G4V8Z0_SCHMA Loading...

Protein yippee-like

AlphaFold DB , UniProt , Accession G4V8Z0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 147 aa.

						>G4V8Z0_SCHMA|G4V8Z0
MVKTFQVYLGAQGNSSTRSNSSNSSCSNSSDTDDRTYSCVHCRAHLARHQDLISKSFQGSQGRAYLFDTVVNVSCGKPEERLLLTGLHSVADIYCDCCHTVLGWKYEQAFESSQKYKEGKYIIELAHLIKDNGWDWVVSELEQRRPY
					

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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	46	Very low	42.9	Very low	249 Å²	249	155.8 Å²	155.8	100%	1.227	84%	0.838	S	S	*	*				0	100.2	0	-87.4	179	-175.1	0	0	108.3
2	V	38.1	Very low	42.9	Very low	123 Å²	123	160 Å²	160	75%	0.745	85%	0.848	S	S	*	*			trans	-100	122.4	174.4	-75.3	0	0	0	0	108.3
3	K	41.6	Very low	42.6	Very low	199 Å²	199	153.4 Å²	153.4	87%	0.865	84%	0.841	S	S	*	*			trans	-106.2	99.9	172	-90.3	177.5	172.1	175.6	0	108.3
4	T	42.8	Very low	42.4	Very low	120 Å²	120	153.7 Å²	153.7	74%	0.736	84%	0.842	S	S	*	*			trans	-68.4	129.7	164.3	-53.8	0	0	0	0	108.9
5	F	48.1	Very low	42.3	Very low	189 Å²	189	149.7 Å²	149.7	83%	0.829	83%	0.829	S	S	*	*			trans	-130.3	107.7	162.4	-105.5	-91.1	0	0	0	108.9	V7	F5-V7 HydrophobicContact CD1-CG2 4.44Å
6	Q	43.1	Very low	42.4	Very low	176 Å²	176	148.4 Å²	148.4	82%	0.822	83%	0.834	S	S	*	*			trans	-105.7	120.2	171.9	-173.4	-166.6	21.6	0	0	106.2
7	V	52.7	Low	42.5	Very low	126 Å²	126	147.2 Å²	147.2	76%	0.764	83%	0.831	S	S	*	*			trans	-149.2	110.9	160.2	-157.9	0	0	0	0	108.9	F5	F5-V7 HydrophobicContact CD1-CG2 4.44Å
8	Y	37.3	Very low	42.6	Very low	181 Å²	181	151.7 Å²	151.7	71%	0.71	83%	0.833	S	S	*	*			trans	-106.9	172.5	155.2	-97	-88.6	0	0	0	107.5
9	L	44.4	Very low	42.9	Very low	180 Å²	180	149.5 Å²	149.5	94%	0.942	83%	0.829	S	S	*	*			trans	109.7	124.8	177.5	-57.7	173.8	0	0	0	111.2
10	G	39	Very low	42.8	Very low	78 Å²	78	150 Å²	150	80%	0.804	83%	0.83	S	S	*	*			cis	-173.5	168.7	9.4	0	0	0	0	0	111.5
11	A	38.7	Very low	43.2	Very low	93 Å²	93	147.9 Å²	147.9	77%	0.769	83%	0.826	S	S	*	*			trans	-117.5	145.9	174.3	0	0	0	0	0	110.1
12	Q	43.3	Very low	43.7	Very low	206 Å²	206	141.4 Å²	141.4	96%	0.963	81%	0.805	S	S	*	*			trans	148.9	138.4	164.3	-86.3	167.2	54.9	0	0	107.1
13	G	38.3	Very low	43.9	Very low	74 Å²	74	144.2 Å²	144.2	76%	0.763	82%	0.816	S	S	*	*			cis	157.5	144.4	5.9	0	0	0	0	0	108.9
14	N	39.9	Very low	44.6	Very low	158 Å²	158	139.1 Å²	139.1	85%	0.845	81%	0.806	S	S	*	*			trans	76	115.1	156	-90.8	21.6	0	0	0	125.4
15	S	40.9	Very low	44.9	Very low	94 Å²	94	139.5 Å²	139.5	66%	0.657	81%	0.813	S	S	*	*				70.8	119.3	115.9	-51.6	0	0	0	0	122.5
16	S	44	Very low	44.3	Very low	128 Å²	128	135.2 Å²	135.2	90%	0.895	81%	0.805	S	S	*	*			trans	-165.7	146.3	131.6	-78.9	0	0	0	0	112.8
17	T	43.7	Very low	44.8	Very low	128 Å²	128	132.1 Å²	132.1	79%	0.785	80%	0.803	S	S	*	*			trans	-79	161.6	-162.1	45.6	0	0	0	0	118.4
18	R	45.1	Very low	44.3	Very low	229 Å²	229	133.2 Å²	133.2	86%	0.864	81%	0.805	S	S	*	*				117.6	120	121.4	-105.9	167.3	172	-159.5	-4.4	120.6
19	S	48.3	Very low	44.7	Very low	109 Å²	109	129.8 Å²	129.8	76%	0.762	81%	0.807	S	S	*	*			trans	99	116.9	138.7	-3.9	0	0	0	0	122.3
20	N	41.7	Very low	45.2	Very low	159 Å²	159	125.3 Å²	125.3	85%	0.85	79%	0.791	S	S	*	*			trans	34.9	123.1	144	-85.8	15.9	0	0	0	121
21	S	50.4	Low	46	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	80%	0.796	S	S	*	*				174.3	147.4	101.7	-69.7	0	0	0	0	112.5
22	S	57.4	Low	47.1	Very low	114 Å²	114	128.2 Å²	128.2	80%	0.797	78%	0.778	S	S	*	*			trans	70.5	120.2	157.3	40.1	0	0	0	0	120.2	S24	S22-S24 PolarHBondContact O-N 3.05Å
23	N	42	Very low	48.5	Very low	181 Å²	181	120.7 Å²	120.7	97%	0.968	74%	0.744	S	S	*	*			trans	-43.1	111.8	168.4	-87	-7.3	0	0	0	113.2
24	S	55.3	Low	50.4	Low	93 Å²	93	122.8 Å²	122.8	65%	0.65	74%	0.738	S	S	*	*			trans	-135.3	121.6	155	53.6	0	0	0	0	106.2	S22 C26	S22-S24 PolarHBondContact O-N 3.05Å; S24-C26 PolarHBondContact O-N 2.99Å
25	S	48.9	Very low	52.7	Low	128 Å²	128	119 Å²	119	90%	0.895	71%	0.712	S	S	*	*			trans	-60.7	86.6	169.1	23.3	0	0	0	0	108.8	S27	S25-S27 PolarHBondContact O-N 2.96Å
26	C	36	Very low	55.2	Low	98 Å²	98	116.4 Å²	116.4	66%	0.662	69%	0.692	S	S	*	*			trans	-79.9	99.2	174.6	48.6	0	0	0	0	108.4	S24 N28	S24-C26 PolarHBondContact O-N 2.99Å; C26-N28 PolarHBondContact O-N 3.44Å
27	S	52.6	Low	57.6	Low	111 Å²	111	110.4 Å²	110.4	78%	0.776	65%	0.649	S	S	*	*			trans	-61.5	106.9	153.7	-49.9	0	0	0	0	105.9	S25 S29	S25-S27 PolarHBondContact O-N 2.96Å; S27-S29 PolarHBondContact O-N 3.09Å
28	N	42.8	Very low	60.1	Low	149 Å²	149	105.3 Å²	105.3	80%	0.797	62%	0.619	S	S	*	*			trans	-59.3	88.2	167.5	-90.2	-21.2	0	0	0	107.9	C26 S30	C26-N28 PolarHBondContact O-N 3.44Å; N28-S30 PolarHBondContact O-N 3.37Å
29	S	46.9	Very low	62.5	Low	110 Å²	110	94.4 Å²	94.4	77%	0.769	58%	0.578	S	S	*	*			trans	-70.8	81.7	156.5	51.7	0	0	0	0	105.5	S27 D31	S27-S29 PolarHBondContact O-N 3.09Å; S29-D31 PolarHBondContact O-N 2.84Å
30	S	53.7	Low	64.7	Low	86 Å²	86	91.7 Å²	91.7	60%	0.601	56%	0.557	S	S	*	*			trans	-47.9	118.1	157.5	37.5	0	0	0	0	105.7	N28 T32	N28-S30 PolarHBondContact O-N 3.37Å; S30-T32 PolarHBondContact O-N 3.16Å; S30-T32 PolarHBondContact O-OG1 2.69Å
31	D	56.4	Low	67.2	Low	171 Å²	171	89.3 Å²	89.3	91%	0.914	54%	0.54	S	S	*	.			trans	-61.4	67.3	-178.6	-160.8	14.6	0	0	0	109.1	S29 D33	S29-D31 PolarHBondContact O-N 2.84Å; D31-D33 PolarHBondContact O-N 2.94Å
32	T	62.3	Low	69.3	Low	61 Å²	61	86.6 Å²	86.6	37%	0.374	52%	0.52	S	S	.	.			trans	-79.8	111.4	179.7	49.2	0	0	0	0	105.2	S30 D34	S30-T32 PolarHBondContact O-N 3.16Å; S30-T32 PolarHBondContact O-OG1 2.69Å; T32-D34 VanDerWaalsContact C-N 3.32Å; T32-D34 PolarHBondContact O-N 2.82Å; T32-D34 VanDerWaalsContact O-OD1 3.1Å; T32-D34 PolarHBondContact OG1-OD1 3.38Å
33	D	71.8	Confident	71.1	Confident	47 Å²	47	89.1 Å²	89.1	25%	0.251	51%	0.513	S	S	.	.			trans	-57	98.1	169.7	179.7	39.5	0	0	0	110	D31 R35 H49	D31-D33 PolarHBondContact O-N 2.94Å; D33-R35 PolarHBondContact O-N 2.99Å; D33-R35 VanDerWaalsContact OD1-CD 3.25Å; D33-R35 WeakPolarHBondContact OD1-CD 3.18Å; D33-R35 WeakPolarHBondContact OD1-CG 3.3Å; D33-R35 IonicContact OD1-CZ 3.38Å; D33-R35 IonicContact OD1-NE 3.28Å; D33-R35 PolarHBondContact OD1-NE 2.82Å; D33-R35 IonicContact OD1-NH1 2.85Å; D33-R35 IonicContact OD1-NH2 3.5Å; D33-R35 PolarHBondContact OD1-NH2 3.5Å; D33-R35 IonicContact OD2-CZ 3.73Å; D33-R35 IonicContact OD2-NE 3.01Å; D33-R35 PolarHBondContact OD2-NE 2.68Å; D33-R35 IonicContact OD2-NH2 2.76Å; D33-R35 PolarHBondContact OD2-NH2 2.84Å; D33-H49 WeakPolarHBondContact OD2-CB 3.3Å; D33-H49 IonicContact OD2-CD2 2.74Å; D33-H49 PolarHBondContact OD2-CD2 2.77Å; D33-H49 IonicContact OD2-CE1 3.14Å; D33-H49 IonicContact OD2-CG 2.54Å; D33-H49 IonicContact OD2-ND1 3.14Å; D33-H49 PolarHBondContact OD2-ND1 3.35Å; D33-H49 IonicContact OD2-NE2 3.67Å; D33-H49 PolarHBondContact OD2-NE2 3.09Å
34	D	78	Confident	73.6	Confident	119 Å²	119	81.1 Å²	81.1	64%	0.636	47%	0.472	S	S	*	.			trans	-74.8	11.2	-174.2	-69.1	-27.6	0	0	0	112.9	T32 T36	T32-D34 VanDerWaalsContact C-N 3.32Å; T32-D34 PolarHBondContact O-N 2.82Å; T32-D34 VanDerWaalsContact O-OD1 3.1Å; T32-D34 PolarHBondContact OG1-OD1 3.38Å; D34-T36 PolarHBondContact O-N 3.47Å
35	R	88.5	Confident	75.4	Confident	79 Å²	79	79.7 Å²	79.7	30%	0.298	46%	0.455	S	S	.	.			trans	-63.3	127.3	175.2	-66	-175.8	-57.6	-137.9	-12.1	109.3	D33 H49 D131	D33-R35 PolarHBondContact O-N 2.99Å; D33-R35 VanDerWaalsContact OD1-CD 3.25Å; D33-R35 WeakPolarHBondContact OD1-CD 3.18Å; D33-R35 WeakPolarHBondContact OD1-CG 3.3Å; D33-R35 IonicContact OD1-CZ 3.38Å; D33-R35 IonicContact OD1-NE 3.28Å; D33-R35 PolarHBondContact OD1-NE 2.82Å; D33-R35 IonicContact OD1-NH1 2.85Å; D33-R35 IonicContact OD1-NH2 3.5Å; D33-R35 PolarHBondContact OD1-NH2 3.5Å; D33-R35 IonicContact OD2-CZ 3.73Å; D33-R35 IonicContact OD2-NE 3.01Å; D33-R35 PolarHBondContact OD2-NE 2.68Å; D33-R35 IonicContact OD2-NH2 2.76Å; D33-R35 PolarHBondContact OD2-NH2 2.84Å; R35-H49 HydrophobicContact CB-CB 3.77Å; R35-H49 PolarHBondContact NE-ND1 3.33Å; R35-H49 PolarHBondContact NH2-CE1 2.77Å; R35-H49 PolarHBondContact NH2-NE2 2.8Å; R35-H49 VanDerWaalsContact NH2-NE2 3.19Å; R35-H49 VanDerWaalsContact O-CB 3.22Å; R35-H49 WeakPolarHBondContact O-CB 3.42Å; R35-H49 PolarHBondContact O-N 2.74Å; R35-D131 WeakPolarHBondContact CA-O 3.1Å; R35-D131 WeakPolarHBondContact CB-O 3.27Å
36	T	92.9	Very high	77.6	Confident	39 Å²	39	73.6 Å²	73.6	24%	0.239	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	157.7	177.8	57	0	0	0	0	110.6	D34 D131	D34-T36 PolarHBondContact O-N 3.47Å; T36-D131 PolarHBondContact N-O 3.24Å; T36-D131 PolarHBondContact O-N 3.45Å
