-T337 PolarHBondContact ND2-OG1 3.44Å; N334-T337 PolarHBondContact OD1-N 3.2Å; N334-G338 WeakPolarHBondContact O-CA 3.3Å; N334-G338 PolarHBondContact O-N 3.24Å; N334-D339 HydrophobicContact CB-CB 4.24Å; N334-D339 PolarHBondContact N-O 3.4Å
335	S	95.9	Very high	93.3	Very high	48 Å²	48	50.5 Å²	50.5	34%	0.336	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.7	-175.6	69.6	0	0	0	0	114.4	R315 Y316 I333	R315-S335 CarbonylContact C-O 3.49Å; R315-S335 WeakPolarHBondContact CA-O 3.38Å; R315-S335 WeakPolarHBondContact CD-O 3.22Å; R315-S335 PolarHBondContact NH1-OG 2.79Å; Y316-S335 PolarHBondContact N-O 3.41Å; Y316-S335 WeakPolarHBondContact O-CA 3.29Å; I333-S335 PolarHBondContact O-N 2.86Å
336	E	93.3	Very high	93.3	Very high	121 Å²	121	49.3 Å²	49.3	57%	0.565	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-49.1	-177.9	-67.6	-178.5	179.6	0	0	112	R315 N334	R315-E336 IonicContact CZ-OE1 3.1Å; R315-E336 VanDerWaalsContact NH1-CD 3.31Å; R315-E336 IonicContact NH1-OE1 3.83Å; R315-E336 PolarHBondContact NH1-OE1 2.77Å; R315-E336 IonicContact NH2-OE1 2.69Å; R315-E336 PolarHBondContact NH2-OE1 2.78Å; N334-E336 PolarHBondContact O-N 2.8Å; N334-E336 PolarHBondContact OD1-N 2.8Å
337	T	95.3	Very high	93.6	Very high	65 Å²	65	45.8 Å²	45.8	40%	0.399	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-21.8	-171.9	60	0	0	0	0	113.1	T298 N334 D339	T298-T337 WeakPolarHBondContact CG2-O 3.47Å; N334-T337 VanDerWaalsContact CB-OG1 3.24Å; N334-T337 WeakPolarHBondContact CB-OG1 3.33Å; N334-T337 PolarHBondContact ND2-OG1 3.44Å; N334-T337 PolarHBondContact OD1-N 3.2Å; T337-D339 VanDerWaalsContact C-N 3.28Å; T337-D339 VanDerWaalsContact CB-OD2 3.3Å; T337-D339 WeakPolarHBondContact CB-OD2 3.35Å; T337-D339 PolarHBondContact OG1-N 3.43Å; T337-D339 PolarHBondContact OG1-OD2 2.64Å
338	G	95.3	Very high	93.9	Very high	0 Å²	0	45 Å²	45	0%	0	27%	0.266	C	S	.	.			trans	78.5	10.7	-173	0	0	0	0	0	113.8	V299 N334 I340	V299-G338 PolarHBondContact N-O 3.04Å; N334-G338 WeakPolarHBondContact O-CA 3.3Å; N334-G338 PolarHBondContact O-N 3.24Å; G338-I340 PolarHBondContact O-N 3.17Å
339	D	97.7	Very high	94.3	Very high	44 Å²	44	40 Å²	40	24%	0.235	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	122.4	178.2	-58.9	-33.5	0	0	0	110.9	Y295 T298 I333 N334 T337	Y295-D339 HydrophobicContact CD2-CB 4.4Å; Y295-D339 HydrophobicContact CE2-CB 4.28Å; T298-D339 WeakPolarHBondContact CB-OD1 3.21Å; T298-D339 VanDerWaalsContact CG2-OD1 3.27Å; T298-D339 WeakPolarHBondContact CG2-OD1 3.49Å; T298-D339 PolarHBondContact OG1-OD1 3.41Å; I333-D339 CarbonylContact C-O 3.51Å; I333-D339 VanDerWaalsContact CA-O 3.28Å; I333-D339 WeakPolarHBondContact CA-O 3.33Å; N334-D339 HydrophobicContact CB-CB 4.24Å; N334-D339 PolarHBondContact N-O 3.4Å; T337-D339 VanDerWaalsContact C-N 3.28Å; T337-D339 VanDerWaalsContact CB-OD2 3.3Å; T337-D339 WeakPolarHBondContact CB-OD2 3.35Å; T337-D339 PolarHBondContact OG1-N 3.43Å; T337-D339 PolarHBondContact OG1-OD2 2.64Å
340	I	97.8	Very high	94.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	124.5	173.2	-56.8	-179.9	0	0	0	108.4	V296 M297 V299 F331 T332 I333 G338 V359 A378 I380	V296-I340 HydrophobicContact CB-CG2 4.47Å; V296-I340 WeakPolarHBondContact CB-O 3.45Å; V296-I340 PolarHBondContact N-O 3.45Å; M297-I340 HydrophobicContact CG-CB 4.23Å; M297-I340 HydrophobicContact CG-CD1 3.95Å; M297-I340 HydrophobicContact CG-CG1 4.35Å; M297-I340 PolarHBondContact O-N 3.4Å; M297-I340 HydrophobicContact SD-CD1 4.33Å; V299-I340 HydrophobicContact CG1-CD1 4.06Å; F331-I340 HydrophobicContact CB-CG2 3.86Å; F331-I340 HydrophobicContact CD1-CG2 4.26Å; F331-I340 HydrophobicContact CG-CG2 4.3Å; T332-I340 CarbonylContact O-C 3.51Å; T332-I340 WeakPolarHBondContact O-CA 3.37Å; I333-I340 HydrophobicContact CB-CG1 4.25Å; I333-I340 HydrophobicContact CD1-CD1 4.45Å; I333-I340 HydrophobicContact CD1-CG1 3.91Å; I333-I340 HydrophobicContact CG1-CG1 4.03Å; G338-I340 PolarHBondContact O-N 3.17Å; I340-V359 HydrophobicContact CD1-CG1 4.06Å; I340-A378 HydrophobicContact CD1-CB 4.05Å; I340-I380 HydrophobicContact CG2-CD1 4.24Å
341	V	96.9	Very high	94.5	Very high	38 Å²	38	45.3 Å²	45.3	23%	0.23	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	154.1	179	-52.3	0	0	0	0	110.9	T294 F331 T332	T294-V341 CarbonylContact O-C 3.56Å; T294-V341 VanDerWaalsContact O-CA 3.24Å; T294-V341 WeakPolarHBondContact O-CA 3.17Å; T294-V341 WeakPolarHBondContact O-CB 3.27Å; F331-V341 CarbonylContact C-O 3.58Å; F331-V341 WeakPolarHBondContact CA-O 3.18Å; T332-V341 HydrophobicContact CG2-CG2 3.41Å; T332-V341 VanDerWaalsContact CG2-CG2 3.41Å; T332-V341 PolarHBondContact N-O 2.82Å; T332-V341 PolarHBondContact O-N 2.94Å
342	T	96.3	Very high	94.4	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	144.5	175.3	63.7	0	0	0	0	110.9	V286 K291 G293 T294 V296 M330 F331 L347	V286-T342 HydrophobicContact CG2-CG2 3.95Å; K291-T342 PolarHBondContact O-OG1 3.2Å; G293-T342 WeakPolarHBondContact CA-O 3.13Å; G293-T342 PolarHBondContact N-O 3.4Å; G293-T342 PolarHBondContact N-OG1 2.77Å; T294-T342 PolarHBondContact N-OG1 3.32Å; T294-T342 VanDerWaalsContact N-OG1 3.09Å; T294-T342 PolarHBondContact O-N 2.88Å; V296-T342 HydrophobicContact CG2-CG2 3.88Å; M330-T342 WeakPolarHBondContact O-CA 3.38Å; F331-T342 HydrophobicContact CD1-CG2 4.35Å; F331-T342 HydrophobicContact CE1-CG2 4.19Å; T342-L347 HydrophobicContact CG2-CD1 3.85Å
343	V	94	Very high	94.3	Very high	65 Å²	65	48.6 Å²	48.6	39%	0.394	27%	0.273	S	S	.	.			trans	-127.5	-19.5	177.1	-67.6	0	0	0	0	114.4	N329 M330 T332	N329-V343 WeakPolarHBondContact O-CG2 3.45Å; M330-V343 WeakPolarHBondContact O-CG2 3.31Å; M330-V343 PolarHBondContact O-N 2.9Å; T332-V343 VanDerWaalsContact CB-CG1 3.5Å; T332-V343 HydrophobicContact CG2-CG1 3.22Å
344	A	88.7	Confident	94.2	Very high	20 Å²	20	52.4 Å²	52.4	17%	0.165	29%	0.29	C	S	.	.	S	Bend	trans	-118.9	146.6	176.4	0	0	0	0	0	110	M330	M330-A344 HydrophobicContact CE-CB 4.47Å; M330-A344 HydrophobicContact SD-CB 3.82Å
345	A	86.9	Confident	94.2	Very high	73 Å²	73	49.1 Å²	49.1	60%	0.603	27%	0.273	S	S	*	.	S	Bend	trans	-78.3	163.1	167.8	0	0	0	0	0	110.2	P292	P292-A345 HydrophobicContact CG-CB 4.5Å
346	G	87.2	Confident	94.2	Very high	39 Å²	39	48.9 Å²	48.9	40%	0.402	27%	0.269	S	S	.	.			trans	101.2	20.9	177.2	0	0	0	0	0	114.5	P326 D348	P326-G346 VanDerWaalsContact CG-O 3.32Å; P326-G346 WeakPolarHBondContact CG-O 3.48Å; G346-D348 PolarHBondContact O-N 3.02Å
347	L	93.7	Very high	94.4	Very high	7 Å²	7	43.1 Å²	43.1	4%	0.037	24%	0.243	C	C	.	.			trans	-61.4	121.6	157.6	-68.7	170.1	0	0	0	107.3	V286 G289 M330 F331 T342 Y355 V382	V286-L347 HydrophobicContact CG1-CD1 3.83Å; V286-L347 HydrophobicContact CG2-CD1 3.95Å; G289-L347 PolarHBondContact N-O 3.24Å; M330-L347 HydrophobicContact CE-CB 4.46Å; M330-L347 HydrophobicContact CE-CD2 3.55Å; M330-L347 HydrophobicContact CE-CG 3.63Å; F331-L347 HydrophobicContact CZ-CD2 4.05Å; T342-L347 HydrophobicContact CG2-CD1 3.85Å; L347-Y355 HydrophobicContact CD2-CD2 4.35Å; L347-Y355 HydrophobicContact CD2-CE2 3.64Å; L347-V382 HydrophobicContact CD2-CG2 4.23Å
348	D	94.7	Very high	94.5	Very high	28 Å²	28	42.2 Å²	42.2	15%	0.15	24%	0.235	C	C	.	.			trans	-148.6	111.7	-172.3	169.3	-33.6	0	0	0	105.1	G346 E350 K351 V352	G346-D348 PolarHBondContact O-N 3.02Å; D348-E350 WeakPolarHBondContact OD1-CB 3.17Å; D348-E350 PolarHBondContact OD1-N 3Å; D348-E350 VanDerWaalsContact OD1-N 3.15Å; D348-K351 HydrophobicContact CB-CB 4.42Å; D348-K351 PolarHBondContact O-N 2.92Å; D348-K351 WeakPolarHBondContact OD1-CG 3Å; D348-K351 PolarHBondContact OD1-N 3.29Å; D348-K351 VanDerWaalsContact OD2-CD 3.31Å; D348-K351 WeakPolarHBondContact OD2-CD 3.37Å; D348-K351 WeakPolarHBondContact OD2-CE 3.1Å; D348-K351 WeakPolarHBondContact OD2-CG 3.21Å; D348-K351 IonicContact OD2-NZ 2.9Å; D348-K351 PolarHBondContact OD2-NZ 2.93Å; D348-V352 CarbonylContact O-C 3.47Å; D348-V352 PolarHBondContact O-N 2.83Å
349	R	95.5	Very high	94.6	Very high	25 Å²	25	42.2 Å²	42.2	9%	0.094	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-38.5	-173.1	-171.7	-145.8	67	90.3	-0.9	110	E288 K351 V352 Q353 V382 D384 R418	E288-R349 WeakPolarHBondContact OE2-CB 3.13Å; E288-R349 PolarHBondContact OE2-N 2.9Å; R349-K351 PolarHBondContact O-N 2.79Å; R349-V352 CarbonylContact O-C 3.57Å; R349-V352 PolarHBondContact O-N 2.88Å; R349-Q353 HydrophobicContact CG-CG 4.17Å; R349-Q353 WeakPolarHBondContact O-CG 3.22Å; R349-Q353 PolarHBondContact O-N 3.46Å; R349-V382 HydrophobicContact CB-CB 4.47Å; R349-V382 HydrophobicContact CB-CG1 4.01Å; R349-D384 WeakPolarHBondContact CD-OD1 3.32Å; R349-D384 IonicContact CZ-OD1 2.76Å; R349-D384 IonicContact NE-OD1 3.59Å; R349-D384 PolarHBondContact NE-OD1 2.9Å; R349-R418 PolarHBondContact NH2-O 2.89Å
350	E	95	Very high	94.6	Very high	54 Å²	54	41.2 Å²	41.2	25%	0.252	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.3	178.8	-71	58.6	-117.9	0	0	111.6	D348 R418	D348-E350 WeakPolarHBondContact OD1-CB 3.17Å; D348-E350 PolarHBondContact OD1-N 3Å; D348-E350 VanDerWaalsContact OD1-N 3.15Å; E350-R418 HydrophobicContact CG-CB 3.96Å; E350-R418 WeakPolarHBondContact CG-O 3.5Å
351	K	93.1	Very high	94.6	Very high	167 Å²	167	41.2 Å²	41.2	73%	0.726	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-50.2	173	-67.7	-176.3	-173.8	111.3	0	113.2	D348 R349	D348-K351 HydrophobicContact CB-CB 4.42Å; D348-K351 PolarHBondContact O-N 2.92Å; D348-K351 WeakPolarHBondContact OD1-CG 3Å; D348-K351 PolarHBondContact OD1-N 3.29Å; D348-K351 VanDerWaalsContact OD2-CD 3.31Å; D348-K351 WeakPolarHBondContact OD2-CD 3.37Å; D348-K351 WeakPolarHBondContact OD2-CE 3.1Å; D348-K351 WeakPolarHBondContact OD2-CG 3.21Å; D348-K351 IonicContact OD2-NZ 2.9Å; D348-K351 PolarHBondContact OD2-NZ 2.93Å; R349-K351 PolarHBondContact O-N 2.79Å
352	V	93.9	Very high	94.5	Very high	19 Å²	19	39.5 Å²	39.5	12%	0.115	22%	0.218	C	C	.	.			trans	-139.7	102.4	-174.9	-178.2	0	0	0	0	110.6	P323 D348 R349 Q354 Y355 V382	P323-V352 HydrophobicContact CG-CB 4.42Å; P323-V352 HydrophobicContact CG-CG1 3.42Å; P323-V352 VanDerWaalsContact CG-CG1 3.42Å; P323-V352 HydrophobicContact CG-CG2 4.05Å; D348-V352 CarbonylContact O-C 3.47Å; D348-V352 PolarHBondContact O-N 2.83Å; R349-V352 CarbonylContact O-C 3.57Å; R349-V352 PolarHBondContact O-N 2.88Å; V352-Q354 WeakPolarHBondContact CG1-O 3.33Å; V352-Y355 HydrophobicContact CB-CE2 4.24Å; V352-Y355 HydrophobicContact CG1-CD1 4.48Å; V352-Y355 HydrophobicContact CG1-CD2 4.15Å; V352-Y355 HydrophobicContact CG1-CE1 4.02Å; V352-Y355 HydrophobicContact CG1-CE2 3.63Å; V352-V382 WeakPolarHBondContact O-CG2 3.49Å
353	Q	94.4	Very high	94.5	Very high	120 Å²	120	39.5 Å²	39.5	56%	0.561	22%	0.218	S	C	*	.	S	Bend	trans	-77.1	-23	-177.5	-58.7	-178.4	79.9	0	0	113.9	R349 V382	R349-Q353 HydrophobicContact CG-CG 4.17Å; R349-Q353 WeakPolarHBondContact O-CG 3.22Å; R349-Q353 PolarHBondContact O-N 3.46Å; Q353-V382 PolarHBondContact O-N 2.78Å
354	Q	96.1	Very high	94.4	Very high	97 Å²	97	38.9 Å²	38.9	45%	0.453	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	141.2	-173.1	-172.3	175.2	82.2	0	0	112.3	P323 V352 I379 I380	P323-Q354 WeakPolarHBondContact CD-O 3.21Å; V352-Q354 WeakPolarHBondContact CG1-O 3.33Å; Q354-I379 HydrophobicContact CG-CG2 3.78Å; Q354-I379 VanDerWaalsContact NE2-CG2 3.28Å; Q354-I380 CarbonylContact C-O 3.59Å; Q354-I380 WeakPolarHBondContact CA-O 3.38Å
355	Y	96.3	Very high	94.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	135.8	171.5	-66.4	-95.4	0	0	0	110.6	Q321 T322 P323 S325 P326 M330 F331 L347 V352 I380 V382	Q321-Y355 HydrophobicContact CG-CD1 3.95Å; T322-Y355 CarbonylContact O-C 3.58Å; T322-Y355 WeakPolarHBondContact O-CA 3.21Å; P323-Y355 HydrophobicContact CG-CD1 4.26Å; P323-Y355 HydrophobicContact CG-CE1 4.1Å; S325-Y355 PolarHBondContact O-OH 3.24Å; P326-Y355 WeakPolarHBondContact CD-OH 3.36Å; M330-Y355 HydrophobicContact CG-CE1 3.95Å; F331-Y355 HydrophobicContact CE2-CD1 4.06Å; F331-Y355 AromaticContact CE2-CD2 3.94Å; F331-Y355 HydrophobicContact CE2-CD2 3.94Å; F331-Y355 AromaticContact CE2-CG 3.65Å; F331-Y355 HydrophobicContact CE2-CG 3.65Å; F331-Y355 HydrophobicContact CZ-CD2 4.03Å; F331-Y355 HydrophobicContact CZ-CG 4.21Å; L347-Y355 HydrophobicContact CD2-CD2 4.35Å; L347-Y355 HydrophobicContact CD2-CE2 3.64Å; V352-Y355 HydrophobicContact CB-CE2 4.24Å; V352-Y355 HydrophobicContact CG1-CD1 4.48Å; V352-Y355 HydrophobicContact CG1-CD2 4.15Å; V352-Y355 HydrophobicContact CG1-CE1 4.02Å; V352-Y355 HydrophobicContact CG1-CE2 3.63Å; Y355-I380 PolarHBondContact N-O 2.79Å; Y355-I380 PolarHBondContact O-N 2.99Å; Y355-V382 HydrophobicContact CD2-CG2 4.04Å; Y355-V382 HydrophobicContact CE2-CG2 3.88Å
356	T	97.1	Very high	94.6	Very high	44 Å²	44	41.3 Å²	41.3	27%	0.27	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	120.6	168.9	-48.7	0	0	0	0	108.7	Q321 T322 T377	Q321-T356 WeakPolarHBondContact CA-O 3.31Å; T322-T356 PolarHBondContact N-O 2.9Å; T322-T356 PolarHBondContact O-N 2.76Å; T322-T356 PolarHBondContact OG1-O 2.84Å; T356-T377 HydrophobicContact CG2-CG2 3.47Å; T356-T377 VanDerWaalsContact CG2-CG2 3.47Å
357	V	96.8	Very high	94.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.1	-176.4	-177.9	0	0	0	0	108.7	I318 T320 Q321 F331 V359 A378 I380	I318-V357 HydrophobicContact CB-CG1 4.28Å; I318-V357 HydrophobicContact CD1-CG1 3.94Å; I318-V357 HydrophobicContact CG1-CG1 3.76Å; I318-V357 HydrophobicContact CG2-CG1 3.61Å; T320-V357 WeakPolarHBondContact O-CA 3.32Å; Q321-V357 HydrophobicContact CG-CG2 4.19Å; F331-V357 HydrophobicContact CD2-CG2 3.93Å; F331-V357 HydrophobicContact CE2-CG2 4.44Å; V357-V359 HydrophobicContact CG1-CG1 4.24Å; V357-A378 HydrophobicContact CB-CB 4.28Å; V357-A378 PolarHBondContact N-O 3.34Å; V357-A378 PolarHBondContact O-N 3.32Å; V357-I380 HydrophobicContact CG2-CD1 3.73Å; V357-I380 HydrophobicContact CG2-CG1 4.2Å
358	I	97.3	Very high	94.5	Very high	46 Å²	46	46.8 Å²	46.8	24%	0.236	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	116.9	173.6	-55.8	-59.3	0	0	0	108.2	V319 T320 T375 T377	V319-I358 HydrophobicContact CB-CB 4.47Å; V319-I358 HydrophobicContact CB-CG2 4.32Å; V319-I358 PolarHBondContact N-O 3.04Å; T320-I358 PolarHBondContact O-N 2.74Å; T320-I358 WeakPolarHBondContact OG1-CB 3.38Å; T320-I358 WeakPolarHBondContact OG1-CG1 3.22Å; I358-T375 HydrophobicContact CG2-CG2 4.4Å; I358-T377 HydrophobicContact CD1-CG2 4.01Å; I358-T377 WeakPolarHBondContact CD1-OG1 3.37Å
359	V	97.6	Very high	94.3	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	144.7	176.7	-65.2	0	0	0	0	110	F277 V299 R317 I318 I333 I340 V357 T375 A376	F277-V359 HydrophobicContact CE1-CG2 3.94Å; F277-V359 HydrophobicContact CZ-CB 4.47Å; F277-V359 HydrophobicContact CZ-CG2 3.84Å; V299-V359 HydrophobicContact CG1-CG2 4.36Å; V299-V359 HydrophobicContact CG2-CB 4.44Å; V299-V359 HydrophobicContact CG2-CG1 4.4Å; V299-V359 HydrophobicContact CG2-CG2 4.21Å; R317-V359 CarbonylContact O-C 3.58Å; R317-V359 WeakPolarHBondContact O-CA 3.27Å; I318-V359 HydrophobicContact CG1-CG1 4.35Å; I333-V359 HydrophobicContact CD1-CG1 4.11Å; I340-V359 HydrophobicContact CD1-CG1 4.06Å; V357-V359 HydrophobicContact CG1-CG1 4.24Å; V359-T375 CarbonylContact O-C 3.56Å; V359-T375 WeakPolarHBondContact O-CA 3.3Å; V359-T375 WeakPolarHBondContact O-CB 3.3Å; V359-A376 HydrophobicContact CG2-CB 3.93Å; V359-A376 VanDerWaalsContact CG2-O 3.3Å; V359-A376 WeakPolarHBondContact CG2-O 3.49Å; V359-A376 PolarHBondContact N-O 2.02Å; V359-A376 PolarHBondContact O-N 3.09Å
360	Q	97.1	Very high	93.9	Very high	23 Å²	23	59.1 Å²	59.1	11%	0.107	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.6	176.4	-176	173.3	29.5	0	0	109.6	Y316 R317 V319 S373 N374 T375	Y316-Q360 CarbonylContact C-O 3.58Å; Y316-Q360 WeakPolarHBondContact CA-O 3.26Å; R317-Q360 HydrophobicContact CG-CB 4.14Å; R317-Q360 PolarHBondContact N-O 2.92Å; R317-Q360 PolarHBondContact O-N 3.15Å; V319-Q360 HydrophobicContact CG2-CB 3.48Å; V319-Q360 VanDerWaalsContact CG2-CB 3.48Å; V319-Q360 HydrophobicContact CG2-CG 4.44Å; Q360-S373 PolarHBondContact NE2-OG 3.17Å; Q360-N374 WeakPolarHBondContact CA-O 3.14Å; Q360-N374 WeakPolarHBondContact CG-O 3.31Å; Q360-T375 HydrophobicContact CB-CG2 4.05Å; Q360-T375 HydrophobicContact CG-CG2 4.08Å
361	A	97.4	Very high	93.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	136.8	167.9	0	0	0	0	0	108.2	P275 F277 A301 V314 R315 Y316 S373 N374	P275-A361 HydrophobicContact CB-CB 3.9Å; F277-A361 HydrophobicContact CD2-CB 4.47Å; F277-A361 HydrophobicContact CE1-CB 4.27Å; F277-A361 HydrophobicContact CE2-CB 3.63Å; F277-A361 HydrophobicContact CZ-CB 3.51Å; A301-A361 HydrophobicContact CB-CB 3.59Å; V314-A361 HydrophobicContact CG1-CB 3.68Å; R315-A361 WeakPolarHBondContact O-CA 3.26Å; Y316-A361 HydrophobicContact CD1-CB 4.15Å; Y316-A361 HydrophobicContact CE1-CB 4.1Å; A361-S373 WeakPolarHBondContact O-CA 3.24Å; A361-S373 WeakPolarHBondContact O-CB 3.38Å; A361-N374 PolarHBondContact N-O 2.9Å; A361-N374 PolarHBondContact O-N 1.99Å
362	T	96.5	Very high	93.8	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	128.8	178.5	-54.4	0	0	0	0	108.8	R315 L368 L372 S373	R315-T362 PolarHBondContact N-O 3.02Å; R315-T362 PolarHBondContact O-N 3.09Å; T362-L368 HydrophobicContact CG2-CD2 4.29Å; T362-L372 WeakPolarHBondContact CA-O 3.46Å; T362-S373 VanDerWaalsContact OG1-CB 3.24Å; T362-S373 WeakPolarHBondContact OG1-CB 3.47Å
363	D	94.9	Very high	93.8	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	-69	-169	174.1	65.7	32.4	0	0	0	111.5	N271 P275 N311 M313 E365 G366 G371 L372	N271-D363 PolarHBondContact ND2-OD1 2.97Å; N271-D363 PolarHBondContact ND2-OD2 3.27Å; N271-D363 PolarHBondContact OD1-OD2 3.49Å; P275-D363 HydrophobicContact CG-CB 3.95Å; N311-D363 VanDerWaalsContact O-CB 3.26Å; N311-D363 WeakPolarHBondContact O-CB 3.27Å; M313-D363 CarbonylContact O-C 3.49Å; D363-E365 VanDerWaalsContact C-N 3.26Å; D363-E365 PolarHBondContact O-N 3.05Å; D363-G366 WeakPolarHBondContact O-CA 3.48Å; D363-G366 PolarHBondContact O-N 3.22Å; D363-G371 VanDerWaalsContact OD1-C 3.24Å; D363-G371 WeakPolarHBondContact OD1-CA 3.46Å; D363-L372 VanDerWaalsContact CG-N 3.25Å; D363-L372 PolarHBondContact N-O 2.92Å; D363-L372 VanDerWaalsContact N-O 3.11Å; D363-L372 PolarHBondContact OD1-N 3.49Å; D363-L372 WeakPolarHBondContact OD2-CA 3.42Å; D363-L372 WeakPolarHBondContact OD2-CB 3.4Å; D363-L372 PolarHBondContact OD2-N 2.95Å
364	M	93.1	Very high	93.9	Very high	53 Å²	53	49.9 Å²	49.9	26%	0.261	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	56.9	40.5	176.4	-73.9	-75.9	-154.5	0	0	112.6	N271 A310 N311 M313 G366 N367	N271-M364 HydrophobicContact CB-CE 3.99Å; A310-M364 HydrophobicContact CB-SD 3.76Å; A310-M364 WeakPolarHBondContact O-CA 3.35Å; A310-M364 PolarHBondContact O-N 2.87Å; N311-M364 WeakPolarHBondContact OD1-CE 3.36Å; M313-M364 PolarHBondContact O-N 3.31Å; M364-G366 PolarHBondContact O-N 3.46Å; M364-G366 VanDerWaalsContact O-N 3.16Å; M364-N367 HydrophobicContact CB-CB 4.21Å; M364-N367 VanDerWaalsContact O-CB 3.29Å; M364-N367 WeakPolarHBondContact O-CB 3.49Å; M364-N367 PolarHBondContact O-N 2.97Å; M364-N367 VanDerWaalsContact O-N 3.13Å
365	E	90.6	Very high	93.9	Very high	122 Å²	122	48.3 Å²	48.3	57%	0.57	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	53.3	30.8	-173.4	-59.4	-177.1	164.8	0	0	113	M313 R315 D363	M313-E365 HydrophobicContact CB-CG 4.28Å; M313-E365 PolarHBondContact O-N 3.38Å; M313-E365 VanDerWaalsContact O-N 3.13Å; M313-E365 HydrophobicContact SD-CG 4.31Å; R315-E365 WeakPolarHBondContact CG-O 3.13Å; D363-E365 VanDerWaalsContact C-N 3.26Å; D363-E365 PolarHBondContact O-N 3.05Å
366	G	88.3	Confident	94	Very high	21 Å²	21	48.5 Å²	48.5	22%	0.216	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	83.8	16.8	178.6	0	0	0	0	0	115.1	D363 M364 L368	D363-G366 WeakPolarHBondContact O-CA 3.48Å; D363-G366 PolarHBondContact O-N 3.22Å; M364-G366 PolarHBondContact O-N 3.46Å; M364-G366 VanDerWaalsContact O-N 3.16Å; G366-L368 PolarHBondContact O-N 3.35Å
367	N	91.8	Very high	94	Very high	66 Å²	66	48.3 Å²	48.3	35%	0.353	26%	0.256	S	S	.	.			trans	-76.3	109.1	-178.2	-169.9	-31	0	0	0	112.4	M364 N369 Y370 G371	M364-N367 HydrophobicContact CB-CB 4.21Å; M364-N367 VanDerWaalsContact O-CB 3.29Å; M364-N367 WeakPolarHBondContact O-CB 3.49Å; M364-N367 PolarHBondContact O-N 2.97Å; M364-N367 VanDerWaalsContact O-N 3.13Å; N367-N369 VanDerWaalsContact C-N 3.28Å; N367-N369 PolarHBondContact O-N 3.39Å; N367-N369 PolarHBondContact OD1-N 3.29Å; N367-Y370 PolarHBondContact O-N 3.27Å; N367-G371 WeakPolarHBondContact O-CA 3.47Å; N367-G371 PolarHBondContact O-N 3.16Å
368	L	87.9	Confident	94.1	Very high	95 Å²	95	48.3 Å²	48.3	50%	0.497	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-14.3	-176.5	-66.5	175	0	0	0	117.3	R317 T362 G366	R317-L368 VanDerWaalsContact CZ-CD2 3.45Å; R317-L368 VanDerWaalsContact NH1-CG 3.28Å; R317-L368 VanDerWaalsContact NH2-CD1 3.33Å; T362-L368 HydrophobicContact CG2-CD2 4.29Å; G366-L368 PolarHBondContact O-N 3.35Å
369	N	89.1	Confident	94.1	Very high	138 Å²	138	48 Å²	48	74%	0.738	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-25.4	-179.9	-66.2	-42.2	0	0	0	112.4	N367	N367-N369 VanDerWaalsContact C-N 3.28Å; N367-N369 PolarHBondContact O-N 3.39Å; N367-N369 PolarHBondContact OD1-N 3.29Å
370	Y	87.6	Confident	94.1	Very high	174 Å²	174	48 Å²	48	68%	0.682	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.6	-25.5	-172.9	-56.9	-66.2	0	0	0	113	N367	N367-Y370 PolarHBondContact O-N 3.27Å
371	G	91.5	Very high	94.1	Very high	13 Å²	13	49.8 Å²	49.8	13%	0.134	27%	0.267	C	S	.	.			trans	-87.2	150.3	-175.9	0	0	0	0	0	114.3	D363 N367	D363-G371 VanDerWaalsContact OD1-C 3.24Å; D363-G371 WeakPolarHBondContact OD1-CA 3.46Å; N367-G371 WeakPolarHBondContact O-CA 3.47Å; N367-G371 PolarHBondContact O-N 3.16Å
372	L	93.7	Very high	94	Very high	71 Å²	71	50.1 Å²	50.1	37%	0.372	27%	0.269	S	S	.	.			trans	-87.7	147.5	174.1	-51.7	175.1	0	0	0	108.9	N273 R274 P275 T362 D363	N273-L372 WeakPolarHBondContact O-CD1 3.38Å; R274-L372 HydrophobicContact CB-CB 3.54Å; R274-L372 HydrophobicContact CB-CD1 4.14Å; R274-L372 HydrophobicContact CB-CG 4.48Å; P275-L372 WeakPolarHBondContact CD-O 3.34Å; T362-L372 WeakPolarHBondContact CA-O 3.46Å; D363-L372 VanDerWaalsContact CG-N 3.25Å; D363-L372 PolarHBondContact N-O 2.92Å; D363-L372 VanDerWaalsContact N-O 3.11Å; D363-L372 PolarHBondContact OD1-N 3.49Å; D363-L372 WeakPolarHBondContact OD2-CA 3.42Å; D363-L372 WeakPolarHBondContact OD2-CB 3.4Å; D363-L372 PolarHBondContact OD2-N 2.95Å
373	S	94.9	Very high	94	Very high	51 Å²	51	52.1 Å²	52.1	36%	0.357	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	152.6	-174.2	70.1	0	0	0	0	112.2	Q360 A361 T362	Q360-S373 PolarHBondContact NE2-OG 3.17Å; A361-S373 WeakPolarHBondContact O-CA 3.24Å; A361-S373 WeakPolarHBondContact O-CB 3.38Å; T362-S373 VanDerWaalsContact OG1-CB 3.24Å; T362-S373 WeakPolarHBondContact OG1-CB 3.47Å
374	N	96.2	Very high	94.1	Very high	32 Å²	32	53.1 Å²	53.1	17%	0.171	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	160.7	176.3	-162.8	5.5	0	0	0	109.3	P275 F277 Q360 A361	P275-N374 WeakPolarHBondContact O-CB 3.24Å; P275-N374 PolarHBondContact O-ND2 3.44Å; F277-N374 WeakPolarHBondContact CE2-O 3.32Å; Q360-N374 WeakPolarHBondContact CA-O 3.14Å; Q360-N374 WeakPolarHBondContact CG-O 3.31Å; A361-N374 PolarHBondContact N-O 2.9Å; A361-N374 PolarHBondContact O-N 1.99Å
375	T	97.1	Very high	94.2	Very high	64 Å²	64	52.7 Å²	52.7	39%	0.393	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	147.5	-175.1	56.1	0	0	0	0	111.8	I358 V359 Q360	I358-T375 HydrophobicContact CG2-CG2 4.4Å; V359-T375 CarbonylContact O-C 3.56Å; V359-T375 WeakPolarHBondContact O-CA 3.3Å; V359-T375 WeakPolarHBondContact O-CB 3.3Å; Q360-T375 HydrophobicContact CB-CG2 4.05Å; Q360-T375 HydrophobicContact CG-CG2 4.08Å
376	A	97.1	Very high	94.5	Very high	3 Å²	3	47 Å²	47	3%	0.025	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	164.8	170	0	0	0	0	0	110.5	F277 Y282 V359	F277-A376 HydrophobicContact CB-CB 3.95Å; F277-A376 HydrophobicContact CD1-CB 3.82Å; F277-A376 HydrophobicContact CD2-CB 3.52Å; F277-A376 HydrophobicContact CE1-CB 4.15Å; F277-A376 HydrophobicContact CE2-CB 3.86Å; F277-A376 HydrophobicContact CG-CB 3.48Å; F277-A376 VanDerWaalsContact CG-CB 3.48Å; F277-A376 HydrophobicContact CZ-CB 4.16Å; Y282-A376 HydrophobicContact CD2-CB 4.38Å; Y282-A376 HydrophobicContact CE2-CB 4.14Å; V359-A376 HydrophobicContact CG2-CB 3.93Å; V359-A376 VanDerWaalsContact CG2-O 3.3Å; V359-A376 WeakPolarHBondContact CG2-O 3.49Å; V359-A376 PolarHBondContact N-O 2.02Å; V359-A376 PolarHBondContact O-N 3.09Å
377	T	97.9	Very high	94.8	Very high	41 Å²	41	48.2 Å²	48.2	25%	0.252	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	128.2	-179.8	-55.4	0	0	0	0	110.3	Q280 V281 Y282 T356 I358 I379	Q280-T377 PolarHBondContact O-N 3.3Å; V281-T377 CarbonylContact C-O 3.53Å; V281-T377 VanDerWaalsContact CA-O 3.25Å; V281-T377 WeakPolarHBondContact CA-O 3.48Å; Y282-T377 PolarHBondContact N-O 3.12Å; T356-T377 HydrophobicContact CG2-CG2 3.47Å; T356-T377 VanDerWaalsContact CG2-CG2 3.47Å; I358-T377 HydrophobicContact CD1-CG2 4.01Å; I358-T377 WeakPolarHBondContact CD1-OG1 3.37Å; T377-I379 HydrophobicContact CG2-CG1 4.2Å
378	A	97.8	Very high	94.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119	170.3	0	0	0	0	0	109.6	Y282 M297 I340 V357	Y282-A378 CarbonylContact O-C 3.55Å; Y282-A378 WeakPolarHBondContact O-CA 3.32Å; M297-A378 HydrophobicContact SD-CB 3.95Å; I340-A378 HydrophobicContact CD1-CB 4.05Å; V357-A378 HydrophobicContact CB-CB 4.28Å; V357-A378 PolarHBondContact N-O 3.34Å; V357-A378 PolarHBondContact O-N 3.32Å
379	I	97.8	Very high	95.2	Very high	40 Å²	40	43 Å²	43	21%	0.205	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	113.2	176.7	-55.7	178	0	0	0	107.6	V281 Y282 N283 G284 Q354 T377	V281-I379 HydrophobicContact CG1-CD1 3.72Å; V281-I379 HydrophobicContact CG1-CG1 4.09Å; Y282-I379 PolarHBondContact O-N 2.8Å; N283-I379 WeakPolarHBondContact CA-O 3.23Å; G284-I379 PolarHBondContact N-O 3.23Å; Q354-I379 HydrophobicContact CG-CG2 3.78Å; Q354-I379 VanDerWaalsContact NE2-CG2 3.28Å; T377-I379 HydrophobicContact CG2-CG1 4.2Å
380	I	97.4	Very high	95.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113.1	-176.1	-43.3	-168.2	0	0	0	108.3	G284 V286 V296 M297 F331 I340 Q354 Y355 V357	G284-I380 CarbonylContact O-C 3.58Å; G284-I380 WeakPolarHBondContact O-CA 3.37Å; V286-I380 HydrophobicContact CG1-CG2 3.79Å; V296-I380 HydrophobicContact CG1-CD1 4.26Å; V296-I380 HydrophobicContact CG1-CG2 3.62Å; M297-I380 HydrophobicContact CE-CB 4.3Å; M297-I380 HydrophobicContact CE-CD1 4.13Å; M297-I380 HydrophobicContact CE-CG1 3.61Å; M297-I380 HydrophobicContact CE-CG2 4.44Å; F331-I380 HydrophobicContact CD1-CD1 3.82Å; F331-I380 HydrophobicContact CD2-CD1 3.79Å; F331-I380 HydrophobicContact CE1-CD1 3.8Å; F331-I380 HydrophobicContact CE1-CG2 4.04Å; F331-I380 HydrophobicContact CE2-CD1 3.79Å; F331-I380 HydrophobicContact CG-CD1 3.82Å; F331-I380 HydrophobicContact CZ-CB 4.25Å; F331-I380 HydrophobicContact CZ-CD1 3.79Å; F331-I380 HydrophobicContact CZ-CG2 3.87Å; I340-I380 HydrophobicContact CG2-CD1 4.24Å; Q354-I380 CarbonylContact C-O 3.59Å; Q354-I380 WeakPolarHBondContact CA-O 3.38Å; Y355-I380 PolarHBondContact N-O 2.79Å; Y355-I380 PolarHBondContact O-N 2.99Å; V357-I380 HydrophobicContact CG2-CD1 3.73Å; V357-I380 HydrophobicContact CG2-CG1 4.2Å
381	T	97.2	Very high	95.9	Very high	60 Å²	60	30.9 Å²	30.9	37%	0.368	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	130.4	176.9	-53.4	0	0	0	0	109.5	G284 S285 V286	G284-T381 PolarHBondContact O-N 3.16Å; S285-T381 CarbonylContact C-O 3.57Å; S285-T381 WeakPolarHBondContact CA-O 3.42Å; V286-T381 PolarHBondContact N-O 2.75Å
382	V	96.5	Very high	96.1	Very high	6 Å²	6	30.6 Å²	30.6	4%	0.036	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	121.4	175.3	-174.6	0	0	0	0	108.2	V286 E288 L347 R349 V352 Q353 Y355	V286-V382 CarbonylContact O-C 3.6Å; V286-V382 VanDerWaalsContact O-CA 3.29Å; V286-V382 WeakPolarHBondContact O-CA 3.21Å; E288-V382 HydrophobicContact CB-CG1 3.62Å; L347-V382 HydrophobicContact CD2-CG2 4.23Å; R349-V382 HydrophobicContact CB-CB 4.47Å; R349-V382 HydrophobicContact CB-CG1 4.01Å; V352-V382 WeakPolarHBondContact O-CG2 3.49Å; Q353-V382 PolarHBondContact O-N 2.78Å; Y355-V382 HydrophobicContact CD2-CG2 4.04Å; Y355-V382 HydrophobicContact CE2-CG2 3.88Å
383	T	95.8	Very high	96.2	Very high	45 Å²	45	30.8 Å²	30.8	28%	0.276	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	142	178.3	33	0	0	0	0	111	V286 D287 E288	V286-T383 PolarHBondContact O-N 3.18Å; V286-T383 PolarHBondContact O-OG1 2.89Å; D287-T383 WeakPolarHBondContact CA-OG1 3.2Å; D287-T383 PolarHBondContact N-OG1 2.76Å; D287-T383 VanDerWaalsContact N-OG1 3.13Å; D287-T383 WeakPolarHBondContact OD1-CB 3.44Å; D287-T383 PolarHBondContact OD1-OG1 2.77Å; E288-T383 PolarHBondContact N-O 3.28Å
384	D	96.8	Very high	96.2	Very high	21 Å²	21	30.1 Å²	30.1	11%	0.112	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-71.9	134	-174.1	-170.4	74.9	0	0	0	112.1	E288 R349 Q420 S423 N425	E288-D384 WeakPolarHBondContact OE1-CA 3.35Å; R349-D384 WeakPolarHBondContact CD-OD1 3.32Å; R349-D384 IonicContact CZ-OD1 2.76Å; R349-D384 IonicContact NE-OD1 3.59Å; R349-D384 PolarHBondContact NE-OD1 2.9Å; D384-Q420 HydrophobicContact CB-CB 3.87Å; D384-Q420 WeakPolarHBondContact OD1-CB 3.32Å; D384-Q420 PolarHBondContact OD1-N 3.35Å; D384-Q420 WeakPolarHBondContact OD2-CB 3.35Å; D384-Q420 PolarHBondContact OD2-N 3.22Å; D384-S423 PolarHBondContact OD2-OG 3.35Å; D384-N425 PolarHBondContact O-ND2 3.19Å; D384-N425 WeakPolarHBondContact OD2-CB 3.31Å; D384-N425 PolarHBondContact OD2-ND2 3.11Å
385	V	95.6	Very high	96	Very high	43 Å²	43	33 Å²	33	26%	0.261	20%	0.2	S	C	.	.			trans	-127.7	140.7	173.4	174.8	0	0	0	0	107.2	D287 E288 D387 A481	D287-V385 HydrophobicContact CB-CG2 3.96Å; E288-V385 HydrophobicContact CG-CB 3.77Å; E288-V385 HydrophobicContact CG-CG2 3.98Å; E288-V385 PolarHBondContact OE1-N 3.33Å; V385-D387 VanDerWaalsContact C-N 3.31Å; V385-D387 PolarHBondContact O-N 3.45Å; V385-A481 HydrophobicContact CG1-CB 3.86Å
386	N	95.8	Very high	95.9	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.021	21%	0.21	C	C	.	.	S	Bend	trans	-67.4	84.1	-179.8	-176.1	-3.9	0	0	0	112.5	D419 N425 N476 A478 L480 A481	N386-D419 VanDerWaalsContact CA-OD2 3.3Å; N386-D419 WeakPolarHBondContact CA-OD2 3.39Å; N386-D419 PolarHBondContact OD1-OD2 3.2Å; N386-D419 VanDerWaalsContact OD1-OD2 3.12Å; N386-N425 HydrophobicContact CB-CB 3.74Å; N386-N476 WeakPolarHBondContact ND2-CB 3.47Å; N386-N476 PolarHBondContact ND2-OD1 2.69Å; N386-N476 VanDerWaalsContact ND2-OD1 3.1Å; N386-N476 PolarHBondContact OD1-OD1 2.88Å; N386-A478 PolarHBondContact ND2-O 3.16Å; N386-L480 VanDerWaalsContact OD1-CD2 3.26Å; N386-L480 WeakPolarHBondContact OD1-CD2 3.33Å; N386-A481 WeakPolarHBondContact O-CB 3.46Å; N386-A481 PolarHBondContact O-N 3.4Å
387	D	94.4	Very high	95.9	Very high	45 Å²	45	35.6 Å²	35.6	24%	0.241	21%	0.214	C	C	.	.			trans	-114.3	-5.9	179	86.2	-18.6	0	0	0	114	V385 A481 I484	V385-D387 VanDerWaalsContact C-N 3.31Å; V385-D387 PolarHBondContact O-N 3.45Å; D387-A481 HydrophobicContact CB-CB 4.38Å; D387-I484 HydrophobicContact CB-CD1 4.44Å; D387-I484 HydrophobicContact CB-CG1 4.21Å
388	N	94.3	Very high	95.8	Very high	33 Å²	33	37.3 Å²	37.3	18%	0.176	23%	0.232	C	C	.	.	S	Bend	trans	-112.4	105.3	171.5	-58.5	-86.1	0	0	0	111.2	R418 D419	N388-R418 HydrophobicContact CB-CB 3.96Å; N388-D419 VanDerWaalsContact CB-OD1 3.23Å; N388-D419 WeakPolarHBondContact CB-OD1 3.36Å; N388-D419 PolarHBondContact N-OD1 2.97Å; N388-D419 VanDerWaalsContact N-OD1 3.17Å; N388-D419 PolarHBondContact ND2-OD1 2.77Å
389	P	94.6	Very high	95.7	Very high	19 Å²	19	37.8 Å²	37.8	12%	0.123	24%	0.237	C	C	.	.			trans	-66.5	151.4	174.5	28.2	-33.9	0	0	0	111.6	L480	P389-L480 HydrophobicContact CB-CD1 4.23Å; P389-L480 HydrophobicContact CB-CD2 3.78Å; P389-L480 HydrophobicContact CG-CD2 4.46Å
390	P	95.8	Very high	95.6	Very high	1 Å²	1	42 Å²	42	1%	0.006	26%	0.256	C	S	.	.			trans	-72.1	134.8	-179.6	25.4	-30.3	0	0	0	109.2	D417 V474 N476 S490	P390-D417 HydrophobicContact CB-CB 4.29Å; P390-V474 HydrophobicContact CB-CG1 4.13Å; P390-V474 HydrophobicContact CB-CG2 3.99Å; P390-V474 HydrophobicContact CG-CB 4.42Å; P390-V474 HydrophobicContact CG-CG1 4.05Å; P390-V474 HydrophobicContact CG-CG2 3.8Å; P390-N476 VanDerWaalsContact CD-ND2 3.33Å; P390-N476 WeakPolarHBondContact CD-ND2 3.3Å; P390-N476 WeakPolarHBondContact CD-OD1 3.33Å; P390-S490 WeakPolarHBondContact O-CB 3.47Å; P390-S490 PolarHBondContact O-OG 3.18Å
391	E	95.4	Very high	95.5	Very high	56 Å²	56	42.1 Å²	42.1	26%	0.262	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	129.6	-176.9	-58.6	-167.5	140.4	0	0	110.5	V415 M416 S487 Q489	E391-V415 CarbonylContact O-C 3.59Å; E391-V415 VanDerWaalsContact O-CA 3.25Å; E391-V415 WeakPolarHBondContact O-CA 3.27Å; E391-M416 PolarHBondContact N-O 3.43Å; E391-M416 PolarHBondContact O-N 2.89Å; E391-S487 WeakPolarHBondContact OE1-CB 3.33Å; E391-S487 PolarHBondContact OE1-OG 3.11Å; E391-Q489 HydrophobicContact CB-CB 4.02Å; E391-Q489 HydrophobicContact CG-CB 4.24Å
392	F	96.4	Very high	95.3	Very high	7 Å²	7	40.9 Å²	40.9	3%	0.031	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	138	171	-69	-73.8	0	0	0	110.5	A394 F397 L413 V415 Y430 V472 V474 Q489 S490 A492	F392-A394 VanDerWaalsContact CB-O 3.3Å; F392-A394 WeakPolarHBondContact CB-O 3.17Å; F392-A394 PolarHBondContact O-N 2.92Å; F392-F397 HydrophobicContact CB-CE2 4.14Å; F392-F397 HydrophobicContact CB-CZ 4.39Å; F392-F397 AromaticContact CD1-CE2 3.74Å; F392-F397 HydrophobicContact CD1-CE2 3.74Å; F392-F397 HydrophobicContact CD1-CZ 4.07Å; F392-F397 HydrophobicContact CE1-CE2 4.46Å; F392-F397 HydrophobicContact CG-CE2 4.14Å; F392-L413 HydrophobicContact CD1-CB 4.34Å; F392-L413 HydrophobicContact CE1-CB 3.82Å; F392-L413 HydrophobicContact CE1-CD1 4.22Å; F392-V415 HydrophobicContact CD1-CG1 3.49Å; F392-V415 VanDerWaalsContact CD1-CG1 3.49Å; F392-V415 HydrophobicContact CE1-CG1 3.68Å; F392-V415 HydrophobicContact CG-CG1 4.17Å; F392-V415 HydrophobicContact CZ-CG1 4.5Å; F392-Y430 HydrophobicContact CE1-CD1 4.16Å; F392-Y430 AromaticContact CE1-CE1 3.68Å; F392-Y430 HydrophobicContact CE1-CE1 3.68Å; F392-Y430 HydrophobicContact CZ-CD1 4.09Å; F392-Y430 HydrophobicContact CZ-CE1 4.01Å; F392-V472 HydrophobicContact CZ-CG1 4.31Å; F392-V474 HydrophobicContact CD2-CG1 3.99Å; F392-V474 HydrophobicContact CE1-CB 4.41Å; F392-V474 HydrophobicContact CE1-CG1 4.36Å; F392-V474 HydrophobicContact CE2-CB 4Å; F392-V474 HydrophobicContact CE2-CG1 3.55Å; F392-V474 HydrophobicContact CZ-CB 3.75Å; F392-V474 HydrophobicContact CZ-CG1 3.76Å; F392-Q489 VanDerWaalsContact CD2-O 3.27Å; F392-Q489 WeakPolarHBondContact CD2-O 3.36Å; F392-Q489 PolarHBondContact N-O 2.96Å; F392-S490 WeakPolarHBondContact CE2-O 3.38Å; F392-A492 HydrophobicContact CB-CB 4.2Å; F392-A492 HydrophobicContact CD1-CB 4.17Å; F392-A492 HydrophobicContact CD2-CB 3.46Å; F392-A492 VanDerWaalsContact CD2-CB 3.46Å; F392-A492 HydrophobicContact CE1-CB 4.42Å; F392-A492 HydrophobicContact CE2-CB 3.75Å; F392-A492 HydrophobicContact CG-CB 3.69Å; F392-A492 HydrophobicContact CZ-CB 4.23Å
