A0A087YRT9_POEFO Loading...

peptidylprolyl isomerase

PPIases accelerate the folding of proteins. It catalyzes the cis-trans isomerization of proline imidic peptide bonds in oligopeptides.

AlphaFold DB , UniProt , Accession A0A087YRT9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 138 aa.

						>A0A087YRT9_POEFO|A0A087YRT9
MRLLLLVVMAALSLGPAAVSGADKKKLQIGIKKRVDNCPIKSRKGDVLNMHYTGKLEDGTEFDSSIPRGQPFTFTLGTGQVIKGWDQGLLGMCEGEKRKLVIPAELGYGDRGAPPKIPGGATLIFEVELLSIERRSDL
					

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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	44.3	Very low	52.8	Low	219 Å²	219	150.3 Å²	150.3	100%	1.079	81%	0.814	S	S	*	*				0	115.2	0	-176	85.7	79.8	0	0	107.7
2	R	46.9	Very low	53.1	Low	230 Å²	230	150.2 Å²	150.2	87%	0.868	81%	0.811	S	S	*	*			trans	67.2	141.3	167	-70	168.7	172	179	-4.5	116.6
3	L	41.9	Very low	53.6	Low	153 Å²	153	147.1 Å²	147.1	80%	0.801	81%	0.808	S	S	*	*			cis	-170.4	146.1	-14.4	-172.3	68.3	0	0	0	104.1
4	L	54	Low	54.2	Low	129 Å²	129	147.9 Å²	147.9	68%	0.675	81%	0.809	S	S	*	*			trans	-52.2	152.3	177.7	-67.7	99.3	0	0	0	113.9	L6	L4-L6 HydrophobicContact CD2-CD1 4.18Å
5	L	46.9	Very low	54.7	Low	163 Å²	163	141.5 Å²	141.5	85%	0.853	79%	0.792	S	S	*	*			trans	-153.9	89.2	140.7	-102.1	138.9	0	0	0	109.8	V7	L5-V7 PolarHBondContact O-N 3.3Å
6	L	52.8	Low	54.8	Low	146 Å²	146	140.6 Å²	140.6	76%	0.764	79%	0.793	S	S	*	*			trans	-66.7	108	160.9	-86.2	145	0	0	0	107.8	L4 V8	L4-L6 HydrophobicContact CD2-CD1 4.18Å; L6-V8 PolarHBondContact O-N 3.25Å
7	V	57.6	Low	55	Low	125 Å²	125	137.4 Å²	137.4	76%	0.758	79%	0.788	S	S	*	*			trans	-80.1	100.5	168.9	179.9	0	0	0	0	107.3	L5 M9	L5-V7 PolarHBondContact O-N 3.3Å; V7-M9 PolarHBondContact O-N 3.15Å; V7-M9 VanDerWaalsContact O-N 3.15Å
8	V	57.8	Low	54.8	Low	128 Å²	128	135.1 Å²	135.1	78%	0.776	79%	0.789	S	S	*	*			trans	-71.5	102	169.2	177.6	0	0	0	0	107.1	L6 A10	L6-V8 PolarHBondContact O-N 3.25Å; V8-A10 PolarHBondContact O-N 3.02Å
9	M	59.6	Low	54.4	Low	179 Å²	179	135.3 Å²	135.3	88%	0.882	79%	0.792	S	S	*	*			trans	-66.7	99.6	163.2	-95	-147.8	-159.1	0	0	107.8	V7 A11	V7-M9 PolarHBondContact O-N 3.15Å; V7-M9 VanDerWaalsContact O-N 3.15Å; M9-A11 PolarHBondContact O-N 3.02Å
10	A	59.3	Low	54.2	Low	83 Å²	83	134.2 Å²	134.2	69%	0.686	79%	0.792	S	S	*	*			trans	-65.5	99.7	162	0	0	0	0	0	107.7	V8 L12	V8-A10 PolarHBondContact O-N 3.02Å; A10-L12 VanDerWaalsContact C-N 3.27Å; A10-L12 PolarHBondContact O-N 2.91Å
11	A	60.1	Low	53.9	Low	98 Å²	98	130.5 Å²	130.5	81%	0.81	78%	0.782	S	S	*	*			trans	-66.1	93.4	165	0	0	0	0	0	107.5	M9 S13	M9-A11 PolarHBondContact O-N 3.02Å; A11-S13 VanDerWaalsContact C-N 3.31Å; A11-S13 PolarHBondContact O-N 2.93Å
12	L	56.2	Low	54.4	Low	149 Å²	149	123.7 Å²	123.7	78%	0.78	76%	0.76	S	S	*	*			trans	-67.8	93.9	172	-151.2	81.1	0	0	0	106.7	A10 L14	A10-L12 VanDerWaalsContact C-N 3.27Å; A10-L12 PolarHBondContact O-N 2.91Å; L12-L14 PolarHBondContact O-N 2.93Å
13	S	59.6	Low	55.1	Low	110 Å²	110	120.3 Å²	120.3	77%	0.769	76%	0.759	S	S	*	*			trans	-63.3	101.3	173.5	56	0	0	0	0	108.3	A11 G15	A11-S13 VanDerWaalsContact C-N 3.31Å; A11-S13 PolarHBondContact O-N 2.93Å; S13-G15 PolarHBondContact O-N 2.88Å
14	L	61.3	Low	56.5	Low	158 Å²	158	121.2 Å²	121.2	83%	0.827	76%	0.757	S	S	*	*			trans	-63.1	91.6	159.1	-94.7	77	0	0	0	106.6	L12	L12-L14 PolarHBondContact O-N 2.93Å
15	G	62.3	Low	58.2	Low	53 Å²	53	120.6 Å²	120.6	55%	0.546	75%	0.749	S	S	.	*			trans	-59.7	136	160.2	0	0	0	0	0	107.7	S13 A17	S13-G15 PolarHBondContact O-N 2.88Å; G15-A17 PolarHBondContact O-N 3Å
16	P	56.9	Low	60.5	Low	126 Å²	126	121.1 Å²	121.1	82%	0.818	74%	0.744	S	S	*	*			trans	-59.5	117	175.2	23.9	-30	0	0	0	107.6	A18	P16-A18 PolarHBondContact O-N 2.84Å
17	A	57.2	Low	62.7	Low	86 Å²	86	115.8 Å²	115.8	71%	0.711	72%	0.716	S	S	*	*			trans	-55.3	114.4	165.4	0	0	0	0	0	106.3	G15 V19	G15-A17 PolarHBondContact O-N 3Å; A17-V19 PolarHBondContact O-N 3.01Å
18	A	51.8	Low	64.7	Low	96 Å²	96	115.5 Å²	115.5	79%	0.793	71%	0.707	S	S	*	*			trans	-58	103.5	175.6	0	0	0	0	0	107.7	P16 S20	P16-A18 PolarHBondContact O-N 2.84Å; A18-S20 PolarHBondContact O-N 3.08Å
19	V	47.9	Very low	66.6	Low	140 Å²	140	113.4 Å²	113.4	85%	0.848	69%	0.69	S	S	*	*			trans	-71.6	81.2	170.2	-175.9	0	0	0	0	106.1	A17 G21	A17-V19 PolarHBondContact O-N 3.01Å; V19-G21 PolarHBondContact O-N 2.85Å; V19-G21 VanDerWaalsContact O-N 3.08Å
20	S	49.3	Very low	68.4	Low	113 Å²	113	106.5 Å²	106.5	79%	0.79	67%	0.665	S	S	*	*			trans	-83.9	64.6	163.8	-166.2	0	0	0	0	108.6	A18	A18-S20 PolarHBondContact O-N 3.08Å
21	G	48.6	Very low	70.3	Confident	57 Å²	57	105.7 Å²	105.7	59%	0.588	65%	0.648	S	S	*	*			trans	-92.2	56.7	157.9	0	0	0	0	0	108.1	V19 D23	V19-G21 PolarHBondContact O-N 2.85Å; V19-G21 VanDerWaalsContact O-N 3.08Å; G21-D23 PolarHBondContact O-N 3.09Å; G21-D23 VanDerWaalsContact O-N 3.09Å
22	A	55.3	Low	72.1	Confident	75 Å²	75	107.2 Å²	107.2	62%	0.62	64%	0.637	S	S	*	*			trans	-61.6	114.1	166.3	0	0	0	0	0	106.7	K24	A22-K24 PolarHBondContact O-N 2.93Å
23	D	61.8	Low	74.1	Confident	159 Å²	159	104.7 Å²	104.7	85%	0.85	62%	0.619	S	S	*	*			trans	-50.8	104.2	173.6	-78.1	-56.4	0	0	0	108.7	G21 K25	G21-D23 PolarHBondContact O-N 3.09Å; G21-D23 VanDerWaalsContact O-N 3.09Å; D23-K25 PolarHBondContact O-N 2.85Å
24	K	71.3	Confident	75.8	Confident	172 Å²	172	108.1 Å²	108.1	75%	0.748	62%	0.615	S	S	*	*			trans	-61.5	109.2	-179.7	-67.9	-173.2	-179.4	-175.4	0	107.7	A22 K26	A22-K24 PolarHBondContact O-N 2.93Å; K24-K26 PolarHBondContact O-N 3.32Å
25	K	89.1	Confident	77.5	Confident	116 Å²	116	102.6 Å²	102.6	50%	0.504	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-52.3	132.9	173.1	-73.5	-175.3	179.9	-179.5	0	107.6	D23 E57 P103	D23-K25 PolarHBondContact O-N 2.85Å; K25-E57 IonicContact NZ-OE1 2.81Å; K25-E57 PolarHBondContact NZ-OE1 2.98Å; K25-E57 IonicContact NZ-OE2 3Å; K25-P103 HydrophobicContact CB-CB 3.74Å; K25-P103 WeakPolarHBondContact O-CB 3.5Å; K25-P103 VanDerWaalsContact O-CG 3.22Å; K25-P103 WeakPolarHBondContact O-CG 3.22Å
26	K	95.9	Very high	79	Confident	175 Å²	175	108.2 Å²	108.2	76%	0.761	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-93.7	154.9	178.2	-65.6	-178.9	-178.5	175.8	0	110	K24 Q28	K24-K26 PolarHBondContact O-N 3.32Å; K26-Q28 PolarHBondContact O-N 3.35Å