37	Y	94.9	Very high	80.4	Confident	1 Å²	1	69 Å²	69	0%	0.004	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.6	176.9	-63.3	-80.7	0	0	0	109.4	L46 A47 H49 Y65 F67 L128 I129 K130	Y37-L46 WeakPolarHBondContact O-CA 3.36Å; Y37-L46 PolarHBondContact O-N 3.46Å; Y37-A47 WeakPolarHBondContact CB-O 3.12Å; Y37-A47 PolarHBondContact N-O 3.31Å; Y37-A47 PolarHBondContact O-N 2.94Å; Y37-A47 VanDerWaalsContact O-N 3.13Å; Y37-H49 HydrophobicContact CE2-CB 4.33Å; Y37-H49 AromaticContact CE2-ND1 3.92Å; Y37-H49 AromaticContact CZ-ND1 3.92Å; Y37-H49 PolarHBondContact OH-ND1 2.97Å; Y37-Y65 HydrophobicContact CE1-CD2 4.09Å; Y37-Y65 AromaticContact CE1-CE2 3.97Å; Y37-Y65 HydrophobicContact CE1-CE2 3.97Å; Y37-F67 HydrophobicContact CD1-CZ 4.31Å; Y37-F67 AromaticContact CD2-CE1 3.47Å; Y37-F67 HydrophobicContact CD2-CE1 3.47Å; Y37-F67 VanDerWaalsContact CD2-CE1 3.47Å; Y37-F67 AromaticContact CD2-CZ 3.66Å; Y37-F67 HydrophobicContact CD2-CZ 3.66Å; Y37-F67 AromaticContact CE2-CE1 3.64Å; Y37-F67 HydrophobicContact CE2-CE1 3.64Å; Y37-F67 AromaticContact CE2-CZ 3.89Å; Y37-F67 HydrophobicContact CE2-CZ 3.89Å; Y37-F67 HydrophobicContact CG-CE1 4.16Å; Y37-F67 AromaticContact CG-CZ 3.87Å; Y37-F67 HydrophobicContact CG-CZ 3.87Å; Y37-L128 HydrophobicContact CD1-CD1 4.45Å; Y37-L128 HydrophobicContact CD1-CD2 3.51Å; Y37-L128 HydrophobicContact CD1-CG 3.85Å; Y37-L128 HydrophobicContact CE1-CD2 4.16Å; Y37-L128 HydrophobicContact CG-CD1 4.43Å; Y37-L128 HydrophobicContact CG-CD2 4.02Å; Y37-L128 HydrophobicContact CG-CG 4.3Å; Y37-I129 CarbonylContact C-O 3.48Å; Y37-I129 VanDerWaalsContact CA-O 3.29Å; Y37-I129 WeakPolarHBondContact CA-O 3.25Å; Y37-K130 HydrophobicContact CD1-CB 3.92Å; Y37-K130 HydrophobicContact CD1-CG 4.06Å; Y37-K130 HydrophobicContact CE1-CB 3.75Å; Y37-K130 HydrophobicContact CE1-CD 3.87Å; Y37-K130 HydrophobicContact CE1-CG 3.56Å
38	S	95.3	Very high	82.3	Confident	21 Å²	21	69.1 Å²	69.1	15%	0.147	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	155.9	-175	-60.7	0	0	0	0	111.5	A44 I129	S38-A44 CarbonylContact C-O 3.53Å; S38-A44 WeakPolarHBondContact CA-O 3.48Å; S38-A44 WeakPolarHBondContact CB-O 3.44Å; S38-I129 PolarHBondContact N-O 2.81Å; S38-I129 PolarHBondContact O-N 2.87Å
39	C	96.2	Very high	84.7	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	135.3	177.1	179.6	0	0	0	0	110.9	H41 C42 R43 A44 L46 C98	C39-H41 VanDerWaalsContact C-N 3.29Å; C39-H41 PolarHBondContact O-N 3.26Å; C39-C42 VanDerWaalsContact SG-SG 3.68Å; C39-R43 WeakPolarHBondContact O-CA 3.45Å; C39-R43 PolarHBondContact O-N 3.3Å; C39-A44 HydrophobicContact CB-CB 4.49Å; C39-A44 PolarHBondContact N-O 3.17Å; C39-L46 HydrophobicContact CB-CD1 3.96Å; C39-L46 HydrophobicContact CB-CD2 4.45Å; C39-L46 HydrophobicContact CB-CG 4.27Å; C39-C98 VanDerWaalsContact SG-SG 3.63Å
40	V	94.7	Very high	86.8	Confident	52 Å²	52	63.7 Å²	63.7	32%	0.315	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-34.2	179	73.5	0	0	0	0	113.5	H127 I129	V40-H127 HydrophobicContact CG1-CB 4.45Å; V40-H127 PolarHBondContact N-O 2.78Å; V40-I129 HydrophobicContact CB-CD1 4.13Å; V40-I129 HydrophobicContact CB-CG1 3.95Å; V40-I129 HydrophobicContact CG2-CD1 3.86Å; V40-I129 HydrophobicContact CG2-CG1 3.89Å
41	H	93.8	Very high	88.7	Confident	110 Å²	110	60.4 Å²	60.4	51%	0.509	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-40.6	-171.3	-62.3	-72.9	0	0	0	113.4	C39 H127	C39-H41 VanDerWaalsContact C-N 3.29Å; C39-H41 PolarHBondContact O-N 3.26Å; H41-H127 AromaticContact NE2-CE1 3.94Å; H41-H127 AromaticContact NE2-ND1 3.35Å; H41-H127 PolarHBondContact NE2-ND1 2.95Å
42	C	95.5	Very high	90.5	Very high	48 Å²	48	53.7 Å²	53.7	32%	0.324	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-2.4	-174.9	62.1	0	0	0	0	114.4	C39 A44 C95 C97 C98	C39-C42 VanDerWaalsContact SG-SG 3.68Å; C42-A44 PolarHBondContact O-N 2.89Å; C42-A44 VanDerWaalsContact O-N 3.08Å; C42-A44 VanDerWaalsContact SG-CB 3.53Å; C42-C95 PolarHBondContact SG-SG 2.79Å; C42-C97 HydrophobicContact CB-CB 4.32Å; C42-C98 HydrophobicContact CB-CB 3.91Å; C42-C98 VanDerWaalsContact SG-SG 3.61Å
43	R	93.9	Very high	92	Very high	167 Å²	167	53.6 Å²	53.6	63%	0.63	26%	0.258	S	S	*	.			trans	60.7	11.8	-176.5	-51.4	-59.3	-176.4	132.7	-4.3	115.1	C39 H45	C39-R43 WeakPolarHBondContact O-CA 3.45Å; C39-R43 PolarHBondContact O-N 3.3Å; R43-H45 PolarHBondContact O-N 2.74Å
44	A	94.4	Very high	93.1	Very high	14 Å²	14	53 Å²	53	12%	0.116	26%	0.258	C	S	.	.			trans	-57.9	133	172.1	0	0	0	0	0	110.3	S38 C39 C42 L46 C97	S38-A44 CarbonylContact C-O 3.53Å; S38-A44 WeakPolarHBondContact CA-O 3.48Å; S38-A44 WeakPolarHBondContact CB-O 3.44Å; C39-A44 HydrophobicContact CB-CB 4.49Å; C39-A44 PolarHBondContact N-O 3.17Å; C42-A44 PolarHBondContact O-N 2.89Å; C42-A44 VanDerWaalsContact O-N 3.08Å; C42-A44 VanDerWaalsContact SG-CB 3.53Å; A44-L46 PolarHBondContact O-N 2.73Å; A44-C97 HydrophobicContact CB-CB 4.16Å
45	H	94.4	Very high	93.8	Very high	62 Å²	62	52 Å²	52	29%	0.287	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	130.4	175.3	175.8	-86	0	0	0	109.7	R43 V71 N72	R43-H45 PolarHBondContact O-N 2.74Å; H45-V71 WeakPolarHBondContact ND1-CG2 3.42Å; H45-N72 PolarHBondContact O-ND2 3.06Å
46	L	95.2	Very high	94	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-47.5	-179.1	-63.9	176.2	0	0	0	111.5	Y37 C39 A44 V70 V71 V73 L102 I123 L128	Y37-L46 WeakPolarHBondContact O-CA 3.36Å; Y37-L46 PolarHBondContact O-N 3.46Å; C39-L46 HydrophobicContact CB-CD1 3.96Å; C39-L46 HydrophobicContact CB-CD2 4.45Å; C39-L46 HydrophobicContact CB-CG 4.27Å; A44-L46 PolarHBondContact O-N 2.73Å; L46-V70 HydrophobicContact CB-CG1 4.3Å; L46-V70 CarbonylContact O-C 3.53Å; L46-V70 VanDerWaalsContact O-CA 3.29Å; L46-V70 WeakPolarHBondContact O-CA 3.19Å; L46-V70 VanDerWaalsContact O-CG1 3.3Å; L46-V70 WeakPolarHBondContact O-CG1 3.43Å; L46-V71 PolarHBondContact O-N 3.27Å; L46-V73 HydrophobicContact CD2-CG1 3.91Å; L46-L102 HydrophobicContact CD1-CD1 3.77Å; L46-L102 HydrophobicContact CD1-CD2 4.23Å; L46-L102 HydrophobicContact CD2-CD1 3.57Å; L46-L102 HydrophobicContact CG-CD1 4.33Å; L46-I123 HydrophobicContact CB-CD1 4.33Å; L46-I123 HydrophobicContact CD1-CD1 4.42Å; L46-L128 HydrophobicContact CD1-CD1 3.75Å
47	A	95	Very high	93.9	Very high	2 Å²	2	53.4 Å²	53.4	2%	0.017	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	154.2	-177.2	0	0	0	0	0	111.5	Y37 F67 V70	Y37-A47 WeakPolarHBondContact CB-O 3.12Å; Y37-A47 PolarHBondContact N-O 3.31Å; Y37-A47 PolarHBondContact O-N 2.94Å; Y37-A47 VanDerWaalsContact O-N 3.13Å; A47-F67 HydrophobicContact CB-CD1 3.56Å; A47-F67 HydrophobicContact CB-CE1 3.75Å; A47-F67 HydrophobicContact CB-CG 4.06Å; A47-F67 HydrophobicContact CB-CZ 4.39Å; A47-V70 HydrophobicContact CB-CG2 4.48Å
48	R	92.4	Very high	93.8	Very high	114 Å²	114	60.9 Å²	60.9	43%	0.43	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	163	170.8	-56.7	169.4	-63.5	173.8	3.7	109.9	Q50 D51	R48-Q50 PolarHBondContact O-N 2.9Å; R48-D51 WeakPolarHBondContact CB-OD2 3.32Å; R48-D51 IonicContact CZ-OD2 3.5Å; R48-D51 IonicContact NE-OD2 2.92Å; R48-D51 PolarHBondContact NE-OD2 3.48Å; R48-D51 IonicContact NH2-OD1 2.74Å; R48-D51 PolarHBondContact NH2-OD1 3.48Å; R48-D51 IonicContact NH2-OD2 3.18Å; R48-D51 PolarHBondContact NH2-OD2 2.79Å; R48-D51 PolarHBondContact O-N 3.14Å
49	H	91.9	Very high	93.4	Very high	32 Å²	32	60.5 Å²	60.5	15%	0.148	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-64.5	-31.2	174.5	-164.3	97.8	0	0	0	113.8	D33 R35 Y37 D51 L52	D33-H49 WeakPolarHBondContact OD2-CB 3.3Å; D33-H49 IonicContact OD2-CD2 2.74Å; D33-H49 PolarHBondContact OD2-CD2 2.77Å; D33-H49 IonicContact OD2-CE1 3.14Å; D33-H49 IonicContact OD2-CG 2.54Å; D33-H49 IonicContact OD2-ND1 3.14Å; D33-H49 PolarHBondContact OD2-ND1 3.35Å; D33-H49 IonicContact OD2-NE2 3.67Å; D33-H49 PolarHBondContact OD2-NE2 3.09Å; R35-H49 HydrophobicContact CB-CB 3.77Å; R35-H49 PolarHBondContact NE-ND1 3.33Å; R35-H49 PolarHBondContact NH2-CE1 2.77Å; R35-H49 PolarHBondContact NH2-NE2 2.8Å; R35-H49 VanDerWaalsContact NH2-NE2 3.19Å; R35-H49 VanDerWaalsContact O-CB 3.22Å; R35-H49 WeakPolarHBondContact O-CB 3.42Å; R35-H49 PolarHBondContact O-N 2.74Å; Y37-H49 HydrophobicContact CE2-CB 4.33Å; Y37-H49 AromaticContact CE2-ND1 3.92Å; Y37-H49 AromaticContact CZ-ND1 3.92Å; Y37-H49 PolarHBondContact OH-ND1 2.97Å; H49-D51 PolarHBondContact O-N 3.09Å; H49-L52 WeakPolarHBondContact O-CB 3.38Å; H49-L52 PolarHBondContact O-N 2.64Å
50	Q	91.7	Very high	92.9	Very high	112 Å²	112	65 Å²	65	52%	0.523	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-61.6	-27	176.8	-61.5	174.5	26	0	0	112.4	R48 L52	R48-Q50 PolarHBondContact O-N 2.9Å; Q50-L52 VanDerWaalsContact C-N 3.31Å