393	T	95.1	Very high	95.1	Very high	75 Å²	75	40.7 Å²	40.7	46%	0.46	25%	0.248	S	C	.	.	S	Bend	trans	-66.1	-24.9	175.1	60.9	0	0	0	0	112.5	T414 M416	T393-T414 PolarHBondContact N-O 2.86Å; T393-T414 PolarHBondContact OG1-O 2.94Å; T393-T414 PolarHBondContact OG1-OG1 3.43Å; T393-M416 HydrophobicContact CG2-CE 4.39Å; T393-M416 HydrophobicContact CG2-CG 3.97Å
394	A	94.7	Very high	94.9	Very high	37 Å²	37	42.7 Å²	42.7	31%	0.306	26%	0.257	S	S	.	.	S	Bend	trans	-134.4	147.2	178.4	0	0	0	0	0	111.1	F392 T396 F397	F392-A394 VanDerWaalsContact CB-O 3.3Å; F392-A394 WeakPolarHBondContact CB-O 3.17Å; F392-A394 PolarHBondContact O-N 2.92Å; A394-T396 VanDerWaalsContact C-N 3.29Å; A394-T396 PolarHBondContact O-N 2.87Å; A394-F397 HydrophobicContact CB-CE1 4.31Å; A394-F397 HydrophobicContact CB-CE2 4.37Å; A394-F397 HydrophobicContact CB-CZ 4.04Å; A394-F397 VanDerWaalsContact O-CE2 3.3Å; A394-F397 WeakPolarHBondContact O-CE2 3.43Å
395	S	92.9	Very high	94.6	Very high	92 Å²	92	48.7 Å²	48.7	64%	0.643	28%	0.278	S	S	*	.	S	Bend	trans	-74.8	-20.2	176.3	55.6	0	0	0	0	113.6	A492 G493	S395-A492 WeakPolarHBondContact O-CA 3.37Å; S395-G493 PolarHBondContact O-N 3.19Å
396	T	95.3	Very high	94.4	Very high	97 Å²	97	50.3 Å²	50.3	60%	0.595	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.3	133.8	-176.8	52.9	0	0	0	0	111	A394 G493	A394-T396 VanDerWaalsContact C-N 3.29Å; A394-T396 PolarHBondContact O-N 2.87Å; T396-G493 CarbonylContact C-O 3.59Å; T396-G493 WeakPolarHBondContact CA-O 3.39Å
397	F	96.4	Very high	94.1	Very high	26 Å²	26	58.5 Å²	58.5	11%	0.114	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	153	173.2	-63.3	-92.5	0	0	0	109.8	F392 A394 L413 A492 G493 V494 T495	F392-F397 HydrophobicContact CB-CE2 4.14Å; F392-F397 HydrophobicContact CB-CZ 4.39Å; F392-F397 AromaticContact CD1-CE2 3.74Å; F392-F397 HydrophobicContact CD1-CE2 3.74Å; F392-F397 HydrophobicContact CD1-CZ 4.07Å; F392-F397 HydrophobicContact CE1-CE2 4.46Å; F392-F397 HydrophobicContact CG-CE2 4.14Å; A394-F397 HydrophobicContact CB-CE1 4.31Å; A394-F397 HydrophobicContact CB-CE2 4.37Å; A394-F397 HydrophobicContact CB-CZ 4.04Å; A394-F397 VanDerWaalsContact O-CE2 3.3Å; A394-F397 WeakPolarHBondContact O-CE2 3.43Å; F397-L413 HydrophobicContact CB-CD2 3.75Å; F397-L413 HydrophobicContact CD1-CD2 4.03Å; F397-L413 HydrophobicContact CD2-CD2 3.6Å; F397-L413 HydrophobicContact CE2-CD2 4.19Å; F397-L413 HydrophobicContact CG-CD2 3.51Å; F397-A492 HydrophobicContact CD2-CB 3.99Å; F397-A492 HydrophobicContact CE2-CB 3.85Å; F397-G493 PolarHBondContact N-O 3.27Å; F397-V494 HydrophobicContact CB-CG1 4.25Å; F397-V494 HydrophobicContact CB-CG2 4.31Å; F397-V494 CarbonylContact O-C 3.58Å; F397-V494 WeakPolarHBondContact O-CA 3.42Å; F397-T495 PolarHBondContact O-N 3.2Å; F397-T495 PolarHBondContact O-OG1 2.98Å
398	A	96.1	Very high	94	Very high	77 Å²	77	58.5 Å²	58.5	64%	0.636	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.7	146.4	175.8	0	0	0	0	0	110.1	T495	A398-T495 VanDerWaalsContact CA-O 3.28Å; A398-T495 WeakPolarHBondContact CA-O 3.35Å
399	G	95.3	Very high	93.9	Very high	9 Å²	9	60.6 Å²	60.6	9%	0.093	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	158.3	175.5	0	0	0	0	0	110.9	V410 T495 I496 S497	G399-V410 WeakPolarHBondContact CA-O 3.06Å; G399-T495 PolarHBondContact N-O 2.83Å; G399-T495 VanDerWaalsContact N-O 3.07Å; G399-I496 WeakPolarHBondContact O-CA 2.95Å; G399-S497 PolarHBondContact O-N 2.87Å; G399-S497 PolarHBondContact O-OG 2.88Å
400	E	95.3	Very high	93.9	Very high	130 Å²	130	60.4 Å²	60.4	61%	0.607	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.6	137.1	179.6	-52	-166.1	152.3	0	0	108.9	S497 M499	E400-S497 WeakPolarHBondContact CA-O 3.32Å; E400-S497 WeakPolarHBondContact CG-OG 3.48Å; E400-M499 HydrophobicContact CB-CG 4.35Å; E400-M499 HydrophobicContact CB-SD 4.19Å
401	V	95.3	Very high	93.9	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.006	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	128.8	178.9	64.9	0	0	0	0	109.4	V410 V456 V460 I496 S497 V498 M499	V401-V410 HydrophobicContact CB-CG1 4.28Å; V401-V410 HydrophobicContact CB-CG2 4Å; V401-V410 HydrophobicContact CG2-CG2 4.09Å; V401-V456 HydrophobicContact CG2-CG2 3.55Å; V401-V460 HydrophobicContact CG1-CG2 4.01Å; V401-I496 HydrophobicContact CB-CG2 4.34Å; V401-I496 HydrophobicContact CG1-CG2 3.59Å; V401-S497 PolarHBondContact N-O 3.42Å; V401-V498 HydrophobicContact CG1-CG2 4.09Å; V401-V498 CarbonylContact O-C 3.59Å; V401-V498 WeakPolarHBondContact O-CA 3.09Å; V401-M499 PolarHBondContact O-N 3.09Å
402	P	93.4	Very high	93.9	Very high	35 Å²	35	61.8 Å²	61.8	23%	0.227	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	141.1	167.7	4.9	9.2	0	0	0	110	R405 M499 I501	P402-R405 HydrophobicContact CB-CG 3.99Å; P402-R405 HydrophobicContact CG-CG 3.92Å; P402-R405 WeakPolarHBondContact O-CB 2.94Å; P402-M499 HydrophobicContact CB-CE 3.91Å; P402-M499 HydrophobicContact CG-CE 3.63Å; P402-I501 HydrophobicContact CB-CD1 3.37Å; P402-I501 HydrophobicContact CB-CG1 4.23Å
403	E	93	Very high	93.9	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.009	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	164.9	175.6	76.4	-174.5	127	0	0	113.1	R405 V460 Y462 V498 M499 D500 I501	E403-R405 PolarHBondContact O-N 2.82Å; E403-V460 WeakPolarHBondContact CB-O 3.47Å; E403-Y462 WeakPolarHBondContact OE2-CB 3.22Å; E403-Y462 PolarHBondContact OE2-N 2.7Å; E403-V498 HydrophobicContact CB-CG1 3.96Å; E403-M499 PolarHBondContact N-O 3.34Å; E403-M499 VanDerWaalsContact N-O 3.16Å; E403-D500 WeakPolarHBondContact OE1-CA 3.43Å; E403-I501 HydrophobicContact CG-CB 4.09Å; E403-I501 HydrophobicContact CG-CG1 4.45Å; E403-I501 PolarHBondContact OE1-N 3.05Å
404	N	90.6	Very high	93.9	Very high	87 Å²	87	60 Å²	60	47%	0.465	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	7.7	-177.9	-64.3	-48.6	0	0	0	115.9	V460 E503	N404-V460 PolarHBondContact N-O 3.46Å; N404-E503 PolarHBondContact ND2-OE1 3.13Å
405	R	89.8	Confident	93.9	Very high	146 Å²	146	59.3 Å²	59.3	55%	0.551	33%	0.332	S	S	*	.			trans	-91.2	143.4	173.6	-65.3	-65.6	-173.5	164.1	-0.9	111.5	P402 E403 T408 V456	P402-R405 HydrophobicContact CB-CG 3.99Å; P402-R405 HydrophobicContact CG-CG 3.92Å; P402-R405 WeakPolarHBondContact O-CB 2.94Å; E403-R405 PolarHBondContact O-N 2.82Å; R405-T408 HydrophobicContact CB-CG2 4.03Å; R405-V456 WeakPolarHBondContact O-CG1 3.1Å
406	V	92	Very high	94	Very high	78 Å²	78	60.9 Å²	60.9	47%	0.473	33%	0.331	S	S	.	.			trans	-128.8	158.4	172.3	-66.9	0	0	0	0	109.2	T408 A459	V406-T408 PolarHBondContact O-N 3.2Å; V406-T408 VanDerWaalsContact O-N 3.16Å; V406-A459 HydrophobicContact CG1-CB 4.12Å
407	E	89.9	Confident	94	Very high	176 Å²	176	57.1 Å²	57.1	82%	0.822	31%	0.307	S	S	*	.	S	Bend	trans	59.3	24.4	178.8	-54.1	-171.4	155.5	0	0	114.4	V456	E407-V456 WeakPolarHBondContact CA-O 3.28Å; E407-V456 PolarHBondContact N-O 2.73Å
408	T	91.6	Very high	93.9	Very high	45 Å²	45	64.3 Å²	64.3	28%	0.276	33%	0.333	S	S	.	.			trans	-97.7	140.3	176.5	54.2	0	0	0	0	110.7	R405 V406 T455 V456	R405-T408 HydrophobicContact CB-CG2 4.03Å; V406-T408 PolarHBondContact O-N 3.2Å; V406-T408 VanDerWaalsContact O-N 3.16Å; T408-T455 VanDerWaalsContact O-CA 3.27Å; T408-T455 WeakPolarHBondContact O-CA 2.95Å; T408-V456 PolarHBondContact O-N 3.47Å
409	V	93.5	Very high	93.9	Very high	76 Å²	76	60.7 Å²	60.7	46%	0.461	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	126.6	172.1	-177.9	0	0	0	0	108.5	N412 M453 V454 T455	V409-N412 WeakPolarHBondContact CG1-OD1 3.46Å; V409-M453 HydrophobicContact CG1-CB 4.21Å; V409-M453 HydrophobicContact CG1-CG 4.44Å; V409-M453 HydrophobicContact CG2-SD 4.25Å; V409-V454 CarbonylContact C-O 3.54Å; V409-V454 WeakPolarHBondContact CA-O 3.49Å; V409-T455 HydrophobicContact CG2-CG2 3.96Å
410	V	94.3	Very high	93.9	Very high	16 Å²	16	64.8 Å²	64.8	10%	0.097	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-39.5	-174.2	-177.7	0	0	0	0	111.6	G399 V401 F441 V454 V456 I496	G399-V410 WeakPolarHBondContact CA-O 3.06Å; V401-V410 HydrophobicContact CB-CG1 4.28Å; V401-V410 HydrophobicContact CB-CG2 4Å; V401-V410 HydrophobicContact CG2-CG2 4.09Å; V410-F441 HydrophobicContact CG2-CE1 4.4Å; V410-V454 PolarHBondContact N-O 3.03Å; V410-V456 HydrophobicContact CG2-CG2 3.42Å; V410-V456 VanDerWaalsContact CG2-CG2 3.42Å; V410-I496 HydrophobicContact CG1-CB 4.34Å; V410-I496 HydrophobicContact CG1-CD1 4.07Å; V410-I496 HydrophobicContact CG1-CG1 3.91Å; V410-I496 HydrophobicContact CG1-CG2 3.65Å
411	A	94.7	Very high	93.8	Very high	10 Å²	10	62.2 Å²	62.2	8%	0.083	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	146.3	-179.7	0	0	0	0	0	110.5	V454 V494	A411-V454 HydrophobicContact CB-CB 4.47Å; A411-V454 HydrophobicContact CB-CG2 4.4Å; A411-V454 PolarHBondContact O-N 3.42Å; A411-V494 HydrophobicContact CB-CG1 4.37Å
412	N	95.5	Very high	93.6	Very high	76 Å²	76	68.2 Å²	68.2	41%	0.406	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	124.3	170.4	-68.9	3.8	0	0	0	109.4	V409 E451	V409-N412 WeakPolarHBondContact CG1-OD1 3.46Å; N412-E451 WeakPolarHBondContact CB-OE2 3.23Å; N412-E451 PolarHBondContact ND2-OE2 2.91Å
413	L	96.5	Very high	93.7	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	103	179.5	-49.4	179	0	0	0	109	F392 F397 Y430 V443 E451 G452 V454 V472 V494	F392-L413 HydrophobicContact CD1-CB 4.34Å; F392-L413 HydrophobicContact CE1-CB 3.82Å; F392-L413 HydrophobicContact CE1-CD1 4.22Å; F397-L413 HydrophobicContact CB-CD2 3.75Å; F397-L413 HydrophobicContact CD1-CD2 4.03Å; F397-L413 HydrophobicContact CD2-CD2 3.6Å; F397-L413 HydrophobicContact CE2-CD2 4.19Å; F397-L413 HydrophobicContact CG-CD2 3.51Å; L413-Y430 HydrophobicContact CB-CE1 4.33Å; L413-Y430 HydrophobicContact CD1-CD1 4.39Å; L413-Y430 PolarHBondContact O-OH 3.21Å; L413-V443 HydrophobicContact CD1-CG1 4.24Å; L413-E451 WeakPolarHBondContact O-CA 3.4Å; L413-G452 WeakPolarHBondContact CB-O 3.47Å; L413-G452 WeakPolarHBondContact CG-O 3.48Å; L413-G452 PolarHBondContact N-O 3.46Å; L413-G452 PolarHBondContact O-N 2.89Å; L413-V454 HydrophobicContact CD1-CG2 3.76Å; L413-V454 HydrophobicContact CD2-CG2 4.08Å; L413-V454 HydrophobicContact CG-CG2 3.81Å; L413-V472 HydrophobicContact CD1-CB 4.15Å; L413-V472 HydrophobicContact CD1-CG1 3.78Å; L413-V472 HydrophobicContact CD1-CG2 4.22Å; L413-V494 HydrophobicContact CD1-CG2 4.28Å; L413-V494 HydrophobicContact CD2-CG1 4.47Å; L413-V494 HydrophobicContact CD2-CG2 3.63Å
414	T	95.8	Very high	93.8	Very high	43 Å²	43	70.2 Å²	70.2	26%	0.264	36%	0.356	S	S	.	.			trans	-82.1	133.2	179.5	53.6	0	0	0	0	111	T393 E451	T393-T414 PolarHBondContact N-O 2.86Å; T393-T414 PolarHBondContact OG1-O 2.94Å; T393-T414 PolarHBondContact OG1-OG1 3.43Å; T414-E451 HydrophobicContact CG2-CG 4.11Å
415	V	95.4	Very high	94	Very high	24 Å²	24	67.4 Å²	67.4	15%	0.145	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	154.9	177.4	-62.4	0	0	0	0	110.7	E391 F392 A428 Y430 N450 V474	E391-V415 CarbonylContact O-C 3.59Å; E391-V415 VanDerWaalsContact O-CA 3.25Å; E391-V415 WeakPolarHBondContact O-CA 3.27Å; F392-V415 HydrophobicContact CD1-CG1 3.49Å; F392-V415 VanDerWaalsContact CD1-CG1 3.49Å; F392-V415 HydrophobicContact CE1-CG1 3.68Å; F392-V415 HydrophobicContact CG-CG1 4.17Å; F392-V415 HydrophobicContact CZ-CG1 4.5Å; V415-A428 HydrophobicContact CG2-CB 4.11Å; V415-Y430 HydrophobicContact CG1-CE1 3.77Å; V415-Y430 VanDerWaalsContact CG1-OH 3.27Å; V415-Y430 WeakPolarHBondContact CG1-OH 3.46Å; V415-Y430 WeakPolarHBondContact CG2-OH 3.4Å; V415-N450 WeakPolarHBondContact CG2-O 3.25Å; V415-V474 HydrophobicContact CG1-CB 4.44Å; V415-V474 HydrophobicContact CG1-CG1 4.15Å; V415-V474 HydrophobicContact CG1-CG2 4.21Å
416	M	94.1	Very high	94.3	Very high	125 Å²	125	62.1 Å²	62.1	62%	0.616	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.2	169.1	-69.6	-168	-63.9	0	0	108.9	E391 T393	E391-M416 PolarHBondContact N-O 3.43Å; E391-M416 PolarHBondContact O-N 2.89Å; T393-M416 HydrophobicContact CG2-CE 4.39Å; T393-M416 HydrophobicContact CG2-CG 3.97Å
417	D	95.1	Very high	94.4	Very high	17 Å²	17	60.5 Å²	60.5	9%	0.091	31%	0.31	C	S	.	.			trans	-135.4	137	174.6	-166.9	-49.4	0	0	0	107.2	P390 D419 W426 N476	P390-D417 HydrophobicContact CB-CB 4.29Å; D417-D419 WeakPolarHBondContact OD1-CB 3.44Å; D417-D419 PolarHBondContact OD1-N 3.3Å; D417-W426 HydrophobicContact CB-CG 4.33Å; D417-W426 PolarHBondContact O-NE1 3.41Å; D417-N476 PolarHBondContact OD2-ND2 2.69Å
418	R	94.8	Very high	94.7	Very high	177 Å²	177	52.3 Å²	52.3	67%	0.668	27%	0.272	S	S	*	.			trans	-96.9	-12.9	-171.9	-65	-176	177.9	162.8	5.4	113	R349 E350 N388	R349-R418 PolarHBondContact NH2-O 2.89Å; E350-R418 HydrophobicContact CG-CB 3.96Å; E350-R418 WeakPolarHBondContact CG-O 3.5Å; N388-R418 HydrophobicContact CB-CB 3.96Å
419	D	95.8	Very high	94.9	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	27%	0.271	C	S	.	.	S	Bend	trans	-63.6	172.9	176.4	-63.7	-12.1	0	0	0	110.6	N386 N388 D417 P421 N425 W426	N386-D419 VanDerWaalsContact CA-OD2 3.3Å; N386-D419 WeakPolarHBondContact CA-OD2 3.39Å; N386-D419 PolarHBondContact OD1-OD2 3.2Å; N386-D419 VanDerWaalsContact OD1-OD2 3.12Å; N388-D419 VanDerWaalsContact CB-OD1 3.23Å; N388-D419 WeakPolarHBondContact CB-OD1 3.36Å; N388-D419 PolarHBondContact N-OD1 2.97Å; N388-D419 VanDerWaalsContact N-OD1 3.17Å; N388-D419 PolarHBondContact ND2-OD1 2.77Å; D417-D419 WeakPolarHBondContact OD1-CB 3.44Å; D417-D419 PolarHBondContact OD1-N 3.3Å; D419-P421 WeakPolarHBondContact O-CD 3.31Å; D419-N425 HydrophobicContact CB-CB 4.01Å; D419-W426 HydrophobicContact CB-CB 4.39Å
420	Q	95.1	Very high	95.1	Very high	96 Å²	96	49.3 Å²	49.3	45%	0.449	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-56.5	120.6	-176.4	-176.8	175.5	12.2	0	0	112.7	D384 H422 S423 W426	D384-Q420 HydrophobicContact CB-CB 3.87Å; D384-Q420 WeakPolarHBondContact OD1-CB 3.32Å; D384-Q420 PolarHBondContact OD1-N 3.35Å; D384-Q420 WeakPolarHBondContact OD2-CB 3.35Å; D384-Q420 PolarHBondContact OD2-N 3.22Å; Q420-H422 PolarHBondContact O-N 3.46Å; Q420-S423 WeakPolarHBondContact O-CB 3.34Å; Q420-S423 PolarHBondContact O-N 3.1Å; Q420-S423 VanDerWaalsContact O-N 3.08Å; Q420-S423 PolarHBondContact O-OG 2.98Å; Q420-W426 WeakPolarHBondContact O-CB 3.27Å
421	P	93.9	Very high	95.1	Very high	76 Å²	76	56.4 Å²	56.4	49%	0.494	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	141.3	-179.8	-27.2	34.9	0	0	0	113.1	D419 S423	D419-P421 WeakPolarHBondContact O-CD 3.31Å; P421-S423 PolarHBondContact O-N 3.25Å
422	H	91.6	Very high	95.2	Very high	126 Å²	126	58.3 Å²	58.3	58%	0.583	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	12.6	-176.3	-48	-68.3	0	0	0	115.4	Q420 W426	Q420-H422 PolarHBondContact O-N 3.46Å; H422-W426 AromaticContact ND1-CZ3 3.91Å
423	S	94.3	Very high	95.2	Very high	12 Å²	12	59.3 Å²	59.3	8%	0.084	29%	0.29	C	S	.	.	S	Bend	trans	-85.7	160.2	169	88.9	0	0	0	0	110.8	D384 Q420 P421 N425 W426 N427	D384-S423 PolarHBondContact OD2-OG 3.35Å; Q420-S423 WeakPolarHBondContact O-CB 3.34Å; Q420-S423 PolarHBondContact O-N 3.1Å; Q420-S423 VanDerWaalsContact O-N 3.08Å; Q420-S423 PolarHBondContact O-OG 2.98Å; P421-S423 PolarHBondContact O-N 3.25Å; S423-N425 PolarHBondContact O-N 3.07Å; S423-N425 WeakPolarHBondContact OG-CB 3.48Å; S423-N425 PolarHBondContact OG-N 2.69Å; S423-N425 VanDerWaalsContact OG-N 3.09Å; S423-W426 PolarHBondContact O-N 3.15Å; S423-W426 PolarHBondContact OG-N 2.81Å; S423-N427 PolarHBondContact O-N 2.92Å; S423-N427 PolarHBondContact O-OD1 3.04Å
424	P	95.3	Very high	95.1	Very high	67 Å²	67	62 Å²	62	44%	0.435	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.7	170.1	-23.8	35	0	0	0	114	Q477 A478	P424-Q477 WeakPolarHBondContact O-CB 3.22Å; P424-Q477 PolarHBondContact O-N 2.88Å; P424-A478 HydrophobicContact CB-CB 4.17Å; P424-A478 WeakPolarHBondContact O-CB 3.23Å; P424-A478 PolarHBondContact O-N 3.36Å
425	N	95.1	Very high	94.9	Very high	29 Å²	29	61.5 Å²	61.5	16%	0.155	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-33.3	175.3	-56.7	-23.8	0	0	0	110.4	D384 N386 D419 S423 N476 A478	D384-N425 PolarHBondContact O-ND2 3.19Å; D384-N425 WeakPolarHBondContact OD2-CB 3.31Å; D384-N425 PolarHBondContact OD2-ND2 3.11Å; N386-N425 HydrophobicContact CB-CB 3.74Å; D419-N425 HydrophobicContact CB-CB 4.01Å; S423-N425 PolarHBondContact O-N 3.07Å; S423-N425 WeakPolarHBondContact OG-CB 3.48Å; S423-N425 PolarHBondContact OG-N 2.69Å; S423-N425 VanDerWaalsContact OG-N 3.09Å; N425-N476 VanDerWaalsContact O-CB 3.25Å; N425-N476 WeakPolarHBondContact O-CB 3.47Å; N425-N476 PolarHBondContact O-ND2 2.67Å; N425-A478 VanDerWaalsContact OD1-CB 3.25Å; N425-A478 WeakPolarHBondContact OD1-CB 3.38Å
426	W	95.3	Very high	94.9	Very high	35 Å²	35	61.4 Å²	61.4	13%	0.133	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-29.5	177.8	-178.7	87.8	0	0	0	114.7	D417 D419 Q420 H422 S423 A428 N450	D417-W426 HydrophobicContact CB-CG 4.33Å; D417-W426 PolarHBondContact O-NE1 3.41Å; D419-W426 HydrophobicContact CB-CB 4.39Å; Q420-W426 WeakPolarHBondContact O-CB 3.27Å; H422-W426 AromaticContact ND1-CZ3 3.91Å; S423-W426 PolarHBondContact O-N 3.15Å; S423-W426 PolarHBondContact OG-N 2.81Å; W426-A428 PolarHBondContact O-N 3.11Å; W426-N450 HydrophobicContact CE3-CB 4.27Å; W426-N450 HydrophobicContact CH2-CB 3.33Å; W426-N450 HydrophobicContact CZ2-CB 3.81Å; W426-N450 HydrophobicContact CZ3-CB 3.57Å; W426-N450 PolarHBondContact O-ND2 3.33Å
427	N	95.4	Very high	94.7	Very high	44 Å²	44	61.8 Å²	61.8	24%	0.235	32%	0.322	C	S	.	.			trans	-62	120	-175.9	-73.1	-11.5	0	0	0	112	S423 N476 Q477	S423-N427 PolarHBondContact O-N 2.92Å; S423-N427 PolarHBondContact O-OD1 3.04Å; N427-N476 CarbonylContact O-C 3.5Å; N427-N476 VanDerWaalsContact O-CA 3.27Å; N427-N476 WeakPolarHBondContact O-CA 3.31Å; N427-Q477 HydrophobicContact CB-CB 4.16Å; N427-Q477 PolarHBondContact ND2-OE1 2.63Å; N427-Q477 PolarHBondContact O-N 3.06Å
428	A	95.9	Very high	94.5	Very high	3 Å²	3	64.5 Å²	64.5	3%	0.025	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	141.2	-176.8	0	0	0	0	0	112.4	V415 W426 Y430 T445 N450 V474	V415-A428 HydrophobicContact CG2-CB 4.11Å; W426-A428 PolarHBondContact O-N 3.11Å; A428-Y430 HydrophobicContact CB-CE2 3.78Å; A428-T445 HydrophobicContact CB-CG2 4.43Å; A428-T445 WeakPolarHBondContact O-CB 3.28Å; A428-T445 WeakPolarHBondContact O-CG2 3.39Å; A428-T445 PolarHBondContact O-OG1 2.84Å; A428-N450 VanDerWaalsContact CB-OD1 3.27Å; A428-N450 WeakPolarHBondContact CB-OD1 3.49Å; A428-N450 PolarHBondContact N-OD1 3.41Å; A428-V474 HydrophobicContact CB-CG2 3.78Å
429	V	95.9	Very high	94.5	Very high	45 Å²	45	57.9 Å²	57.9	27%	0.273	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	114.8	175.9	-179.8	0	0	0	0	107.6	S475 Q477	V429-S475 WeakPolarHBondContact CA-O 3.45Å; V429-S475 WeakPolarHBondContact CB-O 3.37Å; V429-S475 PolarHBondContact N-O 2.97Å; V429-S475 PolarHBondContact O-N 2.65Å; V429-S475 PolarHBondContact O-OG 3.01Å; V429-Q477 HydrophobicContact CG2-CB 4.14Å
430	Y	96.3	Very high	94.4	Very high	14 Å²	14	58.8 Å²	58.8	6%	0.055	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	142.9	-178	-60.3	-85.4	0	0	0	111.8	F392 L413 V415 A428 V443 T445 N450 G452 V472 M473 V474	F392-Y430 HydrophobicContact CE1-CD1 4.16Å; F392-Y430 AromaticContact CE1-CE1 3.68Å; F392-Y430 HydrophobicContact CE1-CE1 3.68Å; F392-Y430 HydrophobicContact CZ-CD1 4.09Å; F392-Y430 HydrophobicContact CZ-CE1 4.01Å; L413-Y430 HydrophobicContact CB-CE1 4.33Å; L413-Y430 HydrophobicContact CD1-CD1 4.39Å; L413-Y430 PolarHBondContact O-OH 3.21Å; V415-Y430 HydrophobicContact CG1-CE1 3.77Å; V415-Y430 VanDerWaalsContact CG1-OH 3.27Å; V415-Y430 WeakPolarHBondContact CG1-OH 3.46Å; V415-Y430 WeakPolarHBondContact CG2-OH 3.4Å; A428-Y430 HydrophobicContact CB-CE2 3.78Å; Y430-V443 HydrophobicContact CD1-CG1 4.36Å; Y430-V443 HydrophobicContact CD2-CG1 4.1Å; Y430-V443 HydrophobicContact CG-CG1 3.7Å; Y430-T445 WeakPolarHBondContact CD2-OG1 3.25Å; Y430-T445 HydrophobicContact CE2-CG2 4.1Å; Y430-N450 PolarHBondContact OH-O 2.8Å; Y430-G452 VanDerWaalsContact CE2-N 3.31Å; Y430-G452 VanDerWaalsContact CZ-CA 3.49Å; Y430-G452 VanDerWaalsContact CZ-N 3.28Å; Y430-G452 PolarHBondContact OH-N 3.27Å; Y430-G452 VanDerWaalsContact OH-N 3.16Å; Y430-V472 HydrophobicContact CD1-CG1 4.29Å; Y430-M473 WeakPolarHBondContact CA-O 3.35Å; Y430-V474 HydrophobicContact CD1-CB 3.85Å; Y430-V474 HydrophobicContact CD1-CG2 3.84Å; Y430-V474 HydrophobicContact CE1-CB 3.8Å; Y430-V474 HydrophobicContact CE1-CG2 3.56Å
431	R	95.2	Very high	94.5	Very high	165 Å²	165	54.7 Å²	54.7	62%	0.623	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.4	133.9	174.2	-64	-176	-177.3	164	3.6	110.8	I433 V472 M473	R431-I433 PolarHBondContact O-N 3.09Å; R431-V472 WeakPolarHBondContact O-CA 3.22Å; R431-M473 PolarHBondContact N-O 3.17Å; R431-M473 PolarHBondContact O-N 3.12Å
432	I	96.5	Very high	94.5	Very high	50 Å²	50	52.7 Å²	52.7	26%	0.256	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	115.8	170.6	-54.2	173.7	0	0	0	107.1	S434 F441 V443 L470 V472	I432-S434 WeakPolarHBondContact CG2-O 3.46Å; I432-F441 HydrophobicContact CD1-CB 3.91Å; I432-F441 WeakPolarHBondContact CD1-O 3.37Å; I432-V443 HydrophobicContact CD1-CG2 4.03Å; I432-V443 HydrophobicContact CG1-CG2 3.73Å; I432-L470 HydrophobicContact CD1-CD1 4.39Å; I432-V472 HydrophobicContact CG1-CG2 4.39Å
433	I	95.1	Very high	94.8	Very high	97 Å²	97	47.9 Å²	47.9	50%	0.497	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-23	-178.9	58.2	166.3	0	0	0	112.5	R431 T471 M473 T491	R431-I433 PolarHBondContact O-N 3.09Å; I433-T471 HydrophobicContact CD1-CG2 3.69Å; I433-T471 HydrophobicContact CG1-CG2 3.82Å; I433-T471 WeakPolarHBondContact CG1-O 3.37Å; I433-T471 PolarHBondContact N-O 3.45Å; I433-M473 HydrophobicContact CD1-CB 4.44Å; I433-M473 HydrophobicContact CG2-CB 3.82Å; I433-M473 HydrophobicContact CG2-SD 4.5Å; I433-T491 HydrophobicContact CD1-CG2 4.13Å
434	S	94.8	Very high	94.7	Very high	57 Å²	57	55 Å²	55	40%	0.399	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	168.4	175.6	74.8	0	0	0	0	112	I432 L470 T471	I432-S434 WeakPolarHBondContact CG2-O 3.46Å; S434-L470 WeakPolarHBondContact O-CA 3.07Å; S434-T471 PolarHBondContact N-O 3.15Å; S434-T471 PolarHBondContact O-N 2.86Å; S434-T471 WeakPolarHBondContact OG-CB 3.27Å; S434-T471 PolarHBondContact OG-OG1 2.83Å
435	G	92.5	Very high	94.7	Very high	32 Å²	32	54.1 Å²	54.1	33%	0.33	30%	0.3	S	S	.	.	S	Bend	trans	100.5	-12.8	173.5	0	0	0	0	0	115.7	M469	G435-M469 WeakPolarHBondContact CA-O 3.34Å
436	D	94.1	Very high	94.6	Very high	22 Å²	22	54.6 Å²	54.6	12%	0.118	30%	0.303	C	S	.	.			trans	-139.6	83.8	176.1	177.9	19.5	0	0	0	111.6	S438 G439 H440 F441 L470	D436-S438 PolarHBondContact O-N 3.31Å; D436-S438 PolarHBondContact OD1-N 2.88Å; D436-G439 PolarHBondContact OD1-N 3.34Å; D436-G439 VanDerWaalsContact OD2-C 3.29Å; D436-G439 WeakPolarHBondContact OD2-CA 3.16Å; D436-H440 VanDerWaalsContact CG-N 3.29Å; D436-H440 IonicContact OD1-CD2 2.95Å; D436-H440 PolarHBondContact OD1-N 2.78Å; D436-H440 VanDerWaalsContact OD1-N 3.13Å; D436-H440 WeakPolarHBondContact OD2-CA 3.33Å; D436-H440 PolarHBondContact OD2-N 3.26Å; D436-F441 HydrophobicContact CB-CD2 4.22Å; D436-F441 PolarHBondContact OD2-N 2.85Å; D436-L470 HydrophobicContact CB-CD2 3.65Å
437	P	90.8	Very high	94.3	Very high	132 Å²	132	57.9 Å²	57.9	86%	0.857	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-15.1	179.4	30.4	-35.1	0	0	0	113.5
438	S	91.8	Very high	93.9	Very high	74 Å²	74	60.9 Å²	60.9	52%	0.517	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-4.2	-175.4	-69	0	0	0	0	113.5	D436 H440	D436-S438 PolarHBondContact O-N 3.31Å; D436-S438 PolarHBondContact OD1-N 2.88Å; S438-H440 WeakPolarHBondContact CB-NE2 3.4Å
439	G	93.4	Very high	93.7	Very high	38 Å²	38	63.9 Å²	63.9	39%	0.392	37%	0.366	S	S	.	.			trans	70.4	42.9	174.3	0	0	0	0	0	113.1	D436 V457	D436-G439 PolarHBondContact OD1-N 3.34Å; D436-G439 VanDerWaalsContact OD2-C 3.29Å; D436-G439 WeakPolarHBondContact OD2-CA 3.16Å; G439-V457 VanDerWaalsContact O-CG2 3.31Å; G439-V457 WeakPolarHBondContact O-CG2 3.22Å
440	H	94.1	Very high	93.6	Very high	21 Å²	21	62 Å²	62	10%	0.097	35%	0.354	C	S	.	.			trans	-71.8	-29.8	172	-69.2	-85.8	0	0	0	113.7	D436 S438 V457 K458 A459 V460	D436-H440 VanDerWaalsContact CG-N 3.29Å; D436-H440 IonicContact OD1-CD2 2.95Å; D436-H440 PolarHBondContact OD1-N 2.78Å; D436-H440 VanDerWaalsContact OD1-N 3.13Å; D436-H440 WeakPolarHBondContact OD2-CA 3.33Å; D436-H440 PolarHBondContact OD2-N 3.26Å; S438-H440 WeakPolarHBondContact CB-NE2 3.4Å; H440-V457 WeakPolarHBondContact O-CG2 3.49Å; H440-V457 PolarHBondContact O-N 3.36Å; H440-K458 PolarHBondContact ND1-O 3.19Å; H440-K458 PolarHBondContact O-N 3.46Å; H440-A459 PolarHBondContact CE1-O 2.88Å; H440-A459 VanDerWaalsContact CE1-O 3.24Å; H440-A459 PolarHBondContact ND1-O 3.49Å; H440-V460 HydrophobicContact CB-CG1 3.93Å
441	F	96.3	Very high	93.5	Very high	10 Å²	10	63.7 Å²	63.7	4%	0.044	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	148.4	-173.6	-55	-81.6	0	0	0	112.2	V410 I432 D436 V454 T455 V456 V460 F468 L470 I496	V410-F441 HydrophobicContact CG2-CE1 4.4Å; I432-F441 HydrophobicContact CD1-CB 3.91Å; I432-F441 WeakPolarHBondContact CD1-O 3.37Å; D436-F441 HydrophobicContact CB-CD2 4.22Å; D436-F441 PolarHBondContact OD2-N 2.85Å; F441-V454 HydrophobicContact CB-CG1 4.36Å; F441-V454 HydrophobicContact CD1-CG1 4.35Å; F441-T455 CarbonylContact C-O 3.44Å; F441-T455 VanDerWaalsContact CA-O 3.32Å; F441-T455 WeakPolarHBondContact CA-O 3.32Å; F441-V456 HydrophobicContact CD1-CG2 4.23Å; F441-V456 HydrophobicContact CE1-CG2 4.02Å; F441-V460 HydrophobicContact CE2-CG1 4.4Å; F441-V460 HydrophobicContact CZ-CG1 3.91Å; F441-F468 HydrophobicContact CE2-CB 3.94Å; F441-F468 AromaticContact CE2-CD1 3.79Å; F441-F468 HydrophobicContact CE2-CD1 3.79Å; F441-F468 AromaticContact CE2-CD2 3.64Å; F441-F468 HydrophobicContact CE2-CD2 3.64Å; F441-F468 HydrophobicContact CE2-CE1 4.16Å; F441-F468 HydrophobicContact CE2-CE2 4.04Å; F441-F468 AromaticContact CE2-CG 3.51Å; F441-F468 HydrophobicContact CE2-CG 3.51Å; F441-F468 HydrophobicContact CE2-CZ 4.27Å; F441-F468 HydrophobicContact CZ-CB 4.39Å; F441-F468 AromaticContact CZ-CD2 3.72Å; F441-F468 HydrophobicContact CZ-CD2 3.72Å; F441-F468 HydrophobicContact CZ-CE2 4.11Å; F441-F468 HydrophobicContact CZ-CG 4.02Å; F441-L470 HydrophobicContact CB-CD1 4.03Å; F441-L470 HydrophobicContact CD2-CD1 4.07Å; F441-L470 HydrophobicContact CD2-CD2 4.09Å; F441-L470 HydrophobicContact CG-CD1 4.02Å; F441-I496 HydrophobicContact CD1-CD1 3.64Å; F441-I496 HydrophobicContact CD2-CD1 4.33Å; F441-I496 HydrophobicContact CE1-CD1 3.45Å; F441-I496 VanDerWaalsContact CE1-CD1 3.45Å; F441-I496 HydrophobicContact CE1-CG2 4.1Å; F441-I496 HydrophobicContact CE2-CD1 4.18Å; F441-I496 HydrophobicContact CG-CD1 4.08Å; F441-I496 HydrophobicContact CZ-CB 4.48Å; F441-I496 HydrophobicContact CZ-CD1 3.74Å; F441-I496 HydrophobicContact CZ-CG2 4.05Å
442	S	95.8	Very high	93.6	Very high	33 Å²	33	55.9 Å²	55.9	23%	0.231	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	148.8	168.9	83.2	0	0	0	0	110	T455 V457	S442-T455 PolarHBondContact N-O 2.65Å; S442-T455 PolarHBondContact O-N 3.26Å; S442-T455 PolarHBondContact O-OG1 3.34Å; S442-T455 PolarHBondContact OG-OG1 3.21Å; S442-V457 VanDerWaalsContact OG-CG1 3.23Å; S442-V457 WeakPolarHBondContact OG-CG1 3.22Å
443	V	96.6	Very high	93.5	Very high	25 Å²	25	56.1 Å²	56.1	15%	0.152	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.4	177	-167.5	0	0	0	0	108.6	L413 Y430 I432 M453 V454 V472	L413-V443 HydrophobicContact CD1-CG1 4.24Å; Y430-V443 HydrophobicContact CD1-CG1 4.36Å; Y430-V443 HydrophobicContact CD2-CG1 4.1Å; Y430-V443 HydrophobicContact CG-CG1 3.7Å; I432-V443 HydrophobicContact CD1-CG2 4.03Å; I432-V443 HydrophobicContact CG1-CG2 3.73Å; V443-M453 WeakPolarHBondContact CA-O 3.49Å; V443-V454 HydrophobicContact CG1-CG2 4.47Å; V443-V454 HydrophobicContact CG2-CG2 4.12Å; V443-V472 HydrophobicContact CG2-CG1 4.34Å
444	R	93.3	Very high	93.6	Very high	162 Å²	162	51.5 Å²	51.5	61%	0.611	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.4	176	-64.3	-172.9	178.7	-174.1	1.2	109.4	G452 M453	R444-G452 CarbonylContact O-C 3.49Å; R444-M453 PolarHBondContact N-O 2.9Å; R444-M453 PolarHBondContact O-N 2.66Å
445	T	95.1	Very high	93.6	Very high	49 Å²	49	49.5 Å²	49.5	30%	0.301	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	130.4	173.4	-49	0	0	0	0	109.5	A428 Y430 E451	A428-T445 HydrophobicContact CB-CG2 4.43Å; A428-T445 WeakPolarHBondContact O-CB 3.28Å; A428-T445 WeakPolarHBondContact O-CG2 3.39Å; A428-T445 PolarHBondContact O-OG1 2.84Å; Y430-T445 WeakPolarHBondContact CD2-OG1 3.25Å; Y430-T445 HydrophobicContact CE2-CG2 4.1Å; T445-E451 CarbonylContact C-O 3.56Å; T445-E451 WeakPolarHBondContact CA-O 3.27Å
446	D	92.9	Very high	93.8	Very high	39 Å²	39	48 Å²	48	21%	0.209	28%	0.28	C	S	.	.			trans	-75	120.3	165.6	178.2	-14.9	0	0	0	109.3	V448 T449 N450 E451	D446-V448 PolarHBondContact O-N 2.99Å; D446-V448 PolarHBondContact OD1-N 3.46Å; D446-T449 VanDerWaalsContact CB-OG1 3.27Å; D446-T449 WeakPolarHBondContact CB-OG1 3.27Å; D446-T449 PolarHBondContact OD1-N 2.84Å; D446-T449 PolarHBondContact OD2-OG1 3.36Å; D446-N450 WeakPolarHBondContact O-CA 3.49Å; D446-N450 PolarHBondContact O-N 3.15Å; D446-E451 PolarHBondContact N-O 2.89Å
447	P	88.1	Confident	93.8	Very high	104 Å²	104	50.4 Å²	50.4	68%	0.675	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-18	-176.3	28.6	-36.1	0	0	0	114.3
448	V	87.4	Confident	93.9	Very high	107 Å²	107	49.5 Å²	49.5	65%	0.648	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-51.9	-178	-177.9	0	0	0	0	110.8	D446	D446-V448 PolarHBondContact O-N 2.99Å; D446-V448 PolarHBondContact OD1-N 3.46Å
449	T	91.1	Very high	94	Very high	66 Å²	66	47.9 Å²	47.9	41%	0.405	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-15.2	-175.3	62	0	0	0	0	113.1	D446 E451	D446-T449 VanDerWaalsContact CB-OG1 3.27Å; D446-T449 WeakPolarHBondContact CB-OG1 3.27Å; D446-T449 PolarHBondContact OD1-N 2.84Å; D446-T449 PolarHBondContact OD2-OG1 3.36Å; T449-E451 PolarHBondContact O-N 3.49Å; T449-E451 WeakPolarHBondContact OG1-CB 3.15Å; T449-E451 WeakPolarHBondContact OG1-CG 3.44Å; T449-E451 PolarHBondContact OG1-N 2.87Å
450	N	94.3	Very high	94	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.027	25%	0.251	C	S	.	.			trans	61.4	16.9	-171.4	-153.1	31.2	0	0	0	113.5	V415 W426 A428 Y430 D446	V415-N450 WeakPolarHBondContact CG2-O 3.25Å; W426-N450 HydrophobicContact CE3-CB 4.27Å; W426-N450 HydrophobicContact CH2-CB 3.33Å; W426-N450 HydrophobicContact CZ2-CB 3.81Å; W426-N450 HydrophobicContact CZ3-CB 3.57Å; W426-N450 PolarHBondContact O-ND2 3.33Å; A428-N450 VanDerWaalsContact CB-OD1 3.27Å; A428-N450 WeakPolarHBondContact CB-OD1 3.49Å; A428-N450 PolarHBondContact N-OD1 3.41Å; Y430-N450 PolarHBondContact OH-O 2.8Å; D446-N450 WeakPolarHBondContact O-CA 3.49Å; D446-N450 PolarHBondContact O-N 3.15Å
451	E	95.1	Very high	93.9	Very high	50 Å²	50	48.5 Å²	48.5	23%	0.234	26%	0.264	C	S	.	.			trans	-79.1	147.5	177.3	-66.5	-178.9	-178.2	0	0	111.6	N412 L413 T414 T445 D446 T449	N412-E451 WeakPolarHBondContact CB-OE2 3.23Å; N412-E451 PolarHBondContact ND2-OE2 2.91Å; L413-E451 WeakPolarHBondContact O-CA 3.4Å; T414-E451 HydrophobicContact CG2-CG 4.11Å; T445-E451 CarbonylContact C-O 3.56Å; T445-E451 WeakPolarHBondContact CA-O 3.27Å; D446-E451 PolarHBondContact N-O 2.89Å; T449-E451 PolarHBondContact O-N 3.49Å; T449-E451 WeakPolarHBondContact OG1-CB 3.15Å; T449-E451 WeakPolarHBondContact OG1-CG 3.44Å; T449-E451 PolarHBondContact OG1-N 2.87Å
452	G	95.9	Very high	93.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	105.5	173.2	0	0	0	0	0	111.1	L413 Y430 R444 V454	L413-G452 WeakPolarHBondContact CB-O 3.47Å; L413-G452 WeakPolarHBondContact CG-O 3.48Å; L413-G452 PolarHBondContact N-O 3.46Å; L413-G452 PolarHBondContact O-N 2.89Å; Y430-G452 VanDerWaalsContact CE2-N 3.31Å; Y430-G452 VanDerWaalsContact CZ-CA 3.49Å; Y430-G452 VanDerWaalsContact CZ-N 3.28Å; Y430-G452 PolarHBondContact OH-N 3.27Å; Y430-G452 VanDerWaalsContact OH-N 3.16Å; R444-G452 CarbonylContact O-C 3.49Å; G452-V454 PolarHBondContact O-N 3.04Å
453	M	95.7	Very high	93.6	Very high	55 Å²	55	49.9 Å²	49.9	27%	0.271	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	109.9	173.3	-65.2	-169.5	-64.3	0	0	110.3	V409 V443 R444 T455	V409-M453 HydrophobicContact CG1-CB 4.21Å; V409-M453 HydrophobicContact CG1-CG 4.44Å; V409-M453 HydrophobicContact CG2-SD 4.25Å; V443-M453 WeakPolarHBondContact CA-O 3.49Å; R444-M453 PolarHBondContact N-O 2.9Å; R444-M453 PolarHBondContact O-N 2.66Å; M453-T455 HydrophobicContact CB-CG2 4.46Å; M453-T455 PolarHBondContact O-N 3.08Å
454	V	96.6	Very high	93.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	119.7	171.2	-172.8	0	0	0	0	108.2	V409 V410 A411 L413 F441 V443 G452 L470 I496	V409-V454 CarbonylContact C-O 3.54Å; V409-V454 WeakPolarHBondContact CA-O 3.49Å; V410-V454 PolarHBondContact N-O 3.03Å; A411-V454 HydrophobicContact CB-CB 4.47Å; A411-V454 HydrophobicContact CB-CG2 4.4Å; A411-V454 PolarHBondContact O-N 3.42Å; L413-V454 HydrophobicContact CD1-CG2 3.76Å; L413-V454 HydrophobicContact CD2-CG2 4.08Å; L413-V454 HydrophobicContact CG-CG2 3.81Å; F441-V454 HydrophobicContact CB-CG1 4.36Å; F441-V454 HydrophobicContact CD1-CG1 4.35Å; V443-V454 HydrophobicContact CG1-CG2 4.47Å; V443-V454 HydrophobicContact CG2-CG2 4.12Å; G452-V454 PolarHBondContact O-N 3.04Å; V454-L470 HydrophobicContact CG1-CD1 4.28Å; V454-I496 HydrophobicContact CG1-CD1 4.11Å