27	L	98.2	Very high	80.8	Confident	33 Å²	33	108.5 Å²	108.5	17%	0.173	60%	0.601	C	S	.	*	P	Polyproline II helix	trans	-56	129.6	168.2	177.9	62.6	0	0	0	110	I29 Q87 I102 L106	L27-I29 HydrophobicContact CD2-CD1 4.21Å; L27-I29 HydrophobicContact CD2-CG1 4.27Å; L27-I29 HydrophobicContact CG-CG1 4.08Å; L27-Q87 HydrophobicContact CD2-CB 3.58Å; L27-I102 HydrophobicContact CD1-CB 4.39Å; L27-I102 HydrophobicContact CD1-CG1 3.77Å; L27-L106 HydrophobicContact CB-CD1 3.74Å
28	Q	98.6	Very high	82.6	Confident	120 Å²	120	105.9 Å²	105.9	56%	0.561	58%	0.577	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.2	135.1	173.3	-46.1	178.4	1.8	0	0	109.6	K26 L100 V101	K26-Q28 PolarHBondContact O-N 3.35Å; Q28-L100 WeakPolarHBondContact O-CA 3.36Å; Q28-V101 HydrophobicContact CB-CB 4.02Å; Q28-V101 HydrophobicContact CB-CG2 4.43Å; Q28-V101 HydrophobicContact CG-CB 4.31Å; Q28-V101 PolarHBondContact N-O 3.33Å; Q28-V101 PolarHBondContact O-N 3.5Å
29	I	98.6	Very high	84.6	Confident	84 Å²	84	106.7 Å²	106.7	43%	0.431	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.2	111	-177.3	-53.1	169.5	0	0	0	107.7	L27 L100	L27-I29 HydrophobicContact CD2-CD1 4.21Å; L27-I29 HydrophobicContact CD2-CG1 4.27Å; L27-I29 HydrophobicContact CG-CG1 4.08Å; I29-L100 HydrophobicContact CB-CD2 4.23Å; I29-L100 HydrophobicContact CG1-CD2 3.98Å; I29-L100 HydrophobicContact CG2-CD2 3.85Å
30	G	98.3	Very high	86.9	Confident	34 Å²	34	103.6 Å²	103.6	35%	0.351	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.1	130.6	173.1	0	0	0	0	0	110.8	R98 K99	G30-R98 CarbonylContact O-C 3.37Å; G30-R98 VanDerWaalsContact O-CA 3.23Å; G30-R98 WeakPolarHBondContact O-CA 3.34Å; G30-K99 PolarHBondContact N-O 2.9Å; G30-K99 PolarHBondContact O-N 3.4Å
31	I	98.1	Very high	89.2	Confident	65 Å²	65	104 Å²	104	33%	0.333	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	122.4	174	-60	168.8	0	0	0	108.7	R34 E96 R98	I31-R34 VanDerWaalsContact CD1-NH1 3.32Å; I31-R34 HydrophobicContact CG2-CG 3.64Å; I31-E96 HydrophobicContact CG2-CG 4.3Å; I31-R98 HydrophobicContact CG1-CG 4.33Å
32	K	98.2	Very high	91.5	Very high	130 Å²	130	101.5 Å²	101.5	57%	0.565	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	-29.7	-177.9	-67.6	-72.4	-70.2	178.3	0	112.7	K97 K99	K32-K97 HydrophobicContact CB-CB 3.87Å; K32-K97 PolarHBondContact N-O 2.8Å; K32-K99 HydrophobicContact CD-CB 4.17Å; K32-K99 HydrophobicContact CG-CB 3.91Å
33	K	98.2	Very high	93.6	Very high	96 Å²	96	104.2 Å²	104.2	42%	0.417	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	122.7	174	177.9	-175.4	168.1	-155.9	0	107.9	G95 E96 K97	K33-G95 WeakPolarHBondContact CD-O 2.97Å; K33-G95 WeakPolarHBondContact CE-O 3.29Å; K33-G95 PolarHBondContact NZ-O 2.99Å; K33-G95 VanDerWaalsContact NZ-O 3.1Å; K33-E96 WeakPolarHBondContact O-CA 3.17Å; K33-E96 WeakPolarHBondContact O-CG 3.2Å; K33-K97 HydrophobicContact CB-CB 3.74Å; K33-K97 HydrophobicContact CB-CD 4.19Å; K33-K97 HydrophobicContact CB-CG 3.86Å; K33-K97 HydrophobicContact CD-CD 4.29Å; K33-K97 HydrophobicContact CD-CG 4.23Å; K33-K97 PolarHBondContact N-O 2.91Å; K33-K97 PolarHBondContact O-N 3.1Å
34	R	96.1	Very high	95.3	Very high	182 Å²	182	103.7 Å²	103.7	69%	0.687	50%	0.497	S	S	*	.			trans	-87.9	161.1	173.3	-69.3	-177.8	-175.4	-78.9	-0.6	110.4	I31	I31-R34 VanDerWaalsContact CD1-NH1 3.32Å; I31-R34 HydrophobicContact CG2-CG 3.64Å
35	V	96.8	Very high	96.5	Very high	43 Å²	43	97.8 Å²	97.8	26%	0.261	49%	0.485	S	S	.	.			trans	-125.9	121.7	175.1	-179.1	0	0	0	0	106.9	N37 C93 E94 E96	V35-N37 WeakPolarHBondContact CG1-O 3.16Å; V35-C93 HydrophobicContact CB-CB 3.92Å; V35-C93 HydrophobicContact CG1-CB 4.35Å; V35-C93 HydrophobicContact CG2-CB 4.16Å; V35-E94 WeakPolarHBondContact CG2-O 3.42Å; V35-E96 HydrophobicContact CG2-CB 4.04Å
36	D	92.4	Very high	97	Very high	170 Å²	170	92.4 Å²	92.4	91%	0.909	46%	0.462	S	S	*	.	S	Bend	trans	-73.3	-41.7	-172.3	-63	-30.7	0	0	0	112
37	N	94.6	Very high	97.1	Very high	133 Å²	133	86 Å²	86	71%	0.711	44%	0.437	S	S	*	.			trans	-102.5	109.2	175.3	-177	26.7	0	0	0	110.7	V35	V35-N37 WeakPolarHBondContact CG1-O 3.16Å
38	C	95.4	Very high	97.1	Very high	31 Å²	31	84.4 Å²	84.4	21%	0.209	43%	0.429	C	S	.	.			trans	-129.3	79.2	-174.9	-178.1	0	0	0	0	111	I40 K41 C93	C38-I40 VanDerWaalsContact C-N 3.28Å; C38-I40 PolarHBondContact O-N 3Å; C38-I40 PolarHBondContact SG-O 3.39Å; C38-I40 VanDerWaalsContact SG-O 3.35Å; C38-K41 WeakPolarHBondContact SG-CG 3.39Å; C38-C93 HydrophobicContact CB-CB 3.77Å; C38-C93 WeakPolarHBondContact CB-SG 3.39Å; C38-C93 WeakPolarHBondContact SG-CB 3.41Å; C38-C93 CovalentContact SG-SG 2.01Å; C38-C93 PolarHBondContact SG-SG 2.62Å
39	P	93.9	Very high	97.1	Very high	112 Å²	112	80.3 Å²	80.3	73%	0.727	41%	0.411	S	S	*	.	S	Bend	trans	-69.6	-28.9	-177.3	27.9	-34.7	0	0	0	112.2
40	I	95.8	Very high	97.1	Very high	75 Å²	75	76.3 Å²	76.3	39%	0.385	39%	0.39	S	S	.	.			trans	-124.5	129.4	178.7	-57.1	178.3	0	0	0	108.4	C38 I132	C38-I40 VanDerWaalsContact C-N 3.28Å; C38-I40 PolarHBondContact O-N 3Å; C38-I40 PolarHBondContact SG-O 3.39Å; C38-I40 VanDerWaalsContact SG-O 3.35Å; I40-I132 HydrophobicContact CB-CD1 4.47Å; I40-I132 HydrophobicContact CG2-CB 4.37Å; I40-I132 HydrophobicContact CG2-CD1 3.88Å; I40-I132 HydrophobicContact CG2-CG2 4.08Å
41	K	97.8	Very high	97.1	Very high	122 Å²	122	76.4 Å²	76.4	53%	0.53	38%	0.382	S	S	.	.			trans	-110.6	141.2	170.6	-71.8	-177.7	-178.4	-179.2	0	109.8	C38 M92 R134	C38-K41 WeakPolarHBondContact SG-CG 3.39Å; K41-M92 CarbonylContact C-O 3.59Å; K41-M92 WeakPolarHBondContact CA-O 3.47Å; K41-R134 PolarHBondContact O-NH2 3.41Å
42	S	98.4	Very high	97.1	Very high	5 Å²	5	74.5 Å²	74.5	4%	0.035	37%	0.37	C	S	.	.			trans	-61	137.4	176.6	62.7	0	0	0	0	111	D46 L89 G91 M92	S42-D46 WeakPolarHBondContact CA-OD2 3.39Å; S42-L89 PolarHBondContact OG-O 3.18Å; S42-G91 PolarHBondContact O-N 2.92Å; S42-G91 PolarHBondContact OG-N 2.01Å; S42-G91 VanDerWaalsContact OG-N 3.11Å; S42-M92 PolarHBondContact N-O 2.94Å; S42-M92 PolarHBondContact OG-N 2.99Å