51	D	93.7	Very high	92.5	Very high	18 Å²	18	69 Å²	69	10%	0.096	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-86.5	-1.6	179.1	-56.8	-61.7	0	0	0	112.2	R48 H49 I53 F67 D68 T69	R48-D51 WeakPolarHBondContact CB-OD2 3.32Å; R48-D51 IonicContact CZ-OD2 3.5Å; R48-D51 IonicContact NE-OD2 2.92Å; R48-D51 PolarHBondContact NE-OD2 3.48Å; R48-D51 IonicContact NH2-OD1 2.74Å; R48-D51 PolarHBondContact NH2-OD1 3.48Å; R48-D51 IonicContact NH2-OD2 3.18Å; R48-D51 PolarHBondContact NH2-OD2 2.79Å; R48-D51 PolarHBondContact O-N 3.14Å; H49-D51 PolarHBondContact O-N 3.09Å; D51-I53 PolarHBondContact O-N 2.86Å; D51-F67 CarbonylContact O-C 3.54Å; D51-F67 VanDerWaalsContact O-CA 3.31Å; D51-F67 WeakPolarHBondContact O-CA 3.45Å; D51-D68 PolarHBondContact O-N 2.9Å; D51-T69 PolarHBondContact OD1-OG1 2.79Å
52	L	94.3	Very high	92.4	Very high	29 Å²	29	65.1 Å²	65.1	15%	0.152	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	119	179.2	-178.5	71.9	0	0	0	111.1	H49 Q50 K55 Y65 F67	H49-L52 WeakPolarHBondContact O-CB 3.38Å; H49-L52 PolarHBondContact O-N 2.64Å; Q50-L52 VanDerWaalsContact C-N 3.31Å; L52-K55 HydrophobicContact CD1-CG 4.5Å; L52-K55 HydrophobicContact CD2-CD 4.2Å; L52-K55 HydrophobicContact CD2-CG 3.82Å; L52-Y65 HydrophobicContact CD1-CD2 4.06Å; L52-Y65 HydrophobicContact CD1-CG 3.98Å; L52-F67 HydrophobicContact CB-CD1 4.2Å; L52-F67 HydrophobicContact CB-CE1 3.97Å; L52-F67 HydrophobicContact CD1-CD1 4.04Å; L52-F67 HydrophobicContact CD1-CE1 3.57Å; L52-F67 HydrophobicContact CD1-CE2 4.35Å; L52-F67 HydrophobicContact CD1-CZ 3.75Å; L52-F67 HydrophobicContact CG-CE1 4.36Å
53	I	94.1	Very high	92.3	Very high	59 Å²	59	71.5 Å²	71.5	30%	0.303	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-47.4	178.2	-61.2	174.4	0	0	0	111.1	D51 L66 D68 K120	D51-I53 PolarHBondContact O-N 2.86Å; I53-L66 HydrophobicContact CB-CB 4.45Å; I53-L66 HydrophobicContact CB-CD2 4.04Å; I53-L66 HydrophobicContact CB-CG 4.27Å; I53-L66 HydrophobicContact CD1-CD2 4.24Å; I53-L66 HydrophobicContact CD1-CG 4.39Å; I53-L66 HydrophobicContact CG2-CD2 3.87Å; I53-L66 PolarHBondContact N-O 3.17Å; I53-D68 HydrophobicContact CD1-CB 3.81Å; I53-D68 HydrophobicContact CG1-CB 4.03Å; I53-K120 HydrophobicContact CD1-CD 3.5Å; I53-K120 HydrophobicContact CD1-CG 4.11Å
54	S	93.9	Very high	92.4	Very high	34 Å²	34	63.6 Å²	63.6	24%	0.238	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	143.9	-174.5	179.5	0	0	0	0	112.8	S56 L66	S54-S56 PolarHBondContact OG-N 3.21Å; S54-L66 PolarHBondContact N-O 3.27Å; S54-L66 PolarHBondContact O-N 3.01Å
55	K	93.7	Very high	92.5	Very high	98 Å²	98	64.6 Å²	64.6	43%	0.426	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-0.6	176.3	-62.6	179.7	-172.4	165	0	113.5	L52 F57 Y65	L52-K55 HydrophobicContact CD1-CG 4.5Å; L52-K55 HydrophobicContact CD2-CD 4.2Å; L52-K55 HydrophobicContact CD2-CG 3.82Å; K55-F57 VanDerWaalsContact C-N 3.31Å; K55-F57 PolarHBondContact O-N 2.76Å; K55-Y65 VanDerWaalsContact CA-CD1 3.46Å; K55-Y65 HydrophobicContact CB-CD1 3.75Å; K55-Y65 HydrophobicContact CB-CE1 3.48Å; K55-Y65 VanDerWaalsContact CB-CE1 3.48Å; K55-Y65 HydrophobicContact CD-CE1 4.19Å; K55-Y65 HydrophobicContact CG-CD1 3.85Å; K55-Y65 HydrophobicContact CG-CE1 3.59Å; K55-Y65 HydrophobicContact CG-CE2 4.44Å; K55-Y65 HydrophobicContact CG-CG 4.38Å
56	S	91.4	Very high	92.6	Very high	114 Å²	114	61.7 Å²	61.7	80%	0.797	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	32.6	-170	-55	0	0	0	0	112.6	S54	S54-S56 PolarHBondContact OG-N 3.21Å
57	F	91.9	Very high	92.6	Very high	34 Å²	34	61.7 Å²	61.7	15%	0.149	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	156.2	178	-77.9	-97	0	0	0	111	K55 A64 L66 K117 I122	K55-F57 VanDerWaalsContact C-N 3.31Å; K55-F57 PolarHBondContact O-N 2.76Å; F57-A64 CarbonylContact C-O 3.56Å; F57-A64 WeakPolarHBondContact CA-O 3.49Å; F57-A64 HydrophobicContact CB-CB 4.42Å; F57-A64 WeakPolarHBondContact CB-O 3.34Å; F57-A64 PolarHBondContact N-O 2.98Å; F57-A64 PolarHBondContact O-N 3.06Å; F57-L66 HydrophobicContact CD2-CB 3.6Å; F57-L66 HydrophobicContact CD2-CD2 4.5Å; F57-L66 HydrophobicContact CE1-CD1 4.48Å; F57-L66 HydrophobicContact CE2-CB 3.61Å; F57-L66 HydrophobicContact CE2-CD2 3.64Å; F57-L66 HydrophobicContact CE2-CG 4.14Å; F57-L66 HydrophobicContact CG-CB 4.22Å; F57-L66 HydrophobicContact CZ-CB 4.2Å; F57-L66 HydrophobicContact CZ-CD1 4.36Å; F57-L66 HydrophobicContact CZ-CD2 3.65Å; F57-L66 HydrophobicContact CZ-CG 4.3Å; F57-K117 HydrophobicContact CE1-CD 4.46Å; F57-I122 HydrophobicContact CB-CD1 4.24Å; F57-I122 HydrophobicContact CD1-CD1 3.42Å; F57-I122 VanDerWaalsContact CD1-CD1 3.42Å; F57-I122 HydrophobicContact CD1-CG1 4.36Å; F57-I122 HydrophobicContact CE1-CD1 4.04Å; F57-I122 HydrophobicContact CG-CD1 4.06Å
58	Q	91.5	Very high	92.7	Very high	158 Å²	158	64.9 Å²	64.9	74%	0.738	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.2	135.2	178.2	-172.6	176.8	-35.5	0	0	108	G62	Q58-G62 CarbonylContact C-O 3.57Å; Q58-G62 WeakPolarHBondContact CA-O 3.37Å; Q58-G62 VanDerWaalsContact CG-O 3.3Å; Q58-G62 WeakPolarHBondContact CG-O 3.16Å
59	G	87.5	Confident	92.8	Very high	13 Å²	13	62.3 Å²	62.3	13%	0.134	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-163.9	169.4	0	0	0	0	0	114.2	G62 W104	G59-G62 PolarHBondContact N-O 3.39Å; G59-W104 VanDerWaalsContact CA-CH2 3.45Å
60	S	85.9	Confident	93	Very high	94 Å²	94	61.5 Å²	61.5	66%	0.657	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-40.4	-177.2	69	0	0	0	0	111.7	E124	S60-E124 WeakPolarHBondContact CA-OE1 3.16Å; S60-E124 WeakPolarHBondContact CB-OE1 3.5Å; S60-E124 PolarHBondContact N-OE1 3.39Å; S60-E124 PolarHBondContact OG-OE1 3.31Å
61	Q	86.6	Confident	93.2	Very high	138 Å²	138	59.4 Å²	59.4	65%	0.645	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	13.7	-179	-52.7	-61.2	-50.5	0	0	113.8	E124 A126	Q61-E124 WeakPolarHBondContact CB-OE2 3.45Å; Q61-E124 WeakPolarHBondContact CG-OE2 3.4Å; Q61-E124 PolarHBondContact N-OE1 2.91Å; Q61-E124 VanDerWaalsContact N-OE1 3.16Å; Q61-A126 HydrophobicContact CB-CB 4.42Å
62	G	91.5	Very high	93.3	Very high	28 Å²	28	62.1 Å²	62.1	29%	0.289	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	119.9	-136.4	177.4	0	0	0	0	0	113.4	Q58 G59	Q58-G62 CarbonylContact C-O 3.57Å; Q58-G62 WeakPolarHBondContact CA-O 3.37Å; Q58-G62 VanDerWaalsContact CG-O 3.3Å; Q58-G62 WeakPolarHBondContact CG-O 3.16Å; G59-G62 PolarHBondContact N-O 3.39Å
63	R	94.3	Very high	93.3	Very high	182 Å²	182	62.2 Å²	62.2	69%	0.687	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	144.4	-175.6	-67.6	-171	-63.8	-177.5	-0.7	111.5	L125	R63-L125 HydrophobicContact CB-CD1 4.25Å; R63-L125 HydrophobicContact CB-CD2 4.08Å; R63-L125 WeakPolarHBondContact O-CD1 3.29Å; R63-L125 PolarHBondContact O-N 2.89Å
64	A	95.6	Very high	93.4	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	157.2	177.6	0	0	0	0	0	111.2	F57 I122 I123 E124	F57-A64 CarbonylContact C-O 3.56Å; F57-A64 WeakPolarHBondContact CA-O 3.49Å; F57-A64 HydrophobicContact CB-CB 4.42Å; F57-A64 WeakPolarHBondContact CB-O 3.34Å; F57-A64 PolarHBondContact N-O 2.98Å; F57-A64 PolarHBondContact O-N 3.06Å; A64-I122 HydrophobicContact CB-CG2 3.52Å; A64-I123 WeakPolarHBondContact CA-O 3.21Å; A64-I123 WeakPolarHBondContact CB-O 3.39Å; A64-E124 HydrophobicContact CB-CG 4.28Å
65	Y	95.9	Very high	93.5	Very high	36 Å²	36	62.7 Å²	62.7	14%	0.141	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	143	178.1	-70.8	-11.2	0	0	0	110.6	Y37 L52 K55 F67 I122 I123 L125 L128	Y37-Y65 HydrophobicContact CE1-CD2 4.09Å; Y37-Y65 AromaticContact CE1-CE2 3.97Å; Y37-Y65 HydrophobicContact CE1-CE2 3.97Å; L52-Y65 HydrophobicContact CD1-CD2 4.06Å; L52-Y65 HydrophobicContact CD1-CG 3.98Å; K55-Y65 VanDerWaalsContact CA-CD1 3.46Å; K55-Y65 HydrophobicContact CB-CD1 3.75Å; K55-Y65 HydrophobicContact CB-CE1 3.48Å; K55-Y65 VanDerWaalsContact CB-CE1 3.48Å; K55-Y65 HydrophobicContact CD-CE1 4.19Å; K55-Y65 HydrophobicContact CG-CD1 3.85Å; K55-Y65 HydrophobicContact CG-CE1 3.59Å; K55-Y65 HydrophobicContact CG-CE2 4.44Å; K55-Y65 HydrophobicContact CG-CG 4.38Å; Y65-F67 HydrophobicContact CD2-CZ 4.2Å; Y65-I122 WeakPolarHBondContact O-CA 3.49Å; Y65-I123 PolarHBondContact N-O 3.11Å; Y65-I123 PolarHBondContact O-N 2.74Å; Y65-L125 HydrophobicContact CD1-CD1 3.51Å; Y65-L125 HydrophobicContact CD2-CD1 3.98Å; Y65-L125 HydrophobicContact CE1-CD1 3.55Å; Y65-L125 HydrophobicContact CE1-CD2 4.06Å; Y65-L125 HydrophobicContact CE1-CG 4.3Å; Y65-L125 HydrophobicContact CE2-CD1 4Å; Y65-L125 HydrophobicContact CE2-CD2 4.49Å; Y65-L125 HydrophobicContact CE2-CG 4.31Å; Y65-L125 HydrophobicContact CG-CD1 3.74Å; Y65-L128 HydrophobicContact CD2-CD2 3.99Å