455	T	95.4	Very high	93.3	Very high	15 Å²	15	50.1 Å²	50.1	9%	0.092	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	145.4	-174.5	53.5	0	0	0	0	111.3	T408 V409 F441 S442 M453	T408-T455 VanDerWaalsContact O-CA 3.27Å; T408-T455 WeakPolarHBondContact O-CA 2.95Å; V409-T455 HydrophobicContact CG2-CG2 3.96Å; F441-T455 CarbonylContact C-O 3.44Å; F441-T455 VanDerWaalsContact CA-O 3.32Å; F441-T455 WeakPolarHBondContact CA-O 3.32Å; S442-T455 PolarHBondContact N-O 2.65Å; S442-T455 PolarHBondContact O-N 3.26Å; S442-T455 PolarHBondContact O-OG1 3.34Å; S442-T455 PolarHBondContact OG-OG1 3.21Å; M453-T455 HydrophobicContact CB-CG2 4.46Å; M453-T455 PolarHBondContact O-N 3.08Å
456	V	95.8	Very high	93.2	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.006	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	118.1	174	-169.9	0	0	0	0	109.5	V401 R405 E407 T408 V410 F441 K458	V401-V456 HydrophobicContact CG2-CG2 3.55Å; R405-V456 WeakPolarHBondContact O-CG1 3.1Å; E407-V456 WeakPolarHBondContact CA-O 3.28Å; E407-V456 PolarHBondContact N-O 2.73Å; T408-V456 PolarHBondContact O-N 3.47Å; V410-V456 HydrophobicContact CG2-CG2 3.42Å; V410-V456 VanDerWaalsContact CG2-CG2 3.42Å; F441-V456 HydrophobicContact CD1-CG2 4.23Å; F441-V456 HydrophobicContact CE1-CG2 4.02Å; V456-K458 VanDerWaalsContact CG1-O 3.24Å; V456-K458 WeakPolarHBondContact CG1-O 3.38Å
457	V	94.6	Very high	93.2	Very high	73 Å²	73	55.9 Å²	55.9	44%	0.442	31%	0.305	S	S	.	.	S	Bend	trans	-100.3	-21.6	176.6	-67.8	0	0	0	0	112.7	G439 H440 S442	G439-V457 VanDerWaalsContact O-CG2 3.31Å; G439-V457 WeakPolarHBondContact O-CG2 3.22Å; H440-V457 WeakPolarHBondContact O-CG2 3.49Å; H440-V457 PolarHBondContact O-N 3.36Å; S442-V457 VanDerWaalsContact OG-CG1 3.23Å; S442-V457 WeakPolarHBondContact OG-CG1 3.22Å
458	K	94	Very high	93.6	Very high	113 Å²	113	51.8 Å²	51.8	49%	0.491	28%	0.277	S	S	.	.	S	Bend	trans	-137.6	131.8	176.5	180	-171.6	179.8	-169.7	0	109.1	H440 V456 V460	H440-K458 PolarHBondContact ND1-O 3.19Å; H440-K458 PolarHBondContact O-N 3.46Å; V456-K458 VanDerWaalsContact CG1-O 3.24Å; V456-K458 WeakPolarHBondContact CG1-O 3.38Å; K458-V460 PolarHBondContact O-N 2.64Å
459	A	91.9	Very high	94	Very high	39 Å²	39	53.1 Å²	53.1	32%	0.322	28%	0.278	S	S	.	.			trans	-47.4	135.3	-179.4	0	0	0	0	0	111.3	V406 H440	V406-A459 HydrophobicContact CG1-CB 4.12Å; H440-A459 PolarHBondContact CE1-O 2.88Å; H440-A459 VanDerWaalsContact CE1-O 3.24Å; H440-A459 PolarHBondContact ND1-O 3.49Å
460	V	93.6	Very high	94.2	Very high	1 Å²	1	50 Å²	50	1%	0.006	26%	0.258	C	S	.	.			trans	-98	149.3	172	-64	0	0	0	0	108.6	V401 E403 N404 H440 F441 K458 F468 V498	V401-V460 HydrophobicContact CG1-CG2 4.01Å; E403-V460 WeakPolarHBondContact CB-O 3.47Å; N404-V460 PolarHBondContact N-O 3.46Å; H440-V460 HydrophobicContact CB-CG1 3.93Å; F441-V460 HydrophobicContact CE2-CG1 4.4Å; F441-V460 HydrophobicContact CZ-CG1 3.91Å; K458-V460 PolarHBondContact O-N 2.64Å; V460-F468 HydrophobicContact CB-CE2 4.24Å; V460-F468 HydrophobicContact CG1-CE2 3.83Å; V460-F468 HydrophobicContact CG1-CZ 4.13Å; V460-V498 HydrophobicContact CB-CG2 4.5Å; V460-V498 HydrophobicContact CG2-CG1 3.92Å; V460-V498 HydrophobicContact CG2-CG2 4.16Å
461	D	92.8	Very high	94.3	Very high	71 Å²	71	51.6 Å²	51.6	38%	0.38	27%	0.268	S	S	.	.			trans	-120.4	121.1	-177.7	163.2	-16.4	0	0	0	106.2	E463 L464 N465	D461-E463 WeakPolarHBondContact OD1-CA 3.28Å; D461-E463 WeakPolarHBondContact OD1-CB 3.4Å; D461-E463 PolarHBondContact OD1-N 2.89Å; D461-L464 HydrophobicContact CB-CB 4.27Å; D461-L464 PolarHBondContact O-N 2.9Å; D461-L464 PolarHBondContact OD1-N 3.2Å; D461-N465 PolarHBondContact O-N 3.39Å
462	Y	94.1	Very high	94.4	Very high	39 Å²	39	49.2 Å²	49.2	15%	0.153	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-40	-174.5	177.6	-97.8	0	0	0	112	E403 L464 N465 R466 V498 D500 F537	E403-Y462 WeakPolarHBondContact OE2-CB 3.22Å; E403-Y462 PolarHBondContact OE2-N 2.7Å; Y462-L464 PolarHBondContact O-N 3.23Å; Y462-N465 CarbonylContact O-C 3.6Å; Y462-N465 PolarHBondContact O-N 3.05Å; Y462-R466 HydrophobicContact CD1-CG 4.41Å; Y462-R466 HydrophobicContact CD2-CB 4.23Å; Y462-R466 HydrophobicContact CD2-CG 4.02Å; Y462-R466 HydrophobicContact CE1-CG 4.08Å; Y462-R466 HydrophobicContact CE2-CB 3.82Å; Y462-R466 HydrophobicContact CE2-CG 3.64Å; Y462-R466 HydrophobicContact CG-CG 4.39Å; Y462-R466 WeakPolarHBondContact O-CG 3.17Å; Y462-R466 PolarHBondContact O-N 2.77Å; Y462-V498 HydrophobicContact CD2-CB 3.96Å; Y462-V498 HydrophobicContact CD2-CG1 3.96Å; Y462-V498 VanDerWaalsContact CD2-O 3.29Å; Y462-V498 WeakPolarHBondContact CD2-O 3.33Å; Y462-V498 VanDerWaalsContact CE2-O 3.26Å; Y462-V498 WeakPolarHBondContact CE2-O 3.17Å; Y462-V498 HydrophobicContact CG-CG1 4.46Å; Y462-D500 HydrophobicContact CD1-CB 3.6Å; Y462-D500 HydrophobicContact CD2-CB 4.01Å; Y462-D500 HydrophobicContact CE1-CB 3.56Å; Y462-D500 WeakPolarHBondContact CE1-OD2 3.39Å; Y462-D500 HydrophobicContact CE2-CB 3.99Å; Y462-D500 HydrophobicContact CG-CB 3.83Å; Y462-F537 HydrophobicContact CD1-CD2 4.04Å; Y462-F537 HydrophobicContact CE1-CB 3.91Å; Y462-F537 AromaticContact CE1-CD2 3.62Å; Y462-F537 HydrophobicContact CE1-CD2 3.62Å; Y462-F537 HydrophobicContact CE1-CE2 4.45Å; Y462-F537 AromaticContact CE1-CG 3.98Å; Y462-F537 HydrophobicContact CE1-CG 3.98Å
463	E	92.2	Very high	94.4	Very high	33 Å²	33	51.4 Å²	51.4	15%	0.154	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.2	178.9	-75.7	45.2	-115.4	0	0	111.4	D461 P534 R536	D461-E463 WeakPolarHBondContact OD1-CA 3.28Å; D461-E463 WeakPolarHBondContact OD1-CB 3.4Å; D461-E463 PolarHBondContact OD1-N 2.89Å; E463-P534 WeakPolarHBondContact CG-O 3.34Å; E463-R536 HydrophobicContact CG-CG 4.49Å
464	L	91.1	Very high	94.4	Very high	124 Å²	124	48.9 Å²	48.9	65%	0.649	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-53.3	177.1	-165.2	76.4	0	0	0	112.1	D461 Y462	D461-L464 HydrophobicContact CB-CB 4.27Å; D461-L464 PolarHBondContact O-N 2.9Å; D461-L464 PolarHBondContact OD1-N 3.2Å; Y462-L464 PolarHBondContact O-N 3.23Å
465	N	91.4	Very high	94.3	Very high	68 Å²	68	50.1 Å²	50.1	36%	0.364	26%	0.264	S	S	.	.			trans	-140.3	103.3	-175.2	-67	-62.7	0	0	0	112	D461 Y462 A467 F468 V498	D461-N465 PolarHBondContact O-N 3.39Å; Y462-N465 CarbonylContact O-C 3.6Å; Y462-N465 PolarHBondContact O-N 3.05Å; N465-A467 VanDerWaalsContact C-N 3.3Å; N465-A467 PolarHBondContact O-N 2.71Å; N465-F468 HydrophobicContact CB-CE1 4.33Å; N465-F468 HydrophobicContact CB-CE2 3.93Å; N465-F468 HydrophobicContact CB-CZ 3.7Å; N465-V498 WeakPolarHBondContact O-CG2 3.21Å
466	R	92.8	Very high	94.3	Very high	143 Å²	143	50 Å²	50	54%	0.54	26%	0.263	S	S	.	.	S	Bend	trans	-72.4	-19.2	179.8	-59.4	-178.3	-67.3	177	0	114.8	Y462 V498	Y462-R466 HydrophobicContact CD1-CG 4.41Å; Y462-R466 HydrophobicContact CD2-CB 4.23Å; Y462-R466 HydrophobicContact CD2-CG 4.02Å; Y462-R466 HydrophobicContact CE1-CG 4.08Å; Y462-R466 HydrophobicContact CE2-CB 3.82Å; Y462-R466 HydrophobicContact CE2-CG 3.64Å; Y462-R466 HydrophobicContact CG-CG 4.39Å; Y462-R466 WeakPolarHBondContact O-CG 3.17Å; Y462-R466 PolarHBondContact O-N 2.77Å; R466-V498 PolarHBondContact O-N 3.24Å
467	A	94.2	Very high	94.3	Very high	66 Å²	66	55.9 Å²	55.9	55%	0.545	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	148.2	178.2	0	0	0	0	0	111.9	N465 I496	N465-A467 VanDerWaalsContact C-N 3.3Å; N465-A467 PolarHBondContact O-N 2.71Å; A467-I496 CarbonylContact C-O 3.37Å; A467-I496 WeakPolarHBondContact CA-O 3.38Å
468	F	95.1	Very high	94.3	Very high	18 Å²	18	53.3 Å²	53.3	8%	0.079	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.4	172.7	-65.7	-96.1	0	0	0	110.1	F441 V460 N465 L470 T495 I496 V498	F441-F468 HydrophobicContact CE2-CB 3.94Å; F441-F468 AromaticContact CE2-CD1 3.79Å; F441-F468 HydrophobicContact CE2-CD1 3.79Å; F441-F468 AromaticContact CE2-CD2 3.64Å; F441-F468 HydrophobicContact CE2-CD2 3.64Å; F441-F468 HydrophobicContact CE2-CE1 4.16Å; F441-F468 HydrophobicContact CE2-CE2 4.04Å; F441-F468 AromaticContact CE2-CG 3.51Å; F441-F468 HydrophobicContact CE2-CG 3.51Å; F441-F468 HydrophobicContact CE2-CZ 4.27Å; F441-F468 HydrophobicContact CZ-CB 4.39Å; F441-F468 AromaticContact CZ-CD2 3.72Å; F441-F468 HydrophobicContact CZ-CD2 3.72Å; F441-F468 HydrophobicContact CZ-CE2 4.11Å; F441-F468 HydrophobicContact CZ-CG 4.02Å; V460-F468 HydrophobicContact CB-CE2 4.24Å; V460-F468 HydrophobicContact CG1-CE2 3.83Å; V460-F468 HydrophobicContact CG1-CZ 4.13Å; N465-F468 HydrophobicContact CB-CE1 4.33Å; N465-F468 HydrophobicContact CB-CE2 3.93Å; N465-F468 HydrophobicContact CB-CZ 3.7Å; F468-L470 HydrophobicContact CB-CD2 4.18Å; F468-T495 WeakPolarHBondContact O-CA 3.47Å; F468-I496 HydrophobicContact CB-CB 4.31Å; F468-I496 PolarHBondContact N-O 3.08Å; F468-I496 PolarHBondContact O-N 2.95Å; F468-V498 HydrophobicContact CD2-CG2 4.07Å; F468-V498 HydrophobicContact CE2-CG2 3.97Å
469	M	95.6	Very high	94.3	Very high	136 Å²	136	53.5 Å²	53.5	67%	0.67	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.7	92.5	173.6	-172	175.2	75.1	0	0	108.5	G435 T495	G435-M469 WeakPolarHBondContact CA-O 3.34Å; M469-T495 HydrophobicContact CG-CG2 4.33Å
470	L	96.4	Very high	94.4	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	144.4	-179.8	-46.6	-177.1	0	0	0	109.9	I432 S434 D436 F441 V454 F468 V472 G493 V494 I496	I432-L470 HydrophobicContact CD1-CD1 4.39Å; S434-L470 WeakPolarHBondContact O-CA 3.07Å; D436-L470 HydrophobicContact CB-CD2 3.65Å; F441-L470 HydrophobicContact CB-CD1 4.03Å; F441-L470 HydrophobicContact CD2-CD1 4.07Å; F441-L470 HydrophobicContact CD2-CD2 4.09Å; F441-L470 HydrophobicContact CG-CD1 4.02Å; V454-L470 HydrophobicContact CG1-CD1 4.28Å; F468-L470 HydrophobicContact CB-CD2 4.18Å; L470-V472 HydrophobicContact CB-CG2 4.28Å; L470-G493 CarbonylContact O-C 3.6Å; L470-G493 WeakPolarHBondContact O-CA 3.43Å; L470-V494 HydrophobicContact CB-CB 4.19Å; L470-V494 PolarHBondContact N-O 3.38Å; L470-V494 PolarHBondContact O-N 3.47Å; L470-I496 HydrophobicContact CD1-CD1 3.56Å; L470-I496 HydrophobicContact CG-CD1 4.15Å
471	T	96.3	Very high	94.2	Very high	38 Å²	38	55.2 Å²	55.2	23%	0.233	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.5	162.5	-48.4	0	0	0	0	107.4	I433 S434 T491	I433-T471 HydrophobicContact CD1-CG2 3.69Å; I433-T471 HydrophobicContact CG1-CG2 3.82Å; I433-T471 WeakPolarHBondContact CG1-O 3.37Å; I433-T471 PolarHBondContact N-O 3.45Å; S434-T471 PolarHBondContact N-O 3.15Å; S434-T471 PolarHBondContact O-N 2.86Å; S434-T471 WeakPolarHBondContact OG-CB 3.27Å; S434-T471 PolarHBondContact OG-OG1 2.83Å; T471-T491 HydrophobicContact CG2-CG2 3.39Å
472	V	96.8	Very high	93.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	131.9	-176.6	-175.4	0	0	0	0	108.8	F392 L413 Y430 R431 I432 V443 L470 T491 A492 V494	F392-V472 HydrophobicContact CZ-CG1 4.31Å; L413-V472 HydrophobicContact CD1-CB 4.15Å; L413-V472 HydrophobicContact CD1-CG1 3.78Å; L413-V472 HydrophobicContact CD1-CG2 4.22Å; Y430-V472 HydrophobicContact CD1-CG1 4.29Å; R431-V472 WeakPolarHBondContact O-CA 3.22Å; I432-V472 HydrophobicContact CG1-CG2 4.39Å; V443-V472 HydrophobicContact CG2-CG1 4.34Å; L470-V472 HydrophobicContact CB-CG2 4.28Å; V472-T491 CarbonylContact O-C 3.57Å; V472-T491 WeakPolarHBondContact O-CA 3.26Å; V472-A492 PolarHBondContact N-O 3.49Å; V472-A492 PolarHBondContact O-N 3.23Å; V472-V494 HydrophobicContact CB-CG2 4.44Å; V472-V494 HydrophobicContact CG2-CG2 3.75Å
473	M	95.6	Very high	93.5	Very high	47 Å²	47	59.7 Å²	59.7	23%	0.232	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	139.2	174.2	179.3	-179.7	148.3	0	0	109.3	Y430 R431 I433 M486 S490	Y430-M473 WeakPolarHBondContact CA-O 3.35Å; R431-M473 PolarHBondContact N-O 3.17Å; R431-M473 PolarHBondContact O-N 3.12Å; I433-M473 HydrophobicContact CD1-CB 4.44Å; I433-M473 HydrophobicContact CG2-CB 3.82Å; I433-M473 HydrophobicContact CG2-SD 4.5Å; M473-M486 HydrophobicContact CE-CE 3.31Å; M473-M486 HydrophobicContact CE-SD 3.22Å; M473-M486 WeakPolarHBondContact CE-SD 3.25Å; M473-M486 HydrophobicContact SD-CE 3.84Å; M473-M486 HydrophobicContact SD-SD 4.5Å; M473-S490 WeakPolarHBondContact CA-O 3.39Å
474	V	96.2	Very high	93.3	Very high	1 Å²	1	61 Å²	61	1%	0.006	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.7	171.7	64.6	0	0	0	0	110	P390 F392 V415 A428 Y430 S490	P390-V474 HydrophobicContact CB-CG1 4.13Å; P390-V474 HydrophobicContact CB-CG2 3.99Å; P390-V474 HydrophobicContact CG-CB 4.42Å; P390-V474 HydrophobicContact CG-CG1 4.05Å; P390-V474 HydrophobicContact CG-CG2 3.8Å; F392-V474 HydrophobicContact CD2-CG1 3.99Å; F392-V474 HydrophobicContact CE1-CB 4.41Å; F392-V474 HydrophobicContact CE1-CG1 4.36Å; F392-V474 HydrophobicContact CE2-CB 4Å; F392-V474 HydrophobicContact CE2-CG1 3.55Å; F392-V474 HydrophobicContact CZ-CB 3.75Å; F392-V474 HydrophobicContact CZ-CG1 3.76Å; V415-V474 HydrophobicContact CG1-CB 4.44Å; V415-V474 HydrophobicContact CG1-CG1 4.15Å; V415-V474 HydrophobicContact CG1-CG2 4.21Å; A428-V474 HydrophobicContact CB-CG2 3.78Å; Y430-V474 HydrophobicContact CD1-CB 3.85Å; Y430-V474 HydrophobicContact CD1-CG2 3.84Å; Y430-V474 HydrophobicContact CE1-CB 3.8Å; Y430-V474 HydrophobicContact CE1-CG2 3.56Å; V474-S490 PolarHBondContact N-O 3.29Å
475	S	95.1	Very high	93.2	Very high	27 Å²	27	62.7 Å²	62.7	19%	0.189	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	159.5	173.7	57.9	0	0	0	0	109.2	V429	V429-S475 WeakPolarHBondContact CA-O 3.45Å; V429-S475 WeakPolarHBondContact CB-O 3.37Å; V429-S475 PolarHBondContact N-O 2.97Å; V429-S475 PolarHBondContact O-N 2.65Å; V429-S475 PolarHBondContact O-OG 3.01Å
476	N	95.3	Very high	92.9	Very high	12 Å²	12	63.7 Å²	63.7	6%	0.064	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	166.8	174	-46.7	94.1	0	0	0	112.2	N386 P390 D417 N425 N427 A478	N386-N476 WeakPolarHBondContact ND2-CB 3.47Å; N386-N476 PolarHBondContact ND2-OD1 2.69Å; N386-N476 VanDerWaalsContact ND2-OD1 3.1Å; N386-N476 PolarHBondContact OD1-OD1 2.88Å; P390-N476 VanDerWaalsContact CD-ND2 3.33Å; P390-N476 WeakPolarHBondContact CD-ND2 3.3Å; P390-N476 WeakPolarHBondContact CD-OD1 3.33Å; D417-N476 PolarHBondContact OD2-ND2 2.69Å; N425-N476 VanDerWaalsContact O-CB 3.25Å; N425-N476 WeakPolarHBondContact O-CB 3.47Å; N425-N476 PolarHBondContact O-ND2 2.67Å; N427-N476 CarbonylContact O-C 3.5Å; N427-N476 VanDerWaalsContact O-CA 3.27Å; N427-N476 WeakPolarHBondContact O-CA 3.31Å; N476-A478 WeakPolarHBondContact CB-O 3.47Å
477	Q	94.8	Very high	92.6	Very high	125 Å²	125	58.2 Å²	58.2	58%	0.584	35%	0.35	S	S	*	.	S	Bend	trans	-67.5	-41.4	169.7	-177.5	-179	-0.1	0	0	111.4	P424 N427 V429	P424-Q477 WeakPolarHBondContact O-CB 3.22Å; P424-Q477 PolarHBondContact O-N 2.88Å; N427-Q477 HydrophobicContact CB-CB 4.16Å; N427-Q477 PolarHBondContact ND2-OE1 2.63Å; N427-Q477 PolarHBondContact O-N 3.06Å; V429-Q477 HydrophobicContact CG2-CB 4.14Å
478	A	94.7	Very high	92.2	Very high	19 Å²	19	64.9 Å²	64.9	16%	0.157	37%	0.367	C	S	.	.	S	Bend	trans	-81.9	149.1	171.8	0	0	0	0	0	111.5	N386 P424 N425 N476	N386-A478 PolarHBondContact ND2-O 3.16Å; P424-A478 HydrophobicContact CB-CB 4.17Å; P424-A478 WeakPolarHBondContact O-CB 3.23Å; P424-A478 PolarHBondContact O-N 3.36Å; N425-A478 VanDerWaalsContact OD1-CB 3.25Å; N425-A478 WeakPolarHBondContact OD1-CB 3.38Å; N476-A478 WeakPolarHBondContact CB-O 3.47Å
479	P	93.9	Very high	91.9	Very high	116 Å²	116	69.2 Å²	69.2	75%	0.753	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-68.2	143.6	173.8	29.4	-34.1	0	0	0	111.2
480	L	93.8	Very high	91.8	Very high	50 Å²	50	62.8 Å²	62.8	26%	0.262	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-59.5	145.4	174.1	-74.9	159.4	0	0	0	111.5	N386 P389 I484 M486	N386-L480 VanDerWaalsContact OD1-CD2 3.26Å; N386-L480 WeakPolarHBondContact OD1-CD2 3.33Å; P389-L480 HydrophobicContact CB-CD1 4.23Å; P389-L480 HydrophobicContact CB-CD2 3.78Å; P389-L480 HydrophobicContact CG-CD2 4.46Å; L480-I484 HydrophobicContact CD2-CG2 4.08Å; L480-M486 HydrophobicContact CD1-CG 3.71Å
481	A	91.3	Very high	91.8	Very high	26 Å²	26	65.2 Å²	65.2	22%	0.215	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-59.4	149.9	177.1	0	0	0	0	0	112.1	V385 N386 D387 G483 I484	V385-A481 HydrophobicContact CG1-CB 3.86Å; N386-A481 WeakPolarHBondContact O-CB 3.46Å; N386-A481 PolarHBondContact O-N 3.4Å; D387-A481 HydrophobicContact CB-CB 4.38Å; A481-G483 PolarHBondContact O-N 3.34Å; A481-I484 HydrophobicContact CB-CG1 4.18Å; A481-I484 PolarHBondContact O-N 3.1Å; A481-I484 VanDerWaalsContact O-N 3.11Å
482	S	86.2	Confident	91.8	Very high	133 Å²	133	63.6 Å²	63.6	93%	0.93	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	120.6	-178.3	-66.2	0	0	0	0	111.5
483	G	84.4	Confident	91.8	Very high	71 Å²	71	64.6 Å²	64.6	73%	0.732	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.8	-9.7	179.7	0	0	0	0	0	114.4	A481	A481-G483 PolarHBondContact O-N 3.34Å
484	I	89.3	Confident	91.8	Very high	62 Å²	62	62.3 Å²	62.3	32%	0.318	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-84.7	134	170.8	-55.6	-59	0	0	0	109.1	D387 L480 A481	D387-I484 HydrophobicContact CB-CD1 4.44Å; D387-I484 HydrophobicContact CB-CG1 4.21Å; L480-I484 HydrophobicContact CD2-CG2 4.08Å; A481-I484 HydrophobicContact CB-CG1 4.18Å; A481-I484 PolarHBondContact O-N 3.1Å; A481-I484 VanDerWaalsContact O-N 3.11Å
485	Q	87.8	Confident	91.9	Very high	159 Å²	159	65.6 Å²	65.6	74%	0.743	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-103.7	147.8	174.5	-62.5	-62.8	-56.7	0	0	108.7
486	M	86.1	Confident	91.9	Very high	89 Å²	89	64.4 Å²	64.4	44%	0.438	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-61.3	142.1	173	-62.4	-165.1	-33.5	0	0	110.7	M473 L480	M473-M486 HydrophobicContact CE-CE 3.31Å; M473-M486 HydrophobicContact CE-SD 3.22Å; M473-M486 WeakPolarHBondContact CE-SD 3.25Å; M473-M486 HydrophobicContact SD-CE 3.84Å; M473-M486 HydrophobicContact SD-SD 4.5Å; L480-M486 HydrophobicContact CD1-CG 3.71Å
487	S	85.8	Confident	91.9	Very high	28 Å²	28	66 Å²	66	20%	0.196	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-70.6	149.2	175.8	-174.6	0	0	0	0	110.3	E391 Q489 S490	E391-S487 WeakPolarHBondContact OE1-CB 3.33Å; E391-S487 PolarHBondContact OE1-OG 3.11Å; S487-Q489 PolarHBondContact O-N 3.13Å; S487-Q489 PolarHBondContact OG-N 3.49Å; S487-S490 PolarHBondContact N-OG 3.09Å; S487-S490 WeakPolarHBondContact O-CB 3.27Å; S487-S490 PolarHBondContact O-N 3.15Å; S487-S490 PolarHBondContact O-OG 3.34Å
488	F	85.4	Confident	91.9	Very high	206 Å²	206	60.4 Å²	60.4	90%	0.904	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-60.9	-23.3	166.7	-70.3	-75	0	0	0	111.4	S490	F488-S490 PolarHBondContact O-N 3.31Å
489	Q	90	Very high	91.8	Very high	109 Å²	109	63.2 Å²	63.2	51%	0.509	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-81.3	-0.7	176.7	-59.8	179.3	-84.3	0	0	112.9	E391 F392 S487 T491	E391-Q489 HydrophobicContact CB-CB 4.02Å; E391-Q489 HydrophobicContact CG-CB 4.24Å; F392-Q489 VanDerWaalsContact CD2-O 3.27Å; F392-Q489 WeakPolarHBondContact CD2-O 3.36Å; F392-Q489 PolarHBondContact N-O 2.96Å; S487-Q489 PolarHBondContact O-N 3.13Å; S487-Q489 PolarHBondContact OG-N 3.49Å; Q489-T491 PolarHBondContact O-N 2.85Å
490	S	93.7	Very high	91.8	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.007	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-81.4	3.2	170.4	-53.2	0	0	0	0	112.6	P390 F392 M473 V474 S487 F488	P390-S490 WeakPolarHBondContact O-CB 3.47Å; P390-S490 PolarHBondContact O-OG 3.18Å; F392-S490 WeakPolarHBondContact CE2-O 3.38Å; M473-S490 WeakPolarHBondContact CA-O 3.39Å; V474-S490 PolarHBondContact N-O 3.29Å; S487-S490 PolarHBondContact N-OG 3.09Å; S487-S490 WeakPolarHBondContact O-CB 3.27Å; S487-S490 PolarHBondContact O-N 3.15Å; S487-S490 PolarHBondContact O-OG 3.34Å; F488-S490 PolarHBondContact O-N 3.31Å
491	T	95.3	Very high	91.7	Very high	51 Å²	51	60.1 Å²	60.1	31%	0.313	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.3	172.8	-55.4	0	0	0	0	110.3	I433 T471 V472 Q489	I433-T491 HydrophobicContact CD1-CG2 4.13Å; T471-T491 HydrophobicContact CG2-CG2 3.39Å; V472-T491 CarbonylContact O-C 3.57Å; V472-T491 WeakPolarHBondContact O-CA 3.26Å; Q489-T491 PolarHBondContact O-N 2.85Å
492	A	96.2	Very high	91.7	Very high	3 Å²	3	59.7 Å²	59.7	3%	0.025	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	150.6	176.4	0	0	0	0	0	111.9	F392 S395 F397 V472	F392-A492 HydrophobicContact CB-CB 4.2Å; F392-A492 HydrophobicContact CD1-CB 4.17Å; F392-A492 HydrophobicContact CD2-CB 3.46Å; F392-A492 VanDerWaalsContact CD2-CB 3.46Å; F392-A492 HydrophobicContact CE1-CB 4.42Å; F392-A492 HydrophobicContact CE2-CB 3.75Å; F392-A492 HydrophobicContact CG-CB 3.69Å; F392-A492 HydrophobicContact CZ-CB 4.23Å; S395-A492 WeakPolarHBondContact O-CA 3.37Å; F397-A492 HydrophobicContact CD2-CB 3.99Å; F397-A492 HydrophobicContact CE2-CB 3.85Å; V472-A492 PolarHBondContact N-O 3.49Å; V472-A492 PolarHBondContact O-N 3.23Å
493	G	96.2	Very high	92	Very high	21 Å²	21	55.6 Å²	55.6	22%	0.216	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	138.4	169.7	0	0	0	0	0	110.9	S395 T396 F397 L470	S395-G493 PolarHBondContact O-N 3.19Å; T396-G493 CarbonylContact C-O 3.59Å; T396-G493 WeakPolarHBondContact CA-O 3.39Å; F397-G493 PolarHBondContact N-O 3.27Å; L470-G493 CarbonylContact O-C 3.6Å; L470-G493 WeakPolarHBondContact O-CA 3.43Å
494	V	97.3	Very high	92.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	114	174.1	-170.4	0	0	0	0	108.5	F397 A411 L413 L470 V472 I496	F397-V494 HydrophobicContact CB-CG1 4.25Å; F397-V494 HydrophobicContact CB-CG2 4.31Å; F397-V494 CarbonylContact O-C 3.58Å; F397-V494 WeakPolarHBondContact O-CA 3.42Å; A411-V494 HydrophobicContact CB-CG1 4.37Å; L413-V494 HydrophobicContact CD1-CG2 4.28Å; L413-V494 HydrophobicContact CD2-CG1 4.47Å; L413-V494 HydrophobicContact CD2-CG2 3.63Å; L470-V494 HydrophobicContact CB-CB 4.19Å; L470-V494 PolarHBondContact N-O 3.38Å; L470-V494 PolarHBondContact O-N 3.47Å; V472-V494 HydrophobicContact CB-CG2 4.44Å; V472-V494 HydrophobicContact CG2-CG2 3.75Å; V494-I496 HydrophobicContact CG1-CG1 4.12Å
495	T	96.7	Very high	92.6	Very high	69 Å²	69	51.2 Å²	51.2	42%	0.423	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	114.1	176	52.8	0	0	0	0	109.6	F397 A398 G399 F468 M469	F397-T495 PolarHBondContact O-N 3.2Å; F397-T495 PolarHBondContact O-OG1 2.98Å; A398-T495 VanDerWaalsContact CA-O 3.28Å; A398-T495 WeakPolarHBondContact CA-O 3.35Å; G399-T495 PolarHBondContact N-O 2.83Å; G399-T495 VanDerWaalsContact N-O 3.07Å; F468-T495 WeakPolarHBondContact O-CA 3.47Å; M469-T495 HydrophobicContact CG-CG2 4.33Å
496	I	96.3	Very high	92.9	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	115.8	178.6	-59.3	174.2	0	0	0	107.9	G399 V401 V410 F441 V454 A467 F468 L470 V494	G399-I496 WeakPolarHBondContact O-CA 2.95Å; V401-I496 HydrophobicContact CB-CG2 4.34Å; V401-I496 HydrophobicContact CG1-CG2 3.59Å; V410-I496 HydrophobicContact CG1-CB 4.34Å; V410-I496 HydrophobicContact CG1-CD1 4.07Å; V410-I496 HydrophobicContact CG1-CG1 3.91Å; V410-I496 HydrophobicContact CG1-CG2 3.65Å; F441-I496 HydrophobicContact CD1-CD1 3.64Å; F441-I496 HydrophobicContact CD2-CD1 4.33Å; F441-I496 HydrophobicContact CE1-CD1 3.45Å; F441-I496 VanDerWaalsContact CE1-CD1 3.45Å; F441-I496 HydrophobicContact CE1-CG2 4.1Å; F441-I496 HydrophobicContact CE2-CD1 4.18Å; F441-I496 HydrophobicContact CG-CD1 4.08Å; F441-I496 HydrophobicContact CZ-CB 4.48Å; F441-I496 HydrophobicContact CZ-CD1 3.74Å; F441-I496 HydrophobicContact CZ-CG2 4.05Å; V454-I496 HydrophobicContact CG1-CD1 4.11Å; A467-I496 CarbonylContact C-O 3.37Å; A467-I496 WeakPolarHBondContact CA-O 3.38Å; F468-I496 HydrophobicContact CB-CB 4.31Å; F468-I496 PolarHBondContact N-O 3.08Å; F468-I496 PolarHBondContact O-N 2.95Å; L470-I496 HydrophobicContact CD1-CD1 3.56Å; L470-I496 HydrophobicContact CG-CD1 4.15Å; V494-I496 HydrophobicContact CG1-CG1 4.12Å
497	S	95.3	Very high	93.3	Very high	46 Å²	46	46 Å²	46	32%	0.322	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	129.4	170.2	42	0	0	0	0	110.2	G399 E400 V401	G399-S497 PolarHBondContact O-N 2.87Å; G399-S497 PolarHBondContact O-OG 2.88Å; E400-S497 WeakPolarHBondContact CA-O 3.32Å; E400-S497 WeakPolarHBondContact CG-OG 3.48Å; V401-S497 PolarHBondContact N-O 3.42Å
498	V	95.2	Very high	93.5	Very high	8 Å²	8	48.7 Å²	48.7	5%	0.048	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	130.4	174.4	-173.9	0	0	0	0	107.9	V401 E403 V460 Y462 N465 R466 F468	V401-V498 HydrophobicContact CG1-CG2 4.09Å; V401-V498 CarbonylContact O-C 3.59Å; V401-V498 WeakPolarHBondContact O-CA 3.09Å; E403-V498 HydrophobicContact CB-CG1 3.96Å; V460-V498 HydrophobicContact CB-CG2 4.5Å; V460-V498 HydrophobicContact CG2-CG1 3.92Å; V460-V498 HydrophobicContact CG2-CG2 4.16Å; Y462-V498 HydrophobicContact CD2-CB 3.96Å; Y462-V498 HydrophobicContact CD2-CG1 3.96Å; Y462-V498 VanDerWaalsContact CD2-O 3.29Å; Y462-V498 WeakPolarHBondContact CD2-O 3.33Å; Y462-V498 VanDerWaalsContact CE2-O 3.26Å; Y462-V498 WeakPolarHBondContact CE2-O 3.17Å; Y462-V498 HydrophobicContact CG-CG1 4.46Å; N465-V498 WeakPolarHBondContact O-CG2 3.21Å; R466-V498 PolarHBondContact O-N 3.24Å; F468-V498 HydrophobicContact CD2-CG2 4.07Å; F468-V498 HydrophobicContact CE2-CG2 3.97Å
499	M	92.8	Very high	93.6	Very high	77 Å²	77	41.8 Å²	41.8	38%	0.379	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123	174.8	-57.2	-175.3	-64.8	0	0	109.1	E400 V401 P402 E403	E400-M499 HydrophobicContact CB-CG 4.35Å; E400-M499 HydrophobicContact CB-SD 4.19Å; V401-M499 PolarHBondContact O-N 3.09Å; P402-M499 HydrophobicContact CB-CE 3.91Å; P402-M499 HydrophobicContact CG-CE 3.63Å; E403-M499 PolarHBondContact N-O 3.34Å; E403-M499 VanDerWaalsContact N-O 3.16Å
500	D	92.3	Very high	93.4	Very high	35 Å²	35	40.8 Å²	40.8	19%	0.187	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-63.6	124	174.8	-163.8	-8.9	0	0	0	110.1	E403 Y462 M538	E403-D500 WeakPolarHBondContact OE1-CA 3.43Å; Y462-D500 HydrophobicContact CD1-CB 3.6Å; Y462-D500 HydrophobicContact CD2-CB 4.01Å; Y462-D500 HydrophobicContact CE1-CB 3.56Å; Y462-D500 WeakPolarHBondContact CE1-OD2 3.39Å; Y462-D500 HydrophobicContact CE2-CB 3.99Å; Y462-D500 HydrophobicContact CG-CB 3.83Å; D500-M538 HydrophobicContact CB-CE 3.73Å; D500-M538 WeakPolarHBondContact O-CE 3.49Å; D500-M538 WeakPolarHBondContact OD1-CE 3.2Å; D500-M538 WeakPolarHBondContact OD2-CG 3.37Å
501	I	92.1	Very high	93.2	Very high	66 Å²	66	45.9 Å²	45.9	34%	0.338	26%	0.258	S	S	.	.			trans	-120.6	128.4	176.3	-67.5	-179.4	0	0	0	107.8	P402 E403 E503	P402-I501 HydrophobicContact CB-CD1 3.37Å; P402-I501 HydrophobicContact CB-CG1 4.23Å; E403-I501 HydrophobicContact CG-CB 4.09Å; E403-I501 HydrophobicContact CG-CG1 4.45Å; E403-I501 PolarHBondContact OE1-N 3.05Å; I501-E503 WeakPolarHBondContact O-CG 3.19Å; I501-E503 PolarHBondContact O-N 3.26Å
502	N	92.2	Very high	93.1	Very high	17 Å²	17	45.2 Å²	45.2	9%	0.091	25%	0.251	C	S	.	.			trans	-50.3	115.1	176.3	-179.8	103.2	0	0	0	113.3	D535 Q540 D589 G591 P593 A595	N502-D535 VanDerWaalsContact CA-OD2 3.23Å; N502-D535 WeakPolarHBondContact CA-OD2 3.15Å; N502-Q540 PolarHBondContact OD1-NE2 3.06Å; N502-D589 PolarHBondContact ND2-OD2 3.47Å; N502-D589 PolarHBondContact OD1-OD2 3.18Å; N502-G591 VanDerWaalsContact OD1-CA 3.28Å; N502-G591 WeakPolarHBondContact OD1-CA 3.33Å; N502-P593 PolarHBondContact ND2-O 2.04Å; N502-A595 WeakPolarHBondContact ND2-CB 3.37Å
503	E	92.3	Very high	93	Very high	47 Å²	47	49.9 Å²	49.9	22%	0.22	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-96.7	157	176.7	-60.7	-165.9	106.5	0	0	112.6	N404 I501 P534 D535	N404-E503 PolarHBondContact ND2-OE1 3.13Å; I501-E503 WeakPolarHBondContact O-CG 3.19Å; I501-E503 PolarHBondContact O-N 3.26Å; E503-P534 HydrophobicContact CB-CB 4.2Å; E503-P534 HydrophobicContact CB-CG 4.04Å; E503-P534 WeakPolarHBondContact OE2-CB 3.29Å; E503-D535 WeakPolarHBondContact CB-OD1 3.46Å; E503-D535 PolarHBondContact N-OD1 3.25Å; E503-D535 PolarHBondContact N-OD2 3.03Å
504	A	92.4	Very high	92.9	Very high	42 Å²	42	50 Å²	50	35%	0.347	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-73.7	136	179.3	0	0	0	0	0	111.6	Y506 A595	A504-Y506 PolarHBondContact O-N 3.32Å; A504-A595 HydrophobicContact CB-CB 3.87Å
505	P	94.2	Very high	92.7	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-65.2	135	171.7	27.2	-34.4	0	0	0	110.3	A531 V532 D533 V542 A587 D589 G597	P505-A531 HydrophobicContact CB-CB 4.21Å; P505-V532 CarbonylContact C-O 3.56Å; P505-V532 WeakPolarHBondContact CA-O 3.17Å; P505-D533 HydrophobicContact CB-CB 4.36Å; P505-V542 HydrophobicContact CB-CG1 4.21Å; P505-V542 HydrophobicContact CB-CG2 3.98Å; P505-V542 HydrophobicContact CG-CG1 4.23Å; P505-V542 HydrophobicContact CG-CG2 4.4Å; P505-A587 HydrophobicContact CB-CB 4.43Å; P505-A587 HydrophobicContact CG-CB 4.1Å; P505-A587 WeakPolarHBondContact CG-O 3.31Å; P505-D589 HydrophobicContact CG-CB 4.46Å; P505-G597 VanDerWaalsContact O-CA 3.3Å; P505-G597 WeakPolarHBondContact O-CA 3.47Å; P505-G597 PolarHBondContact O-N 2.95Å
506	Y	93.7	Very high	92.5	Very high	125 Å²	125	56.9 Å²	56.9	49%	0.49	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-117.3	152.9	-175.6	73.2	-84.3	0	0	0	112.2	A504 P508 A531 V532 P534	A504-Y506 PolarHBondContact O-N 3.32Å; Y506-P508 HydrophobicContact CE2-CG 4.4Å; Y506-P508 WeakPolarHBondContact O-CD 3.41Å; Y506-A531 CarbonylContact O-C 3.6Å; Y506-A531 VanDerWaalsContact O-CA 3.28Å; Y506-A531 WeakPolarHBondContact O-CA 3.45Å; Y506-A531 WeakPolarHBondContact O-CB 3.44Å; Y506-V532 VanDerWaalsContact CD1-O 3.29Å; Y506-V532 WeakPolarHBondContact CD1-O 3.36Å; Y506-V532 HydrophobicContact CE1-CB 4.31Å; Y506-V532 HydrophobicContact CE1-CG1 4.45Å; Y506-V532 PolarHBondContact N-O 3.17Å; Y506-V532 PolarHBondContact O-N 2.96Å; Y506-P534 HydrophobicContact CD1-CG 3.86Å; Y506-P534 HydrophobicContact CE1-CG 3.99Å
507	F	93.5	Very high	92.3	Very high	13 Å²	13	62.7 Å²	62.7	6%	0.057	32%	0.318	C	S	.	.			trans	-88.9	119	174.8	-66.4	-88.4	0	0	0	109.7	S509 N510 F529 A531 Y544 A587 G599	F507-S509 PolarHBondContact O-N 3.48Å; F507-S509 VanDerWaalsContact O-N 3.16Å; F507-N510 HydrophobicContact CB-CB 4.45Å; F507-F529 HydrophobicContact CB-CE2 4.05Å; F507-F529 HydrophobicContact CB-CZ 4.08Å; F507-F529 AromaticContact CD1-CD1 3.96Å; F507-F529 HydrophobicContact CD1-CD1 3.96Å; F507-F529 AromaticContact CD1-CD2 3.76Å; F507-F529 HydrophobicContact CD1-CD2 3.76Å; F507-F529 AromaticContact CD1-CE1 3.71Å; F507-F529 HydrophobicContact CD1-CE1 3.71Å; F507-F529 AromaticContact CD1-CE2 3.5Å; F507-F529 HydrophobicContact CD1-CE2 3.5Å; F507-F529 VanDerWaalsContact CD1-CE2 3.5Å; F507-F529 AromaticContact CD1-CG 4Å; F507-F529 HydrophobicContact CD1-CG 4Å; F507-F529 AromaticContact CD1-CZ 3.48Å; F507-F529 HydrophobicContact CD1-CZ 3.48Å; F507-F529 VanDerWaalsContact CD1-CZ 3.48Å; F507-F529 HydrophobicContact CD2-CZ 4.42Å; F507-F529 AromaticContact CE1-CD1 3.64Å; F507-F529 HydrophobicContact CE1-CD1 3.64Å; F507-F529 HydrophobicContact CE1-CD2 4.2Å; F507-F529 AromaticContact CE1-CE1 3.64Å; F507-F529 HydrophobicContact CE1-CE1 3.64Å; F507-F529 HydrophobicContact CE1-CE2 4.21Å; F507-F529 AromaticContact CE1-CG 3.95Å; F507-F529 HydrophobicContact CE1-CG 3.95Å; F507-F529 AromaticContact CE1-CZ 3.94Å; F507-F529 HydrophobicContact CE1-CZ 3.94Å; F507-F529 HydrophobicContact CG-CE1 4.21Å; F507-F529 AromaticContact CG-CE2 3.98Å; F507-F529 HydrophobicContact CG-CE2 3.98Å; F507-F529 AromaticContact CG-CZ 3.74Å; F507-F529 HydrophobicContact CG-CZ 3.74Å; F507-F529 HydrophobicContact CZ-CD1 4.34Å; F507-F529 HydrophobicContact CZ-CE1 4.11Å; F507-A531 HydrophobicContact CD1-CB 4.01Å; F507-A531 HydrophobicContact CD2-CB 4.42Å; F507-A531 HydrophobicContact CE1-CB 3.92Å; F507-A531 HydrophobicContact CE2-CB 4.33Å; F507-A531 HydrophobicContact CG-CB 4.29Å; F507-A531 HydrophobicContact CZ-CB 4.1Å; F507-Y544 HydrophobicContact CE1-CD1 4.43Å; F507-Y544 HydrophobicContact CE1-CE1 4.2Å; F507-Y544 HydrophobicContact CZ-CD1 4.4Å; F507-Y544 HydrophobicContact CZ-CE1 4.44Å; F507-A587 HydrophobicContact CE2-CB 3.85Å; F507-A587 HydrophobicContact CZ-CB 3.67Å; F507-G599 VanDerWaalsContact CE2-N 3.28Å
508	P	90.8	Very high	92.1	Very high	85 Å²	85	60.8 Å²	60.8	55%	0.552	30%	0.304	S	S	*	.	S	Bend	trans	-61.3	-27.3	-176.8	-25.7	34.6	0	0	0	114.4	Y506 V532	Y506-P508 HydrophobicContact CE2-CG 4.4Å; Y506-P508 WeakPolarHBondContact O-CD 3.41Å; P508-V532 HydrophobicContact CG-CB 4.43Å; P508-V532 HydrophobicContact CG-CG2 3.69Å
509	S	87.7	Confident	91.7	Very high	60 Å²	60	62 Å²	62	42%	0.42	32%	0.319	S	S	.	.	S	Bend	trans	-118	98.3	172.3	45.2	0	0	0	0	109.8	F507 K512	F507-S509 PolarHBondContact O-N 3.48Å; F507-S509 VanDerWaalsContact O-N 3.16Å; S509-K512 WeakPolarHBondContact O-CB 3.37Å; S509-K512 PolarHBondContact O-N 3.25Å
510	N	85.4	Confident	91.6	Very high	88 Å²	88	59.5 Å²	59.5	47%	0.471	31%	0.307	S	S	.	.	S	Bend	trans	-129.4	113	175.5	-165.7	16.3	0	0	0	109.2	F507 T598 T600	F507-N510 HydrophobicContact CB-CB 4.45Å; N510-T598 PolarHBondContact ND2-O 2.94Å; N510-T600 PolarHBondContact OD1-N 2.84Å
511	H	89.9	Confident	91.5	Very high	109 Å²	109	61.6 Å²	61.6	51%	0.505	32%	0.323	S	S	.	.	S	Bend	cis	-78.8	139.1	2.9	-51.8	162.2	0	0	0	112.9	T600 Q602	H511-T600 HydrophobicContact CB-CG2 4.48Å; H511-Q602 HydrophobicContact CB-CG 4.31Å; H511-Q602 PolarHBondContact ND1-NE2 2.76Å
512	K	92.4	Very high	91.5	Very high	37 Å²	37	62.3 Å²	62.3	16%	0.161	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	113	174.9	-177.2	170.3	178.2	175.8	0	110.6	S509 T527 T528 F529 T600 L601 Q602	S509-K512 WeakPolarHBondContact O-CB 3.37Å; S509-K512 PolarHBondContact O-N 3.25Å; K512-T527 PolarHBondContact NZ-OG1 2.76Å; K512-T528 PolarHBondContact NZ-O 2.76Å; K512-F529 HydrophobicContact CB-CD2 4.14Å; K512-F529 HydrophobicContact CB-CE2 3.65Å; K512-F529 HydrophobicContact CB-CZ 4.33Å; K512-F529 HydrophobicContact CD-CD2 3.48Å; K512-F529 VanDerWaalsContact CD-CD2 3.48Å; K512-F529 HydrophobicContact CD-CE2 3.88Å; K512-F529 HydrophobicContact CD-CG 4.41Å; K512-F529 HydrophobicContact CG-CD2 4.43Å; K512-F529 HydrophobicContact CG-CE2 4.4Å; K512-T600 PolarHBondContact N-O 2.94Å; K512-L601 HydrophobicContact CB-CD1 4.17Å; K512-L601 HydrophobicContact CD-CD1 4.28Å; K512-L601 HydrophobicContact CG-CD1 4.09Å; K512-Q602 PolarHBondContact O-N 3.4Å