43	R	98.3	Very high	97.2	Very high	132 Å²	132	69.7 Å²	69.7	50%	0.498	35%	0.352	S	S	.	.			trans	-139.1	168.3	173.8	69.5	-175.1	-176.2	173.3	4.9	110.2	G45 D46	R43-G45 PolarHBondContact O-N 2.8Å; R43-D46 PolarHBondContact N-OD2 3.39Å; R43-D46 WeakPolarHBondContact O-CB 3.27Å; R43-D46 PolarHBondContact O-N 3.13Å; R43-D46 VanDerWaalsContact O-N 3.12Å
44	K	97.9	Very high	97.2	Very high	148 Å²	148	65.1 Å²	65.1	64%	0.643	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	136.4	175.7	-62	-173	178.4	-178.2	0	110.4	D46 L76 L90	K44-D46 VanDerWaalsContact C-N 3.34Å; K44-L76 CarbonylContact C-O 3.59Å; K44-L76 WeakPolarHBondContact CA-O 2.91Å; K44-L90 HydrophobicContact CG-CD2 3.97Å
45	G	97.1	Very high	97.3	Very high	48 Å²	48	60.5 Å²	60.5	50%	0.495	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	90	-15.2	-177.7	0	0	0	0	0	114.8	R43 L76	R43-G45 PolarHBondContact O-N 2.8Å; G45-L76 PolarHBondContact N-O 2.76Å
46	D	98.2	Very high	97.4	Very high	3 Å²	3	59.5 Å²	59.5	2%	0.016	31%	0.31	C	S	.	.			trans	-67.3	143	171.6	-66.9	-17.7	0	0	0	110.3	S42 R43 K44 L48 T75 L76 I132 R134	S42-D46 WeakPolarHBondContact CA-OD2 3.39Å; R43-D46 PolarHBondContact N-OD2 3.39Å; R43-D46 WeakPolarHBondContact O-CB 3.27Å; R43-D46 PolarHBondContact O-N 3.13Å; R43-D46 VanDerWaalsContact O-N 3.12Å; K44-D46 VanDerWaalsContact C-N 3.34Å; D46-L48 HydrophobicContact CB-CD2 3.98Å; D46-T75 WeakPolarHBondContact O-CA 3.38Å; D46-L76 PolarHBondContact O-N 3.2Å; D46-I132 HydrophobicContact CB-CG2 3.86Å; D46-I132 WeakPolarHBondContact OD2-CG2 3.13Å; D46-R134 IonicContact OD1-CZ 3.79Å; D46-R134 IonicContact OD1-NE 3.48Å; D46-R134 PolarHBondContact OD1-NE 3.26Å; D46-R134 IonicContact OD1-NH2 2.71Å; D46-R134 PolarHBondContact OD1-NH2 3Å; D46-R134 IonicContact OD2-CZ 2.91Å; D46-R134 IonicContact OD2-NE 3.27Å; D46-R134 IonicContact OD2-NH2 3.33Å; D46-R134 PolarHBondContact OD2-NH2 3.19Å
47	V	98.3	Very high	97.7	Very high	39 Å²	39	57 Å²	57	24%	0.236	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	119.9	166.9	174.6	0	0	0	0	107.4	T73 F74 E133	V47-T73 HydrophobicContact CG1-CG2 3.43Å; V47-T73 VanDerWaalsContact CG1-CG2 3.43Å; V47-F74 WeakPolarHBondContact CA-O 3.3Å; V47-E133 HydrophobicContact CB-CB 3.93Å; V47-E133 HydrophobicContact CG1-CB 4.36Å; V47-E133 PolarHBondContact N-O 3.1Å; V47-E133 PolarHBondContact O-N 2.92Å
48	L	98.6	Very high	97.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	136.4	180	-56.7	-169.3	0	0	0	109.9	D46 M50 T73 F74 L76 L89 L129 I132	D46-L48 HydrophobicContact CB-CD2 3.98Å; L48-M50 HydrophobicContact CB-CG 4.16Å; L48-M50 HydrophobicContact CB-SD 4.46Å; L48-M50 HydrophobicContact CD1-SD 4.33Å; L48-T73 VanDerWaalsContact O-CA 3.29Å; L48-T73 WeakPolarHBondContact O-CA 3.46Å; L48-F74 HydrophobicContact CB-CE1 4Å; L48-F74 HydrophobicContact CB-CZ 4.13Å; L48-F74 HydrophobicContact CD1-CZ 4.01Å; L48-F74 HydrophobicContact CG-CZ 4.46Å; L48-F74 PolarHBondContact N-O 2.81Å; L48-F74 PolarHBondContact O-N 2.92Å; L48-F74 VanDerWaalsContact O-N 3.13Å; L48-L76 HydrophobicContact CD1-CB 4.08Å; L48-L76 HydrophobicContact CD1-CD1 4.39Å; L48-L76 HydrophobicContact CD1-CD2 4Å; L48-L76 HydrophobicContact CD1-CG 4.38Å; L48-L76 HydrophobicContact CG-CB 4.18Å; L48-L89 HydrophobicContact CD1-CB 4.45Å; L48-L129 HydrophobicContact CB-CD1 4.01Å; L48-L129 HydrophobicContact CD1-CD1 4.3Å; L48-L129 HydrophobicContact CD2-CD1 4.07Å; L48-L129 HydrophobicContact CG-CD1 4.35Å; L48-I132 HydrophobicContact CD2-CB 4.41Å; L48-I132 HydrophobicContact CD2-CG1 3.98Å; L48-I132 HydrophobicContact CD2-CG2 4.23Å
49	N	98.3	Very high	97.9	Very high	35 Å²	35	56.9 Å²	56.9	19%	0.187	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123	170.1	-168.3	-42.7	0	0	0	108.6	P71 L130 S131	N49-P71 WeakPolarHBondContact OD1-CB 3.37Å; N49-L130 WeakPolarHBondContact O-CA 3.49Å; N49-L130 WeakPolarHBondContact O-CB 3.25Å; N49-L130 PolarHBondContact O-N 2.76Å; N49-S131 VanDerWaalsContact CB-OG 3.25Å; N49-S131 WeakPolarHBondContact CB-OG 2.82Å; N49-S131 PolarHBondContact N-O 3.13Å; N49-S131 VanDerWaalsContact N-O 3.12Å; N49-S131 PolarHBondContact O-N 3.12Å
50	M	98.3	Very high	98.1	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	144.6	-168.1	-60	-163	76.1	0	0	113.7	L48 P71 F72 F74 W85 L89 M92 V127 E128 L129	L48-M50 HydrophobicContact CB-CG 4.16Å; L48-M50 HydrophobicContact CB-SD 4.46Å; L48-M50 HydrophobicContact CD1-SD 4.33Å; M50-P71 WeakPolarHBondContact O-CA 3.43Å; M50-F72 PolarHBondContact N-O 3.25Å; M50-F72 PolarHBondContact O-N 3.27Å; M50-F74 HydrophobicContact CG-CE1 4.18Å; M50-F74 HydrophobicContact SD-CE1 3.84Å; M50-F74 HydrophobicContact SD-CZ 4.11Å; M50-W85 HydrophobicContact SD-CZ3 4.41Å; M50-L89 HydrophobicContact CE-CD1 4.49Å; M50-L89 HydrophobicContact CE-CD2 3.93Å; M50-L89 HydrophobicContact SD-CD1 3.75Å; M50-L89 HydrophobicContact SD-CD2 4.25Å; M50-M92 HydrophobicContact CE-CE 4.14Å; M50-M92 HydrophobicContact CE-SD 4.08Å; M50-V127 HydrophobicContact CE-CB 3.73Å; M50-V127 HydrophobicContact CE-CG2 3.89Å; M50-E128 VanDerWaalsContact CA-O 3.32Å; M50-E128 WeakPolarHBondContact CA-O 3.47Å; M50-L129 HydrophobicContact CE-CB 4.05Å; M50-L129 HydrophobicContact CE-CD1 4.45Å; M50-L129 HydrophobicContact CG-CD1 3.86Å; M50-L129 HydrophobicContact SD-CD1 4.39Å
51	H	98.8	Very high	98.3	Very high	36 Å²	36	55.9 Å²	55.9	17%	0.167	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	146.5	156.9	-86.7	-47.2	0	0	0	110.9	S65 I66 V127 E128	H51-S65 WeakPolarHBondContact CA-OG 3.32Å; H51-S65 PolarHBondContact ND1-OG 2.86Å; H51-I66 HydrophobicContact CB-CD1 3.68Å; H51-I66 VanDerWaalsContact CG-CD1 3.49Å; H51-V127 CarbonylContact O-C 3.6Å; H51-V127 VanDerWaalsContact O-CA 3.31Å; H51-V127 WeakPolarHBondContact O-CA 3.45Å; H51-E128 HydrophobicContact CB-CB 4.35Å; H51-E128 PolarHBondContact N-O 2.87Å; H51-E128 PolarHBondContact O-N 2.77Å