66	L	95.9	Very high	93.6	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.005	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.4	174.5	-172.5	75.8	0	0	0	109.5	I53 S54 F57 Y106 K120 Y121 I122	I53-L66 HydrophobicContact CB-CB 4.45Å; I53-L66 HydrophobicContact CB-CD2 4.04Å; I53-L66 HydrophobicContact CB-CG 4.27Å; I53-L66 HydrophobicContact CD1-CD2 4.24Å; I53-L66 HydrophobicContact CD1-CG 4.39Å; I53-L66 HydrophobicContact CG2-CD2 3.87Å; I53-L66 PolarHBondContact N-O 3.17Å; S54-L66 PolarHBondContact N-O 3.27Å; S54-L66 PolarHBondContact O-N 3.01Å; F57-L66 HydrophobicContact CD2-CB 3.6Å; F57-L66 HydrophobicContact CD2-CD2 4.5Å; F57-L66 HydrophobicContact CE1-CD1 4.48Å; F57-L66 HydrophobicContact CE2-CB 3.61Å; F57-L66 HydrophobicContact CE2-CD2 3.64Å; F57-L66 HydrophobicContact CE2-CG 4.14Å; F57-L66 HydrophobicContact CG-CB 4.22Å; F57-L66 HydrophobicContact CZ-CB 4.2Å; F57-L66 HydrophobicContact CZ-CD1 4.36Å; F57-L66 HydrophobicContact CZ-CD2 3.65Å; F57-L66 HydrophobicContact CZ-CG 4.3Å; L66-Y106 HydrophobicContact CD1-CD2 4.47Å; L66-Y106 HydrophobicContact CD1-CE2 4.15Å; L66-K120 HydrophobicContact CD1-CB 3.65Å; L66-K120 HydrophobicContact CD2-CB 4.44Å; L66-K120 HydrophobicContact CG-CB 4.13Å; L66-Y121 CarbonylContact C-O 3.49Å; L66-Y121 WeakPolarHBondContact CA-O 3.48Å; L66-I122 HydrophobicContact CD1-CD1 4.34Å; L66-I122 HydrophobicContact CD1-CG1 3.64Å
67	F	96.7	Very high	93.8	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	146.6	177.8	-66.4	-83.1	0	0	0	111.2	Y37 A47 D51 L52 Y65 V70 Y121 I123 L128	Y37-F67 HydrophobicContact CD1-CZ 4.31Å; Y37-F67 AromaticContact CD2-CE1 3.47Å; Y37-F67 HydrophobicContact CD2-CE1 3.47Å; Y37-F67 VanDerWaalsContact CD2-CE1 3.47Å; Y37-F67 AromaticContact CD2-CZ 3.66Å; Y37-F67 HydrophobicContact CD2-CZ 3.66Å; Y37-F67 AromaticContact CE2-CE1 3.64Å; Y37-F67 HydrophobicContact CE2-CE1 3.64Å; Y37-F67 AromaticContact CE2-CZ 3.89Å; Y37-F67 HydrophobicContact CE2-CZ 3.89Å; Y37-F67 HydrophobicContact CG-CE1 4.16Å; Y37-F67 AromaticContact CG-CZ 3.87Å; Y37-F67 HydrophobicContact CG-CZ 3.87Å; A47-F67 HydrophobicContact CB-CD1 3.56Å; A47-F67 HydrophobicContact CB-CE1 3.75Å; A47-F67 HydrophobicContact CB-CG 4.06Å; A47-F67 HydrophobicContact CB-CZ 4.39Å; D51-F67 CarbonylContact O-C 3.54Å; D51-F67 VanDerWaalsContact O-CA 3.31Å; D51-F67 WeakPolarHBondContact O-CA 3.45Å; L52-F67 HydrophobicContact CB-CD1 4.2Å; L52-F67 HydrophobicContact CB-CE1 3.97Å; L52-F67 HydrophobicContact CD1-CD1 4.04Å; L52-F67 HydrophobicContact CD1-CE1 3.57Å; L52-F67 HydrophobicContact CD1-CE2 4.35Å; L52-F67 HydrophobicContact CD1-CZ 3.75Å; L52-F67 HydrophobicContact CG-CE1 4.36Å; Y65-F67 HydrophobicContact CD2-CZ 4.2Å; F67-V70 HydrophobicContact CB-CG2 3.74Å; F67-V70 HydrophobicContact CG-CG2 4.33Å; F67-Y121 PolarHBondContact N-O 3.36Å; F67-Y121 PolarHBondContact O-N 3.44Å; F67-I123 HydrophobicContact CD2-CB 4.4Å; F67-I123 HydrophobicContact CD2-CD1 3.99Å; F67-I123 HydrophobicContact CD2-CG1 4.27Å; F67-I123 HydrophobicContact CE2-CB 4.22Å; F67-I123 HydrophobicContact CE2-CD1 4.17Å; F67-I123 HydrophobicContact CE2-CG1 4.49Å; F67-L128 HydrophobicContact CE2-CD2 3.97Å; F67-L128 HydrophobicContact CZ-CD2 3.92Å
68	D	96	Very high	93.9	Very high	69 Å²	69	64.8 Å²	64.8	37%	0.369	35%	0.354	S	S	.	.	S	Bend	trans	-73.5	-51.6	172.8	-169	37.7	0	0	0	111.2	D51 I53 K120	D51-D68 PolarHBondContact O-N 2.9Å; I53-D68 HydrophobicContact CD1-CB 3.81Å; I53-D68 HydrophobicContact CG1-CB 4.03Å; D68-K120 IonicContact OD1-NZ 2.64Å; D68-K120 PolarHBondContact OD1-NZ 3.19Å
69	T	94.9	Very high	94.1	Very high	59 Å²	59	62.1 Å²	62.1	36%	0.362	34%	0.342	S	S	.	.			trans	-128.8	144.7	179.1	70.1	0	0	0	0	110.2	D51	D51-T69 PolarHBondContact OD1-OG1 2.79Å
70	V	95.6	Very high	94.4	Very high	16 Å²	16	67.7 Å²	67.7	10%	0.097	36%	0.364	C	S	.	.			trans	-138.3	139.2	176.7	-179.2	0	0	0	0	107.5	L46 A47 F67 V73 Y121 I123	L46-V70 HydrophobicContact CB-CG1 4.3Å; L46-V70 CarbonylContact O-C 3.53Å; L46-V70 VanDerWaalsContact O-CA 3.29Å; L46-V70 WeakPolarHBondContact O-CA 3.19Å; L46-V70 VanDerWaalsContact O-CG1 3.3Å; L46-V70 WeakPolarHBondContact O-CG1 3.43Å; A47-V70 HydrophobicContact CB-CG2 4.48Å; F67-V70 HydrophobicContact CB-CG2 3.74Å; F67-V70 HydrophobicContact CG-CG2 4.33Å; V70-V73 HydrophobicContact CB-CG2 4.11Å; V70-V73 HydrophobicContact CG1-CB 4.27Å; V70-V73 HydrophobicContact CG1-CG1 3.51Å; V70-V73 HydrophobicContact CG1-CG2 3.7Å; V70-Y121 HydrophobicContact CB-CD1 4.22Å; V70-Y121 HydrophobicContact CB-CD2 4.26Å; V70-Y121 HydrophobicContact CB-CG 4.01Å; V70-Y121 VanDerWaalsContact CG2-CB 3.44Å; V70-Y121 HydrophobicContact CG2-CD1 4.21Å; V70-Y121 HydrophobicContact CG2-CD2 3.9Å; V70-Y121 HydrophobicContact CG2-CG 3.58Å; V70-I123 HydrophobicContact CG1-CD1 3.89Å; V70-I123 HydrophobicContact CG2-CD1 3.9Å
71	V	95.8	Very high	94.8	Very high	68 Å²	68	66.4 Å²	66.4	41%	0.412	35%	0.345	S	S	.	.			trans	-113.8	163.2	178.5	-61.8	0	0	0	0	110.4	H45 L46 V73	H45-V71 WeakPolarHBondContact ND1-CG2 3.42Å; L46-V71 PolarHBondContact O-N 3.27Å; V71-V73 VanDerWaalsContact C-N 3.25Å; V71-V73 PolarHBondContact O-N 2.97Å
72	N	95.5	Very high	95	Very high	75 Å²	75	66.8 Å²	66.8	40%	0.401	35%	0.35	S	S	.	.	S	Bend	trans	57.6	37.5	-179.9	-52.9	-41.4	0	0	0	113.3	H45 D96	H45-N72 PolarHBondContact O-ND2 3.06Å; N72-D96 WeakPolarHBondContact O-CB 3.39Å; N72-D96 PolarHBondContact O-N 3.47Å
73	V	96	Very high	94.9	Very high	30 Å²	30	67.9 Å²	67.9	18%	0.182	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	140.8	176	-64.5	0	0	0	0	111.7	L46 V70 V71 Y94 L102 Y121	L46-V73 HydrophobicContact CD2-CG1 3.91Å; V70-V73 HydrophobicContact CB-CG2 4.11Å; V70-V73 HydrophobicContact CG1-CB 4.27Å; V70-V73 HydrophobicContact CG1-CG1 3.51Å; V70-V73 HydrophobicContact CG1-CG2 3.7Å; V71-V73 VanDerWaalsContact C-N 3.25Å; V71-V73 PolarHBondContact O-N 2.97Å; V73-Y94 CarbonylContact C-O 3.52Å; V73-Y94 WeakPolarHBondContact CA-O 3.49Å; V73-L102 HydrophobicContact CG1-CD1 3.7Å; V73-Y121 HydrophobicContact CG2-CE1 4.44Å
74	S	96	Very high	94.5	Very high	40 Å²	40	67 Å²	67	28%	0.28	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	138.7	172.7	-15.5	0	0	0	0	108.8	I93 Y94 D96	S74-I93 WeakPolarHBondContact O-CA 3.37Å; S74-Y94 PolarHBondContact N-O 2.83Å; S74-Y94 PolarHBondContact O-N 3.3Å; S74-D96 PolarHBondContact OG-OD1 3.36Å
75	C	95.7	Very high	94	Very high	63 Å²	63	69.6 Å²	69.6	43%	0.426	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	134.2	178.9	-62.3	0	0	0	0	110.5
76	G	94.9	Very high	93.7	Very high	29 Å²	29	69.3 Å²	69.3	30%	0.299	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	-167.4	173	0	0	0	0	0	113	D92	G76-D92 PolarHBondContact N-O 2.78Å
77	K	95.4	Very high	93.5	Very high	180 Å²	180	72.2 Å²	72.2	78%	0.783	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	136.3	174.3	-67.2	-178.9	-179.1	177.7	0	109.7	E79	K77-E79 PolarHBondContact O-N 3.04Å
78	P	94.8	Very high	93.4	Very high	82 Å²	82	72.3 Å²	72.3	53%	0.532	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	132.8	171.1	-21.2	32.9	0	0	0	111	E107	P78-E107 HydrophobicContact CB-CG 4.18Å; P78-E107 HydrophobicContact CG-CG 4.16Å
79	E	95.5	Very high	93.4	Very high	102 Å²	102	69.8 Å²	69.8	48%	0.477	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	141.4	177.1	-67.1	-177.3	165.2	0	0	109.8	K77 R81 V90	K77-E79 PolarHBondContact O-N 3.04Å; E79-R81 IonicContact OE2-CZ 3.58Å; E79-R81 IonicContact OE2-NE 3.5Å; E79-R81 PolarHBondContact OE2-NE 2.97Å; E79-R81 IonicContact OE2-NH2 2.77Å; E79-R81 PolarHBondContact OE2-NH2 3.28Å; E79-V90 PolarHBondContact N-O 2.9Å; E79-V90 PolarHBondContact O-N 2.82Å; E79-V90 VanDerWaalsContact O-O 3.11Å
80	E	94.5	Very high	93.4	Very high	129 Å²	129	67 Å²	67	60%	0.603	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	124.1	174.5	-64.8	-174.3	164	0	0	110.5	L87 H88	E80-L87 HydrophobicContact CB-CD1 4.26Å; E80-H88 WeakPolarHBondContact CA-O 3.35Å
81	R	93.8	Very high	93.5	Very high	68 Å²	68	66.2 Å²	66.2	26%	0.257	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	135.3	178.9	-60.8	-171.1	-170.3	151.7	-2.1	111.1	E79 L83 H88 V90 D92	E79-R81 IonicContact OE2-CZ 3.58Å; E79-R81 IonicContact OE2-NE 3.5Å; E79-R81 PolarHBondContact OE2-NE 2.97Å; E79-R81 IonicContact OE2-NH2 2.77Å; E79-R81 PolarHBondContact OE2-NH2 3.28Å; R81-L83 HydrophobicContact CB-CD2 4.48Å; R81-L83 PolarHBondContact O-N 2.97Å; R81-H88 PolarHBondContact N-O 2.91Å; R81-H88 PolarHBondContact O-N 2.8Å; R81-V90 HydrophobicContact CB-CG2 4Å; R81-V90 HydrophobicContact CG-CG2 3.73Å; R81-D92 IonicContact CZ-OD1 3.34Å; R81-D92 IonicContact CZ-OD2 3.73Å; R81-D92 IonicContact NH1-OD1 2.68Å; R81-D92 PolarHBondContact NH1-OD1 3Å; R81-D92 IonicContact NH1-OD2 3.8Å; R81-D92 VanDerWaalsContact NH2-CG 3.26Å; R81-D92 IonicContact NH2-OD1 2.62Å; R81-D92 PolarHBondContact NH2-OD1 3.49Å; R81-D92 VanDerWaalsContact NH2-OD1 3.14Å; R81-D92 IonicContact NH2-OD2 3Å; R81-D92 PolarHBondContact NH2-OD2 3.22Å