513	L	93.8	Very high	91.4	Very high	101 Å²	101	64.2 Å²	64.2	53%	0.529	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	128.8	176.2	-175	67.8	0	0	0	111.5	Q602	L513-Q602 CarbonylContact C-O 3.52Å; L513-Q602 WeakPolarHBondContact CA-O 3.36Å; L513-Q602 HydrophobicContact CD1-CB 3.75Å
514	I	93.8	Very high	91.5	Very high	23 Å²	23	64.3 Å²	64.3	12%	0.118	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	153.1	168.8	65.8	170.6	0	0	0	110.2	L526 T527 L601 Q602 I603 Y604	I514-L526 HydrophobicContact CD1-CB 4.17Å; I514-L526 HydrophobicContact CD1-CD1 4.37Å; I514-T527 HydrophobicContact CD1-CG2 4.42Å; I514-T527 HydrophobicContact CG2-CG2 4.15Å; I514-L601 HydrophobicContact CD1-CD1 4.43Å; I514-L601 HydrophobicContact CD1-CD2 4.47Å; I514-L601 HydrophobicContact CG1-CD1 4.42Å; I514-L601 HydrophobicContact CG2-CD1 4.27Å; I514-Q602 PolarHBondContact N-O 3.26Å; I514-I603 HydrophobicContact CD1-CB 4.48Å; I514-I603 HydrophobicContact CD1-CD1 4.26Å; I514-I603 HydrophobicContact CD1-CG1 3.91Å; I514-I603 HydrophobicContact CD1-CG2 4.19Å; I514-I603 HydrophobicContact CG1-CB 4.14Å; I514-I603 HydrophobicContact CG1-CG1 3.9Å; I514-I603 HydrophobicContact CG1-CG2 4.03Å; I514-Y604 PolarHBondContact O-N 2.88Å
515	R	94.3	Very high	91.5	Very high	175 Å²	175	66 Å²	66	66%	0.66	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	127.3	176.9	-54.7	-177	75.5	-173.8	1.9	108.6	Y604	R515-Y604 WeakPolarHBondContact CA-O 3.31Å; R515-Y604 HydrophobicContact CG-CD1 4.46Å
516	L	93.1	Very high	91.4	Very high	38 Å²	38	67.4 Å²	67.4	20%	0.199	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	145.1	-175.9	-162.2	79.8	0	0	0	109.4	V520 L526 L569 I603 Y604 L605 I606	L516-V520 HydrophobicContact CD2-CB 4.27Å; L516-V520 HydrophobicContact CD2-CG2 3.81Å; L516-V520 HydrophobicContact CG-CG2 4.09Å; L516-L526 HydrophobicContact CD1-CD2 4Å; L516-L526 HydrophobicContact CD2-CD2 3.42Å; L516-L526 VanDerWaalsContact CD2-CD2 3.42Å; L516-L526 HydrophobicContact CG-CD2 4.35Å; L516-L569 HydrophobicContact CD2-CD1 4.3Å; L516-I603 HydrophobicContact CB-CG2 4.33Å; L516-Y604 PolarHBondContact N-O 2.75Å; L516-L605 CarbonylContact O-C 3.36Å; L516-L605 WeakPolarHBondContact O-CA 3.25Å; L516-I606 PolarHBondContact O-N 3.27Å
517	E	91.3	Very high	91.3	Very high	124 Å²	124	62.8 Å²	62.8	58%	0.579	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	147	163.6	-64.9	171.8	-179.8	0	0	109.2	V520 I606 I608	E517-V520 VanDerWaalsContact O-CG2 3.27Å; E517-V520 WeakPolarHBondContact O-CG2 3.2Å; E517-I606 HydrophobicContact CG-CB 4.25Å; E517-I606 HydrophobicContact CG-CD1 4.47Å; E517-I606 HydrophobicContact CG-CG2 4.49Å; E517-I608 HydrophobicContact CB-CG2 4.31Å
518	E	90.7	Very high	91.3	Very high	6 Å²	6	66 Å²	66	3%	0.028	38%	0.378	C	S	.	.	S	Bend	trans	-74.8	-178	171.1	78.5	-169.2	125.5	0	0	111.9	V520 R571 L605 I606 D607 I608	E518-V520 PolarHBondContact O-N 3.37Å; E518-V520 VanDerWaalsContact O-N 3.13Å; E518-R571 WeakPolarHBondContact OE2-CA 3.5Å; E518-R571 WeakPolarHBondContact OE2-CB 3.32Å; E518-R571 PolarHBondContact OE2-N 2.89Å; E518-L605 HydrophobicContact CB-CD2 4.48Å; E518-I606 PolarHBondContact N-O 3.01Å; E518-I606 VanDerWaalsContact N-O 3.15Å; E518-D607 VanDerWaalsContact OE1-CA 3.27Å; E518-D607 WeakPolarHBondContact OE1-CA 3.44Å; E518-I608 HydrophobicContact CG-CB 4.18Å; E518-I608 HydrophobicContact CG-CD1 3.55Å; E518-I608 HydrophobicContact CG-CG1 3.42Å; E518-I608 VanDerWaalsContact CG-CG1 3.42Å; E518-I608 HydrophobicContact CG-CG2 4.06Å; E518-I608 PolarHBondContact OE1-N 2.77Å
519	G	87.7	Confident	91.4	Very high	35 Å²	35	62 Å²	62	36%	0.361	35%	0.352	S	S	.	.			trans	73.5	5.2	178.9	0	0	0	0	0	114.5	L569	G519-L569 PolarHBondContact N-O 2.76Å
520	V	89.8	Confident	91.6	Very high	23 Å²	23	62 Å²	62	14%	0.139	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-64.5	128.6	-179.9	172.1	0	0	0	0	110.7	L516 E517 E518 T524 T565 L569	L516-V520 HydrophobicContact CD2-CB 4.27Å; L516-V520 HydrophobicContact CD2-CG2 3.81Å; L516-V520 HydrophobicContact CG-CG2 4.09Å; E517-V520 VanDerWaalsContact O-CG2 3.27Å; E517-V520 WeakPolarHBondContact O-CG2 3.2Å; E518-V520 PolarHBondContact O-N 3.37Å; E518-V520 VanDerWaalsContact O-N 3.13Å; V520-T524 VanDerWaalsContact CG1-CB 3.4Å; V520-T524 HydrophobicContact CG1-CG2 3.61Å; V520-T524 WeakPolarHBondContact CG1-OG1 3.24Å; V520-T565 HydrophobicContact CG1-CG2 4.13Å; V520-L569 HydrophobicContact CB-CD1 4.37Å
521	P	90.2	Very high	91.9	Very high	80 Å²	80	58.4 Å²	58.4	52%	0.519	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-66.6	154.8	-175.8	26.1	-34.1	0	0	0	112.1	T524 T565	P521-T524 WeakPolarHBondContact O-CB 3.48Å; P521-T524 PolarHBondContact O-N 3.45Å; P521-T524 PolarHBondContact O-OG1 2.93Å; P521-T565 PolarHBondContact O-OG1 2.87Å
522	P	92.1	Very high	92.1	Very high	81 Å²	81	56.4 Å²	56.4	53%	0.526	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	142.8	175.5	27.5	-34.9	0	0	0	111.2	T565	P522-T565 WeakPolarHBondContact CA-OG1 3.43Å
523	G	90.8	Very high	92.1	Very high	57 Å²	57	55.9 Å²	55.9	59%	0.588	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	1.6	-176.9	0	0	0	0	0	114.6	T565	G523-T565 PolarHBondContact N-O 3.04Å; G523-T565 PolarHBondContact N-OG1 2.99Å; G523-T565 VanDerWaalsContact N-OG1 3.13Å
524	T	93.1	Very high	92	Very high	48 Å²	48	52.3 Å²	52.3	29%	0.294	31%	0.312	S	S	.	.			trans	-76.9	133.6	178.3	-54.3	0	0	0	0	110.4	V520 P521 T564 T565	V520-T524 VanDerWaalsContact CG1-CB 3.4Å; V520-T524 HydrophobicContact CG1-CG2 3.61Å; V520-T524 WeakPolarHBondContact CG1-OG1 3.24Å; P521-T524 WeakPolarHBondContact O-CB 3.48Å; P521-T524 PolarHBondContact O-N 3.45Å; P521-T524 PolarHBondContact O-OG1 2.93Å; T524-T564 CarbonylContact O-C 3.54Å; T524-T564 VanDerWaalsContact O-CA 3.24Å; T524-T564 WeakPolarHBondContact O-CA 3.43Å; T524-T565 PolarHBondContact N-OG1 2.58Å; T524-T565 PolarHBondContact O-N 2.98Å
525	V	93.6	Very high	91.9	Very high	77 Å²	77	51.6 Å²	51.6	47%	0.467	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	121.6	175.9	175.1	0	0	0	0	109.4	Q562 T564	V525-Q562 HydrophobicContact CG1-CG 3.87Å; V525-T564 HydrophobicContact CG2-CG2 3.95Å
526	L	92.2	Very high	91.5	Very high	30 Å²	30	53 Å²	53	16%	0.157	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-60	179.9	-60.1	-173.9	0	0	0	112.1	I514 L516 L554 I563 T565 I603	I514-L526 HydrophobicContact CD1-CB 4.17Å; I514-L526 HydrophobicContact CD1-CD1 4.37Å; L516-L526 HydrophobicContact CD1-CD2 4Å; L516-L526 HydrophobicContact CD2-CD2 3.42Å; L516-L526 VanDerWaalsContact CD2-CD2 3.42Å; L516-L526 HydrophobicContact CG-CD2 4.35Å; L526-L554 HydrophobicContact CD1-CD2 3.68Å; L526-I563 HydrophobicContact CD1-CG2 4.34Å; L526-I563 PolarHBondContact N-O 2.88Å; L526-T565 HydrophobicContact CD1-CG2 3.96Å; L526-T565 HydrophobicContact CD2-CG2 3.62Å; L526-T565 HydrophobicContact CG-CG2 3.82Å; L526-I603 HydrophobicContact CD1-CD1 4.06Å
527	T	92.1	Very high	91.2	Very high	29 Å²	29	56.2 Å²	56.2	18%	0.178	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	166.6	-177.1	-164	0	0	0	0	110.6	K512 I514 I563 L601	K512-T527 PolarHBondContact NZ-OG1 2.76Å; I514-T527 HydrophobicContact CD1-CG2 4.42Å; I514-T527 HydrophobicContact CG2-CG2 4.15Å; T527-I563 PolarHBondContact O-N 3.25Å; T527-L601 HydrophobicContact CG2-CD1 4.24Å
528	T	92.7	Very high	91	Very high	79 Å²	79	53.2 Å²	53.2	49%	0.485	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	117.9	168.2	50	0	0	0	0	109.4	K512 Q562	K512-T528 PolarHBondContact NZ-O 2.76Å; T528-Q562 HydrophobicContact CG2-CB 4.47Å
529	F	92.6	Very high	90.6	Very high	3 Å²	3	62.4 Å²	62.4	1%	0.013	36%	0.356	C	S	.	.			trans	-110.5	78.4	177.2	-166.6	-140.3	0	0	0	109.1	F507 K512 G561 I563 F585	F507-F529 HydrophobicContact CB-CE2 4.05Å; F507-F529 HydrophobicContact CB-CZ 4.08Å; F507-F529 AromaticContact CD1-CD1 3.96Å; F507-F529 HydrophobicContact CD1-CD1 3.96Å; F507-F529 AromaticContact CD1-CD2 3.76Å; F507-F529 HydrophobicContact CD1-CD2 3.76Å; F507-F529 AromaticContact CD1-CE1 3.71Å; F507-F529 HydrophobicContact CD1-CE1 3.71Å; F507-F529 AromaticContact CD1-CE2 3.5Å; F507-F529 HydrophobicContact CD1-CE2 3.5Å; F507-F529 VanDerWaalsContact CD1-CE2 3.5Å; F507-F529 AromaticContact CD1-CG 4Å; F507-F529 HydrophobicContact CD1-CG 4Å; F507-F529 AromaticContact CD1-CZ 3.48Å; F507-F529 HydrophobicContact CD1-CZ 3.48Å; F507-F529 VanDerWaalsContact CD1-CZ 3.48Å; F507-F529 HydrophobicContact CD2-CZ 4.42Å; F507-F529 AromaticContact CE1-CD1 3.64Å; F507-F529 HydrophobicContact CE1-CD1 3.64Å; F507-F529 HydrophobicContact CE1-CD2 4.2Å; F507-F529 AromaticContact CE1-CE1 3.64Å; F507-F529 HydrophobicContact CE1-CE1 3.64Å; F507-F529 HydrophobicContact CE1-CE2 4.21Å; F507-F529 AromaticContact CE1-CG 3.95Å; F507-F529 HydrophobicContact CE1-CG 3.95Å; F507-F529 AromaticContact CE1-CZ 3.94Å; F507-F529 HydrophobicContact CE1-CZ 3.94Å; F507-F529 HydrophobicContact CG-CE1 4.21Å; F507-F529 AromaticContact CG-CE2 3.98Å; F507-F529 HydrophobicContact CG-CE2 3.98Å; F507-F529 AromaticContact CG-CZ 3.74Å; F507-F529 HydrophobicContact CG-CZ 3.74Å; F507-F529 HydrophobicContact CZ-CD1 4.34Å; F507-F529 HydrophobicContact CZ-CE1 4.11Å; K512-F529 HydrophobicContact CB-CD2 4.14Å; K512-F529 HydrophobicContact CB-CE2 3.65Å; K512-F529 HydrophobicContact CB-CZ 4.33Å; K512-F529 HydrophobicContact CD-CD2 3.48Å; K512-F529 VanDerWaalsContact CD-CD2 3.48Å; K512-F529 HydrophobicContact CD-CE2 3.88Å; K512-F529 HydrophobicContact CD-CG 4.41Å; K512-F529 HydrophobicContact CG-CD2 4.43Å; K512-F529 HydrophobicContact CG-CE2 4.4Å; F529-G561 PolarHBondContact N-O 3.39Å; F529-I563 HydrophobicContact CB-CD1 3.57Å; F529-I563 HydrophobicContact CB-CG1 4.21Å; F529-I563 HydrophobicContact CD1-CD1 4.2Å; F529-I563 HydrophobicContact CG-CD1 4.27Å; F529-F585 HydrophobicContact CD1-CB 4.19Å; F529-F585 AromaticContact CD1-CD2 3.87Å; F529-F585 HydrophobicContact CD1-CD2 3.87Å; F529-F585 HydrophobicContact CD1-CG 4.27Å; F529-F585 HydrophobicContact CE1-CB 4.2Å; F529-F585 HydrophobicContact CE1-CD2 4.01Å
530	S	91.9	Very high	90.7	Very high	60 Å²	60	62.6 Å²	62.6	42%	0.42	35%	0.347	S	S	.	.			trans	-92.4	139	-179.6	55.1	0	0	0	0	111.3	Y544	S530-Y544 WeakPolarHBondContact CA-OH 3.48Å
531	A	93	Very high	90.7	Very high	12 Å²	12	64.1 Å²	64.1	10%	0.099	36%	0.362	C	S	.	.			trans	-92.7	158	169.4	0	0	0	0	0	110	P505 Y506 F507 V542 Y544 A587	P505-A531 HydrophobicContact CB-CB 4.21Å; Y506-A531 CarbonylContact O-C 3.6Å; Y506-A531 VanDerWaalsContact O-CA 3.28Å; Y506-A531 WeakPolarHBondContact O-CA 3.45Å; Y506-A531 WeakPolarHBondContact O-CB 3.44Å; F507-A531 HydrophobicContact CD1-CB 4.01Å; F507-A531 HydrophobicContact CD2-CB 4.42Å; F507-A531 HydrophobicContact CE1-CB 3.92Å; F507-A531 HydrophobicContact CE2-CB 4.33Å; F507-A531 HydrophobicContact CG-CB 4.29Å; F507-A531 HydrophobicContact CZ-CB 4.1Å; A531-V542 HydrophobicContact CB-CG1 4.42Å; A531-Y544 HydrophobicContact CB-CE1 3.94Å; A531-Y544 PolarHBondContact N-OH 2.97Å; A531-Y544 PolarHBondContact O-OH 2.89Å; A531-A587 HydrophobicContact CB-CB 3.48Å; A531-A587 VanDerWaalsContact CB-CB 3.48Å
532	V	92.1	Very high	90.8	Very high	66 Å²	66	61.7 Å²	61.7	40%	0.4	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-115	130.1	174.6	179.4	0	0	0	0	107.4	P505 Y506 P508	P505-V532 CarbonylContact C-O 3.56Å; P505-V532 WeakPolarHBondContact CA-O 3.17Å; Y506-V532 VanDerWaalsContact CD1-O 3.29Å; Y506-V532 WeakPolarHBondContact CD1-O 3.36Å; Y506-V532 HydrophobicContact CE1-CB 4.31Å; Y506-V532 HydrophobicContact CE1-CG1 4.45Å; Y506-V532 PolarHBondContact N-O 3.17Å; Y506-V532 PolarHBondContact O-N 2.96Å; P508-V532 HydrophobicContact CG-CB 4.43Å; P508-V532 HydrophobicContact CG-CG2 3.69Å
533	D	92.6	Very high	90.9	Very high	27 Å²	27	66.2 Å²	66.2	14%	0.144	35%	0.352	C	S	.	.			trans	-85.4	123.2	173.2	-155.1	-38.1	0	0	0	108.9	P505 D535 V542	P505-D533 HydrophobicContact CB-CB 4.36Å; D533-D535 PolarHBondContact O-N 3.23Å; D533-D535 PolarHBondContact OD1-N 3.28Å; D533-V542 HydrophobicContact CB-CG2 4.05Å
534	P	91.6	Very high	91.2	Very high	26 Å²	26	64.3 Å²	64.3	17%	0.169	33%	0.327	C	S	.	.	S	Bend	trans	-58.7	-36.1	173.5	-23	34.2	0	0	0	112.7	E463 E503 Y506 R536	E463-P534 WeakPolarHBondContact CG-O 3.34Å; E503-P534 HydrophobicContact CB-CB 4.2Å; E503-P534 HydrophobicContact CB-CG 4.04Å; E503-P534 WeakPolarHBondContact OE2-CB 3.29Å; Y506-P534 HydrophobicContact CD1-CG 3.86Å; Y506-P534 HydrophobicContact CE1-CG 3.99Å; P534-R536 WeakPolarHBondContact O-CG 3.47Å; P534-R536 PolarHBondContact O-N 3.46Å
535	D	92.3	Very high	91.2	Very high	7 Å²	7	64.6 Å²	64.6	4%	0.037	33%	0.331	C	S	.	.			trans	-68.7	91.5	-170.9	-56.8	-22.4	0	0	0	111.3	N502 E503 D533 M538 Q540	N502-D535 VanDerWaalsContact CA-OD2 3.23Å; N502-D535 WeakPolarHBondContact CA-OD2 3.15Å; E503-D535 WeakPolarHBondContact CB-OD1 3.46Å; E503-D535 PolarHBondContact N-OD1 3.25Å; E503-D535 PolarHBondContact N-OD2 3.03Å; D533-D535 PolarHBondContact O-N 3.23Å; D533-D535 PolarHBondContact OD1-N 3.28Å; D535-M538 HydrophobicContact CB-CB 4.08Å; D535-M538 HydrophobicContact CB-CG 4.44Å; D535-Q540 PolarHBondContact OD2-NE2 3.24Å
536	R	86.5	Confident	91.3	Very high	204 Å²	204	64.7 Å²	64.7	77%	0.77	33%	0.326	S	S	*	.	S	Bend	trans	-80.5	-23.5	-176.4	-71.4	178.8	-175.2	-177.7	4.7	113.3	E463 P534	E463-R536 HydrophobicContact CG-CG 4.49Å; P534-R536 WeakPolarHBondContact O-CG 3.47Å; P534-R536 PolarHBondContact O-N 3.46Å
537	F	86.2	Confident	91.4	Very high	106 Å²	106	68.3 Å²	68.3	47%	0.465	34%	0.344	S	S	.	.	S	Bend	trans	-100.2	-12.7	-173.1	-63.3	-75.3	0	0	0	112.5	Y462	Y462-F537 HydrophobicContact CD1-CD2 4.04Å; Y462-F537 HydrophobicContact CE1-CB 3.91Å; Y462-F537 AromaticContact CE1-CD2 3.62Å; Y462-F537 HydrophobicContact CE1-CD2 3.62Å; Y462-F537 HydrophobicContact CE1-CE2 4.45Å; Y462-F537 AromaticContact CE1-CG 3.98Å; Y462-F537 HydrophobicContact CE1-CG 3.98Å
538	M	86.4	Confident	91.5	Very high	61 Å²	61	69.7 Å²	69.7	30%	0.3	36%	0.355	S	S	.	.	S	Bend	trans	-92.5	142.9	166.6	-60.2	-152.1	-158.3	0	0	110.1	D500 D535 Q540	D500-M538 HydrophobicContact CB-CE 3.73Å; D500-M538 WeakPolarHBondContact O-CE 3.49Å; D500-M538 WeakPolarHBondContact OD1-CE 3.2Å; D500-M538 WeakPolarHBondContact OD2-CG 3.37Å; D535-M538 HydrophobicContact CB-CB 4.08Å; D535-M538 HydrophobicContact CB-CG 4.44Å; M538-Q540 VanDerWaalsContact CB-CD 3.49Å; M538-Q540 PolarHBondContact O-N 2.98Å; M538-Q540 PolarHBondContact O-OE1 3.42Å
539	Q	84	Confident	91.5	Very high	200 Å²	200	66.4 Å²	66.4	94%	0.935	34%	0.335	S	S	*	.			trans	-93.2	79	175.6	-71.4	-175.4	-4	0	0	109.5
540	Q	88.8	Confident	91.6	Very high	38 Å²	38	69.3 Å²	69.3	18%	0.178	35%	0.354	C	S	.	.			trans	-95.2	157.3	170.3	-64.6	103.8	-30.5	0	0	113.4	N502 D535 M538 D589 N590	N502-Q540 PolarHBondContact OD1-NE2 3.06Å; D535-Q540 PolarHBondContact OD2-NE2 3.24Å; M538-Q540 VanDerWaalsContact CB-CD 3.49Å; M538-Q540 PolarHBondContact O-N 2.98Å; M538-Q540 PolarHBondContact O-OE1 3.42Å; Q540-D589 HydrophobicContact CB-CB 4.17Å; Q540-D589 HydrophobicContact CG-CB 4.22Å; Q540-N590 WeakPolarHBondContact CA-OD1 3.48Å; Q540-N590 WeakPolarHBondContact CB-OD1 3.24Å
541	A	89.9	Confident	91.6	Very high	55 Å²	55	67.3 Å²	67.3	46%	0.455	34%	0.341	S	S	.	.			trans	-118.7	118.6	170.9	0	0	0	0	0	109.6	N590	A541-N590 PolarHBondContact N-OD1 3.27Å
542	V	93.2	Very high	91.6	Very high	29 Å²	29	71.6 Å²	71.6	18%	0.176	36%	0.362	C	S	.	.			trans	-78.4	129.6	177.9	-176.9	0	0	0	0	110.7	P505 A531 D533 Y544 A587 A588	P505-V542 HydrophobicContact CB-CG1 4.21Å; P505-V542 HydrophobicContact CB-CG2 3.98Å; P505-V542 HydrophobicContact CG-CG1 4.23Å; P505-V542 HydrophobicContact CG-CG2 4.4Å; A531-V542 HydrophobicContact CB-CG1 4.42Å; D533-V542 HydrophobicContact CB-CG2 4.05Å; V542-Y544 HydrophobicContact CG1-CE1 4.12Å; V542-Y544 HydrophobicContact CG1-CE2 4.33Å; V542-A587 HydrophobicContact CG1-CB 3.79Å; V542-A588 WeakPolarHBondContact CA-O 3.06Å
543	R	94.3	Very high	91.8	Very high	177 Å²	177	69.5 Å²	69.5	67%	0.668	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	136	173.4	-68	-170.3	176.3	-176.7	1.4	111.4	T558 A587 A588	R543-T558 WeakPolarHBondContact CA-O 3.48Å; R543-A587 WeakPolarHBondContact O-CA 3.43Å; R543-A588 PolarHBondContact N-O 2.92Å; R543-A588 PolarHBondContact O-N 2.88Å
544	Y	95.5	Very high	91.9	Very high	17 Å²	17	68.3 Å²	68.3	7%	0.067	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	140.3	-179.1	-56	-83.4	0	0	0	111.5	F507 S530 A531 V542 I556 T558 L586 A587	F507-Y544 HydrophobicContact CE1-CD1 4.43Å; F507-Y544 HydrophobicContact CE1-CE1 4.2Å; F507-Y544 HydrophobicContact CZ-CD1 4.4Å; F507-Y544 HydrophobicContact CZ-CE1 4.44Å; S530-Y544 WeakPolarHBondContact CA-OH 3.48Å; A531-Y544 HydrophobicContact CB-CE1 3.94Å; A531-Y544 PolarHBondContact N-OH 2.97Å; A531-Y544 PolarHBondContact O-OH 2.89Å; V542-Y544 HydrophobicContact CG1-CE1 4.12Å; V542-Y544 HydrophobicContact CG1-CE2 4.33Å; Y544-I556 HydrophobicContact CD1-CD1 4.35Å; Y544-I556 HydrophobicContact CG-CD1 4.29Å; Y544-T558 WeakPolarHBondContact CD2-O 3.01Å; Y544-T558 PolarHBondContact N-O 3.11Å; Y544-T558 WeakPolarHBondContact O-CA 3.37Å; Y544-L586 CarbonylContact C-O 3.6Å; Y544-L586 WeakPolarHBondContact CA-O 3.19Å; Y544-A587 HydrophobicContact CD1-CB 4.06Å; Y544-A587 HydrophobicContact CE1-CB 4Å
545	S	94.7	Very high	92	Very high	54 Å²	54	72.2 Å²	72.2	38%	0.378	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	159.6	173.5	64	0	0	0	0	111.2	F585 L586	S545-F585 WeakPolarHBondContact O-CA 2.96Å; S545-L586 PolarHBondContact N-O 3.36Å; S545-L586 PolarHBondContact O-N 2.76Å
546	K	94.5	Very high	92.2	Very high	79 Å²	79	72.3 Å²	72.3	34%	0.343	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	125.5	178.9	-168.4	171.3	83.8	165.2	0	108.9	D549 N552 L554 F585	K546-D549 HydrophobicContact CD-CB 3.47Å; K546-D549 VanDerWaalsContact CD-CB 3.47Å; K546-D549 WeakPolarHBondContact CD-OD2 3.43Å; K546-D549 HydrophobicContact CG-CB 3.91Å; K546-D549 IonicContact NZ-OD2 2.74Å; K546-D549 PolarHBondContact NZ-OD2 3.3Å; K546-N552 PolarHBondContact NZ-OD1 2.8Å; K546-L554 WeakPolarHBondContact CD-O 3.37Å; K546-L554 PolarHBondContact NZ-O 2.88Å; K546-F585 HydrophobicContact CB-CD1 4.42Å; K546-F585 HydrophobicContact CB-CE1 4.41Å; K546-F585 HydrophobicContact CG-CD1 4.4Å; K546-F585 HydrophobicContact CG-CE1 4.08Å
547	L	93.5	Very high	92.6	Very high	105 Å²	105	65 Å²	65	55%	0.55	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	-56.9	179.3	-175.2	67.1	0	0	0	110.6	T584 T598	L547-T584 PolarHBondContact N-O 2.8Å; L547-T598 HydrophobicContact CD2-CG2 3.91Å
548	S	94.6	Very high	92.9	Very high	59 Å²	59	63.9 Å²	63.9	41%	0.413	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	128.3	177.3	-169.7	0	0	0	0	111.6	A583 T584	S548-A583 CarbonylContact O-C 3.59Å; S548-A583 WeakPolarHBondContact O-CA 3.24Å; S548-T584 WeakPolarHBondContact CB-OG1 3.49Å; S548-T584 PolarHBondContact N-O 2.83Å; S548-T584 VanDerWaalsContact N-O 3.15Å; S548-T584 PolarHBondContact N-OG1 2.88Å; S548-T584 PolarHBondContact O-N 2.89Å
549	D	94.2	Very high	93.2	Very high	10 Å²	10	66 Å²	66	5%	0.053	35%	0.351	C	S	.	.			trans	-152.7	84.8	178.4	176.3	21.8	0	0	0	107.6	K546 A551 N552 W553 L554 Y581	K546-D549 HydrophobicContact CD-CB 3.47Å; K546-D549 VanDerWaalsContact CD-CB 3.47Å; K546-D549 WeakPolarHBondContact CD-OD2 3.43Å; K546-D549 HydrophobicContact CG-CB 3.91Å; K546-D549 IonicContact NZ-OD2 2.74Å; K546-D549 PolarHBondContact NZ-OD2 3.3Å; D549-A551 VanDerWaalsContact C-N 3.26Å; D549-A551 PolarHBondContact O-N 3.28Å; D549-A551 VanDerWaalsContact O-N 3.17Å; D549-N552 PolarHBondContact O-N 3.02Å; D549-N552 VanDerWaalsContact OD2-C 3.24Å; D549-N552 WeakPolarHBondContact OD2-CA 3.19Å; D549-W553 PolarHBondContact OD1-N 2.89Å; D549-W553 PolarHBondContact OD2-N 3.5Å; D549-L554 PolarHBondContact OD2-N 3.42Å; D549-Y581 WeakPolarHBondContact OD1-CE1 3.47Å; D549-Y581 VanDerWaalsContact OD1-CZ 3.32Å; D549-Y581 PolarHBondContact OD1-OH 3.18Å
550	P	93.6	Very high	93.5	Very high	63 Å²	63	60 Å²	60	41%	0.409	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-37.1	-167	-29.1	35.8	0	0	0	114.7	Y575 Y581	P550-Y575 HydrophobicContact CB-CD1 3.49Å; P550-Y575 VanDerWaalsContact CB-CD1 3.49Å; P550-Y575 HydrophobicContact CB-CE1 4.01Å; P550-Y575 HydrophobicContact CB-CG 4.15Å; P550-Y581 WeakPolarHBondContact CD-OH 3.15Å
551	A	92.2	Very high	93.7	Very high	19 Å²	19	58.2 Å²	58.2	16%	0.157	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-1.7	-178.9	0	0	0	0	0	113.6	D549 W553 Y575 Y581	D549-A551 VanDerWaalsContact C-N 3.26Å; D549-A551 PolarHBondContact O-N 3.28Å; D549-A551 VanDerWaalsContact O-N 3.17Å; A551-W553 HydrophobicContact CB-CD2 3.57Å; A551-W553 HydrophobicContact CB-CE3 4.16Å; A551-W553 HydrophobicContact CB-CG 3.83Å; A551-W553 HydrophobicContact CB-CH2 4.23Å; A551-W553 HydrophobicContact CB-CZ2 3.71Å; A551-W553 HydrophobicContact CB-CZ3 4.46Å; A551-W553 PolarHBondContact O-N 3.15Å; A551-Y575 HydrophobicContact CB-CD2 3.56Å; A551-Y575 HydrophobicContact CB-CE2 4.13Å; A551-Y575 HydrophobicContact CB-CG 3.95Å; A551-Y581 HydrophobicContact CB-CE2 3.84Å; A551-Y581 WeakPolarHBondContact CB-OH 3.38Å; A551-Y581 PolarHBondContact N-OH 3.24Å
552	N	93.6	Very high	93.9	Very high	102 Å²	102	58.3 Å²	58.3	55%	0.545	31%	0.309	S	S	.	.			trans	55	33.4	-175.6	-74	-60.7	0	0	0	114.6	K546 D549 L554	K546-N552 PolarHBondContact NZ-OD1 2.8Å; D549-N552 PolarHBondContact O-N 3.02Å; D549-N552 VanDerWaalsContact OD2-C 3.24Å; D549-N552 WeakPolarHBondContact OD2-CA 3.19Å; N552-L554 VanDerWaalsContact C-N 3.33Å
553	W	94.8	Very high	94	Very high	22 Å²	22	56.9 Å²	56.9	8%	0.083	30%	0.3	C	S	.	.			trans	-82.5	-10.6	-177.5	-67.2	-13	0	0	0	114	D549 A551 T565 A566 L569 D570 T576 Y581 L605	D549-W553 PolarHBondContact OD1-N 2.89Å; D549-W553 PolarHBondContact OD2-N 3.5Å; A551-W553 HydrophobicContact CB-CD2 3.57Å; A551-W553 HydrophobicContact CB-CE3 4.16Å; A551-W553 HydrophobicContact CB-CG 3.83Å; A551-W553 HydrophobicContact CB-CH2 4.23Å; A551-W553 HydrophobicContact CB-CZ2 3.71Å; A551-W553 HydrophobicContact CB-CZ3 4.46Å; A551-W553 PolarHBondContact O-N 3.15Å; W553-T565 CarbonylContact O-C 3.56Å; W553-T565 WeakPolarHBondContact O-CA 3.44Å; W553-A566 PolarHBondContact O-N 3.13Å; W553-L569 HydrophobicContact CE3-CB 4.29Å; W553-L569 HydrophobicContact CE3-CD2 4.35Å; W553-L569 HydrophobicContact CE3-CG 4.15Å; W553-D570 HydrophobicContact CH2-CB 4.19Å; W553-D570 WeakPolarHBondContact CH2-O 3.47Å; W553-D570 HydrophobicContact CZ2-CB 4.06Å; W553-T576 HydrophobicContact CH2-CG2 4.41Å; W553-T576 HydrophobicContact CZ3-CG2 4.14Å; W553-Y581 HydrophobicContact CD2-CE2 4.5Å; W553-Y581 HydrophobicContact CE3-CD1 4.14Å; W553-Y581 AromaticContact CE3-CD2 3.85Å; W553-Y581 HydrophobicContact CE3-CD2 3.85Å; W553-Y581 HydrophobicContact CE3-CE1 4.09Å; W553-Y581 AromaticContact CE3-CE2 3.8Å; W553-Y581 HydrophobicContact CE3-CE2 3.8Å; W553-Y581 HydrophobicContact CE3-CG 4Å; W553-Y581 AromaticContact CE3-CZ 3.92Å; W553-Y581 HydrophobicContact CH2-CD2 4.43Å; W553-Y581 AromaticContact CZ3-CD2 3.56Å; W553-Y581 HydrophobicContact CZ3-CD2 3.56Å; W553-Y581 AromaticContact CZ3-CE2 3.81Å; W553-Y581 HydrophobicContact CZ3-CE2 3.81Å; W553-Y581 AromaticContact CZ3-CG 3.94Å; W553-Y581 HydrophobicContact CZ3-CG 3.94Å; W553-L605 HydrophobicContact CZ3-CD1 4.41Å
554	L	95.4	Very high	94	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144.4	-170.2	-56	174.8	0	0	0	111.5	L526 K546 D549 N552 I563 Y581 A583 F585 L601 I603	L526-L554 HydrophobicContact CD1-CD2 3.68Å; K546-L554 WeakPolarHBondContact CD-O 3.37Å; K546-L554 PolarHBondContact NZ-O 2.88Å; D549-L554 PolarHBondContact OD2-N 3.42Å; N552-L554 VanDerWaalsContact C-N 3.33Å; L554-I563 HydrophobicContact CB-CG2 4.39Å; L554-I563 HydrophobicContact CD2-CG2 4.14Å; L554-Y581 HydrophobicContact CD1-CD1 4.31Å; L554-Y581 HydrophobicContact CD1-CE1 3.96Å; L554-Y581 HydrophobicContact CG-CE1 4.31Å; L554-A583 HydrophobicContact CD1-CB 3.53Å; L554-F585 HydrophobicContact CB-CZ 4.17Å; L554-F585 HydrophobicContact CD1-CE2 4.43Å; L554-F585 HydrophobicContact CD1-CZ 3.98Å; L554-L601 HydrophobicContact CD1-CD2 4.27Å; L554-I603 HydrophobicContact CD1-CD1 3.81Å; L554-I603 HydrophobicContact CD2-CD1 3.83Å; L554-I603 HydrophobicContact CG-CD1 4.41Å
555	H	94.4	Very high	94	Very high	108 Å²	108	49.2 Å²	49.2	50%	0.5	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	131.5	170.3	174.9	-90.2	0	0	0	108.7	I563 T564 A566	H555-I563 WeakPolarHBondContact O-CA 3.33Å; H555-T564 PolarHBondContact N-O 2.92Å; H555-T564 PolarHBondContact O-N 2.79Å; H555-T564 PolarHBondContact O-OG1 2.79Å; H555-A566 HydrophobicContact CB-CB 4.44Å
556	I	95.3	Very high	93.9	Very high	8 Å²	8	49.2 Å²	49.2	4%	0.041	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.4	175.9	-169.4	161.7	0	0	0	109.9	Y544 T558 Q562 I563 F585	Y544-I556 HydrophobicContact CD1-CD1 4.35Å; Y544-I556 HydrophobicContact CG-CD1 4.29Å; I556-T558 PolarHBondContact O-N 3.37Å; I556-Q562 WeakPolarHBondContact CA-O 3.25Å; I556-I563 HydrophobicContact CB-CG1 4.38Å; I556-I563 HydrophobicContact CD1-CD1 4.38Å; I556-I563 HydrophobicContact CD1-CG1 4.07Å; I556-I563 HydrophobicContact CG1-CG1 4.08Å; I556-F585 HydrophobicContact CB-CD1 3.86Å; I556-F585 HydrophobicContact CB-CE1 3.8Å; I556-F585 HydrophobicContact CD1-CB 4.22Å; I556-F585 HydrophobicContact CD1-CD1 3.66Å; I556-F585 HydrophobicContact CD1-CE1 4.24Å; I556-F585 HydrophobicContact CD1-CG 3.99Å; I556-F585 HydrophobicContact CG1-CD1 4.38Å; I556-F585 HydrophobicContact CG2-CD1 3.76Å; I556-F585 HydrophobicContact CG2-CE1 3.99Å
557	N	95	Very high	93.8	Very high	51 Å²	51	47.1 Å²	47.1	27%	0.273	28%	0.275	S	S	.	.			trans	-75.1	124	173.3	178.6	-36.8	0	0	0	110.2	T559 N560 G561 Q562	N557-T559 PolarHBondContact O-N 3.48Å; N557-T559 VanDerWaalsContact O-N 3.12Å; N557-T559 PolarHBondContact OD1-N 3.4Å; N557-T559 PolarHBondContact OD1-OG1 3.48Å; N557-T559 VanDerWaalsContact OD1-OG1 3.07Å; N557-N560 WeakPolarHBondContact CB-OD1 3.49Å; N557-N560 PolarHBondContact ND2-OD1 3.42Å; N557-N560 PolarHBondContact OD1-OD1 3.29Å; N557-G561 PolarHBondContact O-N 3.43Å; N557-G561 VanDerWaalsContact O-N 3.08Å; N557-Q562 HydrophobicContact CB-CB 4.21Å; N557-Q562 PolarHBondContact N-O 2.67Å
558	T	92.9	Very high	93.8	Very high	82 Å²	82	45.6 Å²	45.6	50%	0.503	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.3	-173.6	61	0	0	0	0	115.6	R543 Y544 I556	R543-T558 WeakPolarHBondContact CA-O 3.48Å; Y544-T558 WeakPolarHBondContact CD2-O 3.01Å; Y544-T558 PolarHBondContact N-O 3.11Å; Y544-T558 WeakPolarHBondContact O-CA 3.37Å; I556-T558 PolarHBondContact O-N 3.37Å
559	T	92.2	Very high	93.7	Very high	105 Å²	105	42.8 Å²	42.8	64%	0.644	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-28.6	-173.2	56.2	0	0	0	0	114.4	N557	N557-T559 PolarHBondContact O-N 3.48Å; N557-T559 VanDerWaalsContact O-N 3.12Å; N557-T559 PolarHBondContact OD1-N 3.4Å; N557-T559 PolarHBondContact OD1-OG1 3.48Å; N557-T559 VanDerWaalsContact OD1-OG1 3.07Å
560	N	91.1	Very high	93.6	Very high	75 Å²	75	45.2 Å²	45.2	40%	0.401	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-0.2	-174.6	70.2	5.5	0	0	0	113.8	N557 Q562	N557-N560 WeakPolarHBondContact CB-OD1 3.49Å; N557-N560 PolarHBondContact ND2-OD1 3.42Å; N557-N560 PolarHBondContact OD1-OD1 3.29Å; N560-Q562 PolarHBondContact O-N 3.01Å; N560-Q562 WeakPolarHBondContact OD1-CB 3.3Å; N560-Q562 PolarHBondContact OD1-N 3.31Å
561	G	91.9	Very high	93.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.248	C	C	.	.			trans	66.8	16.1	178.6	0	0	0	0	0	114.1	F529 N557	F529-G561 PolarHBondContact N-O 3.39Å; N557-G561 PolarHBondContact O-N 3.43Å; N557-G561 VanDerWaalsContact O-N 3.08Å
562	Q	95.3	Very high	93.6	Very high	57 Å²	57	44.5 Å²	44.5	27%	0.266	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	128.3	177.9	-172.7	176.5	37.1	0	0	110.7	V525 T528 I556 N557 N560	V525-Q562 HydrophobicContact CG1-CG 3.87Å; T528-Q562 HydrophobicContact CG2-CB 4.47Å; I556-Q562 WeakPolarHBondContact CA-O 3.25Å; N557-Q562 HydrophobicContact CB-CB 4.21Å; N557-Q562 PolarHBondContact N-O 2.67Å; N560-Q562 PolarHBondContact O-N 3.01Å; N560-Q562 WeakPolarHBondContact OD1-CB 3.3Å; N560-Q562 PolarHBondContact OD1-N 3.31Å
563	I	95.3	Very high	93.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	126.5	179.8	-58.6	-179	0	0	0	109.5	L526 T527 F529 L554 H555 I556 F585 L601	L526-I563 HydrophobicContact CD1-CG2 4.34Å; L526-I563 PolarHBondContact N-O 2.88Å; T527-I563 PolarHBondContact O-N 3.25Å; F529-I563 HydrophobicContact CB-CD1 3.57Å; F529-I563 HydrophobicContact CB-CG1 4.21Å; F529-I563 HydrophobicContact CD1-CD1 4.2Å; F529-I563 HydrophobicContact CG-CD1 4.27Å; L554-I563 HydrophobicContact CB-CG2 4.39Å; L554-I563 HydrophobicContact CD2-CG2 4.14Å; H555-I563 WeakPolarHBondContact O-CA 3.33Å; I556-I563 HydrophobicContact CB-CG1 4.38Å; I556-I563 HydrophobicContact CD1-CD1 4.38Å; I556-I563 HydrophobicContact CD1-CG1 4.07Å; I556-I563 HydrophobicContact CG1-CG1 4.08Å; I563-F585 HydrophobicContact CD1-CD2 4.17Å; I563-F585 HydrophobicContact CD1-CE1 4.42Å; I563-F585 HydrophobicContact CD1-CE2 3.7Å; I563-F585 HydrophobicContact CD1-CZ 3.84Å; I563-F585 HydrophobicContact CG1-CZ 4.48Å; I563-F585 HydrophobicContact CG2-CZ 4.49Å; I563-L601 HydrophobicContact CD1-CD2 3.71Å; I563-L601 HydrophobicContact CG2-CD2 4.49Å
564	T	94.5	Very high	93.3	Very high	28 Å²	28	47.6 Å²	47.6	17%	0.172	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	149	178.4	51.3	0	0	0	0	111.1	T524 V525 H555	T524-T564 CarbonylContact O-C 3.54Å; T524-T564 VanDerWaalsContact O-CA 3.24Å; T524-T564 WeakPolarHBondContact O-CA 3.43Å; V525-T564 HydrophobicContact CG2-CG2 3.95Å; H555-T564 PolarHBondContact N-O 2.92Å; H555-T564 PolarHBondContact O-N 2.79Å; H555-T564 PolarHBondContact O-OG1 2.79Å
565	T	95.1	Very high	93.2	Very high	4 Å²	4	53.4 Å²	53.4	3%	0.025	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	129.2	174.2	58.8	0	0	0	0	110.8	V520 P521 P522 G523 T524 L526 W553 L569	V520-T565 HydrophobicContact CG1-CG2 4.13Å; P521-T565 PolarHBondContact O-OG1 2.87Å; P522-T565 WeakPolarHBondContact CA-OG1 3.43Å; G523-T565 PolarHBondContact N-O 3.04Å; G523-T565 PolarHBondContact N-OG1 2.99Å; G523-T565 VanDerWaalsContact N-OG1 3.13Å; T524-T565 PolarHBondContact N-OG1 2.58Å; T524-T565 PolarHBondContact O-N 2.98Å; L526-T565 HydrophobicContact CD1-CG2 3.96Å; L526-T565 HydrophobicContact CD2-CG2 3.62Å; L526-T565 HydrophobicContact CG-CG2 3.82Å; W553-T565 CarbonylContact O-C 3.56Å; W553-T565 WeakPolarHBondContact O-CA 3.44Å; T565-L569 HydrophobicContact CG2-CD1 3.41Å; T565-L569 VanDerWaalsContact CG2-CD1 3.41Å
566	A	93.4	Very high	93	Very high	54 Å²	54	49.1 Å²	49.1	45%	0.446	27%	0.274	S	S	.	.	S	Bend	trans	-95.2	-27.8	173.7	0	0	0	0	0	111.8	W553 H555	W553-A566 PolarHBondContact O-N 3.13Å; H555-A566 HydrophobicContact CB-CB 4.44Å
567	A	92.5	Very high	92.8	Very high	35 Å²	35	56.4 Å²	56.4	29%	0.289	31%	0.306	S	S	.	.	S	Bend	trans	-137.9	174.4	173.5	0	0	0	0	0	109.6
568	V	92	Very high	92.5	Very high	73 Å²	73	61.3 Å²	61.3	44%	0.442	33%	0.332	S	S	.	.			trans	-70.1	131.8	173.2	-177.4	0	0	0	0	108.5
569	L	92.7	Very high	92.4	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.005	32%	0.319	C	S	.	.			trans	-79.7	137.3	174	-64.3	93.5	0	0	0	109	L516 G519 V520 W553 T565 I603 L605	L516-L569 HydrophobicContact CD2-CD1 4.3Å; G519-L569 PolarHBondContact N-O 2.76Å; V520-L569 HydrophobicContact CB-CD1 4.37Å; W553-L569 HydrophobicContact CE3-CB 4.29Å; W553-L569 HydrophobicContact CE3-CD2 4.35Å; W553-L569 HydrophobicContact CE3-CG 4.15Å; T565-L569 HydrophobicContact CG2-CD1 3.41Å; T565-L569 VanDerWaalsContact CG2-CD1 3.41Å; L569-I603 HydrophobicContact CD2-CD1 4.13Å; L569-I603 HydrophobicContact CD2-CG2 4.24Å; L569-L605 HydrophobicContact CB-CD1 4.36Å; L569-L605 HydrophobicContact CB-CD2 3.92Å; L569-L605 HydrophobicContact CD2-CD2 3.83Å; L569-L605 HydrophobicContact CG-CD2 4.5Å
570	D	92.7	Very high	92.5	Very high	60 Å²	60	56.1 Å²	56.1	32%	0.321	30%	0.298	S	S	.	.			trans	-134.2	120.1	-172.8	160.8	10.1	0	0	0	107.4	W553 E572 S573	W553-D570 HydrophobicContact CH2-CB 4.19Å; W553-D570 WeakPolarHBondContact CH2-O 3.47Å; W553-D570 HydrophobicContact CZ2-CB 4.06Å; D570-E572 PolarHBondContact OD1-N 3.16Å; D570-S573 WeakPolarHBondContact O-CB 3.43Å; D570-S573 PolarHBondContact OD1-N 2.91Å; D570-S573 VanDerWaalsContact OD1-N 3.14Å
571	R	93.6	Very high	92.7	Very high	21 Å²	21	52.6 Å²	52.6	8%	0.079	28%	0.279	C	S	.	.	S	Bend	trans	-78.9	-32.1	-175.6	-174.5	-162.1	70.6	79.4	4.5	111	E518 S573 T576 N579 L605 D607 A638	E518-R571 WeakPolarHBondContact OE2-CA 3.5Å; E518-R571 WeakPolarHBondContact OE2-CB 3.32Å; E518-R571 PolarHBondContact OE2-N 2.89Å; R571-S573 PolarHBondContact O-N 2.76Å; R571-T576 WeakPolarHBondContact O-CB 3.28Å; R571-T576 PolarHBondContact O-OG1 2.88Å; R571-N579 PolarHBondContact NH1-OD1 3.23Å; R571-N579 VanDerWaalsContact NH1-OD1 3.07Å; R571-L605 HydrophobicContact CB-CB 4Å; R571-L605 HydrophobicContact CB-CD1 4.24Å; R571-L605 HydrophobicContact CG-CB 3.98Å; R571-D607 IonicContact CZ-OD1 2.76Å; R571-D607 IonicContact NE-OD1 2.74Å; R571-D607 PolarHBondContact NE-OD1 2.8Å; R571-D607 IonicContact NH2-OD1 2.78Å; R571-D607 PolarHBondContact NH2-OD1 3.41Å; R571-A638 PolarHBondContact NH2-O 2.86Å; R571-A638 VanDerWaalsContact NH2-O 3.09Å
572	E	92.1	Very high	92.8	Very high	47 Å²	47	57.2 Å²	57.2	22%	0.22	30%	0.301	C	S	.	.	S	Bend	trans	-76.1	-7.6	-178.9	-64.3	65	-123.3	0	0	112.4	D570 N611 A638	D570-E572 PolarHBondContact OD1-N 3.16Å; E572-N611 WeakPolarHBondContact CG-ND2 3.41Å; E572-A638 HydrophobicContact CB-CB 4.4Å; E572-A638 HydrophobicContact CG-CB 3.77Å; E572-A638 WeakPolarHBondContact CG-O 3.49Å
573	S	91.4	Very high	92.8	Very high	26 Å²	26	54.5 Å²	54.5	18%	0.182	29%	0.288	C	S	.	.	S	Bend	trans	-55.3	155.5	176	-156	0	0	0	0	113.9	D570 R571 Y575 T576	D570-S573 WeakPolarHBondContact O-CB 3.43Å; D570-S573 PolarHBondContact OD1-N 2.91Å; D570-S573 VanDerWaalsContact OD1-N 3.14Å; R571-S573 PolarHBondContact O-N 2.76Å; S573-Y575 PolarHBondContact O-N 3.23Å; S573-T576 PolarHBondContact O-N 3.37Å; S573-T576 PolarHBondContact O-OG1 3.09Å
574	L	91.3	Very high	92.8	Very high	162 Å²	162	55.9 Å²	55.9	85%	0.848	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-16.6	175.8	-66.3	164.1	0	0	0	113.1