52	Y	98.8	Very high	98.3	Very high	25 Å²	25	51 Å²	51	10%	0.098	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	159.5	176.2	73	-84.5	0	0	0	113.1	D63 S64 S65 R68 F72 W85 F125 E126	Y52-D63 HydrophobicContact CE2-CB 4.18Å; Y52-D63 PolarHBondContact OH-OD2 2.78Å; Y52-S64 WeakPolarHBondContact O-CA 3.23Å; Y52-S64 PolarHBondContact O-OG 2.92Å; Y52-S64 VanDerWaalsContact O-OG 3.11Å; Y52-S65 PolarHBondContact N-OG 3.36Å; Y52-S65 PolarHBondContact O-N 2.93Å; Y52-S65 PolarHBondContact O-OG 3.44Å; Y52-S65 VanDerWaalsContact O-OG 3.08Å; Y52-R68 PolarHBondContact OH-NH2 3.01Å; Y52-F72 HydrophobicContact CD1-CB 4.18Å; Y52-F72 HydrophobicContact CE1-CB 3.72Å; Y52-F72 HydrophobicContact CE1-CG 4.27Å; Y52-W85 AromaticContact CD1-CH2 3.81Å; Y52-W85 HydrophobicContact CD1-CH2 3.81Å; Y52-W85 HydrophobicContact CD1-CZ2 4.48Å; Y52-W85 HydrophobicContact CD2-CH2 4.39Å; Y52-W85 HydrophobicContact CD2-CZ2 4.26Å; Y52-W85 HydrophobicContact CE1-CH2 4.48Å; Y52-W85 AromaticContact CG-CH2 3.75Å; Y52-W85 HydrophobicContact CG-CH2 3.75Å; Y52-W85 HydrophobicContact CG-CZ2 4Å; Y52-F125 HydrophobicContact CD2-CD1 4.11Å; Y52-F125 HydrophobicContact CD2-CE1 4.11Å; Y52-F125 HydrophobicContact CE2-CE1 4.46Å; Y52-E126 CarbonylContact C-O 3.46Å; Y52-E126 WeakPolarHBondContact CA-O 3.35Å
53	T	98.8	Very high	98.3	Very high	28 Å²	28	53 Å²	53	17%	0.172	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	129.4	161.6	-67.4	0	0	0	0	108.9	K55 E61 S64 F125 E126	T53-K55 HydrophobicContact CG2-CG 4.19Å; T53-E61 HydrophobicContact CG2-CG 3.91Å; T53-E61 WeakPolarHBondContact CG2-OE2 3.38Å; T53-S64 WeakPolarHBondContact OG1-CB 3.23Å; T53-S64 PolarHBondContact OG1-OG 2.85Å; T53-F125 WeakPolarHBondContact O-CA 3.42Å; T53-E126 PolarHBondContact N-O 3.19Å; T53-E126 PolarHBondContact O-N 2.7Å
54	G	98.7	Very high	98.3	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130	178.4	0	0	0	0	0	112	E61 F62 D63 I124	G54-E61 WeakPolarHBondContact O-CA 3.36Å; G54-F62 VanDerWaalsContact CA-CZ 3.49Å; G54-F62 WeakPolarHBondContact O-CD1 3.47Å; G54-F62 PolarHBondContact O-N 3.24Å; G54-D63 PolarHBondContact N-O 3.47Å; G54-I124 WeakPolarHBondContact CA-O 3.4Å
55	K	98.8	Very high	98.3	Very high	85 Å²	85	40 Å²	40	37%	0.37	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	152	-178.6	-59.6	-173.9	174	-171.1	0	112.3	T53 T60 E61 F62 I124	T53-K55 HydrophobicContact CG2-CG 4.19Å; K55-T60 CarbonylContact C-O 3.54Å; K55-T60 WeakPolarHBondContact CA-O 3.44Å; K55-E61 HydrophobicContact CG-CB 4.22Å; K55-F62 VanDerWaalsContact C-CE1 3.45Å; K55-F62 VanDerWaalsContact N-CE1 3.28Å; K55-F62 WeakPolarHBondContact O-CE1 3.41Å; K55-I124 PolarHBondContact N-O 3.17Å; K55-I124 PolarHBondContact O-N 2.95Å
56	L	98.6	Very high	98.3	Very high	22 Å²	22	42 Å²	42	12%	0.115	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	169.4	166.4	-59.3	179.8	0	0	0	110.6	D58 G59 T60 F62 A121 L123	L56-D58 WeakPolarHBondContact CB-OD1 3.45Å; L56-D58 PolarHBondContact O-N 3.43Å; L56-G59 PolarHBondContact O-N 2.83Å; L56-T60 PolarHBondContact N-O 3.17Å; L56-F62 HydrophobicContact CD2-CD1 3.99Å; L56-F62 HydrophobicContact CD2-CE1 4.32Å; L56-F62 HydrophobicContact CG-CD1 4.14Å; L56-A121 HydrophobicContact CD2-CB 4.16Å; L56-L123 HydrophobicContact CD2-CD2 4.19Å
57	E	97.6	Very high	98.2	Very high	117 Å²	117	47 Å²	47	55%	0.547	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.8	179	-75.2	-177.2	127.1	0	0	113.1	K25 G59 T122	K25-E57 IonicContact NZ-OE1 2.81Å; K25-E57 PolarHBondContact NZ-OE1 2.98Å; K25-E57 IonicContact NZ-OE2 3Å; E57-G59 PolarHBondContact O-N 2.82Å; E57-T122 HydrophobicContact CG-CG2 4.14Å
58	D	97.3	Very high	98.1	Very high	120 Å²	120	51.4 Å²	51.4	64%	0.642	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-3.1	174.5	68.9	1.8	0	0	0	113.7	L56 T60	L56-D58 WeakPolarHBondContact CB-OD1 3.45Å; L56-D58 PolarHBondContact O-N 3.43Å; D58-T60 VanDerWaalsContact CG-OG1 3.25Å; D58-T60 WeakPolarHBondContact OD1-CB 3.49Å; D58-T60 PolarHBondContact OD1-N 3.26Å; D58-T60 PolarHBondContact OD1-OG1 2.85Å; D58-T60 PolarHBondContact OD2-OG1 2.83Å
59	G	98	Very high	97.9	Very high	43 Å²	43	54.1 Å²	54.1	44%	0.443	30%	0.298	S	S	.	.			trans	90	-4.3	-178.9	0	0	0	0	0	115	L56 E57 E61	L56-G59 PolarHBondContact O-N 2.83Å; E57-G59 PolarHBondContact O-N 2.82Å; G59-E61 PolarHBondContact O-N 3.16Å
60	T	98.3	Very high	97.9	Very high	73 Å²	73	59.1 Å²	59.1	45%	0.448	32%	0.32	S	S	.	.			trans	-61.7	120.6	176.2	-58.3	0	0	0	0	110.2	K55 L56 D58	K55-T60 CarbonylContact C-O 3.54Å; K55-T60 WeakPolarHBondContact CA-O 3.44Å; L56-T60 PolarHBondContact N-O 3.17Å; D58-T60 VanDerWaalsContact CG-OG1 3.25Å; D58-T60 WeakPolarHBondContact OD1-CB 3.49Å; D58-T60 PolarHBondContact OD1-N 3.26Å; D58-T60 PolarHBondContact OD1-OG1 2.85Å; D58-T60 PolarHBondContact OD2-OG1 2.83Å
61	E	98.5	Very high	97.9	Very high	92 Å²	92	61.1 Å²	61.1	43%	0.43	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	124.7	172.6	-174.6	174.6	124.6	0	0	110.3	T53 G54 K55 G59 S64	T53-E61 HydrophobicContact CG2-CG 3.91Å; T53-E61 WeakPolarHBondContact CG2-OE2 3.38Å; G54-E61 WeakPolarHBondContact O-CA 3.36Å; K55-E61 HydrophobicContact CG-CB 4.22Å; G59-E61 PolarHBondContact O-N 3.16Å; E61-S64 WeakPolarHBondContact OE1-CB 3.38Å
62	F	98.3	Very high	97.8	Very high	20 Å²	20	63.4 Å²	63.4	9%	0.088	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-27.8	176.7	57.5	-105	0	0	0	112.5	G54 K55 L56 K116 I117 L123 F125	G54-F62 VanDerWaalsContact CA-CZ 3.49Å; G54-F62 WeakPolarHBondContact O-CD1 3.47Å; G54-F62 PolarHBondContact O-N 3.24Å; K55-F62 VanDerWaalsContact C-CE1 3.45Å; K55-F62 VanDerWaalsContact N-CE1 3.28Å; K55-F62 WeakPolarHBondContact O-CE1 3.41Å; L56-F62 HydrophobicContact CD2-CD1 3.99Å; L56-F62 HydrophobicContact CD2-CE1 4.32Å; L56-F62 HydrophobicContact CG-CD1 4.14Å; F62-K116 HydrophobicContact CB-CB 4.12Å; F62-K116 WeakPolarHBondContact O-CD 3.21Å; F62-K116 PolarHBondContact O-NZ 2.86Å; F62-I117 HydrophobicContact CB-CG1 4.37Å; F62-I117 HydrophobicContact CD1-CG1 4.32Å; F62-I117 HydrophobicContact CD2-CD1 3.9Å; F62-I117 HydrophobicContact CD2-CG1 4.22Å; F62-I117 HydrophobicContact CE2-CD1 3.92Å; F62-I117 HydrophobicContact CG-CD1 4.23Å; F62-I117 HydrophobicContact CG-CG1 4.07Å; F62-I117 HydrophobicContact CZ-CD1 4.23Å; F62-L123 HydrophobicContact CE1-CD2 3.94Å; F62-L123 HydrophobicContact CZ-CB 4.46Å; F62-L123 HydrophobicContact CZ-CD2 4.21Å; F62-F125 AromaticContact CE2-CE1 3.96Å; F62-F125 HydrophobicContact CE2-CE1 3.96Å; F62-F125 AromaticContact CE2-CZ 3.83Å; F62-F125 HydrophobicContact CE2-CZ 3.83Å; F62-F125 AromaticContact CZ-CE1 3.85Å; F62-F125 HydrophobicContact CZ-CE1 3.85Å; F62-F125 HydrophobicContact CZ-CE2 4.07Å; F62-F125 AromaticContact CZ-CZ 3.52Å; F62-F125 HydrophobicContact CZ-CZ 3.52Å