82	L	91.1	Very high	93.5	Very high	145 Å²	145	64.5 Å²	64.5	76%	0.759	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	109.2	169.3	-73.6	170.8	0	0	0	108.9	L87	L82-L87 HydrophobicContact CD2-CB 3.94Å; L82-L87 HydrophobicContact CD2-CD1 3.73Å; L82-L87 HydrophobicContact CD2-CG 4.46Å; L82-L87 HydrophobicContact CG-CD1 3.98Å
83	L	89.4	Confident	93.6	Very high	52 Å²	52	60.9 Å²	60.9	27%	0.272	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	175.9	176.3	-60	176.6	0	0	0	110	R81 T85 G86 H88 V90 Y106	R81-L83 HydrophobicContact CB-CD2 4.48Å; R81-L83 PolarHBondContact O-N 2.97Å; L83-T85 PolarHBondContact O-N 3.4Å; L83-G86 PolarHBondContact N-O 3.35Å; L83-G86 PolarHBondContact O-N 2.8Å; L83-H88 HydrophobicContact CD1-CB 4.23Å; L83-V90 HydrophobicContact CD1-CG1 4.25Å; L83-Y106 HydrophobicContact CD1-CE1 3.66Å
84	L	85.6	Confident	93.6	Very high	164 Å²	164	63.1 Å²	63.1	86%	0.859	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-31.2	-178.3	-171.3	67.2	0	0	0	113.4
85	T	85.7	Confident	93.6	Very high	54 Å²	54	61.2 Å²	61.2	33%	0.331	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	12	-178.8	57.3	0	0	0	0	113.8	L83 H88 Q114 K117	L83-T85 PolarHBondContact O-N 3.4Å; T85-H88 PolarHBondContact OG1-CE1 2.97Å; T85-H88 PolarHBondContact OG1-NE2 3.14Å; T85-Q114 PolarHBondContact OG1-OE1 2.87Å; T85-K117 PolarHBondContact OG1-NZ 2.74Å
86	G	89.2	Confident	93.7	Very high	30 Å²	30	62.6 Å²	62.6	31%	0.309	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	111.5	-166.3	-179.9	0	0	0	0	0	113.8	L83 H88	L83-G86 PolarHBondContact N-O 3.35Å; L83-G86 PolarHBondContact O-N 2.8Å; G86-H88 PolarHBondContact O-CE1 2.89Å; G86-H88 PolarHBondContact O-ND1 2.93Å
87	L	92.5	Very high	93.6	Very high	62 Å²	62	64.9 Å²	64.9	33%	0.325	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	133.1	178.8	-168.8	68.2	0	0	0	110.6	E80 L82 F110	E80-L87 HydrophobicContact CB-CD1 4.26Å; L82-L87 HydrophobicContact CD2-CB 3.94Å; L82-L87 HydrophobicContact CD2-CD1 3.73Å; L82-L87 HydrophobicContact CD2-CG 4.46Å; L82-L87 HydrophobicContact CG-CD1 3.98Å; L87-F110 HydrophobicContact CB-CD2 4Å; L87-F110 HydrophobicContact CB-CE2 4.49Å; L87-F110 HydrophobicContact CD2-CD2 3.9Å; L87-F110 HydrophobicContact CD2-CE2 3.76Å; L87-F110 HydrophobicContact CD2-CG 4.4Å; L87-F110 HydrophobicContact CD2-CZ 4.17Å; L87-F110 HydrophobicContact CG-CD2 3.81Å; L87-F110 HydrophobicContact CG-CE2 3.8Å; L87-F110 WeakPolarHBondContact O-CD2 3.32Å
88	H	93.7	Very high	93.7	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	143.9	174.3	-60.6	71.3	0	0	0	109.2	E80 R81 L83 T85 G86 V90 Y106 Q108	E80-H88 WeakPolarHBondContact CA-O 3.35Å; R81-H88 PolarHBondContact N-O 2.91Å; R81-H88 PolarHBondContact O-N 2.8Å; L83-H88 HydrophobicContact CD1-CB 4.23Å; T85-H88 PolarHBondContact OG1-CE1 2.97Å; T85-H88 PolarHBondContact OG1-NE2 3.14Å; G86-H88 PolarHBondContact O-CE1 2.89Å; G86-H88 PolarHBondContact O-ND1 2.93Å; H88-V90 HydrophobicContact CB-CG1 3.97Å; H88-Y106 HydrophobicContact CB-CD1 4.14Å; H88-Y106 HydrophobicContact CB-CE1 4.31Å; H88-Y106 AromaticContact CD2-CD1 3.84Å; H88-Y106 AromaticContact CD2-CE1 3.86Å; H88-Q108 CarbonylContact C-O 3.55Å; H88-Q108 WeakPolarHBondContact CA-O 3.33Å
89	S	95.8	Very high	93.7	Very high	16 Å²	16	60.6 Å²	60.6	11%	0.112	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	120.3	163.2	-174.8	0	0	0	0	108.3	E107 Q108	S89-E107 PolarHBondContact O-N 3.5Å; S89-Q108 PolarHBondContact N-O 3.35Å; S89-Q108 PolarHBondContact O-N 3.03Å; S89-Q108 VanDerWaalsContact O-N 3.09Å
90	V	95.8	Very high	93.7	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	144.1	-176.3	-60.1	0	0	0	0	110.6	E79 R81 L83 H88 W104 K105 Y106	E79-V90 PolarHBondContact N-O 2.9Å; E79-V90 PolarHBondContact O-N 2.82Å; E79-V90 VanDerWaalsContact O-O 3.11Å; R81-V90 HydrophobicContact CB-CG2 4Å; R81-V90 HydrophobicContact CG-CG2 3.73Å; L83-V90 HydrophobicContact CD1-CG1 4.25Å; H88-V90 HydrophobicContact CB-CG1 3.97Å; V90-W104 HydrophobicContact CB-CB 4.27Å; V90-W104 HydrophobicContact CB-CG 4.19Å; V90-K105 CarbonylContact C-O 3.52Å; V90-K105 WeakPolarHBondContact CA-O 3.18Å; V90-K105 WeakPolarHBondContact CB-O 3.22Å; V90-Y106 HydrophobicContact CG1-CD1 3.78Å; V90-Y106 HydrophobicContact CG1-CE1 4.14Å; V90-Y106 HydrophobicContact CG1-CG 4.49Å
91	A	96.9	Very high	93.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126.8	174.5	0	0	0	0	0	109.3	I93 W104 K105 E107	A91-I93 PolarHBondContact O-N 3.48Å; A91-W104 CarbonylContact O-C 3.4Å; A91-W104 WeakPolarHBondContact O-CA 3.45Å; A91-W104 WeakPolarHBondContact O-CB 3.17Å; A91-K105 PolarHBondContact N-O 3.17Å; A91-K105 PolarHBondContact O-N 2.93Å; A91-E107 HydrophobicContact CB-CG 4.03Å
92	D	96.1	Very high	93.8	Very high	31 Å²	31	51.2 Å²	51.2	17%	0.166	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	138.7	174.8	-71.6	-29.7	0	0	0	110.7	G76 R81 Y94	G76-D92 PolarHBondContact N-O 2.78Å; R81-D92 IonicContact CZ-OD1 3.34Å; R81-D92 IonicContact CZ-OD2 3.73Å; R81-D92 IonicContact NH1-OD1 2.68Å; R81-D92 PolarHBondContact NH1-OD1 3Å; R81-D92 IonicContact NH1-OD2 3.8Å; R81-D92 VanDerWaalsContact NH2-CG 3.26Å; R81-D92 IonicContact NH2-OD1 2.62Å; R81-D92 PolarHBondContact NH2-OD1 3.49Å; R81-D92 VanDerWaalsContact NH2-OD1 3.14Å; R81-D92 IonicContact NH2-OD2 3Å; R81-D92 PolarHBondContact NH2-OD2 3.22Å; D92-Y94 HydrophobicContact CB-CE2 3.79Å; D92-Y94 WeakPolarHBondContact O-CE2 3.34Å
93	I	96.5	Very high	94	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	136.7	177.1	57.6	164.2	0	0	0	110.5	S74 A91 L102 G103 K105 Y121 I123	S74-I93 WeakPolarHBondContact O-CA 3.37Å; A91-I93 PolarHBondContact O-N 3.48Å; I93-L102 HydrophobicContact CD1-CB 4.21Å; I93-L102 HydrophobicContact CG1-CB 4.24Å; I93-L102 PolarHBondContact O-N 3.32Å; I93-G103 WeakPolarHBondContact CG1-O 3.37Å; I93-G103 PolarHBondContact N-O 2.74Å; I93-K105 HydrophobicContact CG2-CB 3.97Å; I93-Y121 HydrophobicContact CD1-CD1 4.33Å; I93-Y121 HydrophobicContact CG2-CD1 4.15Å; I93-Y121 HydrophobicContact CG2-CE1 4.38Å; I93-I123 HydrophobicContact CD1-CG1 3.83Å
94	Y	96.9	Very high	94.3	Very high	77 Å²	77	43 Å²	43	30%	0.302	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.2	-177.6	-56.5	-96.5	0	0	0	108.6	V73 S74 D92 D96 T100 V101	V73-Y94 CarbonylContact C-O 3.52Å; V73-Y94 WeakPolarHBondContact CA-O 3.49Å; S74-Y94 PolarHBondContact N-O 2.83Å; S74-Y94 PolarHBondContact O-N 3.3Å; D92-Y94 HydrophobicContact CB-CE2 3.79Å; D92-Y94 WeakPolarHBondContact O-CE2 3.34Å; Y94-D96 PolarHBondContact O-N 3.44Å; Y94-T100 WeakPolarHBondContact CA-O 3.16Å; Y94-V101 HydrophobicContact CD1-CG2 3.83Å; Y94-V101 HydrophobicContact CE1-CG2 3.48Å; Y94-V101 VanDerWaalsContact CE1-CG2 3.48Å
95	C	96.9	Very high	94.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	126.9	169.4	-177.6	0	0	0	0	109.5	C42 C97 C98 H99 T100 L102	C42-C95 PolarHBondContact SG-SG 2.79Å; C95-C97 PolarHBondContact O-N 2.54Å; C95-C98 WeakPolarHBondContact CB-SG 3.41Å; C95-C98 PolarHBondContact O-N 2.87Å; C95-C98 VanDerWaalsContact SG-SG 3.61Å; C95-H99 WeakPolarHBondContact O-CA 3.36Å; C95-H99 PolarHBondContact O-N 3.43Å; C95-T100 PolarHBondContact N-O 2.92Å; C95-L102 HydrophobicContact CB-CD1 3.85Å; C95-L102 HydrophobicContact CB-CD2 4.19Å; C95-L102 HydrophobicContact CB-CG 4.09Å
96	D	96	Very high	95.3	Very high	91 Å²	91	34.7 Å²	34.7	49%	0.487	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-26.2	-177.5	-158.2	57.2	0	0	0	112.2	N72 S74 Y94 H99	N72-D96 WeakPolarHBondContact O-CB 3.39Å; N72-D96 PolarHBondContact O-N 3.47Å; S74-D96 PolarHBondContact OG-OD1 3.36Å; Y94-D96 PolarHBondContact O-N 3.44Å; D96-H99 PolarHBondContact O-CE1 2.82Å
97	C	94.8	Very high	95.6	Very high	78 Å²	78	36.5 Å²	36.5	53%	0.527	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-34.6	-178.2	-54.3	0	0	0	0	114.6	C42 A44 C95	C42-C97 HydrophobicContact CB-CB 4.32Å; A44-C97 HydrophobicContact CB-CB 4.16Å; C95-C97 PolarHBondContact O-N 2.54Å
98	C	96	Very high	95.7	Very high	38 Å²	38	38 Å²	38	26%	0.257	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125	1.1	-175	66.6	0	0	0	0	114.4	C39 C42 C95 T100	C39-C98 VanDerWaalsContact SG-SG 3.63Å; C42-C98 HydrophobicContact CB-CB 3.91Å; C42-C98 VanDerWaalsContact SG-SG 3.61Å; C95-C98 WeakPolarHBondContact CB-SG 3.41Å; C95-C98 PolarHBondContact O-N 2.87Å; C95-C98 VanDerWaalsContact SG-SG 3.61Å; C98-T100 PolarHBondContact O-N 2.91Å; C98-T100 PolarHBondContact SG-OG1 3.33Å
99	H	94.9	Very high	95.6	Very high	133 Å²	133	38 Å²	38	62%	0.616	20%	0.198	S	C	*	.			trans	54.1	16.4	179.7	-51.6	-54.9	0	0	0	115.3	C95 D96	C95-H99 WeakPolarHBondContact O-CA 3.36Å; C95-H99 PolarHBondContact O-N 3.43Å; D96-H99 PolarHBondContact O-CE1 2.82Å