575	Y	91.8	Very high	92.8	Very high	125 Å²	125	54.5 Å²	54.5	49%	0.49	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-13.6	-176.3	-58	-69.7	0	0	0	113.4	P550 A551 S573	P550-Y575 HydrophobicContact CB-CD1 3.49Å; P550-Y575 VanDerWaalsContact CB-CD1 3.49Å; P550-Y575 HydrophobicContact CB-CE1 4.01Å; P550-Y575 HydrophobicContact CB-CG 4.15Å; A551-Y575 HydrophobicContact CB-CD2 3.56Å; A551-Y575 HydrophobicContact CB-CE2 4.13Å; A551-Y575 HydrophobicContact CB-CG 3.95Å; S573-Y575 PolarHBondContact O-N 3.23Å
576	T	91.6	Very high	92.8	Very high	18 Å²	18	56.1 Å²	56.1	11%	0.11	30%	0.296	C	S	.	.			trans	-92.3	122.5	176.6	26.6	0	0	0	0	109.4	W553 R571 S573 Y581 L605	W553-T576 HydrophobicContact CH2-CG2 4.41Å; W553-T576 HydrophobicContact CZ3-CG2 4.14Å; R571-T576 WeakPolarHBondContact O-CB 3.28Å; R571-T576 PolarHBondContact O-OG1 2.88Å; S573-T576 PolarHBondContact O-N 3.37Å; S573-T576 PolarHBondContact O-OG1 3.09Å; T576-Y581 HydrophobicContact CG2-CD2 4.1Å; T576-Y581 HydrophobicContact CG2-CG 4.45Å; T576-L605 HydrophobicContact CG2-CD1 3.64Å
577	K	90.3	Very high	92.9	Very high	161 Å²	161	53.5 Å²	53.5	70%	0.7	28%	0.275	S	S	*	.	B	Isolated β-bridge	trans	-117.5	127.7	179	-66.4	-178.5	-177.5	175.5	0	108.7	N579 V580	K577-N579 VanDerWaalsContact C-N 3.27Å; K577-N579 PolarHBondContact O-N 3.25Å; K577-V580 PolarHBondContact N-O 2.92Å; K577-V580 PolarHBondContact O-N 3.49Å
578	N	89.3	Confident	93	Very high	154 Å²	154	53.1 Å²	53.1	82%	0.824	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	42.3	-178.9	-55.9	-27.7	0	0	0	113.1	V580	N578-V580 PolarHBondContact O-N 3.33Å
579	N	90.8	Very high	93.2	Very high	45 Å²	45	50.1 Å²	50.1	24%	0.241	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	15.7	-175.6	-53.6	-14.3	0	0	0	114.7	R571 K577 Y604 L605	R571-N579 PolarHBondContact NH1-OD1 3.23Å; R571-N579 VanDerWaalsContact NH1-OD1 3.07Å; K577-N579 VanDerWaalsContact C-N 3.27Å; K577-N579 PolarHBondContact O-N 3.25Å; N579-Y604 HydrophobicContact CB-CD2 4.45Å; N579-Y604 HydrophobicContact CB-CE2 3.95Å; N579-Y604 WeakPolarHBondContact O-CA 3.34Å; N579-L605 PolarHBondContact O-N 3.44Å
580	V	93.9	Very high	93.1	Very high	33 Å²	33	54.7 Å²	54.7	20%	0.2	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	127.6	177.8	179.2	0	0	0	0	110	K577 N578 Q602 I603 Y604	K577-V580 PolarHBondContact N-O 2.92Å; K577-V580 PolarHBondContact O-N 3.49Å; N578-V580 PolarHBondContact O-N 3.33Å; V580-Q602 HydrophobicContact CG1-CB 3.84Å; V580-Q602 HydrophobicContact CG1-CG 4.19Å; V580-I603 CarbonylContact C-O 3.56Å; V580-I603 WeakPolarHBondContact CA-O 3.35Å; V580-Y604 HydrophobicContact CG2-CD2 3.86Å
581	Y	94.4	Very high	92.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	126.4	165.5	-173.5	-106.4	0	0	0	109.5	D549 P550 A551 W553 L554 T576 A583 I603	D549-Y581 WeakPolarHBondContact OD1-CE1 3.47Å; D549-Y581 VanDerWaalsContact OD1-CZ 3.32Å; D549-Y581 PolarHBondContact OD1-OH 3.18Å; P550-Y581 WeakPolarHBondContact CD-OH 3.15Å; A551-Y581 HydrophobicContact CB-CE2 3.84Å; A551-Y581 WeakPolarHBondContact CB-OH 3.38Å; A551-Y581 PolarHBondContact N-OH 3.24Å; W553-Y581 HydrophobicContact CD2-CE2 4.5Å; W553-Y581 HydrophobicContact CE3-CD1 4.14Å; W553-Y581 AromaticContact CE3-CD2 3.85Å; W553-Y581 HydrophobicContact CE3-CD2 3.85Å; W553-Y581 HydrophobicContact CE3-CE1 4.09Å; W553-Y581 AromaticContact CE3-CE2 3.8Å; W553-Y581 HydrophobicContact CE3-CE2 3.8Å; W553-Y581 HydrophobicContact CE3-CG 4Å; W553-Y581 AromaticContact CE3-CZ 3.92Å; W553-Y581 HydrophobicContact CH2-CD2 4.43Å; W553-Y581 AromaticContact CZ3-CD2 3.56Å; W553-Y581 HydrophobicContact CZ3-CD2 3.56Å; W553-Y581 AromaticContact CZ3-CE2 3.81Å; W553-Y581 HydrophobicContact CZ3-CE2 3.81Å; W553-Y581 AromaticContact CZ3-CG 3.94Å; W553-Y581 HydrophobicContact CZ3-CG 3.94Å; L554-Y581 HydrophobicContact CD1-CD1 4.31Å; L554-Y581 HydrophobicContact CD1-CE1 3.96Å; L554-Y581 HydrophobicContact CG-CE1 4.31Å; T576-Y581 HydrophobicContact CG2-CD2 4.1Å; T576-Y581 HydrophobicContact CG2-CG 4.45Å; Y581-A583 HydrophobicContact CE1-CB 4.27Å; Y581-I603 HydrophobicContact CD1-CD1 4.27Å; Y581-I603 PolarHBondContact N-O 2.62Å; Y581-I603 PolarHBondContact O-N 2.99Å
582	E	94.8	Very high	92.5	Very high	97 Å²	97	59.3 Å²	59.3	45%	0.453	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.3	-176.8	-172	171.9	-162.9	0	0	110.6	T600 Q602	E582-T600 HydrophobicContact CG-CG2 3.66Å; E582-T600 WeakPolarHBondContact OE1-CG2 3.24Å; E582-Q602 HydrophobicContact CG-CG 4.47Å
583	A	94.6	Very high	92.4	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	142.1	176.2	0	0	0	0	0	110.5	S548 L554 Y581 F585 L601	S548-A583 CarbonylContact O-C 3.59Å; S548-A583 WeakPolarHBondContact O-CA 3.24Å; L554-A583 HydrophobicContact CD1-CB 3.53Å; Y581-A583 HydrophobicContact CE1-CB 4.27Å; A583-F585 HydrophobicContact CB-CE2 3.94Å; A583-F585 HydrophobicContact CB-CZ 4.21Å; A583-L601 PolarHBondContact N-O 2.95Å; A583-L601 PolarHBondContact O-N 3.02Å
584	T	95.7	Very high	92.3	Very high	28 Å²	28	65.1 Å²	65.1	17%	0.172	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	138.7	179.2	61.6	0	0	0	0	111.4	L547 S548 G599 T600	L547-T584 PolarHBondContact N-O 2.8Å; S548-T584 WeakPolarHBondContact CB-OG1 3.49Å; S548-T584 PolarHBondContact N-O 2.83Å; S548-T584 VanDerWaalsContact N-O 3.15Å; S548-T584 PolarHBondContact N-OG1 2.88Å; S548-T584 PolarHBondContact O-N 2.89Å; T584-G599 WeakPolarHBondContact CA-O 3.25Å; T584-T600 HydrophobicContact CG2-CG2 4.42Å
585	F	95.4	Very high	92.4	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	146.2	-178.7	-61.9	-83	0	0	0	109.7	F529 S545 K546 L554 I556 I563 A583 T598 G599 L601	F529-F585 HydrophobicContact CD1-CB 4.19Å; F529-F585 AromaticContact CD1-CD2 3.87Å; F529-F585 HydrophobicContact CD1-CD2 3.87Å; F529-F585 HydrophobicContact CD1-CG 4.27Å; F529-F585 HydrophobicContact CE1-CB 4.2Å; F529-F585 HydrophobicContact CE1-CD2 4.01Å; S545-F585 WeakPolarHBondContact O-CA 2.96Å; K546-F585 HydrophobicContact CB-CD1 4.42Å; K546-F585 HydrophobicContact CB-CE1 4.41Å; K546-F585 HydrophobicContact CG-CD1 4.4Å; K546-F585 HydrophobicContact CG-CE1 4.08Å; L554-F585 HydrophobicContact CB-CZ 4.17Å; L554-F585 HydrophobicContact CD1-CE2 4.43Å; L554-F585 HydrophobicContact CD1-CZ 3.98Å; I556-F585 HydrophobicContact CB-CD1 3.86Å; I556-F585 HydrophobicContact CB-CE1 3.8Å; I556-F585 HydrophobicContact CD1-CB 4.22Å; I556-F585 HydrophobicContact CD1-CD1 3.66Å; I556-F585 HydrophobicContact CD1-CE1 4.24Å; I556-F585 HydrophobicContact CD1-CG 3.99Å; I556-F585 HydrophobicContact CG1-CD1 4.38Å; I556-F585 HydrophobicContact CG2-CD1 3.76Å; I556-F585 HydrophobicContact CG2-CE1 3.99Å; I563-F585 HydrophobicContact CD1-CD2 4.17Å; I563-F585 HydrophobicContact CD1-CE1 4.42Å; I563-F585 HydrophobicContact CD1-CE2 3.7Å; I563-F585 HydrophobicContact CD1-CZ 3.84Å; I563-F585 HydrophobicContact CG1-CZ 4.48Å; I563-F585 HydrophobicContact CG2-CZ 4.49Å; A583-F585 HydrophobicContact CB-CE2 3.94Å; A583-F585 HydrophobicContact CB-CZ 4.21Å; F585-T598 WeakPolarHBondContact O-CA 3.2Å; F585-G599 PolarHBondContact N-O 2.75Å; F585-G599 PolarHBondContact O-N 2.83Å; F585-L601 HydrophobicContact CD2-CB 4.17Å; F585-L601 HydrophobicContact CE2-CB 3.81Å; F585-L601 HydrophobicContact CE2-CD2 4.01Å
586	L	95.4	Very high	92.5	Very high	37 Å²	37	55.5 Å²	55.5	19%	0.194	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.9	177.7	-173.3	112.2	0	0	0	108.9	Y544 S545 A588 G597	Y544-L586 CarbonylContact C-O 3.6Å; Y544-L586 WeakPolarHBondContact CA-O 3.19Å; S545-L586 PolarHBondContact N-O 3.36Å; S545-L586 PolarHBondContact O-N 2.76Å; L586-A588 HydrophobicContact CD2-CB 4Å; L586-G597 WeakPolarHBondContact CA-O 3.49Å
587	A	95.5	Very high	92.6	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.7	165	0	0	0	0	0	107.5	P505 F507 A531 V542 R543 Y544 S596 G597	P505-A587 HydrophobicContact CB-CB 4.43Å; P505-A587 HydrophobicContact CG-CB 4.1Å; P505-A587 WeakPolarHBondContact CG-O 3.31Å; F507-A587 HydrophobicContact CE2-CB 3.85Å; F507-A587 HydrophobicContact CZ-CB 3.67Å; A531-A587 HydrophobicContact CB-CB 3.48Å; A531-A587 VanDerWaalsContact CB-CB 3.48Å; V542-A587 HydrophobicContact CG1-CB 3.79Å; R543-A587 WeakPolarHBondContact O-CA 3.43Å; Y544-A587 HydrophobicContact CD1-CB 4.06Å; Y544-A587 HydrophobicContact CE1-CB 4Å; A587-S596 CarbonylContact O-C 3.48Å; A587-S596 WeakPolarHBondContact O-CA 3.42Å; A587-S596 WeakPolarHBondContact O-CB 3.47Å; A587-G597 PolarHBondContact N-O 2.87Å; A587-G597 PolarHBondContact O-N 2.88Å
588	A	94.4	Very high	92.9	Very high	27 Å²	27	50.8 Å²	50.8	22%	0.223	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.8	177	0	0	0	0	0	109.8	V542 R543 L586 A595	V542-A588 WeakPolarHBondContact CA-O 3.06Å; R543-A588 PolarHBondContact N-O 2.92Å; R543-A588 PolarHBondContact O-N 2.88Å; L586-A588 HydrophobicContact CD2-CB 4Å; A588-A595 WeakPolarHBondContact CA-O 3.48Å
589	D	94.6	Very high	93.1	Very high	10 Å²	10	43.5 Å²	43.5	5%	0.053	26%	0.261	C	S	.	.			trans	-76.7	177.8	169.1	66.1	49.3	0	0	0	110.8	N502 P505 Q540 G591 P594 A595	N502-D589 PolarHBondContact ND2-OD2 3.47Å; N502-D589 PolarHBondContact OD1-OD2 3.18Å; P505-D589 HydrophobicContact CG-CB 4.46Å; Q540-D589 HydrophobicContact CB-CB 4.17Å; Q540-D589 HydrophobicContact CG-CB 4.22Å; D589-G591 PolarHBondContact OD1-N 3.3Å; D589-P594 WeakPolarHBondContact OD1-CA 3.34Å; D589-A595 PolarHBondContact N-O 2.92Å; D589-A595 PolarHBondContact OD1-N 2.81Å; D589-A595 WeakPolarHBondContact OD2-CA 3.5Å; D589-A595 VanDerWaalsContact OD2-CB 3.24Å; D589-A595 WeakPolarHBondContact OD2-CB 3.45Å; D589-A595 PolarHBondContact OD2-N 3.49Å; D589-A595 VanDerWaalsContact OD2-N 3.1Å; D589-A595 VanDerWaalsContact OD2-O 3.09Å
590	N	91.8	Very high	93.4	Very high	96 Å²	96	42 Å²	42	51%	0.513	25%	0.254	S	S	.	.			trans	-114.2	25.7	172.1	71.3	-39.9	0	0	0	112.1	Q540 A541	Q540-N590 WeakPolarHBondContact CA-OD1 3.48Å; Q540-N590 WeakPolarHBondContact CB-OD1 3.24Å; A541-N590 PolarHBondContact N-OD1 3.27Å
591	G	88.1	Confident	93.4	Very high	12 Å²	12	40.5 Å²	40.5	12%	0.124	24%	0.244	C	C	.	.			trans	-74.3	-179.1	176.3	0	0	0	0	0	113.2	N502 D589 P593 P594	N502-G591 VanDerWaalsContact OD1-CA 3.28Å; N502-G591 WeakPolarHBondContact OD1-CA 3.33Å; D589-G591 PolarHBondContact OD1-N 3.3Å; G591-P593 CarbonylContact C-O 3.6Å; G591-P593 CarbonylContact O-C 3.57Å; G591-P594 WeakPolarHBondContact O-CA 3.47Å; G591-P594 VanDerWaalsContact O-N 3.15Å
592	I	85.6	Confident	93.4	Very high	166 Å²	166	42.8 Å²	42.8	85%	0.851	26%	0.255	S	S	*	.	S	Bend	trans	-130.4	112.4	-178.9	-56.8	175.1	0	0	0	108.3
593	P	89.3	Confident	93.4	Very high	96 Å²	96	38.1 Å²	38.1	62%	0.623	23%	0.233	S	C	*	.	S	Bend	cis	-65.5	153.9	-8.9	31	-35	0	0	0	111.6	N502 G591 A595	N502-P593 PolarHBondContact ND2-O 2.04Å; G591-P593 CarbonylContact C-O 3.6Å; G591-P593 CarbonylContact O-C 3.57Å; P593-A595 PolarHBondContact O-N 3.33Å
594	P	90.6	Very high	93.4	Very high	99 Å²	99	41.5 Å²	41.5	64%	0.643	25%	0.246	S	C	*	.			trans	-68.9	133.4	177.4	28.1	-33.5	0	0	0	109.9	D589 G591	D589-P594 WeakPolarHBondContact OD1-CA 3.34Å; G591-P594 WeakPolarHBondContact O-CA 3.47Å; G591-P594 VanDerWaalsContact O-N 3.15Å
595	A	92.9	Very high	93.4	Very high	23 Å²	23	40.2 Å²	40.2	19%	0.19	24%	0.238	C	C	.	.			trans	-112.2	156.4	173.3	0	0	0	0	0	111.3	N502 A504 A588 D589 P593	N502-A595 WeakPolarHBondContact ND2-CB 3.37Å; A504-A595 HydrophobicContact CB-CB 3.87Å; A588-A595 WeakPolarHBondContact CA-O 3.48Å; D589-A595 PolarHBondContact N-O 2.92Å; D589-A595 PolarHBondContact OD1-N 2.81Å; D589-A595 WeakPolarHBondContact OD2-CA 3.5Å; D589-A595 VanDerWaalsContact OD2-CB 3.24Å; D589-A595 WeakPolarHBondContact OD2-CB 3.45Å; D589-A595 PolarHBondContact OD2-N 3.49Å; D589-A595 VanDerWaalsContact OD2-N 3.1Å; D589-A595 VanDerWaalsContact OD2-O 3.09Å; P593-A595 PolarHBondContact O-N 3.33Å
596	S	94.4	Very high	93.2	Very high	62 Å²	62	43.4 Å²	43.4	43%	0.434	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	136.5	-176.1	64.6	0	0	0	0	112.1	A587	A587-S596 CarbonylContact O-C 3.48Å; A587-S596 WeakPolarHBondContact O-CA 3.42Å; A587-S596 WeakPolarHBondContact O-CB 3.47Å
597	G	94.1	Very high	93	Very high	13 Å²	13	42.7 Å²	42.7	13%	0.134	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	148.6	172.8	0	0	0	0	0	112.2	P505 L586 A587	P505-G597 VanDerWaalsContact O-CA 3.3Å; P505-G597 WeakPolarHBondContact O-CA 3.47Å; P505-G597 PolarHBondContact O-N 2.95Å; L586-G597 WeakPolarHBondContact CA-O 3.49Å; A587-G597 PolarHBondContact N-O 2.87Å; A587-G597 PolarHBondContact O-N 2.88Å
598	T	95.2	Very high	92.9	Very high	68 Å²	68	45.1 Å²	45.1	42%	0.417	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	131.9	177.8	-56.5	0	0	0	0	110	N510 L547 F585	N510-T598 PolarHBondContact ND2-O 2.94Å; L547-T598 HydrophobicContact CD2-CG2 3.91Å; F585-T598 WeakPolarHBondContact O-CA 3.2Å
599	G	94.5	Very high	92.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.4	176.1	0	0	0	0	0	111.3	F507 T584 F585	F507-G599 VanDerWaalsContact CE2-N 3.28Å; T584-G599 WeakPolarHBondContact CA-O 3.25Å; F585-G599 PolarHBondContact N-O 2.75Å; F585-G599 PolarHBondContact O-N 2.83Å
600	T	95.5	Very high	92.6	Very high	15 Å²	15	47.8 Å²	47.8	9%	0.092	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	125.1	177.8	-57	0	0	0	0	110.2	N510 H511 K512 E582 T584 Q602	N510-T600 PolarHBondContact OD1-N 2.84Å; H511-T600 HydrophobicContact CB-CG2 4.48Å; K512-T600 PolarHBondContact N-O 2.94Å; E582-T600 HydrophobicContact CG-CG2 3.66Å; E582-T600 WeakPolarHBondContact OE1-CG2 3.24Å; T584-T600 HydrophobicContact CG2-CG2 4.42Å; T600-Q602 HydrophobicContact CG2-CG 4.26Å
601	L	95.1	Very high	92.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.4	169.5	-176.5	76.3	0	0	0	109.3	K512 I514 T527 L554 I563 A583 F585 I603	K512-L601 HydrophobicContact CB-CD1 4.17Å; K512-L601 HydrophobicContact CD-CD1 4.28Å; K512-L601 HydrophobicContact CG-CD1 4.09Å; I514-L601 HydrophobicContact CD1-CD1 4.43Å; I514-L601 HydrophobicContact CD1-CD2 4.47Å; I514-L601 HydrophobicContact CG1-CD1 4.42Å; I514-L601 HydrophobicContact CG2-CD1 4.27Å; T527-L601 HydrophobicContact CG2-CD1 4.24Å; L554-L601 HydrophobicContact CD1-CD2 4.27Å; I563-L601 HydrophobicContact CD1-CD2 3.71Å; I563-L601 HydrophobicContact CG2-CD2 4.49Å; A583-L601 PolarHBondContact N-O 2.95Å; A583-L601 PolarHBondContact O-N 3.02Å; F585-L601 HydrophobicContact CD2-CB 4.17Å; F585-L601 HydrophobicContact CE2-CB 3.81Å; F585-L601 HydrophobicContact CE2-CD2 4.01Å; L601-I603 HydrophobicContact CD2-CD1 3.91Å; L601-I603 HydrophobicContact CD2-CG1 3.87Å; L601-I603 HydrophobicContact CG-CG1 4.08Å
602	Q	95	Very high	92.7	Very high	48 Å²	48	47 Å²	47	22%	0.224	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.9	172.3	-67.7	-175.4	-17.9	0	0	108.9	H511 K512 L513 I514 V580 E582 T600	H511-Q602 HydrophobicContact CB-CG 4.31Å; H511-Q602 PolarHBondContact ND1-NE2 2.76Å; K512-Q602 PolarHBondContact O-N 3.4Å; L513-Q602 CarbonylContact C-O 3.52Å; L513-Q602 WeakPolarHBondContact CA-O 3.36Å; L513-Q602 HydrophobicContact CD1-CB 3.75Å; I514-Q602 PolarHBondContact N-O 3.26Å; V580-Q602 HydrophobicContact CG1-CB 3.84Å; V580-Q602 HydrophobicContact CG1-CG 4.19Å; E582-Q602 HydrophobicContact CG-CG 4.47Å; T600-Q602 HydrophobicContact CG2-CG 4.26Å
603	I	94.6	Very high	93.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	107.3	178.2	-48.7	-176.3	0	0	0	107.4	I514 L516 L526 L554 L569 V580 Y581 L601 L605	I514-I603 HydrophobicContact CD1-CB 4.48Å; I514-I603 HydrophobicContact CD1-CD1 4.26Å; I514-I603 HydrophobicContact CD1-CG1 3.91Å; I514-I603 HydrophobicContact CD1-CG2 4.19Å; I514-I603 HydrophobicContact CG1-CB 4.14Å; I514-I603 HydrophobicContact CG1-CG1 3.9Å; I514-I603 HydrophobicContact CG1-CG2 4.03Å; L516-I603 HydrophobicContact CB-CG2 4.33Å; L526-I603 HydrophobicContact CD1-CD1 4.06Å; L554-I603 HydrophobicContact CD1-CD1 3.81Å; L554-I603 HydrophobicContact CD2-CD1 3.83Å; L554-I603 HydrophobicContact CG-CD1 4.41Å; L569-I603 HydrophobicContact CD2-CD1 4.13Å; L569-I603 HydrophobicContact CD2-CG2 4.24Å; V580-I603 CarbonylContact C-O 3.56Å; V580-I603 WeakPolarHBondContact CA-O 3.35Å; Y581-I603 HydrophobicContact CD1-CD1 4.27Å; Y581-I603 PolarHBondContact N-O 2.62Å; Y581-I603 PolarHBondContact O-N 2.99Å; L601-I603 HydrophobicContact CD2-CD1 3.91Å; L601-I603 HydrophobicContact CD2-CG1 3.87Å; L601-I603 HydrophobicContact CG-CG1 4.08Å; I603-L605 HydrophobicContact CG2-CD2 3.92Å; I603-L605 HydrophobicContact CG2-CG 4.35Å; I603-L605 PolarHBondContact O-N 3.39Å
604	Y	94.9	Very high	93.2	Very high	72 Å²	72	38.7 Å²	38.7	28%	0.282	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	111	170.1	-173	-89.7	0	0	0	108.9	I514 R515 L516 N579 V580 I606	I514-Y604 PolarHBondContact O-N 2.88Å; R515-Y604 WeakPolarHBondContact CA-O 3.31Å; R515-Y604 HydrophobicContact CG-CD1 4.46Å; L516-Y604 PolarHBondContact N-O 2.75Å; N579-Y604 HydrophobicContact CB-CD2 4.45Å; N579-Y604 HydrophobicContact CB-CE2 3.95Å; N579-Y604 WeakPolarHBondContact O-CA 3.34Å; V580-Y604 HydrophobicContact CG2-CD2 3.86Å; Y604-I606 HydrophobicContact CD1-CG1 4.25Å; Y604-I606 HydrophobicContact CE1-CG1 4.36Å
605	L	93.9	Very high	93.2	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	125	178.9	-67.7	174	0	0	0	109.8	L516 E518 W553 L569 R571 T576 N579 I603	L516-L605 CarbonylContact O-C 3.36Å; L516-L605 WeakPolarHBondContact O-CA 3.25Å; E518-L605 HydrophobicContact CB-CD2 4.48Å; W553-L605 HydrophobicContact CZ3-CD1 4.41Å; L569-L605 HydrophobicContact CB-CD1 4.36Å; L569-L605 HydrophobicContact CB-CD2 3.92Å; L569-L605 HydrophobicContact CD2-CD2 3.83Å; L569-L605 HydrophobicContact CG-CD2 4.5Å; R571-L605 HydrophobicContact CB-CB 4Å; R571-L605 HydrophobicContact CB-CD1 4.24Å; R571-L605 HydrophobicContact CG-CB 3.98Å; T576-L605 HydrophobicContact CG2-CD1 3.64Å; N579-L605 PolarHBondContact O-N 3.44Å; I603-L605 HydrophobicContact CG2-CD2 3.92Å; I603-L605 HydrophobicContact CG2-CG 4.35Å; I603-L605 PolarHBondContact O-N 3.39Å
606	I	92.3	Very high	93.1	Very high	66 Å²	66	36.2 Å²	36.2	34%	0.338	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	124	172.8	-56.2	170.2	0	0	0	106.6	L516 E517 E518 Y604	L516-I606 PolarHBondContact O-N 3.27Å; E517-I606 HydrophobicContact CG-CB 4.25Å; E517-I606 HydrophobicContact CG-CD1 4.47Å; E517-I606 HydrophobicContact CG-CG2 4.49Å; E518-I606 PolarHBondContact N-O 3.01Å; E518-I606 VanDerWaalsContact N-O 3.15Å; Y604-I606 HydrophobicContact CD1-CG1 4.25Å; Y604-I606 HydrophobicContact CE1-CG1 4.36Å
607	D	91.9	Very high	92.9	Very high	22 Å²	22	35.7 Å²	35.7	12%	0.118	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-59.6	132.2	179.5	-170.7	65.1	0	0	0	111.9	E518 R571 V640 N643	E518-D607 VanDerWaalsContact OE1-CA 3.27Å; E518-D607 WeakPolarHBondContact OE1-CA 3.44Å; R571-D607 IonicContact CZ-OD1 2.76Å; R571-D607 IonicContact NE-OD1 2.74Å; R571-D607 PolarHBondContact NE-OD1 2.8Å; R571-D607 IonicContact NH2-OD1 2.78Å; R571-D607 PolarHBondContact NH2-OD1 3.41Å; D607-V640 HydrophobicContact CB-CG2 3.45Å; D607-V640 VanDerWaalsContact CB-CG2 3.45Å; D607-V640 VanDerWaalsContact OD2-CG2 3.3Å; D607-V640 WeakPolarHBondContact OD2-CG2 3.36Å; D607-V640 PolarHBondContact OD2-N 2.92Å; D607-N643 PolarHBondContact O-ND2 3.17Å; D607-N643 PolarHBondContact OD2-ND2 3.44Å
608	I	91.8	Very high	92.6	Very high	52 Å²	52	40.1 Å²	40.1	27%	0.267	21%	0.21	S	C	.	.			trans	-113.9	152.3	167.4	73.5	-174.9	0	0	0	108.7	E517 E518 D610	E517-I608 HydrophobicContact CB-CG2 4.31Å; E518-I608 HydrophobicContact CG-CB 4.18Å; E518-I608 HydrophobicContact CG-CD1 3.55Å; E518-I608 HydrophobicContact CG-CG1 3.42Å; E518-I608 VanDerWaalsContact CG-CG1 3.42Å; E518-I608 HydrophobicContact CG-CG2 4.06Å; E518-I608 PolarHBondContact OE1-N 2.77Å; I608-D610 VanDerWaalsContact C-N 3.33Å; I608-D610 HydrophobicContact CD1-CB 4.23Å; I608-D610 HydrophobicContact CG1-CB 3.98Å; I608-D610 PolarHBondContact O-N 2.89Å
609	N	91.9	Very high	92.3	Very high	14 Å²	14	43 Å²	43	8%	0.075	22%	0.219	C	C	.	.	S	Bend	trans	-76.7	83.7	176	-163.9	54.3	0	0	0	110.6	D639 N643 D694 P698 L700	N609-D639 WeakPolarHBondContact CA-OD2 3.47Å; N609-D639 PolarHBondContact OD1-OD2 3.11Å; N609-D639 VanDerWaalsContact OD1-OD2 3.11Å; N609-N643 HydrophobicContact CB-CB 3.94Å; N609-N643 PolarHBondContact OD1-O 3.01Å; N609-D694 VanDerWaalsContact ND2-CG 3.26Å; N609-D694 PolarHBondContact ND2-OD1 3.46Å; N609-D694 VanDerWaalsContact ND2-OD1 3.13Å; N609-D694 PolarHBondContact ND2-OD2 3.34Å; N609-D694 PolarHBondContact OD1-OD2 3.4Å; N609-P698 PolarHBondContact ND2-O 2.84Å; N609-L700 PolarHBondContact ND2-N 2.87Å; N609-L700 VanDerWaalsContact O-CD1 3.3Å; N609-L700 WeakPolarHBondContact O-CD1 2.98Å
610	D	91.1	Very high	92.1	Very high	79 Å²	79	44 Å²	44	42%	0.422	23%	0.227	S	C	.	.			trans	-116.8	-9.9	177.3	76.9	-21.8	0	0	0	114.2	I608 D639 L700	I608-D610 VanDerWaalsContact C-N 3.33Å; I608-D610 HydrophobicContact CD1-CB 4.23Å; I608-D610 HydrophobicContact CG1-CB 3.98Å; I608-D610 PolarHBondContact O-N 2.89Å; D610-D639 PolarHBondContact N-OD2 3.06Å; D610-L700 VanDerWaalsContact C-CD1 3.45Å
611	N	91.4	Very high	91.6	Very high	51 Å²	51	48.5 Å²	48.5	27%	0.273	25%	0.247	S	C	.	.	S	Bend	trans	-98.1	138.1	171.6	-64.1	-79.3	0	0	0	110.6	E572 D637 A638 D639 L700	E572-N611 WeakPolarHBondContact CG-ND2 3.41Å; N611-D637 WeakPolarHBondContact CB-OD1 3.18Å; N611-A638 HydrophobicContact CB-CB 4.08Å; N611-D639 VanDerWaalsContact CB-OD1 3.31Å; N611-D639 WeakPolarHBondContact CB-OD1 3.22Å; N611-D639 PolarHBondContact N-OD2 2.88Å; N611-D639 PolarHBondContact ND2-OD1 3.25Å; N611-L700 WeakPolarHBondContact O-CD1 3.21Å
612	A	91.3	Very high	91.1	Very high	41 Å²	41	48.7 Å²	48.7	34%	0.339	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-99.8	140.6	178.5	0	0	0	0	0	110	E614 L700 N702	A612-E614 PolarHBondContact O-N 3.49Å; A612-L700 HydrophobicContact CB-CB 3.95Å; A612-N702 HydrophobicContact CB-CB 3.98Å
613	P	93.1	Very high	90.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-67.2	135	-171.1	23.9	-34.3	0	0	0	112.1	A635 D637 Y647 V692 D694 N702	P613-A635 HydrophobicContact CB-CB 4.14Å; P613-D637 VanDerWaalsContact CA-OD2 3.32Å; P613-D637 WeakPolarHBondContact CA-OD2 3.35Å; P613-D637 HydrophobicContact CB-CB 4.45Å; P613-D637 WeakPolarHBondContact CB-OD2 2.75Å; P613-D637 WeakPolarHBondContact CD-OD2 3.43Å; P613-Y647 HydrophobicContact CB-CD1 4Å; P613-Y647 HydrophobicContact CB-CE1 3.87Å; P613-Y647 HydrophobicContact CG-CD1 4.41Å; P613-V692 HydrophobicContact CB-CB 4.41Å; P613-V692 HydrophobicContact CB-CG1 3.83Å; P613-V692 HydrophobicContact CG-CB 4.15Å; P613-V692 HydrophobicContact CG-CG1 3.79Å; P613-D694 HydrophobicContact CG-CB 4.06Å; P613-N702 WeakPolarHBondContact O-CB 3.47Å
614	E	91.3	Very high	89.6	Confident	86 Å²	86	48.2 Å²	48.2	40%	0.402	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	131.2	176.2	-170.3	173.6	-144.4	0	0	111.5	A612 K618 A635 A636	A612-E614 PolarHBondContact O-N 3.49Å; E614-K618 WeakPolarHBondContact OE1-CE 3.34Å; E614-K618 IonicContact OE1-NZ 3.19Å; E614-K618 PolarHBondContact OE1-NZ 3.43Å; E614-K618 WeakPolarHBondContact OE2-CE 3.46Å; E614-K618 IonicContact OE2-NZ 3.52Å; E614-K618 PolarHBondContact OE2-NZ 3.43Å; E614-A635 CarbonylContact O-C 3.56Å; E614-A635 WeakPolarHBondContact O-CA 3.17Å; E614-A636 PolarHBondContact N-O 2.89Å; E614-A636 PolarHBondContact O-N 3.21Å
615	L	91.3	Very high	88.7	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.016	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	137.4	-179.2	-177	84.4	0	0	0	113.2	I633 F649 I690 V692 S704 I706	L615-I633 HydrophobicContact CD1-CB 4.03Å; L615-I633 HydrophobicContact CD1-CD1 4.24Å; L615-I633 HydrophobicContact CD1-CG2 4.46Å; L615-F649 HydrophobicContact CD1-CD1 4.11Å; L615-F649 HydrophobicContact CD1-CE1 3.96Å; L615-I690 HydrophobicContact CD1-CB 4.47Å; L615-I690 HydrophobicContact CD1-CD1 4.38Å; L615-I690 HydrophobicContact CD1-CG2 4.22Å; L615-I690 HydrophobicContact CD2-CB 4.17Å; L615-I690 HydrophobicContact CD2-CD1 3.98Å; L615-I690 HydrophobicContact CD2-CG1 4.36Å; L615-V692 HydrophobicContact CB-CG2 4.1Å; L615-V692 HydrophobicContact CD1-CG2 3.83Å; L615-S704 WeakPolarHBondContact CB-OG 3.35Å; L615-S704 WeakPolarHBondContact CD2-OG 3.41Å; L615-I706 HydrophobicContact CD2-CB 3.74Å; L615-I706 HydrophobicContact CD2-CG2 4.15Å
616	L	90.3	Very high	87.4	Confident	67 Å²	67	52.1 Å²	52.1	35%	0.351	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	139.9	171.6	-64.2	176.3	0	0	0	111	I633 T634 A636	L616-I633 WeakPolarHBondContact O-CA 3.2Å; L616-T634 HydrophobicContact CB-CG2 3.96Å; L616-T634 PolarHBondContact N-O 2.97Å; L616-T634 PolarHBondContact O-N 3Å; L616-A636 HydrophobicContact CD1-CB 3.55Å; L616-A636 HydrophobicContact CG-CB 4.3Å
617	P	90.5	Very high	86.1	Confident	52 Å²	52	56.4 Å²	56.4	34%	0.338	29%	0.292	S	S	.	.			cis	-78.4	155.8	-6	33.6	-35.4	0	0	0	112.5	E619 A620 I706	P617-E619 VanDerWaalsContact C-N 3.31Å; P617-A620 HydrophobicContact CG-CB 4.43Å; P617-I706 HydrophobicContact CG-CD1 4.43Å; P617-I706 WeakPolarHBondContact O-CD1 3.21Å; P617-I706 WeakPolarHBondContact O-CG1 3.45Å
618	K	88.4	Confident	84.6	Confident	105 Å²	105	59.3 Å²	59.3	46%	0.457	31%	0.307	S	S	.	.	S	Bend	trans	-74.8	-21.2	176.2	-64.9	-177	-178.8	179.9	0	113.3	E614 I706 K707	E614-K618 WeakPolarHBondContact OE1-CE 3.34Å; E614-K618 IonicContact OE1-NZ 3.19Å; E614-K618 PolarHBondContact OE1-NZ 3.43Å; E614-K618 WeakPolarHBondContact OE2-CE 3.46Å; E614-K618 IonicContact OE2-NZ 3.52Å; E614-K618 PolarHBondContact OE2-NZ 3.43Å; K618-I706 WeakPolarHBondContact O-CA 3.41Å; K618-K707 PolarHBondContact O-N 2.99Å
619	E	89.4	Confident	83.6	Confident	130 Å²	130	60.1 Å²	60.1	61%	0.607	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.3	176.7	-54.3	-166.2	157.1	0	0	109.6	P617 K707	P617-E619 VanDerWaalsContact C-N 3.31Å; E619-K707 WeakPolarHBondContact CA-O 3.21Å; E619-K707 HydrophobicContact CG-CB 4.23Å
620	A	88.3	Confident	83	Confident	19 Å²	19	61.1 Å²	61.1	16%	0.157	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	166.8	178.2	0	0	0	0	0	110.9	P617 I631 I706 K707 V708 K709	P617-A620 HydrophobicContact CG-CB 4.43Å; A620-I631 HydrophobicContact CB-CB 4.42Å; A620-I631 HydrophobicContact CB-CD1 3.82Å; A620-I631 HydrophobicContact CB-CG1 3.98Å; A620-I631 HydrophobicContact CB-CG2 3.54Å; A620-I706 HydrophobicContact CB-CD1 3.76Å; A620-I706 HydrophobicContact CB-CG1 4.32Å; A620-K707 PolarHBondContact N-O 3.08Å; A620-V708 CarbonylContact O-C 2.95Å; A620-V708 VanDerWaalsContact O-CA 3.32Å; A620-V708 WeakPolarHBondContact O-CA 3.24Å; A620-K709 PolarHBondContact O-N 2.77Å
621	Q	85.6	Confident	82.8	Confident	111 Å²	111	57.9 Å²	57.9	52%	0.519	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	143.1	177.1	63.4	-175.3	14.2	0	0	110.4	K709	Q621-K709 VanDerWaalsContact CA-O 3.26Å; Q621-K709 WeakPolarHBondContact CA-O 3.38Å; Q621-K709 HydrophobicContact CB-CB 4.27Å
622	I	85.3	Confident	82.7	Confident	4 Å²	4	60 Å²	60	2%	0.021	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	151.6	-179.8	-162.7	165.8	0	0	0	110.7	N629 I631 W662 L676 V708 K709 V710 C711	I622-N629 WeakPolarHBondContact CD1-O 3.46Å; I622-N629 WeakPolarHBondContact CG1-O 3.11Å; I622-I631 HydrophobicContact CB-CD1 4.01Å; I622-I631 HydrophobicContact CB-CG1 4.24Å; I622-I631 HydrophobicContact CD1-CD1 4.22Å; I622-I631 HydrophobicContact CD1-CG1 4.25Å; I622-I631 HydrophobicContact CG2-CD1 4.43Å; I622-W662 HydrophobicContact CD1-CZ3 4.41Å; I622-W662 HydrophobicContact CG2-CH2 3.92Å; I622-W662 HydrophobicContact CG2-CZ3 4.02Å; I622-L676 HydrophobicContact CD1-CG 4.19Å; I622-L676 HydrophobicContact CG2-CD1 4.43Å; I622-V708 HydrophobicContact CB-CG1 4.25Å; I622-V708 HydrophobicContact CG2-CG1 3.5Å; I622-K709 PolarHBondContact N-O 3.32Å; I622-V710 HydrophobicContact CG2-CG2 3.9Å; I622-V710 VanDerWaalsContact O-CA 3.31Å; I622-V710 WeakPolarHBondContact O-CA 3.31Å; I622-C711 PolarHBondContact O-N 3.45Å
623	C	81.3	Confident	82.7	Confident	2 Å²	2	58 Å²	58	1%	0.014	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	151.4	177.5	-57.8	0	0	0	0	112.2	K625 L676 C713 G717	C623-K625 PolarHBondContact O-N 2.81Å; C623-K625 VanDerWaalsContact O-N 3.09Å; C623-L676 WeakPolarHBondContact O-CD1 3.28Å; C623-C713 WeakPolarHBondContact CA-SG 3.44Å; C623-C713 HydrophobicContact CB-CB 3.74Å; C623-C713 WeakPolarHBondContact CB-SG 3.47Å; C623-C713 WeakPolarHBondContact SG-CB 3.29Å; C623-C713 CovalentContact SG-SG 2.02Å; C623-C713 PolarHBondContact SG-SG 2.83Å; C623-G717 PolarHBondContact SG-O 3.02Å
624	E	77.3	Confident	82.6	Confident	35 Å²	35	59.6 Å²	59.6	16%	0.164	31%	0.309	C	S	.	.	S	Bend	trans	-58.7	-17.2	172.2	53.5	168.2	-148	0	0	114.4	Y680 L681 V710 C711	E624-Y680 HydrophobicContact CB-CD2 4.33Å; E624-Y680 HydrophobicContact CB-CE2 4.02Å; E624-Y680 HydrophobicContact CG-CE2 4.25Å; E624-Y680 WeakPolarHBondContact O-CA 3.44Å; E624-Y680 VanDerWaalsContact OE2-CE2 3.27Å; E624-Y680 WeakPolarHBondContact OE2-CE2 3.19Å; E624-Y680 PolarHBondContact OE2-OH 3.05Å; E624-L681 WeakPolarHBondContact CB-O 3.39Å; E624-L681 PolarHBondContact O-N 3.4Å; E624-V710 HydrophobicContact CB-CG1 4.26Å; E624-C711 PolarHBondContact N-O 3.41Å; E624-C711 VanDerWaalsContact N-O 3.09Å
625	K	74.6	Confident	82.6	Confident	118 Å²	118	56 Å²	56	51%	0.513	29%	0.294	S	S	.	.	S	Bend	trans	-117.9	139.7	-179.6	-67.6	173.9	-170	168.4	0	111.7	C623 N627	C623-K625 PolarHBondContact O-N 2.81Å; C623-K625 VanDerWaalsContact O-N 3.09Å; K625-N627 PolarHBondContact O-N 3.1Å
626	P	67.3	Low	82.6	Confident	37 Å²	37	58 Å²	58	24%	0.24	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-18	-167.1	26.9	-35.8	0	0	0	116.4	L676 L679	P626-L676 HydrophobicContact CB-CB 4.39Å; P626-L679 WeakPolarHBondContact CD-O 3.37Å
627	N	64.1	Low	82.7	Confident	156 Å²	156	56.1 Å²	56.1	83%	0.834	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	4.7	-166.2	-70.5	-0.4	0	0	0	115.5	K625	K625-N627 PolarHBondContact O-N 3.1Å
628	L	60.8	Low	82.7	Confident	83 Å²	83	56.2 Å²	56.2	44%	0.435	31%	0.307	S	S	.	.	S	Bend	trans	-115.8	-32.4	-170.8	-75.2	156.9	0	0	0	114.1
629	N	71.1	Confident	82.8	Confident	70 Å²	70	51.6 Å²	51.6	37%	0.374	29%	0.287	S	S	.	.			trans	-155.8	146.2	-179.2	-92.1	-22.2	0	0	0	112.9	I622 G717	I622-N629 WeakPolarHBondContact CD1-O 3.46Å; I622-N629 WeakPolarHBondContact CG1-O 3.11Å; N629-G717 VanDerWaalsContact ND2-C 3.28Å; N629-G717 PolarHBondContact ND2-O 3.06Å
630	A	79.3	Confident	82.9	Confident	35 Å²	35	47.8 Å²	47.8	29%	0.289	27%	0.273	S	S	.	.			trans	-140.9	146.9	177.9	0	0	0	0	0	111	Q673	A630-Q673 HydrophobicContact CB-CG 3.56Å
631	I	86.3	Confident	82.8	Confident	11 Å²	11	52.9 Å²	52.9	6%	0.056	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	116.5	-168	-59	160.6	0	0	0	108.8	A620 I622 I633 Q673 L674 I706 V708	A620-I631 HydrophobicContact CB-CB 4.42Å; A620-I631 HydrophobicContact CB-CD1 3.82Å; A620-I631 HydrophobicContact CB-CG1 3.98Å; A620-I631 HydrophobicContact CB-CG2 3.54Å; I622-I631 HydrophobicContact CB-CD1 4.01Å; I622-I631 HydrophobicContact CB-CG1 4.24Å; I622-I631 HydrophobicContact CD1-CD1 4.22Å; I622-I631 HydrophobicContact CD1-CG1 4.25Å; I622-I631 HydrophobicContact CG2-CD1 4.43Å; I631-I633 HydrophobicContact CG2-CG2 3.9Å; I631-I633 PolarHBondContact O-N 3.4Å; I631-Q673 CarbonylContact O-C 3.55Å; I631-Q673 WeakPolarHBondContact O-CA 3.22Å; I631-L674 HydrophobicContact CB-CB 4.22Å; I631-L674 HydrophobicContact CD1-CD2 4.09Å; I631-L674 PolarHBondContact N-O 3.06Å; I631-L674 PolarHBondContact O-N 3.06Å; I631-I706 HydrophobicContact CG2-CD1 4.13Å; I631-V708 HydrophobicContact CD1-CB 4.49Å; I631-V708 HydrophobicContact CD1-CG1 3.66Å; I631-V708 HydrophobicContact CD1-CG2 3.98Å
632	N	89.8	Confident	82.9	Confident	95 Å²	95	52.1 Å²	52.1	51%	0.508	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	119.9	170.2	-65.9	-18.6	0	0	0	108.8
633	I	91	Very high	83.1	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143.6	176	57.6	171.6	0	0	0	109.4	L615 L616 I631 F649 I664 Y671 A672 L674 I690 I706	L615-I633 HydrophobicContact CD1-CB 4.03Å; L615-I633 HydrophobicContact CD1-CD1 4.24Å; L615-I633 HydrophobicContact CD1-CG2 4.46Å; L616-I633 WeakPolarHBondContact O-CA 3.2Å; I631-I633 HydrophobicContact CG2-CG2 3.9Å; I631-I633 PolarHBondContact O-N 3.4Å; I633-F649 HydrophobicContact CD1-CB 4.45Å; I633-F649 HydrophobicContact CD1-CD1 3.87Å; I633-F649 HydrophobicContact CD1-CE1 4.45Å; I633-F649 HydrophobicContact CD1-CG 4.27Å; I633-F649 HydrophobicContact CG1-CD1 4.37Å; I633-I664 HydrophobicContact CD1-CD1 4.29Å; I633-I664 HydrophobicContact CD1-CG2 4.49Å; I633-Y671 WeakPolarHBondContact O-CA 3.27Å; I633-A672 HydrophobicContact CD1-CB 4.13Å; I633-A672 HydrophobicContact CG1-CB 3.91Å; I633-A672 WeakPolarHBondContact CG1-O 3.4Å; I633-A672 PolarHBondContact N-O 2.81Å; I633-A672 PolarHBondContact O-N 3.33Å; I633-A672 VanDerWaalsContact O-O 3.1Å; I633-L674 HydrophobicContact CD1-CB 4.37Å; I633-L674 HydrophobicContact CG2-CB 4.34Å; I633-I690 HydrophobicContact CD1-CD1 3.86Å; I633-I706 HydrophobicContact CG2-CD1 4.04Å
634	T	92.1	Very high	83.4	Confident	32 Å²	32	54.5 Å²	54.5	20%	0.196	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	-178.9	174.1	-167.6	0	0	0	0	108.7	L616 D670 Y671	L616-T634 HydrophobicContact CB-CG2 3.96Å; L616-T634 PolarHBondContact N-O 2.97Å; L616-T634 PolarHBondContact O-N 3Å; T634-D670 PolarHBondContact OG1-O 2.82Å; T634-Y671 HydrophobicContact CG2-CE1 4.41Å
635	A	91.3	Very high	83.6	Confident	10 Å²	10	53.3 Å²	53.3	8%	0.083	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	147.8	175.9	0	0	0	0	0	110.6	P613 E614 Y647 F649 V692	P613-A635 HydrophobicContact CB-CB 4.14Å; E614-A635 CarbonylContact O-C 3.56Å; E614-A635 WeakPolarHBondContact O-CA 3.17Å; A635-Y647 HydrophobicContact CB-CD1 4.12Å; A635-Y647 HydrophobicContact CB-CD2 3.82Å; A635-Y647 HydrophobicContact CB-CE1 4.2Å; A635-Y647 HydrophobicContact CB-CE2 3.9Å; A635-Y647 HydrophobicContact CB-CG 3.94Å; A635-Y647 WeakPolarHBondContact O-CE2 3.3Å; A635-F649 HydrophobicContact CB-CE1 4.24Å; A635-F649 HydrophobicContact CB-CZ 4.23Å; A635-V692 HydrophobicContact CB-CG1 3.66Å
636	A	90.1	Very high	84.3	Confident	46 Å²	46	50.6 Å²	50.6	38%	0.38	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.8	168.5	0	0	0	0	0	108.6	E614 L616	E614-A636 PolarHBondContact N-O 2.89Å; E614-A636 PolarHBondContact O-N 3.21Å; L616-A636 HydrophobicContact CD1-CB 3.55Å; L616-A636 HydrophobicContact CG-CB 4.3Å