63	D	97.9	Very high	97.8	Very high	46 Å²	46	65.7 Å²	65.7	25%	0.246	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	148.6	177.5	-158.1	-1.2	0	0	0	112.4	Y52 G54 R68	Y52-D63 HydrophobicContact CE2-CB 4.18Å; Y52-D63 PolarHBondContact OH-OD2 2.78Å; G54-D63 PolarHBondContact N-O 3.47Å; D63-R68 IonicContact OD1-CZ 3.65Å; D63-R68 VanDerWaalsContact OD1-CZ 3.27Å; D63-R68 IonicContact OD1-NH1 3.71Å; D63-R68 PolarHBondContact OD1-NH1 2.91Å; D63-R68 IonicContact OD1-NH2 2.74Å; D63-R68 PolarHBondContact OD1-NH2 3.25Å; D63-R68 IonicContact OD2-NH2 2.7Å
64	S	98.4	Very high	97.8	Very high	6 Å²	6	64.6 Å²	64.6	4%	0.042	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	136.5	171.6	-177.9	0	0	0	0	111.8	Y52 T53 E61 I66 P67 R68	Y52-S64 WeakPolarHBondContact O-CA 3.23Å; Y52-S64 PolarHBondContact O-OG 2.92Å; Y52-S64 VanDerWaalsContact O-OG 3.11Å; T53-S64 WeakPolarHBondContact OG1-CB 3.23Å; T53-S64 PolarHBondContact OG1-OG 2.85Å; E61-S64 WeakPolarHBondContact OE1-CB 3.38Å; S64-I66 PolarHBondContact OG-N 3.13Å; S64-P67 WeakPolarHBondContact OG-CD 3.44Å; S64-R68 PolarHBondContact O-NH1 3Å; S64-R68 PolarHBondContact O-NH2 2.85Å
65	S	98.4	Very high	97.8	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.007	36%	0.362	C	S	.	.	S	Bend	trans	-74.9	-21.8	171.9	61.4	0	0	0	0	113.9	H51 Y52 R68 G69 Q70	H51-S65 WeakPolarHBondContact CA-OG 3.32Å; H51-S65 PolarHBondContact ND1-OG 2.86Å; Y52-S65 PolarHBondContact N-OG 3.36Å; Y52-S65 PolarHBondContact O-N 2.93Å; Y52-S65 PolarHBondContact O-OG 3.44Å; Y52-S65 VanDerWaalsContact O-OG 3.08Å; S65-R68 PolarHBondContact O-N 3.13Å; S65-G69 PolarHBondContact O-N 3.07Å; S65-Q70 WeakPolarHBondContact CB-O 3.22Å
66	I	97.3	Very high	97.8	Very high	92 Å²	92	62.1 Å²	62.1	47%	0.472	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-50.8	-169.9	-58.5	-70.8	0	0	0	111.9	H51 S64 R68 G69	H51-I66 HydrophobicContact CB-CD1 3.68Å; H51-I66 VanDerWaalsContact CG-CD1 3.49Å; S64-I66 PolarHBondContact OG-N 3.13Å; I66-R68 PolarHBondContact O-N 3.21Å; I66-G69 PolarHBondContact O-N 3.22Å
67	P	96.8	Very high	97.7	Very high	107 Å²	107	62.4 Å²	62.4	70%	0.695	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.5	-178.7	-21.4	34.5	0	0	0	113.1	S64 G69	S64-P67 WeakPolarHBondContact OG-CD 3.44Å; P67-G69 VanDerWaalsContact C-N 3.33Å
68	R	96.2	Very high	97.7	Very high	131 Å²	131	60.4 Å²	60.4	49%	0.494	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-16.8	176.8	-64.5	-171.3	-69.7	-96.1	8.9	113	Y52 D63 S64 S65 I66 Q70	Y52-R68 PolarHBondContact OH-NH2 3.01Å; D63-R68 IonicContact OD1-CZ 3.65Å; D63-R68 VanDerWaalsContact OD1-CZ 3.27Å; D63-R68 IonicContact OD1-NH1 3.71Å; D63-R68 PolarHBondContact OD1-NH1 2.91Å; D63-R68 IonicContact OD1-NH2 2.74Å; D63-R68 PolarHBondContact OD1-NH2 3.25Å; D63-R68 IonicContact OD2-NH2 2.7Å; S64-R68 PolarHBondContact O-NH1 3Å; S64-R68 PolarHBondContact O-NH2 2.85Å; S65-R68 PolarHBondContact O-N 3.13Å; I66-R68 PolarHBondContact O-N 3.21Å; R68-Q70 HydrophobicContact CB-CB 4.47Å; R68-Q70 PolarHBondContact O-N 2.71Å; R68-Q70 VanDerWaalsContact O-N 3.1Å
69	G	95.1	Very high	97.7	Very high	58 Å²	58	57.3 Å²	57.3	60%	0.598	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	13	-173.3	0	0	0	0	0	114.1	S65 I66 P67	S65-G69 PolarHBondContact O-N 3.07Å; I66-G69 PolarHBondContact O-N 3.22Å; P67-G69 VanDerWaalsContact C-N 3.33Å
70	Q	97.1	Very high	97.7	Very high	140 Å²	140	61 Å²	61	65%	0.654	35%	0.351	S	S	*	.			trans	-117.9	109	-176.7	-170.5	179.7	16.1	0	0	109.2	S65 R68	S65-Q70 WeakPolarHBondContact CB-O 3.22Å; R68-Q70 HydrophobicContact CB-CB 4.47Å; R68-Q70 PolarHBondContact O-N 2.71Å; R68-Q70 VanDerWaalsContact O-N 3.1Å
71	P	97.8	Very high	97.7	Very high	42 Å²	42	58.6 Å²	58.6	27%	0.273	34%	0.336	S	S	.	.			trans	-60.7	161.6	172.2	-24.4	34.8	0	0	0	113	N49 M50 L130	N49-P71 WeakPolarHBondContact OD1-CB 3.37Å; M50-P71 WeakPolarHBondContact O-CA 3.43Å; P71-L130 HydrophobicContact CB-CD1 3.76Å; P71-L130 HydrophobicContact CG-CD1 3.53Å
72	F	98.3	Very high	97.7	Very high	84 Å²	84	55.4 Å²	55.4	37%	0.368	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.8	176.5	178.9	-109.8	0	0	0	110.9	M50 Y52 F74 V81 W85	M50-F72 PolarHBondContact N-O 3.25Å; M50-F72 PolarHBondContact O-N 3.27Å; Y52-F72 HydrophobicContact CD1-CB 4.18Å; Y52-F72 HydrophobicContact CE1-CB 3.72Å; Y52-F72 HydrophobicContact CE1-CG 4.27Å; F72-F74 AromaticContact CD1-CD1 3.72Å; F72-F74 HydrophobicContact CD1-CD1 3.72Å; F72-F74 HydrophobicContact CD1-CE1 4.41Å; F72-F74 HydrophobicContact CD1-CG 4.46Å; F72-F74 HydrophobicContact CE1-CB 3.83Å; F72-F74 AromaticContact CE1-CD1 3.61Å; F72-F74 HydrophobicContact CE1-CD1 3.61Å; F72-F74 HydrophobicContact CE1-CE1 4.5Å; F72-F74 AromaticContact CE1-CG 3.91Å; F72-F74 HydrophobicContact CE1-CG 3.91Å; F72-F74 HydrophobicContact CZ-CB 4.16Å; F72-V81 HydrophobicContact CE1-CG1 3.78Å; F72-V81 HydrophobicContact CZ-CG1 4.19Å; F72-W85 HydrophobicContact CD1-CZ3 4.07Å; F72-W85 HydrophobicContact CE1-CZ3 4.41Å
73	T	98.4	Very high	97.7	Very high	72 Å²	72	60.8 Å²	60.8	44%	0.442	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.3	-177.8	-57	0	0	0	0	110.7	V47 L48	V47-T73 HydrophobicContact CG1-CG2 3.43Å; V47-T73 VanDerWaalsContact CG1-CG2 3.43Å; L48-T73 VanDerWaalsContact O-CA 3.29Å; L48-T73 WeakPolarHBondContact O-CA 3.46Å