100	T	95.1	Very high	95.4	Very high	36 Å²	36	42 Å²	42	22%	0.221	21%	0.213	C	C	.	.			trans	-74.2	139	174.5	-56.1	0	0	0	0	109.7	Y94 C95 C98 L102	Y94-T100 WeakPolarHBondContact CA-O 3.16Å; C95-T100 PolarHBondContact N-O 2.92Å; C98-T100 PolarHBondContact O-N 2.91Å; C98-T100 PolarHBondContact SG-OG1 3.33Å; T100-L102 PolarHBondContact O-N 2.81Å
101	V	95.1	Very high	95.1	Very high	66 Å²	66	46.7 Å²	46.7	40%	0.4	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	122.9	172.7	-178.1	0	0	0	0	108.8	Y94 H127	Y94-V101 HydrophobicContact CD1-CG2 3.83Å; Y94-V101 HydrophobicContact CE1-CG2 3.48Å; Y94-V101 VanDerWaalsContact CE1-CG2 3.48Å; V101-H127 PolarHBondContact O-CD2 3.4Å
102	L	95.5	Very high	94.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-26.9	-180	-61.1	176	0	0	0	112.3	L46 V73 I93 C95 T100 I123 E124 H127	L46-L102 HydrophobicContact CD1-CD1 3.77Å; L46-L102 HydrophobicContact CD1-CD2 4.23Å; L46-L102 HydrophobicContact CD2-CD1 3.57Å; L46-L102 HydrophobicContact CG-CD1 4.33Å; V73-L102 HydrophobicContact CG1-CD1 3.7Å; I93-L102 HydrophobicContact CD1-CB 4.21Å; I93-L102 HydrophobicContact CG1-CB 4.24Å; I93-L102 PolarHBondContact O-N 3.32Å; C95-L102 HydrophobicContact CB-CD1 3.85Å; C95-L102 HydrophobicContact CB-CD2 4.19Å; C95-L102 HydrophobicContact CB-CG 4.09Å; T100-L102 PolarHBondContact O-N 2.81Å; L102-I123 HydrophobicContact CB-CG2 4.21Å; L102-I123 WeakPolarHBondContact O-CA 3.22Å; L102-E124 PolarHBondContact O-N 3.37Å; L102-H127 HydrophobicContact CD2-CB 3.79Å
103	G	95.5	Very high	94.6	Very high	3 Å²	3	52.9 Å²	52.9	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.7	-140	-174.5	0	0	0	0	0	110.4	I93 I122	I93-G103 WeakPolarHBondContact CG1-O 3.37Å; I93-G103 PolarHBondContact N-O 2.74Å; G103-I122 WeakPolarHBondContact CA-O 3.49Å
104	W	96.2	Very high	94.4	Very high	22 Å²	22	54.1 Å²	54.1	8%	0.083	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	157.5	179	61.3	90.4	0	0	0	112.7	G59 V90 A91 Y106 I122	G59-W104 VanDerWaalsContact CA-CH2 3.45Å; V90-W104 HydrophobicContact CB-CB 4.27Å; V90-W104 HydrophobicContact CB-CG 4.19Å; A91-W104 CarbonylContact O-C 3.4Å; A91-W104 WeakPolarHBondContact O-CA 3.45Å; A91-W104 WeakPolarHBondContact O-CB 3.17Å; W104-Y106 AromaticContact NE1-CZ 3.71Å; W104-I122 HydrophobicContact CD2-CB 4.4Å; W104-I122 HydrophobicContact CD2-CG2 4.49Å; W104-I122 HydrophobicContact CH2-CB 4.48Å; W104-I122 HydrophobicContact CH2-CG2 3.68Å; W104-I122 HydrophobicContact CZ2-CB 4.06Å; W104-I122 HydrophobicContact CZ2-CD1 3.71Å; W104-I122 HydrophobicContact CZ2-CG1 4.46Å; W104-I122 HydrophobicContact CZ2-CG2 3.69Å; W104-I122 HydrophobicContact CZ3-CG2 4.18Å; W104-I122 PolarHBondContact N-O 3.47Å; W104-I122 VanDerWaalsContact N-O 3.09Å; W104-I122 PolarHBondContact O-N 2.71Å
105	K	96.4	Very high	94.2	Very high	35 Å²	35	54.4 Å²	54.4	15%	0.152	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	140.6	169.3	-179.4	-171.3	165.2	-144.3	0	109.2	V90 A91 I93 E107 K120 Y121	V90-K105 CarbonylContact C-O 3.52Å; V90-K105 WeakPolarHBondContact CA-O 3.18Å; V90-K105 WeakPolarHBondContact CB-O 3.22Å; A91-K105 PolarHBondContact N-O 3.17Å; A91-K105 PolarHBondContact O-N 2.93Å; I93-K105 HydrophobicContact CG2-CB 3.97Å; K105-E107 WeakPolarHBondContact CD-OE1 3.34Å; K105-E107 WeakPolarHBondContact CE-OE1 3.41Å; K105-E107 VanDerWaalsContact NZ-CD 3.3Å; K105-E107 IonicContact NZ-OE1 2.71Å; K105-E107 PolarHBondContact NZ-OE1 3.48Å; K105-E107 IonicContact NZ-OE2 3.82Å; K105-E107 PolarHBondContact NZ-OE2 2.76Å; K105-E107 VanDerWaalsContact NZ-OE2 3.14Å; K105-E107 PolarHBondContact O-N 3.38Å; K105-K120 WeakPolarHBondContact CA-O 3.22Å; K105-Y121 HydrophobicContact CB-CD1 3.86Å; K105-Y121 HydrophobicContact CB-CE1 3.92Å; K105-Y121 HydrophobicContact CD-CD1 4.36Å; K105-Y121 HydrophobicContact CD-CE1 3.63Å; K105-Y121 HydrophobicContact CG-CD1 4.01Å; K105-Y121 HydrophobicContact CG-CE1 3.78Å
106	Y	95	Very high	93.9	Very high	8 Å²	8	59.8 Å²	59.8	3%	0.031	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	115.3	168.6	-67.8	-83.6	0	0	0	109.8	L66 L83 H88 V90 W104 K117 G119 K120 I122	L66-Y106 HydrophobicContact CD1-CD2 4.47Å; L66-Y106 HydrophobicContact CD1-CE2 4.15Å; L83-Y106 HydrophobicContact CD1-CE1 3.66Å; H88-Y106 HydrophobicContact CB-CD1 4.14Å; H88-Y106 HydrophobicContact CB-CE1 4.31Å; H88-Y106 AromaticContact CD2-CD1 3.84Å; H88-Y106 AromaticContact CD2-CE1 3.86Å; V90-Y106 HydrophobicContact CG1-CD1 3.78Å; V90-Y106 HydrophobicContact CG1-CE1 4.14Å; V90-Y106 HydrophobicContact CG1-CG 4.49Å; W104-Y106 AromaticContact NE1-CZ 3.71Å; Y106-K117 WeakPolarHBondContact CB-O 3.22Å; Y106-K117 HydrophobicContact CD1-CB 4.31Å; Y106-K117 HydrophobicContact CD2-CB 3.86Å; Y106-K117 HydrophobicContact CE1-CD 4.14Å; Y106-K117 HydrophobicContact CE2-CB 4.17Å; Y106-K117 HydrophobicContact CE2-CD 4.18Å; Y106-K117 HydrophobicContact CG-CB 3.93Å; Y106-G119 PolarHBondContact O-N 3.39Å; Y106-K120 PolarHBondContact N-O 2.62Å; Y106-I122 HydrophobicContact CE2-CD1 3.45Å; Y106-I122 VanDerWaalsContact CE2-CD1 3.45Å; Y106-I122 HydrophobicContact CE2-CG1 3.74Å; Y106-I122 WeakPolarHBondContact OH-CD1 3.4Å
107	E	95.7	Very high	93.7	Very high	68 Å²	68	55.8 Å²	55.8	32%	0.318	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-44.6	173.7	-68.3	-62.7	156.2	0	0	110.6	P78 S89 A91 K105	P78-E107 HydrophobicContact CB-CG 4.18Å; P78-E107 HydrophobicContact CG-CG 4.16Å; S89-E107 PolarHBondContact O-N 3.5Å; A91-E107 HydrophobicContact CB-CG 4.03Å; K105-E107 WeakPolarHBondContact CD-OE1 3.34Å; K105-E107 WeakPolarHBondContact CE-OE1 3.41Å; K105-E107 VanDerWaalsContact NZ-CD 3.3Å; K105-E107 IonicContact NZ-OE1 2.71Å; K105-E107 PolarHBondContact NZ-OE1 3.48Å; K105-E107 IonicContact NZ-OE2 3.82Å; K105-E107 PolarHBondContact NZ-OE2 2.76Å; K105-E107 VanDerWaalsContact NZ-OE2 3.14Å; K105-E107 PolarHBondContact O-N 3.38Å
108	Q	94.3	Very high	93.7	Very high	94 Å²	94	55.1 Å²	55.1	44%	0.439	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	138.9	-177.9	-160	175.2	26.4	0	0	111.8	H88 S89 E118	H88-Q108 CarbonylContact C-O 3.55Å; H88-Q108 WeakPolarHBondContact CA-O 3.33Å; S89-Q108 PolarHBondContact N-O 3.35Å; S89-Q108 PolarHBondContact O-N 3.03Å; S89-Q108 VanDerWaalsContact O-N 3.09Å; Q108-E118 WeakPolarHBondContact CA-OE1 3.34Å
109	A	92.4	Very high	93.6	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	131.2	169	0	0	0	0	0	109.4	Q114 K115 E118	A109-Q114 HydrophobicContact CB-CB 3.81Å; A109-K115 HydrophobicContact CB-CD 4.41Å; A109-K115 WeakPolarHBondContact O-CE 3.43Å; A109-K115 PolarHBondContact O-NZ 3.23Å; A109-E118 HydrophobicContact CB-CG 4.08Å; A109-E118 PolarHBondContact N-OE1 3.42Å
110	F	90.5	Very high	93.7	Very high	101 Å²	101	50.7 Å²	50.7	44%	0.443	26%	0.262	S	S	.	.	S	Bend	trans	-80.7	-28.9	-178.9	-69	-89.7	0	0	0	112.3	L87	L87-F110 HydrophobicContact CB-CD2 4Å; L87-F110 HydrophobicContact CB-CE2 4.49Å; L87-F110 HydrophobicContact CD2-CD2 3.9Å; L87-F110 HydrophobicContact CD2-CE2 3.76Å; L87-F110 HydrophobicContact CD2-CG 4.4Å; L87-F110 HydrophobicContact CD2-CZ 4.17Å; L87-F110 HydrophobicContact CG-CD2 3.81Å; L87-F110 HydrophobicContact CG-CE2 3.8Å; L87-F110 WeakPolarHBondContact O-CD2 3.32Å
111	E	91.4	Very high	93.8	Very high	100 Å²	100	50.9 Å²	50.9	47%	0.467	26%	0.259	S	S	.	.	S	Bend	trans	-88.4	133.3	177.6	-176.7	53.5	-110.4	0	0	111.1	S113 Q114 K115	E111-S113 VanDerWaalsContact C-N 3.25Å; E111-S113 VanDerWaalsContact CG-OG 3.27Å; E111-S113 WeakPolarHBondContact CG-OG 3.21Å; E111-S113 PolarHBondContact O-N 2.86Å; E111-Q114 HydrophobicContact CB-CB 4.46Å; E111-Q114 HydrophobicContact CB-CG 4.08Å; E111-Q114 HydrophobicContact CG-CG 4.37Å; E111-Q114 PolarHBondContact O-N 3.44Å; E111-K115 PolarHBondContact O-N 2.79Å
112	S	90.3	Very high	93.8	Very high	92 Å²	92	47.8 Å²	47.8	64%	0.643	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-56.5	-39.3	-179.6	61.5	0	0	0	0	112.4	Q114 K115	S112-Q114 PolarHBondContact O-N 2.77Å; S112-K115 WeakPolarHBondContact O-CB 3.42Å; S112-K115 WeakPolarHBondContact O-CG 3.14Å; S112-K115 PolarHBondContact O-N 3.2Å
113	S	91.8	Very high	93.8	Very high	69 Å²	69	47.8 Å²	47.8	48%	0.483	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-66.2	-15.1	178.2	70.9	0	0	0	0	114.2	E111 Y116	E111-S113 VanDerWaalsContact C-N 3.25Å; E111-S113 VanDerWaalsContact CG-OG 3.27Å; E111-S113 WeakPolarHBondContact CG-OG 3.21Å; E111-S113 PolarHBondContact O-N 2.86Å; S113-Y116 VanDerWaalsContact O-CD1 3.3Å; S113-Y116 WeakPolarHBondContact O-CD1 3.29Å; S113-Y116 WeakPolarHBondContact O-CE1 3.28Å
114	Q	91.5	Very high	93.8	Very high	25 Å²	25	48 Å²	48	12%	0.117	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-106	-3.6	-177.7	-56.6	-53.4	-53.5	0	0	113	T85 A109 E111 S112 Y116 K117	T85-Q114 PolarHBondContact OG1-OE1 2.87Å; A109-Q114 HydrophobicContact CB-CB 3.81Å; E111-Q114 HydrophobicContact CB-CB 4.46Å; E111-Q114 HydrophobicContact CB-CG 4.08Å; E111-Q114 HydrophobicContact CG-CG 4.37Å; E111-Q114 PolarHBondContact O-N 3.44Å; S112-Q114 PolarHBondContact O-N 2.77Å; Q114-Y116 PolarHBondContact O-N 2.94Å; Q114-Y116 VanDerWaalsContact O-N 3.11Å; Q114-K117 WeakPolarHBondContact O-CB 3.2Å; Q114-K117 PolarHBondContact O-N 3.13Å