637	D	92.3	Very high	85.5	Confident	28 Å²	28	49.6 Å²	49.6	15%	0.15	30%	0.297	C	S	.	.			trans	-128	146.3	175	-150.5	-41.5	0	0	0	108.2	N611 P613 D639 I644 Y647	N611-D637 WeakPolarHBondContact CB-OD1 3.18Å; P613-D637 VanDerWaalsContact CA-OD2 3.32Å; P613-D637 WeakPolarHBondContact CA-OD2 3.35Å; P613-D637 HydrophobicContact CB-CB 4.45Å; P613-D637 WeakPolarHBondContact CB-OD2 2.75Å; P613-D637 WeakPolarHBondContact CD-OD2 3.43Å; D637-D639 PolarHBondContact OD1-N 2.93Å; D637-I644 HydrophobicContact CB-CB 4.42Å; D637-I644 HydrophobicContact CB-CG2 3.95Å; D637-Y647 HydrophobicContact CB-CE1 4.2Å
638	A	90.2	Very high	86.7	Confident	54 Å²	54	45.1 Å²	45.1	45%	0.446	28%	0.275	S	S	.	.	S	Bend	trans	-84.8	-18.9	-178.7	0	0	0	0	0	112.2	R571 E572 N611	R571-A638 PolarHBondContact NH2-O 2.86Å; R571-A638 VanDerWaalsContact NH2-O 3.09Å; E572-A638 HydrophobicContact CB-CB 4.4Å; E572-A638 HydrophobicContact CG-CB 3.77Å; E572-A638 WeakPolarHBondContact CG-O 3.49Å; N611-A638 HydrophobicContact CB-CB 4.08Å
639	D	92.4	Very high	88.2	Confident	8 Å²	8	42.2 Å²	42.2	4%	0.043	26%	0.259	C	S	.	.	S	Bend	trans	-69	176.3	178	-63.9	-12	0	0	0	111.6	N609 D610 N611 D637 N643 I644	N609-D639 WeakPolarHBondContact CA-OD2 3.47Å; N609-D639 PolarHBondContact OD1-OD2 3.11Å; N609-D639 VanDerWaalsContact OD1-OD2 3.11Å; D610-D639 PolarHBondContact N-OD2 3.06Å; N611-D639 VanDerWaalsContact CB-OD1 3.31Å; N611-D639 WeakPolarHBondContact CB-OD1 3.22Å; N611-D639 PolarHBondContact N-OD2 2.88Å; N611-D639 PolarHBondContact ND2-OD1 3.25Å; D637-D639 PolarHBondContact OD1-N 2.93Å; D639-N643 HydrophobicContact CB-CB 3.84Å; D639-I644 HydrophobicContact CB-CG2 4.04Å; D639-I644 WeakPolarHBondContact O-CG2 3.25Å
640	V	90.1	Very high	89.1	Confident	50 Å²	50	43.3 Å²	43.3	30%	0.303	26%	0.262	S	S	.	.			trans	-118.8	166.4	175.4	-68.9	0	0	0	0	112.5	D607 N643	D607-V640 HydrophobicContact CB-CG2 3.45Å; D607-V640 VanDerWaalsContact CB-CG2 3.45Å; D607-V640 VanDerWaalsContact OD2-CG2 3.3Å; D607-V640 WeakPolarHBondContact OD2-CG2 3.36Å; D607-V640 PolarHBondContact OD2-N 2.92Å; V640-N643 WeakPolarHBondContact O-CB 3.47Å; V640-N643 PolarHBondContact O-N 2.96Å
641	D	86.1	Confident	89.6	Confident	125 Å²	125	42.2 Å²	42.2	67%	0.668	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	127.1	175.2	-73.4	-51.1	0	0	0	110.5	I644	D641-I644 VanDerWaalsContact OD1-CD1 3.32Å; D641-I644 WeakPolarHBondContact OD1-CD1 3.3Å; D641-I644 WeakPolarHBondContact OD1-CG1 3.37Å
642	P	88.5	Confident	89.7	Confident	95 Å²	95	42.4 Å²	42.4	62%	0.617	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	cis	-99.7	7.2	14.8	39.5	-36.9	0	0	0	116.1	I644	P642-I644 VanDerWaalsContact C-N 3.25Å; P642-I644 PolarHBondContact O-N 2.9Å
643	N	89.4	Confident	89.5	Confident	19 Å²	19	45 Å²	45	10%	0.102	26%	0.26	C	S	.	.	S	Bend	trans	-76.5	-11.1	-174.5	-66.1	-34.4	0	0	0	113.4	D607 N609 D639 V640 D694	D607-N643 PolarHBondContact O-ND2 3.17Å; D607-N643 PolarHBondContact OD2-ND2 3.44Å; N609-N643 HydrophobicContact CB-CB 3.94Å; N609-N643 PolarHBondContact OD1-O 3.01Å; D639-N643 HydrophobicContact CB-CB 3.84Å; V640-N643 WeakPolarHBondContact O-CB 3.47Å; V640-N643 PolarHBondContact O-N 2.96Å; N643-D694 WeakPolarHBondContact O-CB 3.27Å
644	I	87.9	Confident	89	Confident	38 Å²	38	50.8 Å²	50.8	20%	0.195	30%	0.295	C	S	.	.	S	Bend	trans	-86.3	-127.4	177.5	61.4	157.6	0	0	0	113.5	D637 D639 D641 P642 S695	D637-I644 HydrophobicContact CB-CB 4.42Å; D637-I644 HydrophobicContact CB-CG2 3.95Å; D639-I644 HydrophobicContact CB-CG2 4.04Å; D639-I644 WeakPolarHBondContact O-CG2 3.25Å; D641-I644 VanDerWaalsContact OD1-CD1 3.32Å; D641-I644 WeakPolarHBondContact OD1-CD1 3.3Å; D641-I644 WeakPolarHBondContact OD1-CG1 3.37Å; P642-I644 VanDerWaalsContact C-N 3.25Å; P642-I644 PolarHBondContact O-N 2.9Å; I644-S695 PolarHBondContact O-N 2.74Å
645	G	81.6	Confident	88.7	Confident	10 Å²	10	52.8 Å²	52.8	10%	0.103	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-67.5	163.3	175.4	0	0	0	0	0	113.6
646	P	89.2	Confident	88.1	Confident	61 Å²	61	56 Å²	56	40%	0.396	34%	0.335	S	S	.	.	S	Bend	cis	-78.3	126.9	12.5	28.3	-35.6	0	0	0	114.4	G669 S695	P646-G669 CarbonylContact C-O 3.54Å; P646-S695 WeakPolarHBondContact CD-OG 3.23Å; P646-S695 WeakPolarHBondContact CG-OG 3.44Å; P646-S695 PolarHBondContact O-OG 2.87Å
647	Y	91.1	Very high	87.7	Confident	16 Å²	16	56.4 Å²	56.4	6%	0.063	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-74	151.5	-179.6	-54.2	-66.2	0	0	0	113.1	P613 A635 D637 F649 R666 G669 D670 V692 T693	P613-Y647 HydrophobicContact CB-CD1 4Å; P613-Y647 HydrophobicContact CB-CE1 3.87Å; P613-Y647 HydrophobicContact CG-CD1 4.41Å; A635-Y647 HydrophobicContact CB-CD1 4.12Å; A635-Y647 HydrophobicContact CB-CD2 3.82Å; A635-Y647 HydrophobicContact CB-CE1 4.2Å; A635-Y647 HydrophobicContact CB-CE2 3.9Å; A635-Y647 HydrophobicContact CB-CG 3.94Å; A635-Y647 WeakPolarHBondContact O-CE2 3.3Å; D637-Y647 HydrophobicContact CB-CE1 4.2Å; Y647-F649 HydrophobicContact CD2-CZ 4.39Å; Y647-F649 HydrophobicContact CG-CZ 4.45Å; Y647-R666 PolarHBondContact O-NH2 3.39Å; Y647-G669 PolarHBondContact N-O 2.95Å; Y647-D670 HydrophobicContact CD2-CB 4.31Å; Y647-D670 HydrophobicContact CE2-CB 4.5Å; Y647-V692 HydrophobicContact CD1-CG1 4.35Å; Y647-V692 HydrophobicContact CG-CG1 4.39Å; Y647-T693 CarbonylContact C-O 3.56Å; Y647-T693 WeakPolarHBondContact CA-O 3.32Å
648	V	91	Very high	87.3	Confident	61 Å²	61	55.6 Å²	55.6	37%	0.37	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	116.1	171.4	-176.1	0	0	0	0	109.3	E650 V692 T693	V648-E650 HydrophobicContact CG1-CG 4.08Å; V648-V692 WeakPolarHBondContact O-CA 3.31Å; V648-T693 PolarHBondContact N-O 3.23Å; V648-T693 PolarHBondContact O-N 2.87Å
649	F	91.1	Very high	87	Confident	22 Å²	22	57 Å²	57	10%	0.096	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119.1	179.6	-59.7	-90.3	0	0	0	110.7	L615 I633 A635 Y647 I664 A672 I690 V692	L615-F649 HydrophobicContact CD1-CD1 4.11Å; L615-F649 HydrophobicContact CD1-CE1 3.96Å; I633-F649 HydrophobicContact CD1-CB 4.45Å; I633-F649 HydrophobicContact CD1-CD1 3.87Å; I633-F649 HydrophobicContact CD1-CE1 4.45Å; I633-F649 HydrophobicContact CD1-CG 4.27Å; I633-F649 HydrophobicContact CG1-CD1 4.37Å; A635-F649 HydrophobicContact CB-CE1 4.24Å; A635-F649 HydrophobicContact CB-CZ 4.23Å; Y647-F649 HydrophobicContact CD2-CZ 4.39Å; Y647-F649 HydrophobicContact CG-CZ 4.45Å; F649-I664 HydrophobicContact CB-CD1 4.34Å; F649-I664 HydrophobicContact CB-CG2 4.02Å; F649-A672 HydrophobicContact CB-CB 4.08Å; F649-A672 HydrophobicContact CD2-CB 3.51Å; F649-A672 HydrophobicContact CE2-CB 4.07Å; F649-A672 HydrophobicContact CG-CB 3.82Å; F649-I690 HydrophobicContact CD1-CG2 4.41Å; F649-V692 HydrophobicContact CD1-CG1 4.23Å; F649-V692 HydrophobicContact CD1-CG2 3.84Å; F649-V692 HydrophobicContact CE1-CG1 3.95Å; F649-V692 HydrophobicContact CE1-CG2 3.94Å; F649-V692 HydrophobicContact CZ-CG1 4.47Å
650	E	90.8	Very high	86.6	Confident	94 Å²	94	63.5 Å²	63.5	44%	0.439	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	143.6	178.1	-59.8	-162.3	156.1	0	0	112.4	V648 I691	V648-E650 HydrophobicContact CG1-CG 4.08Å; E650-I691 HydrophobicContact CB-CB 4.47Å; E650-I691 PolarHBondContact N-O 3.44Å; E650-I691 PolarHBondContact O-N 3.13Å
651	L	90.4	Very high	86.4	Confident	12 Å²	12	62.7 Å²	62.7	6%	0.063	35%	0.35	C	S	.	.			trans	-82	137.8	167.9	-66.5	172.6	0	0	0	109.1	V658 R659 W662 I664 L674 V688 I690	L651-V658 HydrophobicContact CB-CG1 4.29Å; L651-V658 HydrophobicContact CD1-CG1 4.45Å; L651-V658 HydrophobicContact CD2-CG1 3.81Å; L651-V658 HydrophobicContact CG-CG1 4.4Å; L651-R659 HydrophobicContact CB-CG 3.67Å; L651-R659 HydrophobicContact CD1-CG 4.21Å; L651-R659 PolarHBondContact O-NE 3.05Å; L651-R659 PolarHBondContact O-NH2 3.2Å; L651-W662 HydrophobicContact CD1-CB 4Å; L651-W662 WeakPolarHBondContact CD1-O 3.42Å; L651-I664 HydrophobicContact CD1-CG1 4.26Å; L651-I664 HydrophobicContact CD2-CD1 3.67Å; L651-I664 HydrophobicContact CD2-CG1 4.07Å; L651-I664 HydrophobicContact CG-CD1 3.67Å; L651-I664 HydrophobicContact CG-CG1 3.9Å; L651-L674 HydrophobicContact CD2-CD1 4.33Å; L651-V688 HydrophobicContact CD2-CG1 4.09Å; L651-I690 HydrophobicContact CD2-CG1 4.17Å
652	P	88.4	Confident	86.5	Confident	14 Å²	14	57.1 Å²	57.1	9%	0.091	32%	0.32	C	S	.	.			trans	-64.7	154.4	177.8	27.8	-34.3	0	0	0	111.5	V654 P689 I691	P652-V654 VanDerWaalsContact C-N 3.27Å; P652-V654 PolarHBondContact O-N 2.79Å; P652-P689 WeakPolarHBondContact CD-O 3.45Å; P652-P689 HydrophobicContact CG-CB 3.85Å; P652-P689 HydrophobicContact CG-CG 3.52Å; P652-I691 HydrophobicContact CB-CD1 4.12Å; P652-I691 HydrophobicContact CB-CG1 4.46Å
653	F	83.6	Confident	86.5	Confident	149 Å²	149	54.9 Å²	54.9	65%	0.654	31%	0.305	S	S	*	.	S	Bend	trans	-72.6	-22.2	176.3	-72.6	-86.3	0	0	0	112.9
654	V	81.3	Confident	86.6	Confident	122 Å²	122	55.6 Å²	55.6	74%	0.739	31%	0.308	S	S	*	.	S	Bend	trans	-129.2	127.1	-177.7	-176.4	0	0	0	0	108.7	P652	P652-V654 VanDerWaalsContact C-N 3.27Å; P652-V654 PolarHBondContact O-N 2.79Å
655	P	85.3	Confident	86.6	Confident	74 Å²	74	56.6 Å²	56.6	48%	0.481	32%	0.316	S	S	.	.	S	Bend	cis	-79.8	144	0.3	28.9	-28.7	0	0	0	113.1	A657 V658	P655-A657 PolarHBondContact O-N 3.27Å; P655-V658 HydrophobicContact CG-CG2 3.96Å; P655-V658 PolarHBondContact O-N 3.16Å
656	A	80.1	Confident	86.8	Confident	77 Å²	77	63.2 Å²	63.2	64%	0.636	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.1	-177.4	0	0	0	0	0	114.5	V658 K660	A656-V658 PolarHBondContact O-N 3.23Å; A656-K660 PolarHBondContact O-N 3.13Å
657	A	80.8	Confident	86.7	Confident	55 Å²	55	64.7 Å²	64.7	46%	0.455	34%	0.342	S	S	.	.	H	α-helix	trans	-60.4	-29.8	174.3	0	0	0	0	0	112.8	P655 K660 N661	P655-A657 PolarHBondContact O-N 3.27Å; A657-K660 PolarHBondContact O-N 2.85Å; A657-N661 WeakPolarHBondContact O-CB 3.48Å; A657-N661 VanDerWaalsContact O-CG 3.28Å; A657-N661 PolarHBondContact O-N 3.41Å
658	V	84.6	Confident	86.4	Confident	11 Å²	11	67.6 Å²	67.6	7%	0.067	36%	0.359	C	S	.	.	H	α-helix	trans	-68	-54.9	-176.7	177.4	0	0	0	0	111	L651 P655 A656 K660 N661 W662 V688 P689	L651-V658 HydrophobicContact CB-CG1 4.29Å; L651-V658 HydrophobicContact CD1-CG1 4.45Å; L651-V658 HydrophobicContact CD2-CG1 3.81Å; L651-V658 HydrophobicContact CG-CG1 4.4Å; P655-V658 HydrophobicContact CG-CG2 3.96Å; P655-V658 PolarHBondContact O-N 3.16Å; A656-V658 PolarHBondContact O-N 3.23Å; V658-K660 PolarHBondContact O-N 2.81Å; V658-N661 PolarHBondContact O-N 2.95Å; V658-W662 WeakPolarHBondContact O-CB 3.47Å; V658-W662 PolarHBondContact O-N 3.22Å; V658-V688 HydrophobicContact CG1-CG1 4.16Å; V658-P689 HydrophobicContact CG2-CG 4.07Å
659	R	84.3	Confident	85.9	Confident	83 Å²	83	65.7 Å²	65.7	31%	0.313	35%	0.352	S	S	.	.	H	α-helix	trans	-68.9	-13.2	176.5	-72.1	-173.3	178.2	-154.5	1.9	114.3	L651 R677	L651-R659 HydrophobicContact CB-CG 3.67Å; L651-R659 HydrophobicContact CD1-CG 4.21Å; L651-R659 PolarHBondContact O-NE 3.05Å; L651-R659 PolarHBondContact O-NH2 3.2Å; R659-R677 PolarHBondContact O-NH1 2.76Å
660	K	83.4	Confident	85.6	Confident	145 Å²	145	67.8 Å²	67.8	63%	0.63	36%	0.364	S	S	*	.	H	α-helix	trans	-79.4	-43.8	172.4	-170.6	-179.2	178.5	-174.7	0	111	A656 A657 V658 I678	A656-K660 PolarHBondContact O-N 3.13Å; A657-K660 PolarHBondContact O-N 2.85Å; V658-K660 PolarHBondContact O-N 2.81Å; K660-I678 WeakPolarHBondContact O-CG2 3.29Å
661	N	86.2	Confident	85.6	Confident	34 Å²	34	68.7 Å²	68.7	18%	0.182	36%	0.364	C	S	.	.	H	α-helix	trans	-88.4	-33.2	-174.5	-65.5	-2	0	0	0	112.7	A657 V658 R677 I678	A657-N661 WeakPolarHBondContact O-CB 3.48Å; A657-N661 VanDerWaalsContact O-CG 3.28Å; A657-N661 PolarHBondContact O-N 3.41Å; V658-N661 PolarHBondContact O-N 2.95Å; N661-R677 PolarHBondContact O-N 2.91Å; N661-I678 HydrophobicContact CB-CD1 4.24Å
662	W	88.1	Confident	85.6	Confident	7 Å²	7	68.2 Å²	68.2	3%	0.027	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	150.4	-170.7	-54.6	95.1	0	0	0	111.6	I622 L651 V658 L674 S675 L676 L681 Y686 V688 V708 V710	I622-W662 HydrophobicContact CD1-CZ3 4.41Å; I622-W662 HydrophobicContact CG2-CH2 3.92Å; I622-W662 HydrophobicContact CG2-CZ3 4.02Å; L651-W662 HydrophobicContact CD1-CB 4Å; L651-W662 WeakPolarHBondContact CD1-O 3.42Å; V658-W662 WeakPolarHBondContact O-CB 3.47Å; V658-W662 PolarHBondContact O-N 3.22Å; W662-L674 HydrophobicContact CB-CD1 4.04Å; W662-L674 HydrophobicContact CE3-CD1 4.22Å; W662-L674 HydrophobicContact CE3-CD2 4.19Å; W662-L674 HydrophobicContact CE3-CG 4.02Å; W662-L674 HydrophobicContact CZ3-CD2 4.49Å; W662-S675 WeakPolarHBondContact CA-O 3.43Å; W662-L676 HydrophobicContact CD2-CD2 4.09Å; W662-L676 HydrophobicContact CE3-CD2 3.75Å; W662-L676 HydrophobicContact CE3-CG 4.46Å; W662-L676 HydrophobicContact CH2-CD2 3.63Å; W662-L676 HydrophobicContact CH2-CG 4.48Å; W662-L676 HydrophobicContact CZ2-CD2 3.98Å; W662-L676 HydrophobicContact CZ3-CD2 3.52Å; W662-L676 HydrophobicContact CZ3-CG 4.1Å; W662-L681 HydrophobicContact CH2-CD2 4.17Å; W662-L681 HydrophobicContact CZ2-CD2 3.68Å; W662-Y686 HydrophobicContact CZ2-CG 4.27Å; W662-V688 HydrophobicContact CD2-CG1 4.42Å; W662-V688 HydrophobicContact CD2-CG2 3.92Å; W662-V688 VanDerWaalsContact CE2-CG2 3.44Å; W662-V688 HydrophobicContact CG-CG1 4.16Å; W662-V688 HydrophobicContact CG-CG2 4.31Å; W662-V688 HydrophobicContact CH2-CG2 4.36Å; W662-V688 HydrophobicContact CZ2-CG2 3.7Å; W662-V708 HydrophobicContact CH2-CB 3.86Å; W662-V708 HydrophobicContact CH2-CG1 3.48Å; W662-V708 VanDerWaalsContact CH2-CG1 3.48Å; W662-V708 HydrophobicContact CH2-CG2 4.25Å; W662-V708 HydrophobicContact CZ2-CB 4.35Å; W662-V708 HydrophobicContact CZ2-CG1 4.39Å; W662-V708 HydrophobicContact CZ3-CG1 3.99Å; W662-V708 HydrophobicContact CZ3-CG2 4.5Å; W662-V710 HydrophobicContact CH2-CG2 4.16Å
663	T	88.4	Confident	85.7	Confident	48 Å²	48	70.2 Å²	70.2	29%	0.294	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	145.2	170.3	-170.5	0	0	0	0	109.7	S675 R677	T663-S675 VanDerWaalsContact CG2-OG 3.22Å; T663-S675 WeakPolarHBondContact CG2-OG 3.36Å; T663-S675 PolarHBondContact N-O 2.82Å; T663-S675 PolarHBondContact O-N 2.63Å; T663-R677 HydrophobicContact CG2-CB 4.26Å
664	I	90.5	Very high	86	Confident	34 Å²	34	63.1 Å²	63.1	17%	0.174	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	127.4	175.1	-64.3	179.1	0	0	0	107.7	I633 F649 L651 A672 Q673 L674 I690	I633-I664 HydrophobicContact CD1-CD1 4.29Å; I633-I664 HydrophobicContact CD1-CG2 4.49Å; F649-I664 HydrophobicContact CB-CD1 4.34Å; F649-I664 HydrophobicContact CB-CG2 4.02Å; L651-I664 HydrophobicContact CD1-CG1 4.26Å; L651-I664 HydrophobicContact CD2-CD1 3.67Å; L651-I664 HydrophobicContact CD2-CG1 4.07Å; L651-I664 HydrophobicContact CG-CD1 3.67Å; L651-I664 HydrophobicContact CG-CG1 3.9Å; I664-A672 HydrophobicContact CG2-CB 3.72Å; I664-Q673 CarbonylContact C-O 3.54Å; I664-Q673 WeakPolarHBondContact CA-O 3.09Å; I664-L674 HydrophobicContact CD1-CD1 4.4Å; I664-L674 HydrophobicContact CG1-CD1 3.72Å; I664-I690 HydrophobicContact CD1-CD1 4.26Å; I664-I690 HydrophobicContact CD1-CG1 4.42Å; I664-I690 HydrophobicContact CD1-CG2 3.93Å
665	T	88.1	Confident	86.3	Confident	60 Å²	60	58.4 Å²	58.4	37%	0.368	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	121.3	173.3	48.2	0	0	0	0	109.1	L667 A672 Q673	T665-L667 PolarHBondContact O-N 2.78Å; T665-A672 CarbonylContact O-C 3.59Å; T665-Q673 PolarHBondContact N-O 2.91Å; T665-Q673 PolarHBondContact O-N 3.13Å; T665-Q673 PolarHBondContact OG1-O 3.31Å
666	R	87.2	Confident	86.3	Confident	149 Å²	149	55.3 Å²	55.3	56%	0.562	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	126.9	178.1	-170.2	178.4	-165.8	170.1	14.6	109.8	Y647 N668	Y647-R666 PolarHBondContact O-NH2 3.39Å; R666-N668 WeakPolarHBondContact CG-O 3.48Å; R666-N668 PolarHBondContact NE-O 3.33Å
667	L	85.5	Confident	86.5	Confident	92 Å²	92	59.9 Å²	59.9	48%	0.482	29%	0.291	S	S	.	.			trans	-89.7	-52.1	173.9	-63.7	175.3	0	0	0	109.8	T665 Y671 Q673	T665-L667 PolarHBondContact O-N 2.78Å; L667-Y671 WeakPolarHBondContact CB-O 3.49Å; L667-Y671 PolarHBondContact N-O 2.79Å; L667-Q673 HydrophobicContact CD1-CB 4.11Å; L667-Q673 HydrophobicContact CD2-CB 4.23Å; L667-Q673 HydrophobicContact CG-CB 4.07Å
668	N	85.2	Confident	86.6	Confident	76 Å²	76	59.3 Å²	59.3	41%	0.406	28%	0.28	S	S	.	.	S	Bend	trans	-150	-159.6	177.4	63.3	4.2	0	0	0	110.3	R666 D670 Y671	R666-N668 WeakPolarHBondContact CG-O 3.48Å; R666-N668 PolarHBondContact NE-O 3.33Å; N668-D670 PolarHBondContact OD1-N 3.02Å; N668-Y671 PolarHBondContact N-O 2.96Å; N668-Y671 WeakPolarHBondContact OD1-CA 3.43Å; N668-Y671 VanDerWaalsContact OD1-CB 3.24Å; N668-Y671 WeakPolarHBondContact OD1-CB 3.23Å; N668-Y671 WeakPolarHBondContact OD1-CD2 3.26Å; N668-Y671 PolarHBondContact OD1-N 3.1Å; N668-Y671 PolarHBondContact OD1-O 3.1Å
669	G	80.8	Confident	86.2	Confident	22 Å²	22	66 Å²	66	23%	0.227	32%	0.315	C	S	.	.	S	Bend	trans	-57.2	-46.6	176.2	0	0	0	0	0	113.2	P646 Y647	P646-G669 CarbonylContact C-O 3.54Å; Y647-G669 PolarHBondContact N-O 2.95Å
670	D	85.8	Confident	86	Confident	66 Å²	66	68 Å²	68	35%	0.353	32%	0.323	S	S	.	.	S	Bend	trans	-107.6	-13	-164.3	-47	-41.4	0	0	0	114.3	T634 Y647 N668	T634-D670 PolarHBondContact OG1-O 2.82Å; Y647-D670 HydrophobicContact CD2-CB 4.31Å; Y647-D670 HydrophobicContact CE2-CB 4.5Å; N668-D670 PolarHBondContact OD1-N 3.02Å
671	Y	89.9	Confident	86	Confident	113 Å²	113	61.7 Å²	61.7	44%	0.443	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	137.4	-177.8	-60.6	-97.8	0	0	0	111	I633 T634 L667 N668	I633-Y671 WeakPolarHBondContact O-CA 3.27Å; T634-Y671 HydrophobicContact CG2-CE1 4.41Å; L667-Y671 WeakPolarHBondContact CB-O 3.49Å; L667-Y671 PolarHBondContact N-O 2.79Å; N668-Y671 PolarHBondContact N-O 2.96Å; N668-Y671 WeakPolarHBondContact OD1-CA 3.43Å; N668-Y671 VanDerWaalsContact OD1-CB 3.24Å; N668-Y671 WeakPolarHBondContact OD1-CB 3.23Å; N668-Y671 WeakPolarHBondContact OD1-CD2 3.26Å; N668-Y671 PolarHBondContact OD1-N 3.1Å; N668-Y671 PolarHBondContact OD1-O 3.1Å
672	A	90.9	Very high	85.7	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.008	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	165	167.5	0	0	0	0	0	109.9	I633 F649 I664 T665	I633-A672 HydrophobicContact CD1-CB 4.13Å; I633-A672 HydrophobicContact CG1-CB 3.91Å; I633-A672 WeakPolarHBondContact CG1-O 3.4Å; I633-A672 PolarHBondContact N-O 2.81Å; I633-A672 PolarHBondContact O-N 3.33Å; I633-A672 VanDerWaalsContact O-O 3.1Å; F649-A672 HydrophobicContact CB-CB 4.08Å; F649-A672 HydrophobicContact CD2-CB 3.51Å; F649-A672 HydrophobicContact CE2-CB 4.07Å; F649-A672 HydrophobicContact CG-CB 3.82Å; I664-A672 HydrophobicContact CG2-CB 3.72Å; T665-A672 CarbonylContact O-C 3.59Å
673	Q	90.4	Very high	85.3	Confident	57 Å²	57	69.1 Å²	69.1	27%	0.266	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.6	-178.9	-177.4	173.5	42	0	0	109.1	A630 I631 I664 T665 L667	A630-Q673 HydrophobicContact CB-CG 3.56Å; I631-Q673 CarbonylContact O-C 3.55Å; I631-Q673 WeakPolarHBondContact O-CA 3.22Å; I664-Q673 CarbonylContact C-O 3.54Å; I664-Q673 WeakPolarHBondContact CA-O 3.09Å; T665-Q673 PolarHBondContact N-O 2.91Å; T665-Q673 PolarHBondContact O-N 3.13Å; T665-Q673 PolarHBondContact OG1-O 3.31Å; L667-Q673 HydrophobicContact CD1-CB 4.11Å; L667-Q673 HydrophobicContact CD2-CB 4.23Å; L667-Q673 HydrophobicContact CG-CB 4.07Å
674	L	89.8	Confident	85	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	122.1	174.5	178.7	74.4	0	0	0	108.8	I631 I633 L651 W662 I664 V688 I690 I706 V708	I631-L674 HydrophobicContact CB-CB 4.22Å; I631-L674 HydrophobicContact CD1-CD2 4.09Å; I631-L674 PolarHBondContact N-O 3.06Å; I631-L674 PolarHBondContact O-N 3.06Å; I633-L674 HydrophobicContact CD1-CB 4.37Å; I633-L674 HydrophobicContact CG2-CB 4.34Å; L651-L674 HydrophobicContact CD2-CD1 4.33Å; W662-L674 HydrophobicContact CB-CD1 4.04Å; W662-L674 HydrophobicContact CE3-CD1 4.22Å; W662-L674 HydrophobicContact CE3-CD2 4.19Å; W662-L674 HydrophobicContact CE3-CG 4.02Å; W662-L674 HydrophobicContact CZ3-CD2 4.49Å; I664-L674 HydrophobicContact CD1-CD1 4.4Å; I664-L674 HydrophobicContact CG1-CD1 3.72Å; L674-V688 HydrophobicContact CD1-CG1 4.45Å; L674-V688 HydrophobicContact CD2-CG1 4.34Å; L674-I690 HydrophobicContact CD1-CD1 4.37Å; L674-I690 HydrophobicContact CD2-CD1 4.13Å; L674-I706 HydrophobicContact CD2-CG2 4.07Å; L674-V708 HydrophobicContact CD2-CG2 4.25Å
675	S	87.8	Confident	84.8	Confident	23 Å²	23	72.2 Å²	72.2	16%	0.161	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	160.8	-179.7	54.9	0	0	0	0	111.7	W662 T663	W662-S675 WeakPolarHBondContact CA-O 3.43Å; T663-S675 VanDerWaalsContact CG2-OG 3.22Å; T663-S675 WeakPolarHBondContact CG2-OG 3.36Å; T663-S675 PolarHBondContact N-O 2.82Å; T663-S675 PolarHBondContact O-N 2.63Å
676	L	85.1	Confident	84.8	Confident	8 Å²	8	72.1 Å²	72.1	4%	0.042	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	127.3	173.6	-70.2	173	0	0	0	110	I622 C623 P626 W662 L681	I622-L676 HydrophobicContact CD1-CG 4.19Å; I622-L676 HydrophobicContact CG2-CD1 4.43Å; C623-L676 WeakPolarHBondContact O-CD1 3.28Å; P626-L676 HydrophobicContact CB-CB 4.39Å; W662-L676 HydrophobicContact CD2-CD2 4.09Å; W662-L676 HydrophobicContact CE3-CD2 3.75Å; W662-L676 HydrophobicContact CE3-CG 4.46Å; W662-L676 HydrophobicContact CH2-CD2 3.63Å; W662-L676 HydrophobicContact CH2-CG 4.48Å; W662-L676 HydrophobicContact CZ2-CD2 3.98Å; W662-L676 HydrophobicContact CZ3-CD2 3.52Å; W662-L676 HydrophobicContact CZ3-CG 4.1Å; L676-L681 HydrophobicContact CD1-CB 4.22Å; L676-L681 HydrophobicContact CD2-CB 4.16Å; L676-L681 HydrophobicContact CD2-CD2 3.53Å; L676-L681 HydrophobicContact CD2-CG 4.48Å
677	R	83.8	Confident	84.9	Confident	174 Å²	174	70 Å²	70	66%	0.657	35%	0.353	S	S	*	.			trans	-82.4	-25.4	174.1	-172.3	177.8	179.6	-178.9	3.4	112.2	R659 N661 T663	R659-R677 PolarHBondContact O-NH1 2.76Å; N661-R677 PolarHBondContact O-N 2.91Å; T663-R677 HydrophobicContact CG2-CB 4.26Å
678	I	82.8	Confident	85.1	Confident	43 Å²	43	65.6 Å²	65.6	22%	0.221	33%	0.33	C	S	.	.	S	Bend	trans	-93.8	155.8	-178.3	59.4	176.9	0	0	0	111.6	K660 N661 Y680 L681	K660-I678 WeakPolarHBondContact O-CG2 3.29Å; N661-I678 HydrophobicContact CB-CD1 4.24Å; I678-Y680 VanDerWaalsContact C-N 3.29Å; I678-Y680 VanDerWaalsContact CD1-O 3.23Å; I678-Y680 WeakPolarHBondContact CD1-O 3.39Å; I678-Y680 PolarHBondContact O-N 3.39Å; I678-L681 HydrophobicContact CD1-CB 4.07Å; I678-L681 HydrophobicContact CD1-CD1 3.88Å; I678-L681 HydrophobicContact CD1-CG 4.49Å
679	L	76.4	Confident	85.3	Confident	152 Å²	152	63 Å²	63	80%	0.796	32%	0.318	S	S	*	.	S	Bend	trans	-70.2	-23.5	-176.4	-69.8	167.7	0	0	0	113.9	P626	P626-L679 WeakPolarHBondContact CD-O 3.37Å
680	Y	80.4	Confident	85.8	Confident	124 Å²	124	62 Å²	62	49%	0.486	31%	0.307	S	S	.	.			trans	-153.9	131.9	-177.5	-176.2	-100.1	0	0	0	110.4	E624 I678 E682	E624-Y680 HydrophobicContact CB-CD2 4.33Å; E624-Y680 HydrophobicContact CB-CE2 4.02Å; E624-Y680 HydrophobicContact CG-CE2 4.25Å; E624-Y680 WeakPolarHBondContact O-CA 3.44Å; E624-Y680 VanDerWaalsContact OE2-CE2 3.27Å; E624-Y680 WeakPolarHBondContact OE2-CE2 3.19Å; E624-Y680 PolarHBondContact OE2-OH 3.05Å; I678-Y680 VanDerWaalsContact C-N 3.29Å; I678-Y680 VanDerWaalsContact CD1-O 3.23Å; I678-Y680 WeakPolarHBondContact CD1-O 3.39Å; I678-Y680 PolarHBondContact O-N 3.39Å; Y680-E682 HydrophobicContact CE1-CG 4.02Å
681	L	82.4	Confident	86.1	Confident	12 Å²	12	60.6 Å²	60.6	6%	0.063	30%	0.299	C	S	.	.			trans	-127.6	133.8	169.1	-172.5	63.2	0	0	0	108.7	E624 W662 L676 I678 Y686 V710	E624-L681 WeakPolarHBondContact CB-O 3.39Å; E624-L681 PolarHBondContact O-N 3.4Å; W662-L681 HydrophobicContact CH2-CD2 4.17Å; W662-L681 HydrophobicContact CZ2-CD2 3.68Å; L676-L681 HydrophobicContact CD1-CB 4.22Å; L676-L681 HydrophobicContact CD2-CB 4.16Å; L676-L681 HydrophobicContact CD2-CD2 3.53Å; L676-L681 HydrophobicContact CD2-CG 4.48Å; I678-L681 HydrophobicContact CD1-CB 4.07Å; I678-L681 HydrophobicContact CD1-CD1 3.88Å; I678-L681 HydrophobicContact CD1-CG 4.49Å; L681-Y686 HydrophobicContact CD1-CE1 3.87Å; L681-Y686 HydrophobicContact CD1-CE2 4.37Å; L681-Y686 WeakPolarHBondContact CD1-OH 3.42Å; L681-Y686 HydrophobicContact CD2-CD1 4.39Å; L681-Y686 HydrophobicContact CD2-CD2 4.05Å; L681-Y686 HydrophobicContact CD2-CE1 4.18Å; L681-Y686 HydrophobicContact CD2-CE2 3.81Å; L681-Y686 HydrophobicContact CD2-CG 4.32Å; L681-Y686 HydrophobicContact CG-CE1 4.23Å; L681-Y686 HydrophobicContact CG-CE2 3.85Å; L681-V710 HydrophobicContact CB-CG1 4.42Å; L681-V710 HydrophobicContact CD2-CG2 3.84Å; L681-V710 HydrophobicContact CG-CG2 4.45Å
682	E	80.3	Confident	86.2	Confident	138 Å²	138	55.2 Å²	55.2	65%	0.645	28%	0.278	S	S	*	.			trans	-61	147.6	-178.1	-72.1	179.9	176.4	0	0	111.9	Y680 G684 Y686	Y680-E682 HydrophobicContact CE1-CG 4.02Å; E682-G684 PolarHBondContact O-N 3.31Å; E682-Y686 VanDerWaalsContact O-CE2 3.32Å; E682-Y686 WeakPolarHBondContact O-CE2 3.43Å; E682-Y686 PolarHBondContact O-OH 3.37Å; E682-Y686 VanDerWaalsContact O-OH 3.13Å
683	A	79.8	Confident	86.2	Confident	60 Å²	60	56.7 Å²	56.7	50%	0.496	29%	0.287	S	S	.	.	S	Bend	trans	-65.1	124.7	176.3	0	0	0	0	0	110.9	V710	A683-V710 CarbonylContact C-O 3.59Å; A683-V710 VanDerWaalsContact CA-O 3.26Å; A683-V710 WeakPolarHBondContact CA-O 3.47Å
684	G	82.8	Confident	86.4	Confident	30 Å²	30	54.2 Å²	54.2	31%	0.309	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	173.8	175.8	-172.6	0	0	0	0	0	112.6	E682 V710	E682-G684 PolarHBondContact O-N 3.31Å; G684-V710 PolarHBondContact N-O 3.27Å; G684-V710 PolarHBondContact O-N 3.01Å
685	M	85.4	Confident	86.3	Confident	116 Å²	116	56.8 Å²	56.8	57%	0.571	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	125.7	173.6	-64	-67.8	-67.3	0	0	109.1	K707 K709	M685-K707 HydrophobicContact CE-CB 4.25Å; M685-K709 HydrophobicContact CE-CB 4.47Å; M685-K709 HydrophobicContact SD-CB 3.55Å; M685-K709 VanDerWaalsContact SD-CB 3.55Å; M685-K709 HydrophobicContact SD-CD 4.16Å; M685-K709 HydrophobicContact SD-CG 3.66Å
686	Y	87.4	Confident	86.3	Confident	58 Å²	58	56 Å²	56	23%	0.227	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.2	178.7	-67.3	-91.3	0	0	0	110.4	W662 L681 E682 V708 V710	W662-Y686 HydrophobicContact CZ2-CG 4.27Å; L681-Y686 HydrophobicContact CD1-CE1 3.87Å; L681-Y686 HydrophobicContact CD1-CE2 4.37Å; L681-Y686 WeakPolarHBondContact CD1-OH 3.42Å; L681-Y686 HydrophobicContact CD2-CD1 4.39Å; L681-Y686 HydrophobicContact CD2-CD2 4.05Å; L681-Y686 HydrophobicContact CD2-CE1 4.18Å; L681-Y686 HydrophobicContact CD2-CE2 3.81Å; L681-Y686 HydrophobicContact CD2-CG 4.32Å; L681-Y686 HydrophobicContact CG-CE1 4.23Å; L681-Y686 HydrophobicContact CG-CE2 3.85Å; E682-Y686 VanDerWaalsContact O-CE2 3.32Å; E682-Y686 WeakPolarHBondContact O-CE2 3.43Å; E682-Y686 PolarHBondContact O-OH 3.37Å; E682-Y686 VanDerWaalsContact O-OH 3.13Å; Y686-V708 PolarHBondContact N-O 3.42Å; Y686-V708 PolarHBondContact O-N 2.7Å; Y686-V710 HydrophobicContact CD2-CB 4.13Å; Y686-V710 HydrophobicContact CD2-CG2 3.45Å; Y686-V710 VanDerWaalsContact CD2-CG2 3.45Å; Y686-V710 HydrophobicContact CE2-CB 3.97Å; Y686-V710 HydrophobicContact CE2-CG2 3.67Å
687	D	89.4	Confident	86.3	Confident	104 Å²	104	62.7 Å²	62.7	56%	0.556	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	109.9	171.6	-67.7	-19.5	0	0	0	108.4	P689 I705	D687-P689 WeakPolarHBondContact O-CD 3.21Å; D687-I705 HydrophobicContact CB-CG2 3.7Å
688	V	89.6	Confident	86.6	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	105.1	-178.8	-174.2	0	0	0	0	108.3	L651 V658 W662 L674 I690 I706 V708	L651-V688 HydrophobicContact CD2-CG1 4.09Å; V658-V688 HydrophobicContact CG1-CG1 4.16Å; W662-V688 HydrophobicContact CD2-CG1 4.42Å; W662-V688 HydrophobicContact CD2-CG2 3.92Å; W662-V688 VanDerWaalsContact CE2-CG2 3.44Å; W662-V688 HydrophobicContact CG-CG1 4.16Å; W662-V688 HydrophobicContact CG-CG2 4.31Å; W662-V688 HydrophobicContact CH2-CG2 4.36Å; W662-V688 HydrophobicContact CZ2-CG2 3.7Å; L674-V688 HydrophobicContact CD1-CG1 4.45Å; L674-V688 HydrophobicContact CD2-CG1 4.34Å; V688-I690 HydrophobicContact CG1-CG1 4.25Å; V688-I706 HydrophobicContact CB-CG2 3.79Å; V688-I706 HydrophobicContact CG1-CG2 4.4Å; V688-I706 PolarHBondContact N-O 3.28Å; V688-I706 WeakPolarHBondContact O-CG2 3.13Å; V688-I706 PolarHBondContact O-N 3.07Å; V688-V708 HydrophobicContact CB-CG2 4.41Å; V688-V708 HydrophobicContact CG2-CB 4.36Å; V688-V708 HydrophobicContact CG2-CG2 3.81Å
689	P	90.8	Very high	87	Confident	22 Å²	22	60.1 Å²	60.1	14%	0.143	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	134.3	173.1	29.3	-34.1	0	0	0	110.2	P652 V658 D687 T703 S704 I705	P652-P689 WeakPolarHBondContact CD-O 3.45Å; P652-P689 HydrophobicContact CG-CB 3.85Å; P652-P689 HydrophobicContact CG-CG 3.52Å; V658-P689 HydrophobicContact CG2-CG 4.07Å; D687-P689 WeakPolarHBondContact O-CD 3.21Å; P689-T703 HydrophobicContact CB-CG2 4.2Å; P689-S704 CarbonylContact C-O 3.49Å; P689-S704 WeakPolarHBondContact CA-O 3.34Å; P689-I705 HydrophobicContact CB-CG1 4.35Å
690	I	90.9	Very high	87.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	127	177.2	-55.5	-175.2	0	0	0	107.9	L615 I633 F649 L651 I664 L674 V688 V692 S704 I706	L615-I690 HydrophobicContact CD1-CB 4.47Å; L615-I690 HydrophobicContact CD1-CD1 4.38Å; L615-I690 HydrophobicContact CD1-CG2 4.22Å; L615-I690 HydrophobicContact CD2-CB 4.17Å; L615-I690 HydrophobicContact CD2-CD1 3.98Å; L615-I690 HydrophobicContact CD2-CG1 4.36Å; I633-I690 HydrophobicContact CD1-CD1 3.86Å; F649-I690 HydrophobicContact CD1-CG2 4.41Å; L651-I690 HydrophobicContact CD2-CG1 4.17Å; I664-I690 HydrophobicContact CD1-CD1 4.26Å; I664-I690 HydrophobicContact CD1-CG1 4.42Å; I664-I690 HydrophobicContact CD1-CG2 3.93Å; L674-I690 HydrophobicContact CD1-CD1 4.37Å; L674-I690 HydrophobicContact CD2-CD1 4.13Å; V688-I690 HydrophobicContact CG1-CG1 4.25Å; I690-V692 HydrophobicContact CG2-CG2 4.29Å; I690-S704 PolarHBondContact N-O 3.29Å; I690-S704 PolarHBondContact O-N 2.67Å; I690-S704 PolarHBondContact O-OG 2.94Å; I690-I706 HydrophobicContact CD1-CG2 3.72Å; I690-I706 HydrophobicContact CG1-CG2 4.24Å
691	I	91.6	Very high	88.3	Confident	38 Å²	38	52.8 Å²	52.8	20%	0.195	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.8	171.7	-54.6	175	0	0	0	106.7	E650 P652 N702 T703	E650-I691 HydrophobicContact CB-CB 4.47Å; E650-I691 PolarHBondContact N-O 3.44Å; E650-I691 PolarHBondContact O-N 3.13Å; P652-I691 HydrophobicContact CB-CD1 4.12Å; P652-I691 HydrophobicContact CB-CG1 4.46Å; I691-N702 WeakPolarHBondContact CA-O 3.19Å; I691-T703 HydrophobicContact CG1-CG2 4.15Å
692	V	92.5	Very high	88.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.8	171.5	-170.4	0	0	0	0	107.4	P613 L615 A635 Y647 V648 F649 I690 S701 N702	P613-V692 HydrophobicContact CB-CB 4.41Å; P613-V692 HydrophobicContact CB-CG1 3.83Å; P613-V692 HydrophobicContact CG-CB 4.15Å; P613-V692 HydrophobicContact CG-CG1 3.79Å; L615-V692 HydrophobicContact CB-CG2 4.1Å; L615-V692 HydrophobicContact CD1-CG2 3.83Å; A635-V692 HydrophobicContact CB-CG1 3.66Å; Y647-V692 HydrophobicContact CD1-CG1 4.35Å; Y647-V692 HydrophobicContact CG-CG1 4.39Å; V648-V692 WeakPolarHBondContact O-CA 3.31Å; F649-V692 HydrophobicContact CD1-CG1 4.23Å; F649-V692 HydrophobicContact CD1-CG2 3.84Å; F649-V692 HydrophobicContact CE1-CG1 3.95Å; F649-V692 HydrophobicContact CE1-CG2 3.94Å; F649-V692 HydrophobicContact CZ-CG1 4.47Å; I690-V692 HydrophobicContact CG2-CG2 4.29Å; V692-S701 CarbonylContact O-C 3.53Å; V692-S701 WeakPolarHBondContact O-CA 3.49Å; V692-N702 PolarHBondContact N-O 2.87Å; V692-N702 PolarHBondContact O-N 2.81Å
693	T	91.7	Very high	89.2	Confident	31 Å²	31	52.5 Å²	52.5	19%	0.19	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.9	176	-45.9	0	0	0	0	109.1	Y647 V648 P699 L700 S701	Y647-T693 CarbonylContact C-O 3.56Å; Y647-T693 WeakPolarHBondContact CA-O 3.32Å; V648-T693 PolarHBondContact N-O 3.23Å; V648-T693 PolarHBondContact O-N 2.87Å; T693-P699 HydrophobicContact CG2-CB 4.02Å; T693-L700 WeakPolarHBondContact CA-O 3.39Å; T693-L700 WeakPolarHBondContact CG2-O 3.23Å; T693-S701 WeakPolarHBondContact OG1-CB 3.34Å
694	D	92.7	Very high	89.7	Confident	5 Å²	5	50.4 Å²	50.4	3%	0.027	30%	0.296	C	S	.	.			trans	-78.4	-177.1	175.4	63.3	40.1	0	0	0	112.1	N609 P613 N643 G696 P699 L700	N609-D694 VanDerWaalsContact ND2-CG 3.26Å; N609-D694 PolarHBondContact ND2-OD1 3.46Å; N609-D694 VanDerWaalsContact ND2-OD1 3.13Å; N609-D694 PolarHBondContact ND2-OD2 3.34Å; N609-D694 PolarHBondContact OD1-OD2 3.4Å; P613-D694 HydrophobicContact CG-CB 4.06Å; N643-D694 WeakPolarHBondContact O-CB 3.27Å; D694-G696 PolarHBondContact OD1-N 2.84Å; D694-P699 WeakPolarHBondContact OD1-CA 3.29Å; D694-L700 VanDerWaalsContact CG-N 3.34Å; D694-L700 PolarHBondContact N-O 2.85Å; D694-L700 PolarHBondContact OD1-N 2.91Å; D694-L700 VanDerWaalsContact OD2-CA 3.28Å; D694-L700 WeakPolarHBondContact OD2-CA 3.44Å; D694-L700 WeakPolarHBondContact OD2-CB 3.36Å; D694-L700 PolarHBondContact OD2-N 2.56Å; D694-L700 VanDerWaalsContact OD2-O 3.1Å
695	S	89.1	Confident	90	Very high	55 Å²	55	53.6 Å²	53.6	39%	0.385	31%	0.306	S	S	.	.	S	Bend	trans	-104.1	7.4	174.1	-77.8	0	0	0	0	114	I644 P646	I644-S695 PolarHBondContact O-N 2.74Å; P646-S695 WeakPolarHBondContact CD-OG 3.23Å; P646-S695 WeakPolarHBondContact CG-OG 3.44Å; P646-S695 PolarHBondContact O-OG 2.87Å
696	G	86.8	Confident	90.3	Very high	6 Å²	6	48.1 Å²	48.1	6%	0.062	28%	0.278	C	S	.	.	S	Bend	trans	-68.3	171.6	-179.8	0	0	0	0	0	113.4	D694 P698 P699	D694-G696 PolarHBondContact OD1-N 2.84Å; G696-P698 CarbonylContact O-C 3.52Å; G696-P699 VanDerWaalsContact O-CA 3.24Å; G696-P699 WeakPolarHBondContact O-CA 3.23Å; G696-P699 WeakPolarHBondContact O-CD 3.21Å; G696-P699 VanDerWaalsContact O-N 3.08Å
697	N	84.8	Confident	90.5	Very high	148 Å²	148	49.9 Å²	49.9	79%	0.791	29%	0.288	S	S	*	.	S	Bend	trans	-130.9	106.5	178.6	-177.8	28	0	0	0	111
698	P	90.6	Very high	90.4	Very high	85 Å²	85	45 Å²	45	55%	0.552	26%	0.261	S	S	*	.	S	Bend	cis	-72.7	147.1	3.9	31.3	-35.2	0	0	0	112.3	N609 G696 L700	N609-P698 PolarHBondContact ND2-O 2.84Å; G696-P698 CarbonylContact O-C 3.52Å; P698-L700 PolarHBondContact O-N 2.9Å
699	P	91.1	Very high	90.2	Very high	78 Å²	78	49.4 Å²	49.4	51%	0.506	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-70.7	131.6	-180	27.3	-33.6	0	0	0	110.6	T693 D694 G696	T693-P699 HydrophobicContact CG2-CB 4.02Å; D694-P699 WeakPolarHBondContact OD1-CA 3.29Å; G696-P699 VanDerWaalsContact O-CA 3.24Å; G696-P699 WeakPolarHBondContact O-CA 3.23Å; G696-P699 WeakPolarHBondContact O-CD 3.21Å; G696-P699 VanDerWaalsContact O-N 3.08Å