74	F	98.3	Very high	97.7	Very high	5 Å²	5	58.6 Å²	58.6	2%	0.022	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	162.6	178.2	69.9	-76.2	0	0	0	111.4	V47 L48 M50 F72 L76 V81 W85 L89	V47-F74 WeakPolarHBondContact CA-O 3.3Å; L48-F74 HydrophobicContact CB-CE1 4Å; L48-F74 HydrophobicContact CB-CZ 4.13Å; L48-F74 HydrophobicContact CD1-CZ 4.01Å; L48-F74 HydrophobicContact CG-CZ 4.46Å; L48-F74 PolarHBondContact N-O 2.81Å; L48-F74 PolarHBondContact O-N 2.92Å; L48-F74 VanDerWaalsContact O-N 3.13Å; M50-F74 HydrophobicContact CG-CE1 4.18Å; M50-F74 HydrophobicContact SD-CE1 3.84Å; M50-F74 HydrophobicContact SD-CZ 4.11Å; F72-F74 AromaticContact CD1-CD1 3.72Å; F72-F74 HydrophobicContact CD1-CD1 3.72Å; F72-F74 HydrophobicContact CD1-CE1 4.41Å; F72-F74 HydrophobicContact CD1-CG 4.46Å; F72-F74 HydrophobicContact CE1-CB 3.83Å; F72-F74 AromaticContact CE1-CD1 3.61Å; F72-F74 HydrophobicContact CE1-CD1 3.61Å; F72-F74 HydrophobicContact CE1-CE1 4.5Å; F72-F74 AromaticContact CE1-CG 3.91Å; F72-F74 HydrophobicContact CE1-CG 3.91Å; F72-F74 HydrophobicContact CZ-CB 4.16Å; F74-L76 HydrophobicContact CE2-CB 4.34Å; F74-L76 HydrophobicContact CE2-CD1 4.01Å; F74-V81 HydrophobicContact CB-CG1 4Å; F74-V81 HydrophobicContact CD1-CG1 4.37Å; F74-V81 HydrophobicContact CD2-CB 4.37Å; F74-V81 HydrophobicContact CD2-CG1 3.6Å; F74-V81 HydrophobicContact CD2-CG2 3.8Å; F74-V81 HydrophobicContact CE2-CG1 4.19Å; F74-V81 HydrophobicContact CE2-CG2 3.77Å; F74-V81 HydrophobicContact CG-CG1 3.72Å; F74-W85 HydrophobicContact CD1-CZ3 4.42Å; F74-W85 AromaticContact CE1-CE3 3.85Å; F74-W85 HydrophobicContact CE1-CE3 3.85Å; F74-W85 AromaticContact CE1-CZ3 3.8Å; F74-W85 HydrophobicContact CE1-CZ3 3.8Å; F74-W85 AromaticContact CZ-CE3 3.84Å; F74-W85 HydrophobicContact CZ-CE3 3.84Å; F74-W85 HydrophobicContact CZ-CZ3 4.24Å; F74-L89 HydrophobicContact CE1-CD1 4.39Å; F74-L89 HydrophobicContact CE2-CD1 4.39Å; F74-L89 HydrophobicContact CZ-CD1 3.58Å
75	T	98.4	Very high	97.8	Very high	33 Å²	33	58.8 Å²	58.8	20%	0.202	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	117.2	174.9	-48.7	0	0	0	0	111.1	D46 T78 Q80	D46-T75 WeakPolarHBondContact O-CA 3.38Å; T75-T78 HydrophobicContact CG2-CG2 3.53Å; T75-T78 PolarHBondContact O-OG1 2.74Å; T75-Q80 PolarHBondContact OG1-NE2 2.95Å
76	L	98.6	Very high	97.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	133.7	-175.1	-177.9	64.6	0	0	0	112.3	K44 G45 D46 L48 F74 T78 L89 L90	K44-L76 CarbonylContact C-O 3.59Å; K44-L76 WeakPolarHBondContact CA-O 2.91Å; G45-L76 PolarHBondContact N-O 2.76Å; D46-L76 PolarHBondContact O-N 3.2Å; L48-L76 HydrophobicContact CD1-CB 4.08Å; L48-L76 HydrophobicContact CD1-CD1 4.39Å; L48-L76 HydrophobicContact CD1-CD2 4Å; L48-L76 HydrophobicContact CD1-CG 4.38Å; L48-L76 HydrophobicContact CG-CB 4.18Å; F74-L76 HydrophobicContact CE2-CB 4.34Å; F74-L76 HydrophobicContact CE2-CD1 4.01Å; L76-T78 VanDerWaalsContact C-N 3.35Å; L76-L89 HydrophobicContact CD1-CB 3.96Å; L76-L90 HydrophobicContact CD2-CD2 3.75Å; L76-L90 HydrophobicContact CD2-CG 4.31Å; L76-L90 HydrophobicContact CG-CD2 4.41Å
77	G	97.9	Very high	97.8	Very high	28 Å²	28	60 Å²	60	29%	0.289	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	15.3	170.6	0	0	0	0	0	114.5	D86	G77-D86 VanDerWaalsContact CA-CG 3.48Å; G77-D86 WeakPolarHBondContact CA-OD1 3.41Å; G77-D86 PolarHBondContact N-OD1 3.26Å
78	T	97.3	Very high	97.9	Very high	75 Å²	75	54.9 Å²	54.9	46%	0.46	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-2.6	-179.2	62.5	0	0	0	0	113.3	T75 L76 Q80	T75-T78 HydrophobicContact CG2-CG2 3.53Å; T75-T78 PolarHBondContact O-OG1 2.74Å; L76-T78 VanDerWaalsContact C-N 3.35Å; T78-Q80 VanDerWaalsContact C-N 3.32Å; T78-Q80 WeakPolarHBondContact OG1-CG 3.41Å
79	G	97.1	Very high	98	Very high	56 Å²	56	48.7 Å²	48.7	58%	0.577	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	11.4	-173.9	0	0	0	0	0	114.8	V81 D86	G79-V81 PolarHBondContact O-N 2.86Å; G79-D86 WeakPolarHBondContact CA-OD2 3.07Å; G79-D86 PolarHBondContact N-OD2 2.96Å
80	Q	97.3	Very high	98.2	Very high	121 Å²	121	49 Å²	49	57%	0.565	27%	0.268	S	S	*	.	S	Bend	trans	-66.2	-23.4	172.1	-77.7	179.4	11.2	0	0	113.1	T75 T78	T75-Q80 PolarHBondContact OG1-NE2 2.95Å; T78-Q80 VanDerWaalsContact C-N 3.32Å; T78-Q80 WeakPolarHBondContact OG1-CG 3.41Å
81	V	98.2	Very high	98.2	Very high	22 Å²	22	43.8 Å²	43.8	13%	0.133	25%	0.252	C	S	.	.	S	Bend	trans	-123.3	170.9	179.3	-65.3	0	0	0	0	110.3	F72 F74 G79 W85 D86	F72-V81 HydrophobicContact CE1-CG1 3.78Å; F72-V81 HydrophobicContact CZ-CG1 4.19Å; F74-V81 HydrophobicContact CB-CG1 4Å; F74-V81 HydrophobicContact CD1-CG1 4.37Å; F74-V81 HydrophobicContact CD2-CB 4.37Å; F74-V81 HydrophobicContact CD2-CG1 3.6Å; F74-V81 HydrophobicContact CD2-CG2 3.8Å; F74-V81 HydrophobicContact CE2-CG1 4.19Å; F74-V81 HydrophobicContact CE2-CG2 3.77Å; F74-V81 HydrophobicContact CG-CG1 3.72Å; G79-V81 PolarHBondContact O-N 2.86Å; V81-W85 HydrophobicContact CB-CB 4.11Å; V81-W85 HydrophobicContact CG1-CE3 4.48Å; V81-W85 HydrophobicContact CG2-CB 3.58Å; V81-D86 WeakPolarHBondContact CG2-OD1 3.47Å
82	I	98.6	Very high	98.3	Very high	25 Å²	25	41.8 Å²	41.8	13%	0.128	24%	0.239	C	C	.	.			trans	-57.1	147.2	175.3	61.2	174.4	0	0	0	111.3	G84 W85 D86 I102 Y108 L123 F125	I82-G84 PolarHBondContact O-N 2.95Å; I82-W85 HydrophobicContact CG1-CB 4.24Å; I82-W85 HydrophobicContact CG1-CG 4.04Å; I82-W85 WeakPolarHBondContact O-CB 3.4Å; I82-W85 PolarHBondContact O-N 2.78Å; I82-D86 PolarHBondContact O-N 2.88Å; I82-I102 HydrophobicContact CD1-CD1 3.79Å; I82-I102 HydrophobicContact CD1-CG2 4.4Å; I82-Y108 HydrophobicContact CG2-CE1 4.17Å; I82-Y108 HydrophobicContact CG2-CE2 4.18Å; I82-L123 HydrophobicContact CD1-CD1 3.93Å; I82-F125 HydrophobicContact CD1-CE2 3.86Å; I82-F125 HydrophobicContact CD1-CZ 4.3Å
83	K	98.6	Very high	98.3	Very high	133 Å²	133	38.1 Å²	38.1	58%	0.578	22%	0.224	S	C	*	.	H	α-helix	trans	-56.1	-32.4	-174.7	-65.3	178.5	-178.6	173	0	113.1	W85 D86 Q87 L106	K83-W85 VanDerWaalsContact C-N 3.29Å; K83-W85 PolarHBondContact O-N 2.87Å; K83-D86 PolarHBondContact O-N 2.98Å; K83-Q87 WeakPolarHBondContact O-CB 3.48Å; K83-Q87 VanDerWaalsContact O-CG 3.3Å; K83-Q87 WeakPolarHBondContact O-CG 3.31Å; K83-Q87 PolarHBondContact O-N 2.87Å; K83-L106 HydrophobicContact CB-CB 4.37Å; K83-L106 HydrophobicContact CB-CD2 3.86Å; K83-L106 HydrophobicContact CD-CD2 4.26Å; K83-L106 PolarHBondContact N-O 3.37Å
84	G	98.6	Very high	98.3	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-32.1	177.2	0	0	0	0	0	113.5	I82 G88 L106	I82-G84 PolarHBondContact O-N 2.95Å; G84-G88 WeakPolarHBondContact O-CA 3.39Å; G84-G88 PolarHBondContact O-N 2.83Å; G84-L106 PolarHBondContact N-O 2.8Å