115	K	92	Very high	93.7	Very high	84 Å²	84	49.1 Å²	49.1	37%	0.365	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-56.1	-28.3	-179.8	-71	-64.8	-166.7	-174.1	0	114.2	A109 E111 S112 K117 E118	A109-K115 HydrophobicContact CB-CD 4.41Å; A109-K115 WeakPolarHBondContact O-CE 3.43Å; A109-K115 PolarHBondContact O-NZ 3.23Å; E111-K115 PolarHBondContact O-N 2.79Å; S112-K115 WeakPolarHBondContact O-CB 3.42Å; S112-K115 WeakPolarHBondContact O-CG 3.14Å; S112-K115 PolarHBondContact O-N 3.2Å; K115-K117 PolarHBondContact O-N 2.81Å; K115-E118 HydrophobicContact CD-CG 4.28Å; K115-E118 WeakPolarHBondContact CD-OE1 3.18Å; K115-E118 WeakPolarHBondContact CD-OE2 3.5Å; K115-E118 WeakPolarHBondContact CE-OE1 3.21Å; K115-E118 IonicContact NZ-OE1 3.25Å; K115-E118 PolarHBondContact NZ-OE1 2.82Å; K115-E118 IonicContact NZ-OE2 2.8Å; K115-E118 WeakPolarHBondContact O-CB 3.3Å; K115-E118 PolarHBondContact O-N 3.28Å
116	Y	91.3	Very high	93.5	Very high	113 Å²	113	50.2 Å²	50.2	44%	0.443	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-60.8	-17.2	175.9	77.1	-90.5	0	0	0	113.9	S113 Q114 K120	S113-Y116 VanDerWaalsContact O-CD1 3.3Å; S113-Y116 WeakPolarHBondContact O-CD1 3.29Å; S113-Y116 WeakPolarHBondContact O-CE1 3.28Å; Q114-Y116 PolarHBondContact O-N 2.94Å; Q114-Y116 VanDerWaalsContact O-N 3.11Å; Y116-K120 WeakPolarHBondContact O-CE 3.2Å; Y116-K120 WeakPolarHBondContact O-CG 3.37Å
117	K	92.3	Very high	93.4	Very high	7 Å²	7	51.7 Å²	51.7	3%	0.03	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-84.2	-19.7	176.6	-62.3	177.5	178.6	173.3	0	112.9	F57 T85 Y106 Q114 K115 G119 K120	F57-K117 HydrophobicContact CE1-CD 4.46Å; T85-K117 PolarHBondContact OG1-NZ 2.74Å; Y106-K117 WeakPolarHBondContact CB-O 3.22Å; Y106-K117 HydrophobicContact CD1-CB 4.31Å; Y106-K117 HydrophobicContact CD2-CB 3.86Å; Y106-K117 HydrophobicContact CE1-CD 4.14Å; Y106-K117 HydrophobicContact CE2-CB 4.17Å; Y106-K117 HydrophobicContact CE2-CD 4.18Å; Y106-K117 HydrophobicContact CG-CB 3.93Å; Q114-K117 WeakPolarHBondContact O-CB 3.2Å; Q114-K117 PolarHBondContact O-N 3.13Å; K115-K117 PolarHBondContact O-N 2.81Å; K117-G119 PolarHBondContact O-N 3.08Å; K117-K120 WeakPolarHBondContact O-CB 3.43Å; K117-K120 WeakPolarHBondContact O-CG 3.31Å; K117-K120 PolarHBondContact O-N 2.79Å
118	E	93.9	Very high	93.3	Very high	64 Å²	64	49.4 Å²	49.4	30%	0.299	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	134.4	-179.1	-65.9	-175.4	159.5	0	0	110.7	Q108 A109 K115 K120	Q108-E118 WeakPolarHBondContact CA-OE1 3.34Å; A109-E118 HydrophobicContact CB-CG 4.08Å; A109-E118 PolarHBondContact N-OE1 3.42Å; K115-E118 HydrophobicContact CD-CG 4.28Å; K115-E118 WeakPolarHBondContact CD-OE1 3.18Å; K115-E118 WeakPolarHBondContact CD-OE2 3.5Å; K115-E118 WeakPolarHBondContact CE-OE1 3.21Å; K115-E118 IonicContact NZ-OE1 3.25Å; K115-E118 PolarHBondContact NZ-OE1 2.82Å; K115-E118 IonicContact NZ-OE2 2.8Å; K115-E118 WeakPolarHBondContact O-CB 3.3Å; K115-E118 PolarHBondContact O-N 3.28Å; E118-K120 PolarHBondContact O-N 3.25Å
119	G	94.5	Very high	93.2	Very high	33 Å²	33	46.9 Å²	46.9	34%	0.34	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	-7.5	-174.9	0	0	0	0	0	115.2	Y106 K117 Y121	Y106-G119 PolarHBondContact O-N 3.39Å; K117-G119 PolarHBondContact O-N 3.08Å; G119-Y121 VanDerWaalsContact O-CE2 3.28Å; G119-Y121 WeakPolarHBondContact O-CE2 3.47Å
120	K	96.3	Very high	93.2	Very high	45 Å²	45	50.4 Å²	50.4	20%	0.196	27%	0.265	C	S	.	.			trans	-86.5	156.7	-179.4	-48.6	-57.2	-176.6	162.2	0	111.7	I53 L66 D68 K105 Y106 Y116 K117 E118	I53-K120 HydrophobicContact CD1-CD 3.5Å; I53-K120 HydrophobicContact CD1-CG 4.11Å; L66-K120 HydrophobicContact CD1-CB 3.65Å; L66-K120 HydrophobicContact CD2-CB 4.44Å; L66-K120 HydrophobicContact CG-CB 4.13Å; D68-K120 IonicContact OD1-NZ 2.64Å; D68-K120 PolarHBondContact OD1-NZ 3.19Å; K105-K120 WeakPolarHBondContact CA-O 3.22Å; Y106-K120 PolarHBondContact N-O 2.62Å; Y116-K120 WeakPolarHBondContact O-CE 3.2Å; Y116-K120 WeakPolarHBondContact O-CG 3.37Å; K117-K120 WeakPolarHBondContact O-CB 3.43Å; K117-K120 WeakPolarHBondContact O-CG 3.31Å; K117-K120 PolarHBondContact O-N 2.79Å; E118-K120 PolarHBondContact O-N 3.25Å
121	Y	96.8	Very high	92.9	Very high	40 Å²	40	50 Å²	50	16%	0.157	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	132.4	-174.9	-60.9	-95	0	0	0	110.8	L66 F67 V70 V73 I93 K105 G119	L66-Y121 CarbonylContact C-O 3.49Å; L66-Y121 WeakPolarHBondContact CA-O 3.48Å; F67-Y121 PolarHBondContact N-O 3.36Å; F67-Y121 PolarHBondContact O-N 3.44Å; V70-Y121 HydrophobicContact CB-CD1 4.22Å; V70-Y121 HydrophobicContact CB-CD2 4.26Å; V70-Y121 HydrophobicContact CB-CG 4.01Å; V70-Y121 VanDerWaalsContact CG2-CB 3.44Å; V70-Y121 HydrophobicContact CG2-CD1 4.21Å; V70-Y121 HydrophobicContact CG2-CD2 3.9Å; V70-Y121 HydrophobicContact CG2-CG 3.58Å; V73-Y121 HydrophobicContact CG2-CE1 4.44Å; I93-Y121 HydrophobicContact CD1-CD1 4.33Å; I93-Y121 HydrophobicContact CG2-CD1 4.15Å; I93-Y121 HydrophobicContact CG2-CE1 4.38Å; K105-Y121 HydrophobicContact CB-CD1 3.86Å; K105-Y121 HydrophobicContact CB-CE1 3.92Å; K105-Y121 HydrophobicContact CD-CD1 4.36Å; K105-Y121 HydrophobicContact CD-CE1 3.63Å; K105-Y121 HydrophobicContact CG-CD1 4.01Å; K105-Y121 HydrophobicContact CG-CE1 3.78Å; G119-Y121 VanDerWaalsContact O-CE2 3.28Å; G119-Y121 WeakPolarHBondContact O-CE2 3.47Å
122	I	95.3	Very high	92.4	Very high	1 Å²	1	48 Å²	48	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128	166.7	-72.9	-171.9	0	0	0	109.1	F57 A64 Y65 L66 G103 W104 Y106	F57-I122 HydrophobicContact CB-CD1 4.24Å; F57-I122 HydrophobicContact CD1-CD1 3.42Å; F57-I122 VanDerWaalsContact CD1-CD1 3.42Å; F57-I122 HydrophobicContact CD1-CG1 4.36Å; F57-I122 HydrophobicContact CE1-CD1 4.04Å; F57-I122 HydrophobicContact CG-CD1 4.06Å; A64-I122 HydrophobicContact CB-CG2 3.52Å; Y65-I122 WeakPolarHBondContact O-CA 3.49Å; L66-I122 HydrophobicContact CD1-CD1 4.34Å; L66-I122 HydrophobicContact CD1-CG1 3.64Å; G103-I122 WeakPolarHBondContact CA-O 3.49Å; W104-I122 HydrophobicContact CD2-CB 4.4Å; W104-I122 HydrophobicContact CD2-CG2 4.49Å; W104-I122 HydrophobicContact CH2-CB 4.48Å; W104-I122 HydrophobicContact CH2-CG2 3.68Å; W104-I122 HydrophobicContact CZ2-CB 4.06Å; W104-I122 HydrophobicContact CZ2-CD1 3.71Å; W104-I122 HydrophobicContact CZ2-CG1 4.46Å; W104-I122 HydrophobicContact CZ2-CG2 3.69Å; W104-I122 HydrophobicContact CZ3-CG2 4.18Å; W104-I122 PolarHBondContact N-O 3.47Å; W104-I122 VanDerWaalsContact N-O 3.09Å; W104-I122 PolarHBondContact O-N 2.71Å; Y106-I122 HydrophobicContact CE2-CD1 3.45Å; Y106-I122 VanDerWaalsContact CE2-CD1 3.45Å; Y106-I122 HydrophobicContact CE2-CG1 3.74Å; Y106-I122 WeakPolarHBondContact OH-CD1 3.4Å
123	I	96	Very high	91.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.3	171.7	-58.1	171.9	0	0	0	108.8	L46 A64 Y65 F67 V70 I93 L102 L128	L46-I123 HydrophobicContact CB-CD1 4.33Å; L46-I123 HydrophobicContact CD1-CD1 4.42Å; A64-I123 WeakPolarHBondContact CA-O 3.21Å; A64-I123 WeakPolarHBondContact CB-O 3.39Å; Y65-I123 PolarHBondContact N-O 3.11Å; Y65-I123 PolarHBondContact O-N 2.74Å; F67-I123 HydrophobicContact CD2-CB 4.4Å; F67-I123 HydrophobicContact CD2-CD1 3.99Å; F67-I123 HydrophobicContact CD2-CG1 4.27Å; F67-I123 HydrophobicContact CE2-CB 4.22Å; F67-I123 HydrophobicContact CE2-CD1 4.17Å; F67-I123 HydrophobicContact CE2-CG1 4.49Å; V70-I123 HydrophobicContact CG1-CD1 3.89Å; V70-I123 HydrophobicContact CG2-CD1 3.9Å; I93-I123 HydrophobicContact CD1-CG1 3.83Å; L102-I123 HydrophobicContact CB-CG2 4.21Å; L102-I123 WeakPolarHBondContact O-CA 3.22Å; I123-L128 HydrophobicContact CG2-CB 4.19Å; I123-L128 HydrophobicContact CG2-CD1 3.86Å; I123-L128 HydrophobicContact CG2-CD2 4.42Å; I123-L128 HydrophobicContact CG2-CG 4.39Å
124	E	95.6	Very high	90.2	Very high	8 Å²	8	51.2 Å²	51.2	4%	0.037	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	140.6	178.1	-62.7	-173.1	159.6	0	0	111.3	S60 Q61 A64 L102 A126 H127 L128	S60-E124 WeakPolarHBondContact CA-OE1 3.16Å; S60-E124 WeakPolarHBondContact CB-OE1 3.5Å; S60-E124 PolarHBondContact N-OE1 3.39Å; S60-E124 PolarHBondContact OG-OE1 3.31Å; Q61-E124 WeakPolarHBondContact CB-OE2 3.45Å; Q61-E124 WeakPolarHBondContact CG-OE2 3.4Å; Q61-E124 PolarHBondContact N-OE1 2.91Å; Q61-E124 VanDerWaalsContact N-OE1 3.16Å; A64-E124 HydrophobicContact CB-CG 4.28Å; L102-E124 PolarHBondContact O-N 3.37Å; E124-A126 PolarHBondContact O-N 3.31Å; E124-H127 PolarHBondContact O-N 3.01Å; E124-L128 PolarHBondContact O-N 2.94Å