700	L	92.8	Very high	90	Very high	50 Å²	50	48.6 Å²	48.6	26%	0.262	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-98.8	145.2	174.8	-57.8	174.4	0	0	0	109.9	N609 D610 N611 A612 T693 D694 P698	N609-L700 PolarHBondContact ND2-N 2.87Å; N609-L700 VanDerWaalsContact O-CD1 3.3Å; N609-L700 WeakPolarHBondContact O-CD1 2.98Å; D610-L700 VanDerWaalsContact C-CD1 3.45Å; N611-L700 WeakPolarHBondContact O-CD1 3.21Å; A612-L700 HydrophobicContact CB-CB 3.95Å; T693-L700 WeakPolarHBondContact CA-O 3.39Å; T693-L700 WeakPolarHBondContact CG2-O 3.23Å; D694-L700 VanDerWaalsContact CG-N 3.34Å; D694-L700 PolarHBondContact N-O 2.85Å; D694-L700 PolarHBondContact OD1-N 2.91Å; D694-L700 VanDerWaalsContact OD2-CA 3.28Å; D694-L700 WeakPolarHBondContact OD2-CA 3.44Å; D694-L700 WeakPolarHBondContact OD2-CB 3.36Å; D694-L700 PolarHBondContact OD2-N 2.56Å; D694-L700 VanDerWaalsContact OD2-O 3.1Å; P698-L700 PolarHBondContact O-N 2.9Å
701	S	91.4	Very high	89.5	Confident	73 Å²	73	48.9 Å²	48.9	51%	0.51	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.6	179.3	60.1	0	0	0	0	110.7	V692 T693	V692-S701 CarbonylContact O-C 3.53Å; V692-S701 WeakPolarHBondContact O-CA 3.49Å; T693-S701 WeakPolarHBondContact OG1-CB 3.34Å
702	N	92.2	Very high	88.8	Confident	64 Å²	64	49.9 Å²	49.9	34%	0.342	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.8	177.2	-166	7.6	0	0	0	110.4	A612 P613 I691 V692	A612-N702 HydrophobicContact CB-CB 3.98Å; P613-N702 WeakPolarHBondContact O-CB 3.47Å; I691-N702 WeakPolarHBondContact CA-O 3.19Å; V692-N702 PolarHBondContact N-O 2.87Å; V692-N702 PolarHBondContact O-N 2.81Å
703	T	90.6	Very high	87.9	Confident	79 Å²	79	51.4 Å²	51.4	49%	0.485	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	101.5	174.9	-51.5	0	0	0	0	108.9	P689 I691	P689-T703 HydrophobicContact CB-CG2 4.2Å; I691-T703 HydrophobicContact CG1-CG2 4.15Å
704	S	89.6	Confident	86.8	Confident	16 Å²	16	53 Å²	53	11%	0.112	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	154	178.9	60.7	0	0	0	0	110.4	L615 P689 I690	L615-S704 WeakPolarHBondContact CB-OG 3.35Å; L615-S704 WeakPolarHBondContact CD2-OG 3.41Å; P689-S704 CarbonylContact C-O 3.49Å; P689-S704 WeakPolarHBondContact CA-O 3.34Å; I690-S704 PolarHBondContact N-O 3.29Å; I690-S704 PolarHBondContact O-N 2.67Å; I690-S704 PolarHBondContact O-OG 2.94Å
705	I	89.9	Confident	85.5	Confident	98 Å²	98	60.4 Å²	60.4	50%	0.503	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	118.9	179.3	-59.4	173.2	0	0	0	108.3	D687 P689	D687-I705 HydrophobicContact CB-CG2 3.7Å; P689-I705 HydrophobicContact CB-CG1 4.35Å
706	I	91.2	Very high	84.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	126.4	169	-173.6	171.3	0	0	0	109.6	L615 P617 K618 A620 I631 I633 L674 V688 I690 V708	L615-I706 HydrophobicContact CD2-CB 3.74Å; L615-I706 HydrophobicContact CD2-CG2 4.15Å; P617-I706 HydrophobicContact CG-CD1 4.43Å; P617-I706 WeakPolarHBondContact O-CD1 3.21Å; P617-I706 WeakPolarHBondContact O-CG1 3.45Å; K618-I706 WeakPolarHBondContact O-CA 3.41Å; A620-I706 HydrophobicContact CB-CD1 3.76Å; A620-I706 HydrophobicContact CB-CG1 4.32Å; I631-I706 HydrophobicContact CG2-CD1 4.13Å; I633-I706 HydrophobicContact CG2-CD1 4.04Å; L674-I706 HydrophobicContact CD2-CG2 4.07Å; V688-I706 HydrophobicContact CB-CG2 3.79Å; V688-I706 HydrophobicContact CG1-CG2 4.4Å; V688-I706 PolarHBondContact N-O 3.28Å; V688-I706 WeakPolarHBondContact O-CG2 3.13Å; V688-I706 PolarHBondContact O-N 3.07Å; I690-I706 HydrophobicContact CD1-CG2 3.72Å; I690-I706 HydrophobicContact CG1-CG2 4.24Å; I706-V708 HydrophobicContact CG1-CG2 4.2Å; I706-V708 HydrophobicContact CG2-CG2 4.04Å; I706-V708 PolarHBondContact O-N 2.85Å
707	K	90.9	Very high	83.2	Confident	96 Å²	96	64.1 Å²	64.1	42%	0.417	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	110.8	174.2	-63.1	-174	179.7	172.3	0	109.2	K618 E619 A620 M685	K618-K707 PolarHBondContact O-N 2.99Å; E619-K707 WeakPolarHBondContact CA-O 3.21Å; E619-K707 HydrophobicContact CG-CB 4.23Å; A620-K707 PolarHBondContact N-O 3.08Å; M685-K707 HydrophobicContact CE-CB 4.25Å
708	V	88.6	Confident	82.5	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	114.5	-178.2	-172.8	0	0	0	0	110.4	A620 I622 I631 W662 L674 Y686 V688 I706 V710	A620-V708 CarbonylContact O-C 2.95Å; A620-V708 VanDerWaalsContact O-CA 3.32Å; A620-V708 WeakPolarHBondContact O-CA 3.24Å; I622-V708 HydrophobicContact CB-CG1 4.25Å; I622-V708 HydrophobicContact CG2-CG1 3.5Å; I631-V708 HydrophobicContact CD1-CB 4.49Å; I631-V708 HydrophobicContact CD1-CG1 3.66Å; I631-V708 HydrophobicContact CD1-CG2 3.98Å; W662-V708 HydrophobicContact CH2-CB 3.86Å; W662-V708 HydrophobicContact CH2-CG1 3.48Å; W662-V708 VanDerWaalsContact CH2-CG1 3.48Å; W662-V708 HydrophobicContact CH2-CG2 4.25Å; W662-V708 HydrophobicContact CZ2-CB 4.35Å; W662-V708 HydrophobicContact CZ2-CG1 4.39Å; W662-V708 HydrophobicContact CZ3-CG1 3.99Å; W662-V708 HydrophobicContact CZ3-CG2 4.5Å; L674-V708 HydrophobicContact CD2-CG2 4.25Å; Y686-V708 PolarHBondContact N-O 3.42Å; Y686-V708 PolarHBondContact O-N 2.7Å; V688-V708 HydrophobicContact CB-CG2 4.41Å; V688-V708 HydrophobicContact CG2-CB 4.36Å; V688-V708 HydrophobicContact CG2-CG2 3.81Å; I706-V708 HydrophobicContact CG1-CG2 4.2Å; I706-V708 HydrophobicContact CG2-CG2 4.04Å; I706-V708 PolarHBondContact O-N 2.85Å; V708-V710 HydrophobicContact CG1-CG2 4.43Å
709	K	85.5	Confident	81.5	Confident	94 Å²	94	59.1 Å²	59.1	41%	0.409	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	111.8	171.4	-173.1	176.5	178.8	-175.8	0	109.8	A620 Q621 I622 M685	A620-K709 PolarHBondContact O-N 2.77Å; Q621-K709 VanDerWaalsContact CA-O 3.26Å; Q621-K709 WeakPolarHBondContact CA-O 3.38Å; Q621-K709 HydrophobicContact CB-CB 4.27Å; I622-K709 PolarHBondContact N-O 3.32Å; M685-K709 HydrophobicContact CE-CB 4.47Å; M685-K709 HydrophobicContact SD-CB 3.55Å; M685-K709 VanDerWaalsContact SD-CB 3.55Å; M685-K709 HydrophobicContact SD-CD 4.16Å; M685-K709 HydrophobicContact SD-CG 3.66Å
710	V	85.4	Confident	80.3	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.024	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	128.9	174.6	-177.1	0	0	0	0	109	I622 E624 W662 L681 A683 G684 Y686 V708	I622-V710 HydrophobicContact CG2-CG2 3.9Å; I622-V710 VanDerWaalsContact O-CA 3.31Å; I622-V710 WeakPolarHBondContact O-CA 3.31Å; E624-V710 HydrophobicContact CB-CG1 4.26Å; W662-V710 HydrophobicContact CH2-CG2 4.16Å; L681-V710 HydrophobicContact CB-CG1 4.42Å; L681-V710 HydrophobicContact CD2-CG2 3.84Å; L681-V710 HydrophobicContact CG-CG2 4.45Å; A683-V710 CarbonylContact C-O 3.59Å; A683-V710 VanDerWaalsContact CA-O 3.26Å; A683-V710 WeakPolarHBondContact CA-O 3.47Å; G684-V710 PolarHBondContact N-O 3.27Å; G684-V710 PolarHBondContact O-N 3.01Å; Y686-V710 HydrophobicContact CD2-CB 4.13Å; Y686-V710 HydrophobicContact CD2-CG2 3.45Å; Y686-V710 VanDerWaalsContact CD2-CG2 3.45Å; Y686-V710 HydrophobicContact CE2-CB 3.97Å; Y686-V710 HydrophobicContact CE2-CG2 3.67Å; V708-V710 HydrophobicContact CG1-CG2 4.43Å
711	C	80.1	Confident	78.7	Confident	7 Å²	7	61.5 Å²	61.5	5%	0.047	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	159.2	-171.8	65.1	0	0	0	0	112.3	I622 E624 C713 C719	I622-C711 PolarHBondContact O-N 3.45Å; E624-C711 PolarHBondContact N-O 3.41Å; E624-C711 VanDerWaalsContact N-O 3.09Å; C711-C713 PolarHBondContact O-N 2.94Å; C711-C713 VanDerWaalsContact SG-SG 3.63Å; C711-C719 HydrophobicContact CB-CB 3.61Å; C711-C719 WeakPolarHBondContact CB-SG 3.43Å; C711-C719 WeakPolarHBondContact SG-CA 3.36Å; C711-C719 WeakPolarHBondContact SG-CB 3.24Å; C711-C719 CovalentContact SG-SG 1.99Å; C711-C719 PolarHBondContact SG-SG 2.98Å
712	P	77.1	Confident	76.6	Confident	58 Å²	58	65.6 Å²	65.6	38%	0.377	36%	0.359	S	S	.	.			trans	-71.6	121	165.9	-10	26.6	0	0	0	109.6	T720	P712-T720 PolarHBondContact O-N 3.12Å; P712-T720 PolarHBondContact O-OG1 3.04Å
713	C	72.9	Confident	74.3	Confident	33 Å²	33	66.2 Å²	66.2	22%	0.223	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-98.7	153	-179.2	-67.8	0	0	0	0	112.9	C623 C711 G717 D718	C623-C713 WeakPolarHBondContact CA-SG 3.44Å; C623-C713 HydrophobicContact CB-CB 3.74Å; C623-C713 WeakPolarHBondContact CB-SG 3.47Å; C623-C713 WeakPolarHBondContact SG-CB 3.29Å; C623-C713 CovalentContact SG-SG 2.02Å; C623-C713 PolarHBondContact SG-SG 2.83Å; C711-C713 PolarHBondContact O-N 2.94Å; C711-C713 VanDerWaalsContact SG-SG 3.63Å; C713-G717 PolarHBondContact SG-O 3.41Å; C713-D718 VanDerWaalsContact CA-O 3.25Å; C713-D718 WeakPolarHBondContact CA-O 3.27Å
714	D	69.6	Low	71.9	Confident	65 Å²	65	67.1 Å²	67.1	35%	0.348	40%	0.395	S	S	.	.			trans	-77.9	178.2	167.3	65.1	11.5	0	0	0	112.3	N716 G717 D718 T720	D714-N716 PolarHBondContact O-N 3.26Å; D714-N716 VanDerWaalsContact O-N 3.09Å; D714-N716 WeakPolarHBondContact OD1-CA 3.27Å; D714-N716 PolarHBondContact OD1-N 3.28Å; D714-N716 VanDerWaalsContact OD1-N 3.11Å; D714-G717 PolarHBondContact O-N 2.89Å; D714-G717 PolarHBondContact OD1-N 3.23Å; D714-D718 PolarHBondContact N-O 2.89Å; D714-D718 VanDerWaalsContact N-O 3.11Å; D714-D718 PolarHBondContact OD1-N 2.92Å; D714-T720 HydrophobicContact CB-CG2 3.85Å
715	D	65.8	Low	69.6	Low	160 Å²	160	73.7 Å²	73.7	86%	0.856	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-13.1	179.9	-68	-37.3	0	0	0	113.3
716	N	63.6	Low	67.1	Low	137 Å²	137	73.4 Å²	73.4	73%	0.733	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-3	175.9	-78.2	11.4	0	0	0	113.4	D714	D714-N716 PolarHBondContact O-N 3.26Å; D714-N716 VanDerWaalsContact O-N 3.09Å; D714-N716 WeakPolarHBondContact OD1-CA 3.27Å; D714-N716 PolarHBondContact OD1-N 3.28Å; D714-N716 VanDerWaalsContact OD1-N 3.11Å
717	G	63.9	Low	65.3	Low	2 Å²	2	78.3 Å²	78.3	2%	0.021	49%	0.487	C	S	.	.	S	Bend	trans	89.3	4.3	177.7	0	0	0	0	0	115	C623 N629 C713 D714	C623-G717 PolarHBondContact SG-O 3.02Å; N629-G717 VanDerWaalsContact ND2-C 3.28Å; N629-G717 PolarHBondContact ND2-O 3.06Å; C713-G717 PolarHBondContact SG-O 3.41Å; D714-G717 PolarHBondContact O-N 2.89Å; D714-G717 PolarHBondContact OD1-N 3.23Å
718	D	69	Low	63.1	Low	97 Å²	97	78.1 Å²	78.1	52%	0.519	50%	0.504	S	S	.	.			trans	-89.9	140.4	-178.1	-75.4	-31.9	0	0	0	112.1	C713 D714 T720	C713-D718 VanDerWaalsContact CA-O 3.25Å; C713-D718 WeakPolarHBondContact CA-O 3.27Å; D714-D718 PolarHBondContact N-O 2.89Å; D714-D718 VanDerWaalsContact N-O 3.11Å; D714-D718 PolarHBondContact OD1-N 2.92Å; D718-T720 PolarHBondContact O-N 2.8Å
719	C	70.6	Confident	61.2	Low	31 Å²	31	81.3 Å²	81.3	21%	0.209	54%	0.537	C	S	.	.	B	Isolated β-bridge	trans	-61.9	115.4	178.6	-75.1	0	0	0	0	112.1	C711	C711-C719 HydrophobicContact CB-CB 3.61Å; C711-C719 WeakPolarHBondContact CB-SG 3.43Å; C711-C719 WeakPolarHBondContact SG-CA 3.36Å; C711-C719 WeakPolarHBondContact SG-CB 3.24Å; C711-C719 CovalentContact SG-SG 1.99Å; C711-C719 PolarHBondContact SG-SG 2.98Å
720	T	66.4	Low	59.3	Low	50 Å²	50	81.7 Å²	81.7	31%	0.307	54%	0.542	S	S	.	.			trans	-86.4	119.5	173.9	61.7	0	0	0	0	110.8	P712 D714 D718 I722	P712-T720 PolarHBondContact O-N 3.12Å; P712-T720 PolarHBondContact O-OG1 3.04Å; D714-T720 HydrophobicContact CB-CG2 3.85Å; D718-T720 PolarHBondContact O-N 2.8Å; T720-I722 PolarHBondContact O-N 3.01Å
721	T	57.8	Low	58.1	Low	127 Å²	127	83.5 Å²	83.5	78%	0.779	56%	0.562	S	S	*	*			trans	-81.4	92.5	175.4	53.2	0	0	0	0	110.4
722	I	48	Very low	57.1	Low	160 Å²	160	89 Å²	89	82%	0.821	60%	0.595	S	S	*	*			trans	-119.2	106.6	169.9	-57.1	177.7	0	0	0	108.9	T720	T720-I722 PolarHBondContact O-N 3.01Å
723	G	43.4	Very low	56.5	Low	77 Å²	77	88.6 Å²	88.6	79%	0.794	60%	0.602	S	S	*	*	S	Bend	trans	144.9	52	162.1	0	0	0	0	0	119
724	A	40.4	Very low	55.8	Low	97 Å²	97	88.7 Å²	88.7	80%	0.802	61%	0.606	S	S	*	*			trans	-159.8	51.4	151.2	0	0	0	0	0	112	A726	A724-A726 VanDerWaalsContact C-N 3.3Å; A724-A726 PolarHBondContact O-N 2.93Å
725	V	41.5	Very low	55.7	Low	155 Å²	155	89.5 Å²	89.5	94%	0.939	61%	0.609	S	S	*	*			trans	-96.4	70.6	159.4	-173.5	0	0	0	0	107.1
726	A	38.2	Very low	55.9	Low	91 Å²	91	85.5 Å²	85.5	75%	0.752	59%	0.59	S	S	*	*			trans	-94	115.8	160.5	0	0	0	0	0	106.7	A724 A728	A724-A726 VanDerWaalsContact C-N 3.3Å; A724-A726 PolarHBondContact O-N 2.93Å; A726-A728 PolarHBondContact O-N 3.35Å
727	A	51.9	Low	56.2	Low	103 Å²	103	81.2 Å²	81.2	85%	0.851	57%	0.574	S	S	*	*			trans	-25.9	94.9	174.7	0	0	0	0	0	114.7	G729	A727-G729 PolarHBondContact O-N 3.43Å; A727-G729 VanDerWaalsContact O-N 3.15Å
728	A	44.5	Very low	56.8	Low	93 Å²	93	85.1 Å²	85.1	77%	0.769	59%	0.593	S	S	*	*			trans	-83.6	75.9	156.1	0	0	0	0	0	107	A726 L730	A726-A728 PolarHBondContact O-N 3.35Å; A728-L730 PolarHBondContact O-N 3.29Å
729	G	49.5	Very low	57.2	Low	67 Å²	67	85.2 Å²	85.2	69%	0.691	59%	0.593	S	S	*	*			trans	-52.3	115.1	151.7	0	0	0	0	0	105.8	A727 G731	A727-G729 PolarHBondContact O-N 3.43Å; A727-G729 VanDerWaalsContact O-N 3.15Å; G729-G731 PolarHBondContact O-N 3.29Å
730	L	46.3	Very low	57.6	Low	101 Å²	101	87.8 Å²	87.8	53%	0.529	60%	0.604	S	S	.	*			trans	-60.3	91.5	-178.8	-154.8	75.9	0	0	0	106.5	A728 A734 I735 I738	A728-L730 PolarHBondContact O-N 3.29Å; L730-A734 HydrophobicContact CD1-CB 3.74Å; L730-A734 HydrophobicContact CG-CB 3.79Å; L730-I735 HydrophobicContact CD2-CD1 4.23Å; L730-I735 HydrophobicContact CD2-CG1 3.43Å; L730-I735 VanDerWaalsContact CD2-CG1 3.43Å; L730-I735 HydrophobicContact CG-CG1 3.95Å; L730-I738 HydrophobicContact CD1-CD1 4.24Å; L730-I738 HydrophobicContact CD2-CD1 4.22Å
731	G	60.3	Low	58.2	Low	43 Å²	43	89.1 Å²	89.1	44%	0.443	61%	0.614	S	S	.	*			trans	-52.6	148	177.3	0	0	0	0	0	108	G729 G733 A734 I735	G729-G731 PolarHBondContact O-N 3.29Å; G731-G733 CarbonylContact O-C 3.58Å; G731-G733 PolarHBondContact O-N 2.98Å; G731-A734 WeakPolarHBondContact O-CA 3.32Å; G731-A734 PolarHBondContact O-N 2.84Å; G731-I735 PolarHBondContact O-N 2.78Å
732	T	59.2	Low	59.4	Low	121 Å²	121	87.2 Å²	87.2	74%	0.742	60%	0.599	S	S	*	*	H	α-helix	trans	-50.4	-26.3	176.6	46.4	0	0	0	0	112.1	V736	T732-V736 WeakPolarHBondContact O-CB 3.48Å; T732-V736 WeakPolarHBondContact O-CG2 3.31Å; T732-V736 PolarHBondContact O-N 3.24Å
733	G	63	Low	61	Low	50 Å²	50	84.7 Å²	84.7	52%	0.515	59%	0.586	S	S	.	*	H	α-helix	trans	-64.6	-33.9	169.2	0	0	0	0	0	116.1	G731 A737	G731-G733 CarbonylContact O-C 3.58Å; G731-G733 PolarHBondContact O-N 2.98Å; G733-A737 WeakPolarHBondContact O-CB 3.45Å; G733-A737 PolarHBondContact O-N 3.31Å
734	A	59.6	Low	62.8	Low	36 Å²	36	85.4 Å²	85.4	30%	0.298	57%	0.571	S	S	.	*	H	α-helix	trans	-77.4	-33.6	175.2	0	0	0	0	0	112.1	L730 G731 A737 I738	L730-A734 HydrophobicContact CD1-CB 3.74Å; L730-A734 HydrophobicContact CG-CB 3.79Å; G731-A734 WeakPolarHBondContact O-CA 3.32Å; G731-A734 PolarHBondContact O-N 2.84Å; A734-A737 PolarHBondContact O-N 2.94Å; A734-I738 VanDerWaalsContact O-CB 3.31Å; A734-I738 WeakPolarHBondContact O-CB 3.36Å; A734-I738 WeakPolarHBondContact O-CD1 3.28Å; A734-I738 WeakPolarHBondContact O-CG1 3.5Å; A734-I738 PolarHBondContact O-N 2.93Å
735	I	67.1	Low	64.7	Low	81 Å²	81	86.3 Å²	86.3	42%	0.415	56%	0.562	S	S	.	*	H	α-helix	trans	-66.3	-42.2	170.2	-63.6	170	0	0	0	110.2	L730 G731 I738 L739	L730-I735 HydrophobicContact CD2-CD1 4.23Å; L730-I735 HydrophobicContact CD2-CG1 3.43Å; L730-I735 VanDerWaalsContact CD2-CG1 3.43Å; L730-I735 HydrophobicContact CG-CG1 3.95Å; G731-I735 PolarHBondContact O-N 2.78Å; I735-I738 PolarHBondContact O-N 2.93Å; I735-L739 HydrophobicContact CG2-CD1 4.12Å; I735-L739 WeakPolarHBondContact O-CB 3.42Å; I735-L739 PolarHBondContact O-N 3.27Å
736	V	70.1	Confident	66.6	Low	76 Å²	76	83.8 Å²	83.8	46%	0.461	54%	0.543	S	S	.	.	H	α-helix	trans	-66.9	-39.4	174.2	170.9	0	0	0	0	111.1	T732 L739 I740	T732-V736 WeakPolarHBondContact O-CB 3.48Å; T732-V736 WeakPolarHBondContact O-CG2 3.31Å; T732-V736 PolarHBondContact O-N 3.24Å; V736-L739 PolarHBondContact O-N 2.88Å; V736-I740 HydrophobicContact CG1-CD1 3.57Å; V736-I740 HydrophobicContact CG1-CG1 4.25Å; V736-I740 VanDerWaalsContact O-CB 3.27Å; V736-I740 WeakPolarHBondContact O-CB 3.21Å; V736-I740 WeakPolarHBondContact O-CD1 3.46Å; V736-I740 WeakPolarHBondContact O-CG1 3.29Å; V736-I740 PolarHBondContact O-N 2.73Å
737	A	68.7	Low	68.6	Low	48 Å²	48	82.5 Å²	82.5	40%	0.397	53%	0.525	S	S	.	.	H	α-helix	trans	-69.3	-35.8	176.2	0	0	0	0	0	112.6	G733 A734 I740 C741	G733-A737 WeakPolarHBondContact O-CB 3.45Å; G733-A737 PolarHBondContact O-N 3.31Å; A734-A737 PolarHBondContact O-N 2.94Å; A737-I740 PolarHBondContact O-N 2.86Å; A737-C741 VanDerWaalsContact O-CB 3.22Å; A737-C741 WeakPolarHBondContact O-CB 3.25Å; A737-C741 PolarHBondContact O-N 3.22Å; A737-C741 PolarHBondContact O-SG 2.69Å; A737-C741 VanDerWaalsContact O-SG 3.41Å
738	I	76.8	Confident	70.1	Confident	84 Å²	84	82.8 Å²	82.8	43%	0.431	51%	0.51	S	S	.	.	H	α-helix	trans	-69.9	-41.1	173.3	-68.6	163.1	0	0	0	110	L730 A734 I735 C741 I742	L730-I738 HydrophobicContact CD1-CD1 4.24Å; L730-I738 HydrophobicContact CD2-CD1 4.22Å; A734-I738 VanDerWaalsContact O-CB 3.31Å; A734-I738 WeakPolarHBondContact O-CB 3.36Å; A734-I738 WeakPolarHBondContact O-CD1 3.28Å; A734-I738 WeakPolarHBondContact O-CG1 3.5Å; A734-I738 PolarHBondContact O-N 2.93Å; I735-I738 PolarHBondContact O-N 2.93Å; I738-C741 PolarHBondContact O-N 2.75Å; I738-I742 HydrophobicContact CG2-CD1 3.71Å; I738-I742 HydrophobicContact CG2-CG1 4.34Å; I738-I742 WeakPolarHBondContact O-CB 3.13Å; I738-I742 WeakPolarHBondContact O-CG1 3.36Å; I738-I742 PolarHBondContact O-N 2.72Å
739	L	77.9	Confident	71.8	Confident	98 Å²	98	82.1 Å²	82.1	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-63.7	-39.7	172.5	-87.3	162.7	0	0	0	112.2	I735 V736 I742 L743	I735-L739 HydrophobicContact CG2-CD1 4.12Å; I735-L739 WeakPolarHBondContact O-CB 3.42Å; I735-L739 PolarHBondContact O-N 3.27Å; V736-L739 PolarHBondContact O-N 2.88Å; L739-I742 PolarHBondContact O-N 3.38Å; L739-L743 VanDerWaalsContact O-CB 3.3Å; L739-L743 WeakPolarHBondContact O-CB 3.5Å; L739-L743 PolarHBondContact O-N 3.04Å
740	I	79.4	Confident	73.2	Confident	86 Å²	86	84.1 Å²	84.1	44%	0.441	49%	0.491	S	S	.	.	H	α-helix	trans	-68.6	-41.2	174.5	-71.6	168	0	0	0	110.3	V736 A737 L743 I744	V736-I740 HydrophobicContact CG1-CD1 3.57Å; V736-I740 HydrophobicContact CG1-CG1 4.25Å; V736-I740 VanDerWaalsContact O-CB 3.27Å; V736-I740 WeakPolarHBondContact O-CB 3.21Å; V736-I740 WeakPolarHBondContact O-CD1 3.46Å; V736-I740 WeakPolarHBondContact O-CG1 3.29Å; V736-I740 PolarHBondContact O-N 2.73Å; A737-I740 PolarHBondContact O-N 2.86Å; I740-L743 CarbonylContact O-C 3.56Å; I740-L743 PolarHBondContact O-N 3.48Å; I740-I744 HydrophobicContact CG2-CD1 3.61Å; I740-I744 HydrophobicContact CG2-CG1 4.23Å; I740-I744 WeakPolarHBondContact O-CB 3.31Å; I740-I744 WeakPolarHBondContact O-CG1 3.46Å; I740-I744 PolarHBondContact O-N 2.97Å
741	C	79.6	Confident	74.8	Confident	77 Å²	77	83.9 Å²	83.9	52%	0.52	49%	0.489	S	S	.	.	H	α-helix	trans	-65.8	-39.6	174.9	-84.6	0	0	0	0	111.5	A737 I738 I744 L745	A737-C741 VanDerWaalsContact O-CB 3.22Å; A737-C741 WeakPolarHBondContact O-CB 3.25Å; A737-C741 PolarHBondContact O-N 3.22Å; A737-C741 PolarHBondContact O-SG 2.69Å; A737-C741 VanDerWaalsContact O-SG 3.41Å; I738-C741 PolarHBondContact O-N 2.75Å; C741-I744 PolarHBondContact O-N 3.27Å; C741-L745 VanDerWaalsContact O-CB 3.31Å; C741-L745 WeakPolarHBondContact O-CB 3.34Å; C741-L745 PolarHBondContact O-N 3.19Å
742	I	82	Confident	75.5	Confident	87 Å²	87	87.4 Å²	87.4	45%	0.446	49%	0.493	S	S	.	.	H	α-helix	trans	-66.9	-39.5	174.1	-69.8	167.1	0	0	0	110.4	I738 L739 L745 L746	I738-I742 HydrophobicContact CG2-CD1 3.71Å; I738-I742 HydrophobicContact CG2-CG1 4.34Å; I738-I742 WeakPolarHBondContact O-CB 3.13Å; I738-I742 WeakPolarHBondContact O-CG1 3.36Å; I738-I742 PolarHBondContact O-N 2.72Å; L739-I742 PolarHBondContact O-N 3.38Å; I742-L745 PolarHBondContact O-N 2.9Å; I742-L746 HydrophobicContact CG2-CD1 4.01Å; I742-L746 VanDerWaalsContact O-CB 3.31Å; I742-L746 WeakPolarHBondContact O-CB 3.25Å; I742-L746 WeakPolarHBondContact O-CG 3.27Å; I742-L746 PolarHBondContact O-N 3.21Å
743	L	81.8	Confident	76.3	Confident	108 Å²	108	85.4 Å²	85.4	57%	0.565	48%	0.48	S	S	*	.	H	α-helix	trans	-63.6	-43.3	171.3	-103	149	0	0	0	111.7	L739 I740 L746 T747	L739-L743 VanDerWaalsContact O-CB 3.3Å; L739-L743 WeakPolarHBondContact O-CB 3.5Å; L739-L743 PolarHBondContact O-N 3.04Å; I740-L743 CarbonylContact O-C 3.56Å; I740-L743 PolarHBondContact O-N 3.48Å; L743-L746 PolarHBondContact O-N 2.85Å; L743-T747 WeakPolarHBondContact O-CB 3.36Å; L743-T747 VanDerWaalsContact O-CG2 3.22Å; L743-T747 WeakPolarHBondContact O-CG2 3.43Å; L743-T747 PolarHBondContact O-N 2.8Å; L743-T747 PolarHBondContact O-OG1 2.92Å
744	I	81.6	Confident	76.8	Confident	91 Å²	91	89.1 Å²	89.1	47%	0.467	49%	0.486	S	S	.	.	H	α-helix	trans	-65.5	-42.4	177	-70.8	167.1	0	0	0	110.1	I740 C741 T747 M748	I740-I744 HydrophobicContact CG2-CD1 3.61Å; I740-I744 HydrophobicContact CG2-CG1 4.23Å; I740-I744 WeakPolarHBondContact O-CB 3.31Å; I740-I744 WeakPolarHBondContact O-CG1 3.46Å; I740-I744 PolarHBondContact O-N 2.97Å; C741-I744 PolarHBondContact O-N 3.27Å; I744-T747 VanDerWaalsContact CA-OG1 3.29Å; I744-T747 WeakPolarHBondContact CA-OG1 2.98Å; I744-T747 CarbonylContact O-C 3.49Å; I744-T747 PolarHBondContact O-N 3.47Å; I744-T747 PolarHBondContact O-OG1 3.39Å; I744-M748 HydrophobicContact CG2-CG 4.49Å; I744-M748 WeakPolarHBondContact O-CB 3.44Å; I744-M748 PolarHBondContact O-N 3.03Å
745	L	80.8	Confident	77.4	Confident	116 Å²	116	93.3 Å²	93.3	61%	0.607	49%	0.494	S	S	*	.	H	α-helix	trans	-64.4	-43.2	175.3	-117.9	152.7	0	0	0	111.4	C741 I742 T747 M748 V749	C741-L745 VanDerWaalsContact O-CB 3.31Å; C741-L745 WeakPolarHBondContact O-CB 3.34Å; C741-L745 PolarHBondContact O-N 3.19Å; I742-L745 PolarHBondContact O-N 2.9Å; L745-T747 VanDerWaalsContact C-N 3.34Å; L745-T747 PolarHBondContact O-N 3.26Å; L745-M748 PolarHBondContact O-N 3.07Å; L745-V749 HydrophobicContact CD2-CG2 4.37Å; L745-V749 WeakPolarHBondContact O-CB 3.45Å; L745-V749 WeakPolarHBondContact O-CG2 3.32Å; L745-V749 PolarHBondContact O-N 3.04Å
746	L	80.8	Confident	77.4	Confident	103 Å²	103	94.8 Å²	94.8	54%	0.539	50%	0.5	S	S	.	.	H	α-helix	trans	-64.2	-38.2	173.8	-84.8	163.1	0	0	0	111.9	I742 L743 L750	I742-L746 HydrophobicContact CG2-CD1 4.01Å; I742-L746 VanDerWaalsContact O-CB 3.31Å; I742-L746 WeakPolarHBondContact O-CB 3.25Å; I742-L746 WeakPolarHBondContact O-CG 3.27Å; I742-L746 PolarHBondContact O-N 3.21Å; L743-L746 PolarHBondContact O-N 2.85Å; L746-L750 WeakPolarHBondContact O-CB 3.39Å; L746-L750 PolarHBondContact O-N 2.81Å
747	T	80.8	Confident	77.1	Confident	63 Å²	63	98.3 Å²	98.3	39%	0.387	51%	0.509	S	S	.	.	H	α-helix	trans	-71.4	-34.6	173.9	61.3	0	0	0	0	112.6	L743 I744 L745 L750 L751	L743-T747 WeakPolarHBondContact O-CB 3.36Å; L743-T747 VanDerWaalsContact O-CG2 3.22Å; L743-T747 WeakPolarHBondContact O-CG2 3.43Å; L743-T747 PolarHBondContact O-N 2.8Å; L743-T747 PolarHBondContact O-OG1 2.92Å; I744-T747 VanDerWaalsContact CA-OG1 3.29Å; I744-T747 WeakPolarHBondContact CA-OG1 2.98Å; I744-T747 CarbonylContact O-C 3.49Å; I744-T747 PolarHBondContact O-N 3.47Å; I744-T747 PolarHBondContact O-OG1 3.39Å; L745-T747 VanDerWaalsContact C-N 3.34Å; L745-T747 PolarHBondContact O-N 3.26Å; T747-L750 PolarHBondContact O-N 3.25Å; T747-L751 WeakPolarHBondContact O-CB 3.47Å; T747-L751 WeakPolarHBondContact O-CG 3.36Å; T747-L751 PolarHBondContact O-N 3.24Å
748	M	82.1	Confident	76.9	Confident	110 Å²	110	103.6 Å²	103.6	54%	0.542	52%	0.519	S	S	.	.	H	α-helix	trans	-69.6	-37.8	173.9	-88.1	-93.8	86.2	0	0	111	I744 L745 L751 F752	I744-M748 HydrophobicContact CG2-CG 4.49Å; I744-M748 WeakPolarHBondContact O-CB 3.44Å; I744-M748 PolarHBondContact O-N 3.03Å; L745-M748 PolarHBondContact O-N 3.07Å; M748-L751 HydrophobicContact CE-CB 4.26Å; M748-L751 HydrophobicContact CE-CD1 4.02Å; M748-L751 CarbonylContact O-C 3.48Å; M748-L751 PolarHBondContact O-N 3.12Å; M748-F752 WeakPolarHBondContact O-CA 3.17Å; M748-F752 WeakPolarHBondContact O-CB 3.42Å; M748-F752 PolarHBondContact O-N 2.79Å
749	V	80.4	Confident	76.1	Confident	79 Å²	79	105.8 Å²	105.8	48%	0.479	52%	0.522	S	S	.	.	H	α-helix	trans	-68.4	-41.4	173	171.4	0	0	0	0	110.3	L745 F752 V753	L745-V749 HydrophobicContact CD2-CG2 4.37Å; L745-V749 WeakPolarHBondContact O-CB 3.45Å; L745-V749 WeakPolarHBondContact O-CG2 3.32Å; L745-V749 PolarHBondContact O-N 3.04Å; V749-F752 PolarHBondContact O-N 3.4Å; V749-V753 WeakPolarHBondContact O-CB 3.4Å; V749-V753 WeakPolarHBondContact O-CG2 3.14Å; V749-V753 PolarHBondContact O-N 3.35Å
750	L	79.4	Confident	75	Confident	109 Å²	109	107.4 Å²	107.4	57%	0.571	53%	0.527	S	S	*	.	H	α-helix	trans	-64.6	-39.9	172	-91.2	159.6	0	0	0	112.6	L746 T747 V753 M754	L746-L750 WeakPolarHBondContact O-CB 3.39Å; L746-L750 PolarHBondContact O-N 2.81Å; T747-L750 PolarHBondContact O-N 3.25Å; L750-V753 PolarHBondContact O-N 3.29Å; L750-M754 VanDerWaalsContact O-CB 3.32Å; L750-M754 WeakPolarHBondContact O-CB 3.36Å; L750-M754 WeakPolarHBondContact O-CG 3.31Å; L750-M754 PolarHBondContact O-N 3.33Å
751	L	78.9	Confident	73.5	Confident	95 Å²	95	111.4 Å²	111.4	50%	0.497	54%	0.541	S	S	.	.	H	α-helix	trans	-70	-34.6	174.7	-77.2	170.8	0	0	0	111.5	T747 M748 M754 W755	T747-L751 WeakPolarHBondContact O-CB 3.47Å; T747-L751 WeakPolarHBondContact O-CG 3.36Å; T747-L751 PolarHBondContact O-N 3.24Å; M748-L751 HydrophobicContact CE-CB 4.26Å; M748-L751 HydrophobicContact CE-CD1 4.02Å; M748-L751 CarbonylContact O-C 3.48Å; M748-L751 PolarHBondContact O-N 3.12Å; L751-M754 CarbonylContact O-C 3.6Å; L751-M754 PolarHBondContact O-N 2.78Å; L751-W755 WeakPolarHBondContact O-CA 3.4Å; L751-W755 WeakPolarHBondContact O-CB 3.29Å; L751-W755 PolarHBondContact O-N 2.86Å
752	F	76.1	Confident	72.2	Confident	117 Å²	117	113.3 Å²	113.3	51%	0.513	54%	0.543	S	S	.	.	H	α-helix	trans	-70.5	-38.3	174.5	-177	-98.6	0	0	0	110.9	M748 V749 W755 M756	M748-F752 WeakPolarHBondContact O-CA 3.17Å; M748-F752 WeakPolarHBondContact O-CB 3.42Å; M748-F752 PolarHBondContact O-N 2.79Å; V749-F752 PolarHBondContact O-N 3.4Å; F752-W755 HydrophobicContact CD2-CE3 4.12Å; F752-W755 HydrophobicContact CD2-CZ3 4.33Å; F752-W755 HydrophobicContact CE2-CE3 4.14Å; F752-W755 AromaticContact CE2-CZ3 3.93Å; F752-W755 HydrophobicContact CE2-CZ3 3.93Å; F752-W755 PolarHBondContact O-N 2.92Å; F752-M756 HydrophobicContact CD1-CG 4.34Å; F752-M756 HydrophobicContact CE1-CG 4.01Å; F752-M756 HydrophobicContact CZ-CG 4.21Å; F752-M756 VanDerWaalsContact O-CB 3.27Å; F752-M756 WeakPolarHBondContact O-CB 3.4Å; F752-M756 WeakPolarHBondContact O-CG 3.32Å; F752-M756 PolarHBondContact O-N 2.8Å
753	V	75.8	Confident	70.6	Confident	79 Å²	79	119.2 Å²	119.2	48%	0.479	56%	0.559	S	S	.	*	H	α-helix	trans	-67.9	-42.9	171.2	170.8	0	0	0	0	110.6	V749 L750 W755 K757	V749-V753 WeakPolarHBondContact O-CB 3.4Å; V749-V753 WeakPolarHBondContact O-CG2 3.14Å; V749-V753 PolarHBondContact O-N 3.35Å; L750-V753 PolarHBondContact O-N 3.29Å; V753-W755 VanDerWaalsContact C-N 3.33Å; V753-W755 PolarHBondContact O-N 3.2Å; V753-K757 WeakPolarHBondContact O-CB 3.24Å; V753-K757 PolarHBondContact O-N 2.69Å
754	M	73.8	Confident	68.8	Low	129 Å²	129	121.5 Å²	121.5	64%	0.635	57%	0.567	S	S	*	*	H	α-helix	trans	-66.6	-32.9	173	-78.3	-172.6	73.2	0	0	112.5	L750 L751 K757 R758	L750-M754 VanDerWaalsContact O-CB 3.32Å; L750-M754 WeakPolarHBondContact O-CB 3.36Å; L750-M754 WeakPolarHBondContact O-CG 3.31Å; L750-M754 PolarHBondContact O-N 3.33Å; L751-M754 CarbonylContact O-C 3.6Å; L751-M754 PolarHBondContact O-N 2.78Å; M754-K757 CarbonylContact O-C 3.6Å; M754-R758 WeakPolarHBondContact O-CB 3.41Å; M754-R758 PolarHBondContact O-N 2.92Å
755	W	70.6	Confident	67.1	Low	124 Å²	124	122.4 Å²	122.4	47%	0.47	58%	0.576	S	S	.	*	H	α-helix	trans	-75.9	-41.1	177.6	178.6	82.7	0	0	0	111.1	L751 F752 V753 K757 R758 R759	L751-W755 WeakPolarHBondContact O-CA 3.4Å; L751-W755 WeakPolarHBondContact O-CB 3.29Å; L751-W755 PolarHBondContact O-N 2.86Å; F752-W755 HydrophobicContact CD2-CE3 4.12Å; F752-W755 HydrophobicContact CD2-CZ3 4.33Å; F752-W755 HydrophobicContact CE2-CE3 4.14Å; F752-W755 AromaticContact CE2-CZ3 3.93Å; F752-W755 HydrophobicContact CE2-CZ3 3.93Å; F752-W755 PolarHBondContact O-N 2.92Å; V753-W755 VanDerWaalsContact C-N 3.33Å; V753-W755 PolarHBondContact O-N 3.2Å; W755-K757 VanDerWaalsContact C-N 3.34Å; W755-R758 CarbonylContact O-C 3.44Å; W755-R758 PolarHBondContact O-N 3.08Å; W755-R759 VanDerWaalsContact CZ2-NH1 3.31Å; W755-R759 WeakPolarHBondContact O-CB 3.23Å; W755-R759 PolarHBondContact O-N 2.89Å
756	M	67.9	Low	65	Low	111 Å²	111	127.1 Å²	127.1	55%	0.547	59%	0.592	S	S	.	*	H	α-helix	trans	-58.2	-47.3	167.4	-83.9	-103.3	-78.1	0	0	110.6	F752 R758 R759 E760	F752-M756 HydrophobicContact CD1-CG 4.34Å; F752-M756 HydrophobicContact CE1-CG 4.01Å; F752-M756 HydrophobicContact CZ-CG 4.21Å; F752-M756 VanDerWaalsContact O-CB 3.27Å; F752-M756 WeakPolarHBondContact O-CB 3.4Å; F752-M756 WeakPolarHBondContact O-CG 3.32Å; F752-M756 PolarHBondContact O-N 2.8Å; M756-R758 VanDerWaalsContact C-N 3.29Å; M756-R758 PolarHBondContact O-N 3.25Å; M756-R759 PolarHBondContact O-N 2.91Å; M756-E760 PolarHBondContact O-N 2.89Å
757	K	62.8	Low	62.9	Low	150 Å²	150	131.2 Å²	131.2	65%	0.652	61%	0.609	S	S	*	*	H	α-helix	trans	-70	-23.5	178.6	-155.1	175.8	-172.4	177.6	0	113.3	V753 M754 W755	V753-K757 WeakPolarHBondContact O-CB 3.24Å; V753-K757 PolarHBondContact O-N 2.69Å; M754-K757 CarbonylContact O-C 3.6Å; W755-K757 VanDerWaalsContact C-N 3.34Å
758	R	64.9	Low	60.7	Low	160 Å²	160	135.8 Å²	135.8	60%	0.604	63%	0.629	S	S	*	*	H	α-helix	trans	-82.8	-37.2	171.7	-179.1	179	169.8	176.5	-1.1	111.8	M754 W755 M756 E760 K761 E762	M754-R758 WeakPolarHBondContact O-CB 3.41Å; M754-R758 PolarHBondContact O-N 2.92Å; W755-R758 CarbonylContact O-C 3.44Å; W755-R758 PolarHBondContact O-N 3.08Å; M756-R758 VanDerWaalsContact C-N 3.29Å; M756-R758 PolarHBondContact O-N 3.25Å; R758-E760 VanDerWaalsContact C-N 3.34Å; R758-K761 CarbonylContact O-C 3.55Å; R758-K761 WeakPolarHBondContact O-CA 3.33Å; R758-K761 WeakPolarHBondContact O-CB 3.44Å; R758-K761 PolarHBondContact O-N 3Å; R758-E762 IonicContact CZ-OE1 3.75Å; R758-E762 IonicContact NE-OE1 3.16Å; R758-E762 PolarHBondContact NE-OE1 3.13Å; R758-E762 IonicContact NH2-OE1 2.98Å; R758-E762 PolarHBondContact NH2-OE1 2.87Å; R758-E762 PolarHBondContact O-N 2.57Å
759	R	61	Low	58.9	Low	130 Å²	130	137.2 Å²	137.2	49%	0.491	64%	0.639	S	S	.	*	H	α-helix	trans	-71.4	-30.1	177.5	-153	175.6	-165.7	-177.5	2.7	111.4	W755 M756 K761 R763	W755-R759 VanDerWaalsContact CZ2-NH1 3.31Å; W755-R759 WeakPolarHBondContact O-CB 3.23Å; W755-R759 PolarHBondContact O-N 2.89Å; M756-R759 PolarHBondContact O-N 2.91Å; R759-K761 VanDerWaalsContact C-N 3.29Å; R759-R763 PolarHBondContact O-N 3.06Å
760	E	53.9	Low	56.9	Low	132 Å²	132	141.1 Å²	141.1	62%	0.617	66%	0.655	S	S	*	*	H	α-helix	trans	-63.7	-33	164.2	-99.1	-179.2	156.2	0	0	112.3	M756 R758	M756-E760 PolarHBondContact O-N 2.89Å; R758-E760 VanDerWaalsContact C-N 3.34Å
761	K	49.4	Very low	54.9	Low	170 Å²	170	143 Å²	143	74%	0.739	67%	0.666	S	S	*	*	H	α-helix	trans	-82.6	-26.5	-179.5	-142.6	176.6	-175.5	-176.6	0	113.6	R758 R759	R758-K761 CarbonylContact O-C 3.55Å; R758-K761 WeakPolarHBondContact O-CA 3.33Å; R758-K761 WeakPolarHBondContact O-CB 3.44Å; R758-K761 PolarHBondContact O-N 3Å; R759-K761 VanDerWaalsContact C-N 3.29Å
762	E	52	Low	53.1	Low	117 Å²	117	143.9 Å²	143.9	55%	0.547	68%	0.677	S	S	.	*	H	α-helix	trans	-83.1	-18.6	177.6	-77.5	173.4	-172.7	0	0	113.4	R758 H764	R758-E762 IonicContact CZ-OE1 3.75Å; R758-E762 IonicContact NE-OE1 3.16Å; R758-E762 PolarHBondContact NE-OE1 3.13Å; R758-E762 IonicContact NH2-OE1 2.98Å; R758-E762 PolarHBondContact NH2-OE1 2.87Å; R758-E762 PolarHBondContact O-N 2.57Å; E762-H764 VanDerWaalsContact C-N 3.29Å; E762-H764 PolarHBondContact O-N 3.43Å
763	R	46.9	Very low	51.4	Low	210 Å²	210	147.2 Å²	147.2	79%	0.792	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-13.3	173.2	-78.2	-173.4	-177.8	-177	0.2	114.6	R759	R759-R763 PolarHBondContact O-N 3.06Å
764	H	44.5	Very low	49.9	Very low	157 Å²	157	151.6 Å²	151.6	73%	0.727	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	6.5	-175.5	-82.8	-71.9	0	0	0	116.1	E762	E762-H764 VanDerWaalsContact C-N 3.29Å; E762-H764 PolarHBondContact O-N 3.43Å
765	T	45.6	Very low	48.2	Very low	109 Å²	109	152.9 Å²	152.9	67%	0.669	72%	0.724	S	S	*	*	S	Bend	trans	-147	80.5	173.2	49	0	0	0	0	112.5
766	K	37.3	Very low	47.2	Very low	216 Å²	216	152.8 Å²	152.8	94%	0.939	74%	0.738	S	S	*	*			trans	177.6	123.3	136.1	-96.2	163.4	-170.7	-173.1	0	110.1
767	Q	35.8	Very low	45.7	Very low	189 Å²	189	158.5 Å²	158.5	88%	0.883	75%	0.753	S	S	*	*			trans	-96.6	135.5	-171.4	-163.3	169	3.6	0	0	109
768	L	35.4	Very low	44.6	Very low	158 Å²	158	157.3 Å²	157.3	83%	0.827	75%	0.754	S	S	*	*			trans	-146.8	96.7	157.1	-85.6	165.4	0	0	0	103.8
769	L	43.6	Very low	43.3	Very low	140 Å²	140	157.3 Å²	157.3	73%	0.733	77%	0.766	S	S	*	*				80.5	113.2	96.6	-100.3	135.3	0	0	0	112.6
770	I	39.9	Very low	42.2	Very low	162 Å²	162	158.4 Å²	158.4	83%	0.831	78%	0.78	S	S	*	*			trans	95.1	119.3	162.9	-51.9	161.7	0	0	0	115.1
771	D	35.9	Very low	41.6	Very low	149 Å²	149	159.2 Å²	159.2	80%	0.797	79%	0.787	S	S	*	*			trans	-89.7	133.6	-177.6	-157.8	2.2	0	0	0	109.6
772	P	42.7	Very low	40.8	Very low	112 Å²	112	159.9 Å²	159.9	73%	0.727	79%	0.79	S	S	*	*			trans	-110.5	78.9	-177.5	38.1	-24.8	0	0	0	111.1
773	E	38.8	Very low	40.1	Very low	188 Å²	188	164.4 Å²	164.4	88%	0.879	80%	0.804	S	S	*	*			trans	-140.1	72.6	157.5	-73.2	-149.6	-169.6	0	0	109.9
774	D	44.7	Very low	39.4	Very low	170 Å²	170	161.1 Å²	161.1	91%	0.909	80%	0.802	S	S	*	*			trans	-149.2	73.4	152.2	-104.4	-20.1	0	0	0	105.7
775	D	38.7	Very low	39	Very low	156 Å²	156	162.3 Å²	162.3	83%	0.834	81%	0.808	S	S	*	*			trans	-154	105.2	150.9	-151.3	-10.1	0	0	0	111.1
776	V	49.3	Very low	39.1	Very low	123 Å²	123	166 Å²	166	75%	0.745	82%	0.818	S	S	*	*			trans	-81.2	116	171.1	-89.2	0	0	0	0	108.8
777	R	37.2	Very low	39	Very low	231 Å²	231	159.4 Å²	159.4	87%	0.872	81%	0.811	S	S	*	*			trans	179.2	147.2	140.8	-99.9	159	-153.7	-150.3	8	114.2
778	D	38.9	Very low	39	Very low	124 Å²	124	154.4 Å²	154.4	66%	0.663	81%	0.81	S	S	*	*			trans	84.7	85	156	-59.1	-10.5	0	0	0	119.5
779	N	37	Very low	39.1	Very low	161 Å²	161	150.3 Å²	150.3	86%	0.861	81%	0.806	S	S	*	*			trans	-131.5	83.9	139.9	-88.9	-34.3	0	0	0	109.7	L781	N779-L781 PolarHBondContact O-N 2.82Å