85	W	98.8	Very high	98.3	Very high	9 Å²	9	39.7 Å²	39.7	3%	0.034	23%	0.232	C	C	.	.	H	α-helix	trans	-73.4	-48.2	172.4	-83.1	48.5	0	0	0	110.8	M50 Y52 F72 F74 V81 I82 K83 Q87 G88 L89 F125 V127	M50-W85 HydrophobicContact SD-CZ3 4.41Å; Y52-W85 AromaticContact CD1-CH2 3.81Å; Y52-W85 HydrophobicContact CD1-CH2 3.81Å; Y52-W85 HydrophobicContact CD1-CZ2 4.48Å; Y52-W85 HydrophobicContact CD2-CH2 4.39Å; Y52-W85 HydrophobicContact CD2-CZ2 4.26Å; Y52-W85 HydrophobicContact CE1-CH2 4.48Å; Y52-W85 AromaticContact CG-CH2 3.75Å; Y52-W85 HydrophobicContact CG-CH2 3.75Å; Y52-W85 HydrophobicContact CG-CZ2 4Å; F72-W85 HydrophobicContact CD1-CZ3 4.07Å; F72-W85 HydrophobicContact CE1-CZ3 4.41Å; F74-W85 HydrophobicContact CD1-CZ3 4.42Å; F74-W85 AromaticContact CE1-CE3 3.85Å; F74-W85 HydrophobicContact CE1-CE3 3.85Å; F74-W85 AromaticContact CE1-CZ3 3.8Å; F74-W85 HydrophobicContact CE1-CZ3 3.8Å; F74-W85 AromaticContact CZ-CE3 3.84Å; F74-W85 HydrophobicContact CZ-CE3 3.84Å; F74-W85 HydrophobicContact CZ-CZ3 4.24Å; V81-W85 HydrophobicContact CB-CB 4.11Å; V81-W85 HydrophobicContact CG1-CE3 4.48Å; V81-W85 HydrophobicContact CG2-CB 3.58Å; I82-W85 HydrophobicContact CG1-CB 4.24Å; I82-W85 HydrophobicContact CG1-CG 4.04Å; I82-W85 WeakPolarHBondContact O-CB 3.4Å; I82-W85 PolarHBondContact O-N 2.78Å; K83-W85 VanDerWaalsContact C-N 3.29Å; K83-W85 PolarHBondContact O-N 2.87Å; W85-Q87 PolarHBondContact O-N 3.11Å; W85-Q87 VanDerWaalsContact O-N 3.13Å; W85-G88 PolarHBondContact O-N 2.8Å; W85-G88 VanDerWaalsContact O-N 3.16Å; W85-L89 HydrophobicContact CB-CD1 3.86Å; W85-L89 HydrophobicContact CD2-CD1 3.81Å; W85-L89 HydrophobicContact CE3-CD1 3.45Å; W85-L89 VanDerWaalsContact CE3-CD1 3.45Å; W85-L89 HydrophobicContact CG-CD1 4.03Å; W85-L89 HydrophobicContact CZ3-CD1 4.21Å; W85-L89 WeakPolarHBondContact O-CB 3.16Å; W85-L89 WeakPolarHBondContact O-CG 3.35Å; W85-L89 PolarHBondContact O-N 2.99Å; W85-L89 VanDerWaalsContact O-N 3.07Å; W85-F125 AromaticContact CZ2-CD1 3.65Å; W85-F125 HydrophobicContact CZ2-CD1 3.65Å; W85-F125 AromaticContact CZ2-CE1 3.82Å; W85-F125 HydrophobicContact CZ2-CE1 3.82Å; W85-F125 HydrophobicContact CZ2-CG 4.23Å; W85-F125 AromaticContact NE1-CD1 3.73Å; W85-F125 AromaticContact NE1-CD2 3.51Å; W85-F125 AromaticContact NE1-CE1 3.8Å; W85-F125 AromaticContact NE1-CE2 3.57Å; W85-F125 AromaticContact NE1-CG 3.57Å; W85-F125 AromaticContact NE1-CZ 3.7Å; W85-V127 HydrophobicContact CH2-CG1 4.31Å; W85-V127 HydrophobicContact CZ2-CG1 4.06Å
86	D	98.6	Very high	98.3	Very high	22 Å²	22	38.6 Å²	38.6	12%	0.118	22%	0.224	C	C	.	.	H	α-helix	trans	-56.3	-32.6	178.1	-91.7	-4.1	0	0	0	113.1	G77 G79 V81 I82 K83	G77-D86 VanDerWaalsContact CA-CG 3.48Å; G77-D86 WeakPolarHBondContact CA-OD1 3.41Å; G77-D86 PolarHBondContact N-OD1 3.26Å; G79-D86 WeakPolarHBondContact CA-OD2 3.07Å; G79-D86 PolarHBondContact N-OD2 2.96Å; V81-D86 WeakPolarHBondContact CG2-OD1 3.47Å; I82-D86 PolarHBondContact O-N 2.88Å; K83-D86 PolarHBondContact O-N 2.98Å
87	Q	98.6	Very high	98.3	Very high	97 Å²	97	42.2 Å²	42.2	45%	0.453	24%	0.24	S	C	.	.	H	α-helix	trans	-87.1	-41.2	175.7	-66.6	174.1	23.4	0	0	112.8	L27 K83 W85 L89	L27-Q87 HydrophobicContact CD2-CB 3.58Å; K83-Q87 WeakPolarHBondContact O-CB 3.48Å; K83-Q87 VanDerWaalsContact O-CG 3.3Å; K83-Q87 WeakPolarHBondContact O-CG 3.31Å; K83-Q87 PolarHBondContact O-N 2.87Å; W85-Q87 PolarHBondContact O-N 3.11Å; W85-Q87 VanDerWaalsContact O-N 3.13Å; Q87-L89 PolarHBondContact O-N 3.34Å
88	G	98.6	Very high	98.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-77.1	-18.9	-170.1	0	0	0	0	0	115.3	G84 W85 R98	G84-G88 WeakPolarHBondContact O-CA 3.39Å; G84-G88 PolarHBondContact O-N 2.83Å; W85-G88 PolarHBondContact O-N 2.8Å; W85-G88 VanDerWaalsContact O-N 3.16Å; G88-R98 PolarHBondContact O-NH1 2.85Å
89	L	98.8	Very high	98.4	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	4.3	-170.7	-57.9	176.6	0	0	0	113.9	S42 L48 M50 F74 L76 W85 Q87 M92 L100 V127	S42-L89 PolarHBondContact OG-O 3.18Å; L48-L89 HydrophobicContact CD1-CB 4.45Å; M50-L89 HydrophobicContact CE-CD1 4.49Å; M50-L89 HydrophobicContact CE-CD2 3.93Å; M50-L89 HydrophobicContact SD-CD1 3.75Å; M50-L89 HydrophobicContact SD-CD2 4.25Å; F74-L89 HydrophobicContact CE1-CD1 4.39Å; F74-L89 HydrophobicContact CE2-CD1 4.39Å; F74-L89 HydrophobicContact CZ-CD1 3.58Å; L76-L89 HydrophobicContact CD1-CB 3.96Å; W85-L89 HydrophobicContact CB-CD1 3.86Å; W85-L89 HydrophobicContact CD2-CD1 3.81Å; W85-L89 HydrophobicContact CE3-CD1 3.45Å; W85-L89 VanDerWaalsContact CE3-CD1 3.45Å; W85-L89 HydrophobicContact CG-CD1 4.03Å; W85-L89 HydrophobicContact CZ3-CD1 4.21Å; W85-L89 WeakPolarHBondContact O-CB 3.16Å; W85-L89 WeakPolarHBondContact O-CG 3.35Å; W85-L89 PolarHBondContact O-N 2.99Å; W85-L89 VanDerWaalsContact O-N 3.07Å; Q87-L89 PolarHBondContact O-N 3.34Å; L89-M92 HydrophobicContact CB-SD 4.28Å; L89-M92 HydrophobicContact CD2-SD 3.51Å; L89-M92 VanDerWaalsContact CD2-SD 3.51Å; L89-L100 HydrophobicContact CD2-CD1 3.89Å; L89-L100 HydrophobicContact CG-CD1 4.26Å; L89-V127 HydrophobicContact CD2-CG2 3.79Å
90	L	98.5	Very high	98.5	Very high	65 Å²	65	39.3 Å²	39.3	34%	0.34	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	143.5	172.4	-69.5	165.5	0	0	0	111	K44 L76 M92 R98	K44-L90 HydrophobicContact CG-CD2 3.97Å; L76-L90 HydrophobicContact CD2-CD2 3.75Å; L76-L90 HydrophobicContact CD2-CG 4.31Å; L76-L90 HydrophobicContact CG-CD2 4.41Å; L90-M92 VanDerWaalsContact C-N 3.26Å; L90-M92 PolarHBondContact O-N 3.29Å; L90-R98 PolarHBondContact O-NH1 3.07Å
91	G	98.2	Very high	98.6	Very high	30 Å²	30	35 Å²	35	31%	0.309	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	22.2	174.1	0	0	0	0	0	114.5	S42 R98	S42-G91 PolarHBondContact O-N 2.92Å; S42-G91 PolarHBondContact OG-N 2.01Å; S42-G91 VanDerWaalsContact OG-N 3.11Å; G91-R98 PolarHBondContact O-NH2 3.4Å