125	L	93.9	Very high	88.8	Confident	44 Å²	44	55.9 Å²	55.9	23%	0.23	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-63.6	-24.4	-178.6	-91.4	66.9	0	0	0	112.6	R63 Y65 H127 L128	R63-L125 HydrophobicContact CB-CD1 4.25Å; R63-L125 HydrophobicContact CB-CD2 4.08Å; R63-L125 WeakPolarHBondContact O-CD1 3.29Å; R63-L125 PolarHBondContact O-N 2.89Å; Y65-L125 HydrophobicContact CD1-CD1 3.51Å; Y65-L125 HydrophobicContact CD2-CD1 3.98Å; Y65-L125 HydrophobicContact CE1-CD1 3.55Å; Y65-L125 HydrophobicContact CE1-CD2 4.06Å; Y65-L125 HydrophobicContact CE1-CG 4.3Å; Y65-L125 HydrophobicContact CE2-CD1 4Å; Y65-L125 HydrophobicContact CE2-CD2 4.49Å; Y65-L125 HydrophobicContact CE2-CG 4.31Å; Y65-L125 HydrophobicContact CG-CD1 3.74Å; L125-H127 PolarHBondContact O-N 3.18Å; L125-L128 PolarHBondContact O-N 2.92Å
126	A	93.2	Very high	87.2	Confident	59 Å²	59	61.5 Å²	61.5	49%	0.488	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-60.4	-28.7	176	0	0	0	0	0	112.5	Q61 E124	Q61-A126 HydrophobicContact CB-CB 4.42Å; E124-A126 PolarHBondContact O-N 3.31Å
127	H	92	Very high	85.7	Confident	39 Å²	39	61 Å²	61	18%	0.181	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-106.5	4.8	-178.5	-59.7	-63.9	0	0	0	113.6	V40 H41 V101 L102 E124 L125	V40-H127 HydrophobicContact CG1-CB 4.45Å; V40-H127 PolarHBondContact N-O 2.78Å; H41-H127 AromaticContact NE2-CE1 3.94Å; H41-H127 AromaticContact NE2-ND1 3.35Å; H41-H127 PolarHBondContact NE2-ND1 2.95Å; V101-H127 PolarHBondContact O-CD2 3.4Å; L102-H127 HydrophobicContact CD2-CB 3.79Å; E124-H127 PolarHBondContact O-N 3.01Å; L125-H127 PolarHBondContact O-N 3.18Å
128	L	93.3	Very high	83.9	Confident	19 Å²	19	65.1 Å²	65.1	10%	0.099	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.8	-171.2	-160.8	66	0	0	0	111.8	Y37 L46 Y65 F67 I123 E124 L125	Y37-L128 HydrophobicContact CD1-CD1 4.45Å; Y37-L128 HydrophobicContact CD1-CD2 3.51Å; Y37-L128 HydrophobicContact CD1-CG 3.85Å; Y37-L128 HydrophobicContact CE1-CD2 4.16Å; Y37-L128 HydrophobicContact CG-CD1 4.43Å; Y37-L128 HydrophobicContact CG-CD2 4.02Å; Y37-L128 HydrophobicContact CG-CG 4.3Å; L46-L128 HydrophobicContact CD1-CD1 3.75Å; Y65-L128 HydrophobicContact CD2-CD2 3.99Å; F67-L128 HydrophobicContact CE2-CD2 3.97Å; F67-L128 HydrophobicContact CZ-CD2 3.92Å; I123-L128 HydrophobicContact CG2-CB 4.19Å; I123-L128 HydrophobicContact CG2-CD1 3.86Å; I123-L128 HydrophobicContact CG2-CD2 4.42Å; I123-L128 HydrophobicContact CG2-CG 4.39Å; E124-L128 PolarHBondContact O-N 2.94Å; L125-L128 PolarHBondContact O-N 2.92Å
129	I	92.9	Very high	82	Confident	42 Å²	42	64.6 Å²	64.6	22%	0.215	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.8	169.7	-63.6	-177.2	0	0	0	108.1	Y37 S38 V40	Y37-I129 CarbonylContact C-O 3.48Å; Y37-I129 VanDerWaalsContact CA-O 3.29Å; Y37-I129 WeakPolarHBondContact CA-O 3.25Å; S38-I129 PolarHBondContact N-O 2.81Å; S38-I129 PolarHBondContact O-N 2.87Å; V40-I129 HydrophobicContact CB-CD1 4.13Å; V40-I129 HydrophobicContact CB-CG1 3.95Å; V40-I129 HydrophobicContact CG2-CD1 3.86Å; V40-I129 HydrophobicContact CG2-CG1 3.89Å
130	K	91.2	Very high	80.1	Confident	73 Å²	73	69 Å²	69	32%	0.317	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	116.7	172.9	-176.3	-176.7	-176.8	-132.3	0	109.1	Y37 N132	Y37-K130 HydrophobicContact CD1-CB 3.92Å; Y37-K130 HydrophobicContact CD1-CG 4.06Å; Y37-K130 HydrophobicContact CE1-CB 3.75Å; Y37-K130 HydrophobicContact CE1-CD 3.87Å; Y37-K130 HydrophobicContact CE1-CG 3.56Å; K130-N132 WeakPolarHBondContact CD-OD1 3.41Å; K130-N132 WeakPolarHBondContact CE-OD1 3.41Å; K130-N132 PolarHBondContact NZ-OD1 3.11Å
131	D	85.8	Confident	78.2	Confident	92 Å²	92	73 Å²	73	49%	0.492	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	129.8	162.6	-156.2	-33.4	0	0	0	108.7	R35 T36 G133	R35-D131 WeakPolarHBondContact CA-O 3.1Å; R35-D131 WeakPolarHBondContact CB-O 3.27Å; T36-D131 PolarHBondContact N-O 3.24Å; T36-D131 PolarHBondContact O-N 3.45Å; D131-G133 PolarHBondContact OD1-N 3.28Å
132	N	79.8	Confident	76.4	Confident	60 Å²	60	77.5 Å²	77.5	32%	0.321	40%	0.399	S	S	.	.			trans	-96.3	-3.2	-179.1	-70.9	-42	0	0	0	112.5	K130 W134	K130-N132 WeakPolarHBondContact CD-OD1 3.41Å; K130-N132 WeakPolarHBondContact CE-OD1 3.41Å; K130-N132 PolarHBondContact NZ-OD1 3.11Å; N132-W134 VanDerWaalsContact C-N 3.26Å; N132-W134 HydrophobicContact CB-CD2 4.33Å; N132-W134 HydrophobicContact CB-CG 4.15Å; N132-W134 HydrophobicContact CB-CZ2 4.33Å; N132-W134 PolarHBondContact ND2-NE1 2.65Å; N132-W134 PolarHBondContact O-N 3.41Å
133	G	69.1	Low	74.7	Confident	40 Å²	40	84.8 Å²	84.8	41%	0.412	43%	0.433	S	S	.	.			trans	63.7	30.8	177.9	0	0	0	0	0	113.3	D131 D135	D131-G133 PolarHBondContact OD1-N 3.28Å; G133-D135 PolarHBondContact O-N 3.04Å
134	W	67.4	Low	72.9	Confident	187 Å²	187	94.4 Å²	94.4	71%	0.708	47%	0.469	S	S	*	.			trans	-74.1	79.4	175.2	-53.2	114.6	0	0	0	109.3	N132 W136	N132-W134 VanDerWaalsContact C-N 3.26Å; N132-W134 HydrophobicContact CB-CD2 4.33Å; N132-W134 HydrophobicContact CB-CG 4.15Å; N132-W134 HydrophobicContact CB-CZ2 4.33Å; N132-W134 PolarHBondContact ND2-NE1 2.65Å; N132-W134 PolarHBondContact O-N 3.41Å; W134-W136 PolarHBondContact O-N 3.41Å; W134-W136 VanDerWaalsContact O-N 3.11Å
135	D	62.9	Low	70.9	Confident	124 Å²	124	103.7 Å²	103.7	66%	0.663	50%	0.504	S	S	*	.			trans	-72.2	100.7	168.8	-80.1	-17.6	0	0	0	108.9	G133 V137 V138	G133-D135 PolarHBondContact O-N 3.04Å; D135-V137 PolarHBondContact O-N 3.34Å; D135-V138 PolarHBondContact O-N 3.31Å
136	W	58	Low	69.9	Low	201 Å²	201	107.3 Å²	107.3	76%	0.761	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-13.4	173.1	-60.9	109.3	0	0	0	113.6	W134 V138 S139	W134-W136 PolarHBondContact O-N 3.41Å; W134-W136 VanDerWaalsContact O-N 3.11Å; W136-V138 VanDerWaalsContact C-N 3.26Å; W136-V138 PolarHBondContact O-N 2.93Å; W136-S139 PolarHBondContact O-N 3.46Å; W136-S139 PolarHBondContact O-OG 3.07Å
137	V	59.2	Low	68.5	Low	104 Å²	104	119 Å²	119	63%	0.63	56%	0.564	S	S	*	*	H	α-helix	trans	-68.6	-23.1	-175.5	-173.5	0	0	0	0	112.5	D135	D135-V137 PolarHBondContact O-N 3.34Å
138	V	54.9	Low	67.3	Low	93 Å²	93	123.1 Å²	123.1	56%	0.564	58%	0.583	S	S	*	*	H	α-helix	trans	-75	-33.8	177.9	-176.3	0	0	0	0	111.8	D135 W136 E140 L141 E142	D135-V138 PolarHBondContact O-N 3.31Å; W136-V138 VanDerWaalsContact C-N 3.26Å; W136-V138 PolarHBondContact O-N 2.93Å; V138-E140 PolarHBondContact O-N 2.77Å; V138-L141 PolarHBondContact O-N 3.45Å; V138-E142 PolarHBondContact O-N 3.27Å
139	S	53.1	Low	66	Low	53 Å²	53	128.5 Å²	128.5	37%	0.371	61%	0.609	S	S	.	*	H	α-helix	trans	-68.7	-31.1	-179	33.9	0	0	0	0	114.2	W136 L141 Q143	W136-S139 PolarHBondContact O-N 3.46Å; W136-S139 PolarHBondContact O-OG 3.07Å; S139-L141 VanDerWaalsContact C-N 3.34Å; S139-Q143 PolarHBondContact O-N 2.77Å
140	E	54.2	Low	64.5	Low	126 Å²	126	133.3 Å²	133.3	59%	0.589	63%	0.631	S	S	*	*	H	α-helix	trans	-75.1	-25	-178.7	-154.6	98.9	-164.3	0	0	112.3	V138 R144	V138-E140 PolarHBondContact O-N 2.77Å; E140-R144 WeakPolarHBondContact O-CG 3.41Å
141	L	58.2	Low	62.9	Low	129 Å²	129	136.9 Å²	136.9	68%	0.675	65%	0.649	S	S	*	*	H	α-helix	trans	-83.1	-27.9	177.6	-73.9	171.8	0	0	0	112.7	V138 S139	V138-L141 PolarHBondContact O-N 3.45Å; S139-L141 VanDerWaalsContact C-N 3.34Å
142	E	57.6	Low	61.5	Low	133 Å²	133	139.7 Å²	139.7	62%	0.621	66%	0.659	S	S	*	*	H	α-helix	trans	-76.1	-27.5	172.2	-73.7	179.8	134	0	0	112.7	V138 R144	V138-E142 PolarHBondContact O-N 3.27Å; E142-R144 VanDerWaalsContact C-N 3.31Å; E142-R144 PolarHBondContact O-N 3.21Å
143	Q	59.4	Low	60.2	Low	155 Å²	155	145 Å²	145	72%	0.724	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-6.8	175.7	-76.8	-178.8	-22.3	0	0	114.7	S139	S139-Q143 PolarHBondContact O-N 2.77Å
144	R	58.4	Low	59.6	Low	201 Å²	201	152.5 Å²	152.5	76%	0.758	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	15.3	176.9	-70.1	-176.7	91.1	134.2	4.9	114.5	E140 E142 P146	E140-R144 WeakPolarHBondContact O-CG 3.41Å; E142-R144 VanDerWaalsContact C-N 3.31Å; E142-R144 PolarHBondContact O-N 3.21Å; R144-P146 VanDerWaalsContact O-CD 3.23Å; R144-P146 WeakPolarHBondContact O-CD 3.23Å
145	R	55.1	Low	59	Low	204 Å²	204	149.8 Å²	149.8	77%	0.77	70%	0.7	S	S	*	*			trans	-74.3	114.8	167.8	-67.2	-166.5	-168.5	-131.4	4.3	109.6
146	P	73	Confident	58.7	Low	120 Å²	120	152 Å²	152	78%	0.779	70%	0.703	S	S	*	*			trans	-63.6	145.5	165.9	-9.1	26.3	0	0	0	108.7	R144	R144-P146 VanDerWaalsContact O-CD 3.23Å; R144-P146 WeakPolarHBondContact O-CD 3.23Å
147	Y	62.9	Low	58.7	Low	305 Å²	305	147.5 Å²	147.5	100%	1.196	70%	0.698	S	S	*	*			trans	-53.8	0	170	-115.8	-88.4	0	0	0	112.3

Retrieved 147 of 147 residues in 42 ms (Link to these results)

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