780	I	38.9	Very low	39	Very low	152 Å²	152	152.1 Å²	152.1	78%	0.779	81%	0.811	S	S	*	*			trans	-73.6	104.5	166.9	-69.3	167.5	0	0	0	107.4
781	L	40.3	Very low	38.9	Very low	149 Å²	149	152 Å²	152	78%	0.78	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-81.8	124.6	166.3	-98.8	93	0	0	0	109.9	N779	N779-L781 PolarHBondContact O-N 2.82Å
782	K	33.7	Very low	39.2	Very low	184 Å²	184	151.1 Å²	151.1	80%	0.8	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-95	117.2	174.1	-154.3	173.7	-176.6	-176.2	0	108.1
783	Y	36.6	Very low	39	Very low	212 Å²	212	153.3 Å²	153.3	83%	0.831	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-79.2	126.6	168.3	-85.3	-90.8	0	0	0	108.9
784	D	33.1	Very low	39.2	Very low	141 Å²	141	151.9 Å²	151.9	75%	0.754	80%	0.801	S	S	*	*			trans	-155.2	139.3	149.3	-76.7	-41.6	0	0	0	108.9
785	E	36.5	Very low	38.9	Very low	183 Å²	183	153.3 Å²	153.3	86%	0.855	80%	0.795	S	S	*	*			trans	80.1	92.8	159.5	-68.9	-179.5	162.7	0	0	121.4
786	E	46	Very low	38.8	Very low	186 Å²	186	152.4 Å²	152.4	87%	0.869	79%	0.79	S	S	*	*				71.5	104.3	112.4	-159.1	166.4	-155.7	0	0	120.3
787	G	35.1	Very low	38.6	Very low	78 Å²	78	155.1 Å²	155.1	80%	0.804	80%	0.799	S	S	*	*				107.8	107.9	115.9	0	0	0	0	0	119.1
788	G	37.6	Very low	38.8	Very low	83 Å²	83	147.6 Å²	147.6	86%	0.856	78%	0.782	S	S	*	*				105.6	110.5	129.8	0	0	0	0	0	119.1
789	G	35.9	Very low	38.9	Very low	72 Å²	72	150.2 Å²	150.2	74%	0.742	79%	0.79	S	S	*	*				91.7	98.1	111.7	0	0	0	0	0	119.9
790	E	43.3	Very low	38.8	Very low	179 Å²	179	151.1 Å²	151.1	84%	0.836	79%	0.794	S	S	*	*				60.1	141.1	125.7	-53.7	-165.4	-168	0	0	123.8
791	E	37	Very low	38.4	Very low	159 Å²	159	152.1 Å²	152.1	74%	0.743	80%	0.796	S	S	*	*			trans	96.3	122.3	144.1	-81.1	174.8	-179.2	0	0	122.6
792	D	41.6	Very low	37.9	Very low	131 Å²	131	153 Å²	153	70%	0.701	80%	0.796	S	S	*	*			trans	72	115.3	146.4	-58.8	-11.4	0	0	0	121.7
793	Q	39	Very low	38.3	Very low	158 Å²	158	149.7 Å²	149.7	74%	0.738	79%	0.793	S	S	*	*				-175.4	120.6	104.3	-96.3	168.5	52.9	0	0	113.4	Y795	Q793-Y795 HydrophobicContact CB-CE2 4.41Å; Q793-Y795 PolarHBondContact OE1-OH 2.92Å
794	D	42	Very low	38.1	Very low	157 Å²	157	149.2 Å²	149.2	84%	0.84	80%	0.798	S	S	*	*			trans	-70.1	147.4	168.7	-63	-44.2	0	0	0	112.4
795	Y	39.2	Very low	37.9	Very low	201 Å²	201	146.8 Å²	146.8	79%	0.788	80%	0.798	S	S	*	*			trans	-138.8	136.9	156.5	-79.1	-76.7	0	0	0	114	Q793	Q793-Y795 HydrophobicContact CB-CE2 4.41Å; Q793-Y795 PolarHBondContact OE1-OH 2.92Å
796	D	37.6	Very low	37.7	Very low	136 Å²	136	147.5 Å²	147.5	73%	0.727	80%	0.803	S	S	*	*			trans	-76.6	131.8	-173.7	-176.8	-13.1	0	0	0	113	S798	D796-S798 PolarHBondContact O-N 2.85Å; D796-S798 WeakPolarHBondContact OD1-CB 3.35Å; D796-S798 PolarHBondContact OD1-N 2.91Å; D796-S798 PolarHBondContact OD1-OG 3.03Å
797	L	43.4	Very low	37	Very low	181 Å²	181	141.5 Å²	141.5	95%	0.948	79%	0.792	S	S	*	*			trans	-98.5	52.8	-174.9	-93.8	156.6	0	0	0	112.6
798	S	42.5	Very low	36.7	Very low	73 Å²	73	147.5 Å²	147.5	51%	0.51	80%	0.799	S	S	.	*			trans	-128.1	39.7	-178.7	62.8	0	0	0	0	114.9	D796	D796-S798 PolarHBondContact O-N 2.85Å; D796-S798 WeakPolarHBondContact OD1-CB 3.35Å; D796-S798 PolarHBondContact OD1-N 2.91Å; D796-S798 PolarHBondContact OD1-OG 3.03Å
799	Q	39.7	Very low	36.5	Very low	179 Å²	179	149.8 Å²	149.8	84%	0.836	80%	0.796	S	S	*	*			trans	-152.4	107.8	161.9	-69.3	-66.2	-42.7	0	0	109.7
800	L	35.6	Very low	36.9	Very low	180 Å²	180	151.7 Å²	151.7	94%	0.942	80%	0.795	S	S	*	*			trans	174	82.8	134.1	-90.3	158.7	0	0	0	110
801	Q	30.9	Very low	36.3	Very low	173 Å²	173	148.3 Å²	148.3	81%	0.808	79%	0.791	S	S	*	*			trans	-99.5	115.5	157.7	-102.2	-177	-19.2	0	0	109.3
802	Q	30	Very low	35.8	Very low	168 Å²	168	151.1 Å²	151.1	79%	0.785	80%	0.801	S	S	*	*			trans	65.4	169	139.9	-56.4	-174.4	-2.3	0	0	120.1
803	P	42.6	Very low	35.2	Very low	114 Å²	114	148.9 Å²	148.9	74%	0.74	80%	0.801	S	S	*	*				-132.2	169.3	-59.1	37.7	-22.4	0	0	0	111.3
804	E	31	Very low	35.4	Very low	202 Å²	202	147.7 Å²	147.7	94%	0.944	81%	0.807	S	S	*	*			trans	-128.8	141.4	168.2	-85.1	-166.9	160.9	0	0	113.1
805	A	30.6	Very low	34.9	Very low	89 Å²	89	143.6 Å²	143.6	74%	0.736	80%	0.801	S	S	*	*			trans	-147.6	125.2	161	0	0	0	0	0	112.3
806	M	30.9	Very low	34.8	Very low	198 Å²	198	141.6 Å²	141.6	98%	0.975	81%	0.809	S	S	*	*			trans	67.6	132.5	149.2	-66.9	174.8	-176.2	0	0	118.2
807	G	30.9	Very low	34.9	Very low	61 Å²	61	144.4 Å²	144.4	63%	0.629	81%	0.81	S	S	*	*			cis	148	140.2	6.9	0	0	0	0	0	108.8
808	H	30.2	Very low	34.7	Very low	204 Å²	204	146.4 Å²	146.4	94%	0.944	81%	0.805	S	S	*	*			trans	-173	149.6	148	-87.8	-49.2	0	0	0	111.9
809	V	32.9	Very low	35	Very low	131 Å²	131	149.1 Å²	149.1	79%	0.794	82%	0.818	S	S	*	*			trans	-110.6	159.2	-153.3	175.8	0	0	0	0	109.1
810	P	43.7	Very low	35.2	Very low	111 Å²	111	148.9 Å²	148.9	72%	0.721	82%	0.823	S	S	*	*				-164.1	143.5	64.3	43	-17	0	0	0	123.8
811	S	32	Very low	35.2	Very low	109 Å²	109	144.9 Å²	144.9	76%	0.762	80%	0.799	S	S	*	*			trans	48.6	117.8	132.2	68.9	0	0	0	0	125
812	K	26.5	Very low	35.6	Very low	218 Å²	218	147.7 Å²	147.7	95%	0.948	80%	0.802	S	S	*	*				-167.6	145.2	123.7	-135.1	176.1	-175.7	176.3	0	113.6
813	A	28.7	Very low	36	Very low	84 Å²	84	145.4 Å²	145.4	69%	0.694	80%	0.802	S	S	*	*			trans	-98.2	-171.3	173.6	0	0	0	0	0	111.5
814	P	41.6	Very low	36.1	Very low	133 Å²	133	146.6 Å²	146.6	86%	0.864	81%	0.807	S	S	*	*			cis	-130.3	156	-37.7	26.5	-6.7	0	0	0	113.5
815	G	33.1	Very low	36.4	Very low	71 Å²	71	139.9 Å²	139.9	73%	0.732	79%	0.792	S	S	*	*			trans	153.8	98.2	155.2	0	0	0	0	0	119.2
816	V	37.3	Very low	36.8	Very low	158 Å²	158	140.3 Å²	140.3	96%	0.958	80%	0.795	S	S	*	*			trans	78.6	113.6	151.9	-164	0	0	0	0	118.3
817	R	39	Very low	37.1	Very low	196 Å²	196	139.5 Å²	139.5	74%	0.74	79%	0.789	S	S	*	*			trans	-131.3	145.5	-173.1	-157.2	173	-173.3	-155.3	-4.7	109.5	E821	R817-E821 VanDerWaalsContact CD-OE2 3.22Å; R817-E821 WeakPolarHBondContact CD-OE2 3.37Å; R817-E821 VanDerWaalsContact CZ-CD 3.46Å; R817-E821 IonicContact CZ-OE1 2.86Å; R817-E821 IonicContact CZ-OE2 3.67Å; R817-E821 IonicContact NE-OE1 2.8Å; R817-E821 IonicContact NE-OE2 3.44Å; R817-E821 PolarHBondContact NE-OE2 2.92Å; R817-E821 IonicContact NH1-OE1 3.14Å; R817-E821 PolarHBondContact NH1-OE1 2.99Å; R817-E821 IonicContact NH1-OE2 3.71Å; R817-E821 PolarHBondContact NH1-OE2 3.31Å; R817-E821 IonicContact NH2-OE1 3.82Å; R817-E821 PolarHBondContact NH2-OE1 3.17Å; R817-E821 VanDerWaalsContact NH2-OE1 3.08Å; R817-E821 IonicContact NH2-OE2 3.67Å
818	R	39.3	Very low	37.4	Very low	223 Å²	223	140.8 Å²	140.8	84%	0.842	79%	0.786	S	S	*	*			trans	-73.1	156.2	-174.9	-78.3	-178.4	172.4	139.9	-2.1	113.2	D820	R818-D820 PolarHBondContact O-N 3.37Å
819	V	49.5	Very low	37.9	Very low	129 Å²	129	140.1 Å²	140.1	78%	0.782	78%	0.784	S	S	*	*	S	Bend	trans	-97.6	79.3	-169.1	-168.7	0	0	0	0	110.2
820	D	43.8	Very low	38.2	Very low	175 Å²	175	141.5 Å²	141.5	94%	0.936	78%	0.776	S	S	*	*			trans	-142.8	32.6	153.1	-78.9	-38.7	0	0	0	108.2	R818	R818-D820 PolarHBondContact O-N 3.37Å
821	E	34.5	Very low	38.1	Very low	96 Å²	96	141.6 Å²	141.6	45%	0.449	78%	0.776	S	S	.	*	S	Bend	trans	-117.7	120.7	-177.8	-158.9	163.9	-157.2	0	0	107.5	R817	R817-E821 VanDerWaalsContact CD-OE2 3.22Å; R817-E821 WeakPolarHBondContact CD-OE2 3.37Å; R817-E821 VanDerWaalsContact CZ-CD 3.46Å; R817-E821 IonicContact CZ-OE1 2.86Å; R817-E821 IonicContact CZ-OE2 3.67Å; R817-E821 IonicContact NE-OE1 2.8Å; R817-E821 IonicContact NE-OE2 3.44Å; R817-E821 PolarHBondContact NE-OE2 2.92Å; R817-E821 IonicContact NH1-OE1 3.14Å; R817-E821 PolarHBondContact NH1-OE1 2.99Å; R817-E821 IonicContact NH1-OE2 3.71Å; R817-E821 PolarHBondContact NH1-OE2 3.31Å; R817-E821 IonicContact NH2-OE1 3.82Å; R817-E821 PolarHBondContact NH2-OE1 3.17Å; R817-E821 VanDerWaalsContact NH2-OE1 3.08Å; R817-E821 IonicContact NH2-OE2 3.67Å
822	R	39	Very low	38.6	Very low	232 Å²	232	143.4 Å²	143.4	88%	0.875	78%	0.783	S	S	*	*			trans	-55.6	137.5	173.9	-151.6	-177.4	-140.4	-175.1	5.5	108.7	V824	R822-V824 PolarHBondContact O-N 3.18Å
823	P	38	Very low	39.6	Very low	120 Å²	120	140.5 Å²	140.5	78%	0.779	77%	0.766	S	S	*	*			trans	-56.8	125.1	177.3	-22.7	31.7	0	0	0	111.1	G825	P823-G825 VanDerWaalsContact C-N 3.3Å; P823-G825 PolarHBondContact O-N 3.15Å
824	V	45.1	Very low	40.3	Very low	139 Å²	139	142.2 Å²	142.2	84%	0.842	77%	0.77	S	S	*	*			trans	-69.4	91.8	164.9	179.5	0	0	0	0	107.2	R822	R822-V824 PolarHBondContact O-N 3.18Å
825	G	37.4	Very low	40.5	Very low	61 Å²	61	144.5 Å²	144.5	63%	0.629	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-72.8	143.6	158.1	0	0	0	0	0	109.2	P823 E827	P823-G825 VanDerWaalsContact C-N 3.3Å; P823-G825 PolarHBondContact O-N 3.15Å; G825-E827 PolarHBondContact O-N 2.89Å
826	A	39.7	Very low	41.5	Very low	98 Å²	98	147 Å²	147	81%	0.81	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-50.5	129.4	-177.9	0	0	0	0	0	111.5	P828	A826-P828 WeakPolarHBondContact O-CD 3.39Å
827	E	36.8	Very low	42	Very low	180 Å²	180	142.2 Å²	142.2	84%	0.841	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-48.3	122.9	167.4	-87.1	173.4	137.5	0	0	109.7	G825 Q829	G825-E827 PolarHBondContact O-N 2.89Å; E827-Q829 PolarHBondContact O-N 2.91Å; E827-Q829 VanDerWaalsContact O-N 3.15Å
828	P	37.2	Very low	42.8	Very low	88 Å²	88	140.4 Å²	140.4	57%	0.571	74%	0.744	S	S	*	*			trans	-65.7	113.9	159.6	-7.4	22.7	0	0	0	106.6	A826 Y830	A826-P828 WeakPolarHBondContact O-CD 3.39Å; P828-Y830 HydrophobicContact CB-CD2 4.29Å; P828-Y830 HydrophobicContact CB-CE2 3.96Å; P828-Y830 HydrophobicContact CG-CE2 4.2Å; P828-Y830 WeakPolarHBondContact O-CD2 3.41Å; P828-Y830 PolarHBondContact O-N 2.77Å
829	Q	40.6	Very low	43.5	Very low	190 Å²	190	135.3 Å²	135.3	89%	0.888	74%	0.74	S	S	*	*			trans	-62.7	92.7	163.1	-85.6	177.3	-17.4	0	0	108	E827	E827-Q829 PolarHBondContact O-N 2.91Å; E827-Q829 VanDerWaalsContact O-N 3.15Å
830	Y	38.3	Very low	43.8	Very low	161 Å²	161	132.5 Å²	132.5	63%	0.631	74%	0.736	S	S	*	*			trans	-67.5	126.2	163.7	-74.3	-80.4	0	0	0	107.9	P828 V832	P828-Y830 HydrophobicContact CB-CD2 4.29Å; P828-Y830 HydrophobicContact CB-CE2 3.96Å; P828-Y830 HydrophobicContact CG-CE2 4.2Å; P828-Y830 WeakPolarHBondContact O-CD2 3.41Å; P828-Y830 PolarHBondContact O-N 2.77Å; Y830-V832 PolarHBondContact O-N 3.03Å
831	P	42.1	Very low	44.5	Very low	113 Å²	113	128.7 Å²	128.7	73%	0.734	72%	0.716	S	S	*	*			trans	-58.9	130.5	168.8	22.4	-28.9	0	0	0	108.5	R833	P831-R833 PolarHBondContact O-N 2.85Å
832	V	43.8	Very low	45.6	Very low	147 Å²	147	128.4 Å²	128.4	89%	0.891	72%	0.717	S	S	*	*			trans	-53.2	113.4	177.5	179.6	0	0	0	0	108.6	Y830	Y830-V832 PolarHBondContact O-N 3.03Å
833	R	46.5	Very low	46.5	Very low	156 Å²	156	119.5 Å²	119.5	59%	0.589	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-82.8	132.9	-179.4	-144.6	-177	-74.7	-140	5.1	109.2	P831	P831-R833 PolarHBondContact O-N 2.85Å
834	P	43.3	Very low	47.6	Very low	121 Å²	121	119 Å²	119	79%	0.786	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-65.8	148.5	-179.9	-17.8	30.3	0	0	0	112.7	V836	P834-V836 PolarHBondContact O-N 3.33Å
835	M	46.7	Very low	48.5	Very low	180 Å²	180	117.4 Å²	117.4	89%	0.887	67%	0.67	S	S	*	*	S	Bend	trans	-57.9	130.6	175.1	-67.3	170.6	78.9	0	0	111.8
836	V	54.6	Low	49.5	Very low	123 Å²	123	119 Å²	119	75%	0.745	66%	0.662	S	S	*	*			trans	42.4	108.8	154.9	-169.1	0	0	0	0	116.8	P834	P834-V836 PolarHBondContact O-N 3.33Å
837	P	46.5	Very low	50.5	Low	58 Å²	58	119.4 Å²	119.4	38%	0.377	65%	0.651	S	S	.	*			trans	-77.8	151.5	168.1	8.1	8.4	0	0	0	111.3	F845	P837-F845 HydrophobicContact CG-CB 4.29Å; P837-F845 HydrophobicContact CG-CD2 3.87Å; P837-F845 HydrophobicContact CG-CG 4.23Å
838	H	56.8	Low	51.7	Low	158 Å²	158	117 Å²	117	73%	0.731	64%	0.64	S	S	*	*			trans	-62.9	158	177.5	-84.7	54.9	0	0	0	112.1	G840 D841	H838-G840 PolarHBondContact O-N 2.83Å; H838-D841 PolarHBondContact O-N 2.91Å
839	P	52.4	Low	52.9	Low	117 Å²	117	114.3 Å²	114.3	76%	0.76	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-3.3	-167.9	-22	32.8	0	0	0	117.1
840	G	57.5	Low	53.9	Low	69 Å²	69	110.3 Å²	110.3	71%	0.711	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-21.8	178.1	0	0	0	0	0	115.1	H838	H838-G840 PolarHBondContact O-N 2.83Å
841	D	56.9	Low	54.9	Low	96 Å²	96	111.5 Å²	111.5	51%	0.513	62%	0.616	S	S	.	*			trans	-111.3	19.2	-170	-65	-20.3	0	0	0	113.1	H838 G843 D844 F845	H838-D841 PolarHBondContact O-N 2.91Å; D841-G843 PolarHBondContact O-N 2.89Å; D841-D844 PolarHBondContact O-N 2.85Å; D841-F845 PolarHBondContact O-N 2.82Å; D841-F845 VanDerWaalsContact O-N 3.11Å
842	I	57.3	Low	55.9	Low	90 Å²	90	108.6 Å²	108.6	46%	0.462	60%	0.601	S	S	.	*	H	α-helix	trans	-62.6	-32.5	178.9	-77.3	161.7	0	0	0	111.4	F845 I846	I842-F845 PolarHBondContact O-N 3.38Å; I842-I846 HydrophobicContact CG2-CD1 3.66Å; I842-I846 HydrophobicContact CG2-CG1 4.37Å; I842-I846 WeakPolarHBondContact O-CB 3.34Å; I842-I846 WeakPolarHBondContact O-CD1 3.41Å; I842-I846 WeakPolarHBondContact O-CG1 3.41Å; I842-I846 PolarHBondContact O-N 3.17Å
843	G	58.1	Low	56.5	Low	44 Å²	44	104.1 Å²	104.1	45%	0.454	58%	0.58	S	S	.	*	H	α-helix	trans	-63.5	-44.2	176.8	0	0	0	0	0	112.8	D841 I846 N847	D841-G843 PolarHBondContact O-N 2.89Å; G843-I846 PolarHBondContact O-N 3.37Å; G843-N847 WeakPolarHBondContact O-CB 3.27Å; G843-N847 PolarHBondContact O-N 3.21Å
844	D	61.8	Low	57	Low	110 Å²	110	98.9 Å²	98.9	59%	0.588	56%	0.563	S	S	*	*	H	α-helix	trans	-72.1	-35.9	179.5	-70	-22.3	0	0	0	111.5	D841 I846 N847 E848	D841-D844 PolarHBondContact O-N 2.85Å; D844-I846 VanDerWaalsContact C-N 3.35Å; D844-I846 PolarHBondContact O-N 3.18Å; D844-N847 PolarHBondContact O-N 2.67Å; D844-E848 VanDerWaalsContact O-CB 3.24Å; D844-E848 WeakPolarHBondContact O-CB 3.46Å; D844-E848 PolarHBondContact O-N 2.76Å
845	F	64.1	Low	57.6	Low	106 Å²	106	98.5 Å²	98.5	47%	0.465	55%	0.554	S	S	.	*	H	α-helix	trans	-61.3	-41.9	172.9	-179.6	-96.2	0	0	0	112.4	P837 D841 I842 G849	P837-F845 HydrophobicContact CG-CB 4.29Å; P837-F845 HydrophobicContact CG-CD2 3.87Å; P837-F845 HydrophobicContact CG-CG 4.23Å; D841-F845 PolarHBondContact O-N 2.82Å; D841-F845 VanDerWaalsContact O-N 3.11Å; I842-F845 PolarHBondContact O-N 3.38Å; F845-G849 PolarHBondContact O-N 3.35Å
846	I	58.4	Low	58.3	Low	93 Å²	93	92.4 Å²	92.4	48%	0.477	53%	0.526	S	S	.	.	H	α-helix	trans	-68.5	-46.1	177.3	-68.6	167.3	0	0	0	110.3	I842 G843 D844 E848 G849 L850	I842-I846 HydrophobicContact CG2-CD1 3.66Å; I842-I846 HydrophobicContact CG2-CG1 4.37Å; I842-I846 WeakPolarHBondContact O-CB 3.34Å; I842-I846 WeakPolarHBondContact O-CD1 3.41Å; I842-I846 WeakPolarHBondContact O-CG1 3.41Å; I842-I846 PolarHBondContact O-N 3.17Å; G843-I846 PolarHBondContact O-N 3.37Å; D844-I846 VanDerWaalsContact C-N 3.35Å; D844-I846 PolarHBondContact O-N 3.18Å; I846-E848 VanDerWaalsContact C-N 3.34Å; I846-E848 PolarHBondContact O-N 3.28Å; I846-G849 PolarHBondContact O-N 3.12Å; I846-L850 PolarHBondContact O-N 3.48Å
847	N	59.9	Low	58.1	Low	107 Å²	107	92.7 Å²	92.7	57%	0.572	53%	0.53	S	S	*	.	H	α-helix	trans	-63.7	-38	179.2	-85.1	-6.1	0	0	0	112.6	G843 D844 L850 R851	G843-N847 WeakPolarHBondContact O-CB 3.27Å; G843-N847 PolarHBondContact O-N 3.21Å; D844-N847 PolarHBondContact O-N 2.67Å; N847-L850 PolarHBondContact O-N 2.77Å; N847-R851 WeakPolarHBondContact O-CB 3.34Å; N847-R851 PolarHBondContact O-N 2.91Å
848	E	63.4	Low	58.5	Low	131 Å²	131	95 Å²	95	61%	0.612	54%	0.543	S	S	*	.	H	α-helix	trans	-73.5	-30.6	178	-158.9	169.3	-144.5	0	0	112	D844 I846 A852	D844-E848 VanDerWaalsContact O-CB 3.24Å; D844-E848 WeakPolarHBondContact O-CB 3.46Å; D844-E848 PolarHBondContact O-N 2.76Å; I846-E848 VanDerWaalsContact C-N 3.34Å; I846-E848 PolarHBondContact O-N 3.28Å; E848-A852 WeakPolarHBondContact O-CB 3.25Å; E848-A852 PolarHBondContact O-N 3.14Å; E848-A852 VanDerWaalsContact O-N 3.15Å
849	G	62.4	Low	58.3	Low	31 Å²	31	90.1 Å²	90.1	32%	0.32	53%	0.53	S	S	.	.	H	α-helix	trans	-66.5	-45.1	169.2	0	0	0	0	0	113	F845 I846 A852 A853	F845-G849 PolarHBondContact O-N 3.35Å; I846-G849 PolarHBondContact O-N 3.12Å; G849-A852 PolarHBondContact O-N 2.88Å; G849-A853 PolarHBondContact O-N 3.38Å; G849-A853 VanDerWaalsContact O-N 3.09Å
850	L	61.1	Low	58.1	Low	105 Å²	105	88.9 Å²	88.9	55%	0.55	52%	0.522	S	S	.	.	H	α-helix	trans	-61.7	-45.5	176.5	-138.8	89.8	0	0	0	110.8	I846 N847 A852 A853 D854	I846-L850 PolarHBondContact O-N 3.48Å; N847-L850 PolarHBondContact O-N 2.77Å; L850-A852 VanDerWaalsContact C-N 3.27Å; L850-A852 PolarHBondContact O-N 3.08Å; L850-A853 PolarHBondContact O-N 2.92Å; L850-D854 PolarHBondContact O-N 3.45Å
851	R	59.4	Low	57.5	Low	187 Å²	187	91.5 Å²	91.5	71%	0.706	53%	0.526	S	S	*	.	H	α-helix	trans	-65.8	-28.1	179.6	-145.7	175.9	92	167.7	5.7	113.1	N847 N855	N847-R851 WeakPolarHBondContact O-CB 3.34Å; N847-R851 PolarHBondContact O-N 2.91Å; R851-N855 PolarHBondContact O-ND2 2.84Å
852	A	61.9	Low	56.9	Low	51 Å²	51	97.7 Å²	97.7	42%	0.421	54%	0.544	S	S	.	.	H	α-helix	trans	-76.4	-37.1	174.5	0	0	0	0	0	112.2	E848 G849 L850 D856	E848-A852 WeakPolarHBondContact O-CB 3.25Å; E848-A852 PolarHBondContact O-N 3.14Å; E848-A852 VanDerWaalsContact O-N 3.15Å; G849-A852 PolarHBondContact O-N 2.88Å; L850-A852 VanDerWaalsContact C-N 3.27Å; L850-A852 PolarHBondContact O-N 3.08Å; A852-D856 PolarHBondContact O-N 3.37Å
853	A	58.2	Low	56	Low	54 Å²	54	100.5 Å²	100.5	45%	0.446	56%	0.56	S	S	.	*	H	α-helix	trans	-74.2	-31.4	176.7	0	0	0	0	0	113.2	G849 L850 N855 R902	G849-A853 PolarHBondContact O-N 3.38Å; G849-A853 VanDerWaalsContact O-N 3.09Å; L850-A853 PolarHBondContact O-N 2.92Å; A853-N855 VanDerWaalsContact C-N 3.3Å; A853-R902 PolarHBondContact O-NH1 2.96Å; A853-R902 PolarHBondContact O-NH2 2.87Å
854	D	57.1	Low	54.9	Low	46 Å²	46	102.8 Å²	102.8	25%	0.246	57%	0.569	C	S	.	*	H	α-helix	trans	-68.5	-29.7	174	-83.9	-18.3	0	0	0	113.4	L850 R902	L850-D854 PolarHBondContact O-N 3.45Å; D854-R902 PolarHBondContact O-NH1 2.83Å; D854-R902 IonicContact OD1-CZ 2.92Å; D854-R902 VanDerWaalsContact OD1-CZ 3.26Å; D854-R902 IonicContact OD1-NE 3.18Å; D854-R902 PolarHBondContact OD1-NE 3.44Å; D854-R902 IonicContact OD1-NH2 2.63Å; D854-R902 PolarHBondContact OD1-NH2 3.21Å
855	N	54.4	Low	53.8	Low	112 Å²	112	105.9 Å²	105.9	60%	0.599	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	10.8	-176.5	-67.3	-58.3	0	0	0	113.6	R851 A853 P857	R851-N855 PolarHBondContact O-ND2 2.84Å; A853-N855 VanDerWaalsContact C-N 3.3Å; N855-P857 WeakPolarHBondContact O-CD 3.39Å
856	D	61.2	Low	52.4	Low	53 Å²	53	108.3 Å²	108.3	28%	0.283	60%	0.602	S	S	.	*			trans	-80.1	109.7	176.7	-173	-11.3	0	0	0	110.7	A852 T858	A852-D856 PolarHBondContact O-N 3.37Å; D856-T858 PolarHBondContact O-N 2.82Å; D856-T858 WeakPolarHBondContact OD1-CB 3.48Å; D856-T858 PolarHBondContact OD1-N 3.02Å; D856-T858 PolarHBondContact OD1-OG1 2.86Å
857	P	52.3	Low	51.4	Low	128 Å²	128	110 Å²	110	83%	0.831	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-1.2	-178	34.3	-35.1	0	0	0	113.4	N855	N855-P857 WeakPolarHBondContact O-CD 3.39Å
858	T	53.4	Low	50.2	Low	108 Å²	108	113.5 Å²	113.5	66%	0.663	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-7.3	-179.1	65.8	0	0	0	0	113.9	D856	D856-T858 PolarHBondContact O-N 2.82Å; D856-T858 WeakPolarHBondContact OD1-CB 3.48Å; D856-T858 PolarHBondContact OD1-N 3.02Å; D856-T858 PolarHBondContact OD1-OG1 2.86Å
859	A	53.5	Low	49	Very low	55 Å²	55	114.8 Å²	114.8	46%	0.455	64%	0.638	S	S	.	*	S	Bend	trans	-73.8	124	173.8	0	0	0	0	0	110.4
860	P	48.2	Very low	47.9	Very low	90 Å²	90	124.2 Å²	124.2	58%	0.584	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-68.4	146.2	-178.6	26.7	-32.2	0	0	0	111.4	Y862	P860-Y862 PolarHBondContact O-N 3.18Å
861	P	44.9	Very low	46.7	Very low	124 Å²	124	127.1 Å²	127.1	81%	0.805	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-70	116.5	174.1	28.3	-30.2	0	0	0	108.7	D863	P861-D863 PolarHBondContact O-N 3.45Å
862	Y	42.8	Very low	45.5	Very low	227 Å²	227	121.2 Å²	121.2	89%	0.89	67%	0.673	S	S	*	*			trans	-74.4	95	174.6	-81.9	-86.3	0	0	0	109.5	P860	P860-Y862 PolarHBondContact O-N 3.18Å
863	D	39.9	Very low	44.5	Very low	148 Å²	148	125.1 Å²	125.1	79%	0.791	70%	0.698	S	S	*	*			trans	-146.7	89	159.1	-163.6	7.3	0	0	0	109.4	P861	P861-D863 PolarHBondContact O-N 3.45Å
864	S	34.9	Very low	44	Very low	93 Å²	93	126.5 Å²	126.5	65%	0.65	72%	0.717	S	S	*	*			trans	-155.7	123.8	156.9	58.9	0	0	0	0	109.8	L866	S864-L866 PolarHBondContact O-N 3.25Å
865	L	38	Very low	42.9	Very low	174 Å²	174	129.4 Å²	129.4	91%	0.911	74%	0.741	S	S	*	*	S	Bend	trans	-65.4	38.1	-179.4	-80	156.1	0	0	0	114.3
866	L	35.7	Very low	42.2	Very low	158 Å²	158	131.5 Å²	131.5	83%	0.827	76%	0.758	S	S	*	*			trans	-124.9	13.5	-170.2	-103.6	152.5	0	0	0	114.8	S864	S864-L866 PolarHBondContact O-N 3.25Å
867	V	37.1	Very low	41.3	Very low	127 Å²	127	132.6 Å²	132.6	77%	0.77	77%	0.774	S	S	*	*			trans	-137.7	81	173.5	-170.6	0	0	0	0	110.1
868	F	34.9	Very low	40.7	Very low	181 Å²	181	130.1 Å²	130.1	79%	0.794	77%	0.772	S	S	*	*			trans	-127.4	93.1	156.1	-96.3	-79.8	0	0	0	107.4
869	D	36.7	Very low	39.8	Very low	158 Å²	158	129.7 Å²	129.7	85%	0.845	77%	0.774	S	S	*	*			trans	-171.7	74.9	149.6	-104.7	-9.3	0	0	0	108.1
870	Y	40	Very low	39.3	Very low	229 Å²	229	134.1 Å²	134.1	90%	0.898	80%	0.795	S	S	*	*			trans	-168.4	65.6	154	-130.3	-90.9	0	0	0	111.2
871	E	36.4	Very low	38.7	Very low	167 Å²	167	134.9 Å²	134.9	78%	0.78	80%	0.802	S	S	*	*			trans	-96.3	92.7	162.1	-77.4	-164.9	168.9	0	0	109.9
872	G	33.8	Very low	38.2	Very low	63 Å²	63	134.1 Å²	134.1	65%	0.649	80%	0.8	S	S	*	*			trans	-71.6	136	159.9	0	0	0	0	0	110.1	G874	G872-G874 PolarHBondContact O-N 2.88Å
873	S	41.3	Very low	37.8	Very low	133 Å²	133	130.7 Å²	130.7	93%	0.93	80%	0.796	S	S	*	*	S	Bend	trans	-59.6	112.1	178.5	21.7	0	0	0	0	112.3
874	G	47.9	Very low	37.7	Very low	82 Å²	82	131.2 Å²	131.2	85%	0.845	80%	0.799	S	S	*	*			trans	163.1	35.9	170.6	0	0	0	0	0	119.9	G872	G872-G874 PolarHBondContact O-N 2.88Å
875	S	32.5	Very low	37.7	Very low	108 Å²	108	132.3 Å²	132.3	76%	0.755	81%	0.806	S	S	*	*			trans	-121.8	137	173	-164.8	0	0	0	0	113
876	T	40.1	Very low	37.4	Very low	156 Å²	156	128.2 Å²	128.2	96%	0.957	79%	0.792	S	S	*	*			trans	-94.7	24	-173.7	50.2	0	0	0	0	114
877	A	41.9	Very low	37.9	Very low	75 Å²	75	126.7 Å²	126.7	62%	0.62	80%	0.795	S	S	*	*	S	Bend	trans	-113.8	124.2	171	0	0	0	0	0	108.8	S879	A877-S879 PolarHBondContact O-N 2.76Å
878	G	39.9	Very low	38.1	Very low	77 Å²	77	125.2 Å²	125.2	79%	0.794	79%	0.79	S	S	*	*			trans	-62.5	125.8	-177.1	0	0	0	0	0	112	V880	G878-V880 PolarHBondContact O-N 3.02Å
879	S	35.5	Very low	38.9	Very low	99 Å²	99	119.9 Å²	119.9	69%	0.692	79%	0.787	S	S	*	*			trans	-59.2	123.7	173.8	-72.6	0	0	0	0	111.6	A877 S881	A877-S879 PolarHBondContact O-N 2.76Å; S879-S881 PolarHBondContact O-N 2.97Å
880	V	43.7	Very low	39.6	Very low	148 Å²	148	119.9 Å²	119.9	90%	0.897	79%	0.786	S	S	*	*			trans	-82.3	82.5	165.3	-84.2	0	0	0	0	109.2	G878	G878-V880 PolarHBondContact O-N 3.02Å
881	S	34.9	Very low	40	Very low	105 Å²	105	113.7 Å²	113.7	73%	0.734	77%	0.766	S	S	*	*			trans	-137.5	63.4	172.9	-52.4	0	0	0	0	110.9	S879	S879-S881 PolarHBondContact O-N 2.97Å
882	S	34.1	Very low	40.8	Very low	109 Å²	109	111.4 Å²	111.4	76%	0.762	76%	0.759	S	S	*	*			trans	-168.2	80	161.4	50.4	0	0	0	0	111.8
883	L	34.7	Very low	42	Very low	155 Å²	155	111.7 Å²	111.7	81%	0.812	74%	0.741	S	S	*	*			trans	-105.2	78.8	158.9	-74.1	177	0	0	0	109.3
884	N	37.7	Very low	42.8	Very low	158 Å²	158	110.1 Å²	110.1	85%	0.845	72%	0.722	S	S	*	*	S	Bend	trans	-153.7	40	142.3	-146.3	13.1	0	0	0	114.1
885	S	33.9	Very low	43.4	Very low	117 Å²	117	111.6 Å²	111.6	82%	0.818	70%	0.703	S	S	*	*			trans	-147.4	82.1	170.8	-63.2	0	0	0	0	111.4
886	S	33.7	Very low	44.7	Very low	88 Å²	88	107.1 Å²	107.1	62%	0.615	67%	0.67	S	S	*	*			trans	-167.5	114.2	141.3	46.2	0	0	0	0	110.6	S888	S886-S888 PolarHBondContact O-N 2.84Å
887	S	45.4	Very low	45.7	Very low	126 Å²	126	103.1 Å²	103.1	88%	0.881	64%	0.643	S	S	*	*			trans	-81.8	92.4	163.4	56.4	0	0	0	0	108.8
888	S	41.2	Very low	46.5	Very low	95 Å²	95	106 Å²	106	66%	0.664	65%	0.648	S	S	*	*			trans	-163	133.3	156.3	51.1	0	0	0	0	108.6	S886	S886-S888 PolarHBondContact O-N 2.84Å
889	G	51.9	Low	47.4	Very low	70 Å²	70	109.3 Å²	109.3	72%	0.722	64%	0.637	S	S	*	*	S	Bend	trans	-60.4	160	-174.8	0	0	0	0	0	114.5
890	D	50.2	Low	48.7	Very low	157 Å²	157	105.6 Å²	105.6	84%	0.84	61%	0.614	S	S	*	*			trans	75.7	83	176.8	-53.9	-18.1	0	0	0	115
891	Q	48.9	Very low	49.5	Very low	100 Å²	100	103.1 Å²	103.1	47%	0.467	60%	0.601	S	S	.	*			trans	-91.5	95.1	161	-68.1	-174.5	10.3	0	0	108.1	Y893	Q891-Y893 HydrophobicContact CB-CE1 4.39Å; Q891-Y893 HydrophobicContact CB-CE2 4.18Å; Q891-Y893 WeakPolarHBondContact O-CD2 3.38Å; Q891-Y893 PolarHBondContact O-N 3.49Å; Q891-Y893 PolarHBondContact OE1-OH 3.14Å
892	D	52.8	Low	50.7	Low	119 Å²	119	104.6 Å²	104.6	64%	0.636	59%	0.591	S	S	*	*			trans	-72.4	114.5	172	-79.4	-24.4	0	0	0	109.7	D894 Y895	D892-D894 VanDerWaalsContact C-N 3.3Å; D892-Y895 WeakPolarHBondContact O-CD1 3.18Å; D892-Y895 WeakPolarHBondContact O-CE1 3.39Å
893	Y	59	Low	51.9	Low	68 Å²	68	103.7 Å²	103.7	27%	0.267	57%	0.573	S	S	.	*			trans	-89.8	11.7	179.2	-65.4	-68.2	0	0	0	113.5	Q891 Y895 L896 Y910	Q891-Y893 HydrophobicContact CB-CE1 4.39Å; Q891-Y893 HydrophobicContact CB-CE2 4.18Å; Q891-Y893 WeakPolarHBondContact O-CD2 3.38Å; Q891-Y893 PolarHBondContact O-N 3.49Å; Q891-Y893 PolarHBondContact OE1-OH 3.14Å; Y893-Y895 PolarHBondContact O-N 3.11Å; Y893-Y895 VanDerWaalsContact O-N 3.15Å; Y893-L896 HydrophobicContact CD1-CD1 4.27Å; Y893-L896 WeakPolarHBondContact O-CB 3.42Å; Y893-L896 PolarHBondContact O-N 2.97Å; Y893-Y910 WeakPolarHBondContact CD2-O 3.4Å
894	D	58.2	Low	53.2	Low	100 Å²	100	102.1 Å²	102.1	54%	0.535	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-60.3	-28	-174.1	-73	-14.8	0	0	0	113.6	D892 L896 N897	D892-D894 VanDerWaalsContact C-N 3.3Å; D894-L896 PolarHBondContact O-N 3.33Å; D894-N897 PolarHBondContact O-N 3.06Å
895	Y	60.6	Low	54.3	Low	113 Å²	113	103.1 Å²	103.1	44%	0.443	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-68	-16	178.7	63.3	-95.6	0	0	0	113.6	D892 Y893 N897 D898 W899	D892-Y895 WeakPolarHBondContact O-CD1 3.18Å; D892-Y895 WeakPolarHBondContact O-CE1 3.39Å; Y893-Y895 PolarHBondContact O-N 3.11Å; Y893-Y895 VanDerWaalsContact O-N 3.15Å; Y895-N897 PolarHBondContact O-N 3.14Å; Y895-D898 PolarHBondContact O-N 2.87Å; Y895-W899 AromaticContact CD2-CZ2 3.83Å; Y895-W899 HydrophobicContact CD2-CZ2 3.83Å; Y895-W899 HydrophobicContact CE2-CH2 4.27Å; Y895-W899 AromaticContact CE2-CZ2 3.97Å; Y895-W899 HydrophobicContact CE2-CZ2 3.97Å; Y895-W899 PolarHBondContact O-NE1 3.42Å
896	L	60.5	Low	55.5	Low	14 Å²	14	101.6 Å²	101.6	7%	0.073	54%	0.539	C	S	.	.	G	3₁₀ helix	trans	-68	-22.2	175.9	-68.1	175.1	0	0	0	112.3	Y893 D894 D898 W899 A907	Y893-L896 HydrophobicContact CD1-CD1 4.27Å; Y893-L896 WeakPolarHBondContact O-CB 3.42Å; Y893-L896 PolarHBondContact O-N 2.97Å; D894-L896 PolarHBondContact O-N 3.33Å; L896-D898 VanDerWaalsContact C-N 3.3Å; L896-W899 HydrophobicContact CD2-CE3 4.2Å; L896-W899 HydrophobicContact CD2-CZ3 4.28Å; L896-A907 HydrophobicContact CB-CB 3.82Å
897	N	60.8	Low	57	Low	72 Å²	72	97.4 Å²	97.4	39%	0.385	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-72.6	-24.9	174.5	-77	-41.5	0	0	0	112.6	D894 Y895 W899 A907 G912	D894-N897 PolarHBondContact O-N 3.06Å; Y895-N897 PolarHBondContact O-N 3.14Å; N897-W899 VanDerWaalsContact C-N 3.29Å; N897-W899 PolarHBondContact O-N 3.25Å; N897-A907 WeakPolarHBondContact OD1-CB 3.24Å; N897-G912 PolarHBondContact ND2-O 2.98Å
898	D	59	Low	57.9	Low	137 Å²	137	96 Å²	96	73%	0.733	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-80.2	-11.8	-179.7	-67.7	-24.2	0	0	0	112.9	Y895 L896 G900	Y895-D898 PolarHBondContact O-N 2.87Å; L896-D898 VanDerWaalsContact C-N 3.3Å; D898-G900 PolarHBondContact O-N 3.27Å
899	W	59.3	Low	58.9	Low	145 Å²	145	97.6 Å²	97.6	55%	0.549	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-87.2	5.9	-174.2	-67.6	14.9	0	0	0	113.4	Y895 L896 N897 F903	Y895-W899 AromaticContact CD2-CZ2 3.83Å; Y895-W899 HydrophobicContact CD2-CZ2 3.83Å; Y895-W899 HydrophobicContact CE2-CH2 4.27Å; Y895-W899 AromaticContact CE2-CZ2 3.97Å; Y895-W899 HydrophobicContact CE2-CZ2 3.97Å; Y895-W899 PolarHBondContact O-NE1 3.42Å; L896-W899 HydrophobicContact CD2-CE3 4.2Å; L896-W899 HydrophobicContact CD2-CZ3 4.28Å; N897-W899 VanDerWaalsContact C-N 3.29Å; N897-W899 PolarHBondContact O-N 3.25Å; W899-F903 HydrophobicContact CB-CB 4.38Å; W899-F903 HydrophobicContact CB-CD2 3.94Å; W899-F903 HydrophobicContact CB-CG 4.27Å; W899-F903 VanDerWaalsContact O-CD2 3.28Å; W899-F903 WeakPolarHBondContact O-CD2 3.48Å
900	G	61.4	Low	59.2	Low	21 Å²	21	100.4 Å²	100.4	22%	0.216	48%	0.48	C	S	.	.			trans	94	169.5	172.9	0	0	0	0	0	114.2	D898 R902 F903	D898-G900 PolarHBondContact O-N 3.27Å; G900-R902 PolarHBondContact O-N 2.95Å; G900-F903 PolarHBondContact O-N 3.21Å; G900-F903 VanDerWaalsContact O-N 3.1Å
901	P	61.8	Low	59.7	Low	97 Å²	97	96 Å²	96	63%	0.63	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-15.1	-163.5	22.1	-32	0	0	0	115.1
902	R	59.3	Low	60	Low	136 Å²	136	91.7 Å²	91.7	51%	0.513	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-22.2	177.7	-66	-165.4	-76.9	-149.6	6	113.5	A853 D854 G900	A853-R902 PolarHBondContact O-NH1 2.96Å; A853-R902 PolarHBondContact O-NH2 2.87Å; D854-R902 PolarHBondContact O-NH1 2.83Å; D854-R902 IonicContact OD1-CZ 2.92Å; D854-R902 VanDerWaalsContact OD1-CZ 3.26Å; D854-R902 IonicContact OD1-NE 3.18Å; D854-R902 PolarHBondContact OD1-NE 3.44Å; D854-R902 IonicContact OD1-NH2 2.63Å; D854-R902 PolarHBondContact OD1-NH2 3.21Å; G900-R902 PolarHBondContact O-N 2.95Å
903	F	59.3	Low	59.7	Low	89 Å²	89	88.1 Å²	88.1	39%	0.39	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-4	179.5	-61.1	-83.9	0	0	0	113.2	W899 G900 K905 L906 A907	W899-F903 HydrophobicContact CB-CB 4.38Å; W899-F903 HydrophobicContact CB-CD2 3.94Å; W899-F903 HydrophobicContact CB-CG 4.27Å; W899-F903 VanDerWaalsContact O-CD2 3.28Å; W899-F903 WeakPolarHBondContact O-CD2 3.48Å; G900-F903 PolarHBondContact O-N 3.21Å; G900-F903 VanDerWaalsContact O-N 3.1Å; F903-K905 VanDerWaalsContact C-N 3.26Å; F903-K905 PolarHBondContact O-N 2.76Å; F903-L906 WeakPolarHBondContact O-CA 3.45Å; F903-L906 VanDerWaalsContact O-CB 3.28Å; F903-L906 WeakPolarHBondContact O-CB 3.49Å; F903-L906 PolarHBondContact O-N 2.87Å; F903-A907 PolarHBondContact O-N 3.29Å
904	K	63.5	Low	59.1	Low	123 Å²	123	94.6 Å²	94.6	54%	0.535	48%	0.479	S	S	.	.	H	α-helix	trans	-55	-38.9	179.3	-172.8	165.4	-175.2	162.8	0	113.3	L906 A907 D908	K904-L906 VanDerWaalsContact C-N 3.26Å; K904-L906 PolarHBondContact O-N 3.23Å; K904-A907 PolarHBondContact O-N 3.37Å; K904-D908 WeakPolarHBondContact O-CB 3.25Å; K904-D908 PolarHBondContact O-N 3.19Å
905	K	60.6	Low	58.4	Low	179 Å²	179	99 Å²	99	78%	0.778	50%	0.496	S	S	*	.	H	α-helix	trans	-70	-25	178.4	-148.2	-178.7	-175	-173.3	0	112.9	F903 M909	F903-K905 VanDerWaalsContact C-N 3.26Å; F903-K905 PolarHBondContact O-N 2.76Å; K905-M909 PolarHBondContact O-N 2.79Å
906	L	59.2	Low	57.3	Low	85 Å²	85	105.1 Å²	105.1	45%	0.445	54%	0.536	S	S	.	.	H	α-helix	trans	-79.9	-41.5	174	-143.6	96.3	0	0	0	110.1	F903 K904 M909 Y910	F903-L906 WeakPolarHBondContact O-CA 3.45Å; F903-L906 VanDerWaalsContact O-CB 3.28Å; F903-L906 WeakPolarHBondContact O-CB 3.49Å; F903-L906 PolarHBondContact O-N 2.87Å; K904-L906 VanDerWaalsContact C-N 3.26Å; K904-L906 PolarHBondContact O-N 3.23Å; L906-M909 PolarHBondContact O-N 2.86Å; L906-M909 VanDerWaalsContact O-N 3.16Å; L906-Y910 HydrophobicContact CG-CD2 4.44Å; L906-Y910 HydrophobicContact CG-CE2 4.37Å; L906-Y910 WeakPolarHBondContact O-CD2 3.39Å; L906-Y910 PolarHBondContact O-N 2.92Å
907	A	65	Low	57.2	Low	0 Å²	0	109.7 Å²	109.7	0%	0	56%	0.559	C	S	.	*	H	α-helix	trans	-60.1	-43.5	173.4	0	0	0	0	0	111.8	L896 N897 F903 K904 M909 Y910 G911 G912	L896-A907 HydrophobicContact CB-CB 3.82Å; N897-A907 WeakPolarHBondContact OD1-CB 3.24Å; F903-A907 PolarHBondContact O-N 3.29Å; K904-A907 PolarHBondContact O-N 3.37Å; A907-M909 PolarHBondContact O-N 2.92Å; A907-Y910 PolarHBondContact O-N 3.11Å; A907-G911 PolarHBondContact O-N 2.76Å; A907-G912 PolarHBondContact O-N 3.13Å
908	D	63.8	Low	57	Low	95 Å²	95	111.6 Å²	111.6	51%	0.508	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.1	-28.7	175.4	-72.2	-18.2	0	0	0	112.8	K904	K904-D908 WeakPolarHBondContact O-CB 3.25Å; K904-D908 PolarHBondContact O-N 3.19Å
909	M	62.2	Low	56.9	Low	129 Å²	129	110.2 Å²	110.2	64%	0.635	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-25.2	-175.7	-162.4	177	69.5	0	0	112.9	K905 L906 A907	K905-M909 PolarHBondContact O-N 2.79Å; L906-M909 PolarHBondContact O-N 2.86Å; L906-M909 VanDerWaalsContact O-N 3.16Å; A907-M909 PolarHBondContact O-N 2.92Å
910	Y	59.1	Low	56.7	Low	130 Å²	130	108.2 Å²	108.2	51%	0.51	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.3	16	180	-71.3	-77.2	0	0	0	113.5	Y893 L906 A907	Y893-Y910 WeakPolarHBondContact CD2-O 3.4Å; L906-Y910 HydrophobicContact CG-CD2 4.44Å; L906-Y910 HydrophobicContact CG-CE2 4.37Å; L906-Y910 WeakPolarHBondContact O-CD2 3.39Å; L906-Y910 PolarHBondContact O-N 2.92Å; A907-Y910 PolarHBondContact O-N 3.11Å
911	G	60	Low	56.4	Low	65 Å²	65	113.6 Å²	113.6	67%	0.67	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.6	8.8	168.1	0	0	0	0	0	116.2	A907 G913	A907-G911 PolarHBondContact O-N 2.76Å; G911-G913 PolarHBondContact O-N 3.21Å
912	G	54.5	Low	56.1	Low	8 Å²	8	114.7 Å²	114.7	8%	0.082	58%	0.578	C	S	.	*			trans	-80.3	37.4	176.8	0	0	0	0	0	114.2	N897 A907	N897-G912 PolarHBondContact ND2-O 2.98Å; A907-G912 PolarHBondContact O-N 3.13Å
913	G	45.9	Very low	55.9	Low	45 Å²	45	113.2 Å²	113.2	46%	0.464	58%	0.583	S	S	.	*	S	Bend	trans	-106.4	123.7	175.2	0	0	0	0	0	109.8	G911 E915	G911-G913 PolarHBondContact O-N 3.21Å; G913-E915 PolarHBondContact O-N 3.21Å; G913-E915 VanDerWaalsContact O-N 3.09Å
914	E	47.9	Very low	55.6	Low	204 Å²	204	115.1 Å²	115.1	95%	0.953	60%	0.598	S	S	*	*			trans	-37.8	110.9	178	-65.5	177.2	152.7	0	0	112.3
915	E	43	Very low	54.9	Low	191 Å²	191	114.4 Å²	114.4	89%	0.893	60%	0.603	S	S	*	*			trans	-75.9	127.1	155.1	-72	-169.2	155.3	0	0	107.9	G913	G913-E915 PolarHBondContact O-N 3.21Å; G913-E915 VanDerWaalsContact O-N 3.09Å
916	D	38.1	Very low	54.4	Low	242 Å²	242	108.5 Å²	108.5	100%	1.294	59%	0.587	S	S	*	*			trans	-60.2	0	164.6	-86.3	-39.9	0	0	0	112.3

Retrieved 916 of 916 residues in 786.7 ms (Link to these results)

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