92	M	98.4	Very high	98.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-80.8	149.6	174	-76.6	-171	74	0	0	111.4	K41 S42 M50 L89 L90 E96 R98 V127 L129	K41-M92 CarbonylContact C-O 3.59Å; K41-M92 WeakPolarHBondContact CA-O 3.47Å; S42-M92 PolarHBondContact N-O 2.94Å; S42-M92 PolarHBondContact OG-N 2.99Å; M50-M92 HydrophobicContact CE-CE 4.14Å; M50-M92 HydrophobicContact CE-SD 4.08Å; L89-M92 HydrophobicContact CB-SD 4.28Å; L89-M92 HydrophobicContact CD2-SD 3.51Å; L89-M92 VanDerWaalsContact CD2-SD 3.51Å; L90-M92 VanDerWaalsContact C-N 3.26Å; L90-M92 PolarHBondContact O-N 3.29Å; M92-E96 WeakPolarHBondContact CA-OE2 3.01Å; M92-E96 HydrophobicContact CE-CB 4.02Å; M92-E96 HydrophobicContact CE-CG 4.26Å; M92-E96 WeakPolarHBondContact CE-O 3.18Å; M92-R98 HydrophobicContact CE-CB 4.44Å; M92-R98 HydrophobicContact CE-CG 4Å; M92-R98 HydrophobicContact SD-CG 4.25Å; M92-V127 HydrophobicContact CE-CG2 4.36Å; M92-L129 HydrophobicContact CB-CD2 3.53Å; M92-L129 HydrophobicContact CE-CB 3.78Å
93	C	98.3	Very high	98.6	Very high	8 Å²	8	32.9 Å²	32.9	5%	0.054	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-99.7	149.5	170.9	-52.2	0	0	0	0	110.9	V35 C38 G95 E96	V35-C93 HydrophobicContact CB-CB 3.92Å; V35-C93 HydrophobicContact CG1-CB 4.35Å; V35-C93 HydrophobicContact CG2-CB 4.16Å; C38-C93 HydrophobicContact CB-CB 3.77Å; C38-C93 WeakPolarHBondContact CB-SG 3.39Å; C38-C93 WeakPolarHBondContact SG-CB 3.41Å; C38-C93 CovalentContact SG-SG 2.01Å; C38-C93 PolarHBondContact SG-SG 2.62Å; C93-G95 PolarHBondContact O-N 3.08Å; C93-E96 HydrophobicContact CB-CB 4.26Å; C93-E96 PolarHBondContact N-OE2 2.89Å; C93-E96 WeakPolarHBondContact O-CB 3.4Å; C93-E96 PolarHBondContact O-N 3.23Å
94	E	98.3	Very high	98.6	Very high	89 Å²	89	26.9 Å²	26.9	42%	0.416	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	132.5	168.9	-63.2	-175.7	172	0	0	110.3	V35 E96 S131 I132	V35-E94 WeakPolarHBondContact CG2-O 3.42Å; E94-E96 VanDerWaalsContact C-N 3.31Å; E94-S131 WeakPolarHBondContact OE1-CA 3.35Å; E94-I132 HydrophobicContact CG-CD1 4.18Å; E94-I132 HydrophobicContact CG-CG1 3.94Å; E94-I132 PolarHBondContact OE1-N 3.36Å
95	G	98.3	Very high	98.5	Very high	20 Å²	20	32.1 Å²	32.1	21%	0.206	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	-4.9	-173.2	0	0	0	0	0	115.5	K33 C93 L129	K33-G95 WeakPolarHBondContact CD-O 2.97Å; K33-G95 WeakPolarHBondContact CE-O 3.29Å; K33-G95 PolarHBondContact NZ-O 2.99Å; K33-G95 VanDerWaalsContact NZ-O 3.1Å; C93-G95 PolarHBondContact O-N 3.08Å; G95-L129 WeakPolarHBondContact CA-O 3.29Å; G95-L129 PolarHBondContact N-O 2.82Å
96	E	98.7	Very high	98.5	Very high	10 Å²	10	33.1 Å²	33.1	5%	0.047	17%	0.172	C	C	.	.			trans	-72.4	141	175.4	-168	-176.1	142.7	0	0	110.8	I31 K33 V35 M92 C93 E94 R98 E128 L129	I31-E96 HydrophobicContact CG2-CG 4.3Å; K33-E96 WeakPolarHBondContact O-CA 3.17Å; K33-E96 WeakPolarHBondContact O-CG 3.2Å; V35-E96 HydrophobicContact CG2-CB 4.04Å; M92-E96 WeakPolarHBondContact CA-OE2 3.01Å; M92-E96 HydrophobicContact CE-CB 4.02Å; M92-E96 HydrophobicContact CE-CG 4.26Å; M92-E96 WeakPolarHBondContact CE-O 3.18Å; C93-E96 HydrophobicContact CB-CB 4.26Å; C93-E96 PolarHBondContact N-OE2 2.89Å; C93-E96 WeakPolarHBondContact O-CB 3.4Å; C93-E96 PolarHBondContact O-N 3.23Å; E94-E96 VanDerWaalsContact C-N 3.31Å; E96-R98 IonicContact OE1-CZ 3.72Å; E96-R98 VanDerWaalsContact OE1-CZ 3.25Å; E96-R98 IonicContact OE1-NE 2.91Å; E96-R98 PolarHBondContact OE1-NE 3.18Å; E96-R98 IonicContact OE1-NH2 3.75Å; E96-R98 PolarHBondContact OE1-NH2 2.81Å; E96-R98 IonicContact OE2-NH2 3.25Å; E96-E128 WeakPolarHBondContact O-CA 3.47Å; E96-L129 PolarHBondContact O-N 3.06Å; E96-L129 VanDerWaalsContact O-N 3.08Å
97	K	98.8	Very high	98.5	Very high	77 Å²	77	33 Å²	33	34%	0.335	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.2	172	-60.1	-175.5	177.2	-155.6	0	111.1	K32 K33 V127 E128	K32-K97 HydrophobicContact CB-CB 3.87Å; K32-K97 PolarHBondContact N-O 2.8Å; K33-K97 HydrophobicContact CB-CB 3.74Å; K33-K97 HydrophobicContact CB-CD 4.19Å; K33-K97 HydrophobicContact CB-CG 3.86Å; K33-K97 HydrophobicContact CD-CD 4.29Å; K33-K97 HydrophobicContact CD-CG 4.23Å; K33-K97 PolarHBondContact N-O 2.91Å; K33-K97 PolarHBondContact O-N 3.1Å; K97-V127 CarbonylContact C-O 3.52Å; K97-V127 WeakPolarHBondContact CA-O 3.16Å; K97-E128 WeakPolarHBondContact CE-OE1 3.33Å; K97-E128 WeakPolarHBondContact CE-OE2 3.4Å; K97-E128 HydrophobicContact CG-CB 4Å; K97-E128 HydrophobicContact CG-CG 4.04Å; K97-E128 IonicContact NZ-OE1 3.49Å; K97-E128 PolarHBondContact NZ-OE1 3.5Å; K97-E128 IonicContact NZ-OE2 2.77Å; K97-E128 PolarHBondContact NZ-OE2 2.87Å
98	R	98.8	Very high	98.5	Very high	21 Å²	21	33.2 Å²	33.2	8%	0.079	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	152.5	173.2	-71.4	-176.6	-179.5	171.9	10.3	111.7	G30 I31 G88 L90 G91 M92 E96 L100 E126 V127	G30-R98 CarbonylContact O-C 3.37Å; G30-R98 VanDerWaalsContact O-CA 3.23Å; G30-R98 WeakPolarHBondContact O-CA 3.34Å; I31-R98 HydrophobicContact CG1-CG 4.33Å; G88-R98 PolarHBondContact O-NH1 2.85Å; L90-R98 PolarHBondContact O-NH1 3.07Å; G91-R98 PolarHBondContact O-NH2 3.4Å; M92-R98 HydrophobicContact CE-CB 4.44Å; M92-R98 HydrophobicContact CE-CG 4Å; M92-R98 HydrophobicContact SD-CG 4.25Å; E96-R98 IonicContact OE1-CZ 3.72Å; E96-R98 VanDerWaalsContact OE1-CZ 3.25Å; E96-R98 IonicContact OE1-NE 2.91Å; E96-R98 PolarHBondContact OE1-NE 3.18Å; E96-R98 IonicContact OE1-NH2 3.75Å; E96-R98 PolarHBondContact OE1-NH2 2.81Å; E96-R98 IonicContact OE2-NH2 3.25Å; R98-L100 HydrophobicContact CB-CD2 4.34Å; R98-E126 CarbonylContact O-C 3.59Å; R98-E126 WeakPolarHBondContact O-CA 3.37Å; R98-V127 HydrophobicContact CB-CG2 3.79Å; R98-V127 PolarHBondContact N-O 2.8Å; R98-V127 PolarHBondContact O-N 2.79Å
99	K	98.8	Very high	98.4	Very high	77 Å²	77	34.3 Å²	34.3	34%	0.335	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	121.5	161.7	-178.3	176	-179.8	177.2	0	108	G30 K32 I124 F125 E126	G30-K99 PolarHBondContact N-O 2.9Å; G30-K99 PolarHBondContact O-N 3.4Å; K32-K99 HydrophobicContact CD-CB 4.17Å; K32-K99 HydrophobicContact CG-CB 3.91Å; K99-I124 HydrophobicContact CD-CG2 4.46Å; K99-I124 VanDerWaalsContact CE-CG2 3.41Å; K99-I124 HydrophobicContact CG-CG2 4.31Å; K99-F125 CarbonylContact C-O 3.52Å; K99-F125 VanDerWaalsContact CA-O 3.23Å; K99-F125 WeakPolarHBondContact CA-O 3.38Å; K99-E126 HydrophobicContact CG-CG 4.44Å
100	L	98.8	Very high	98.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	129.2	174.5	-52.7	-177.8	0	0	0	109	Q28 I29 L89 R98 I102 I124 F125	Q28-L100 WeakPolarHBondContact O-CA 3.36Å; I29-L100 HydrophobicContact CB-CD2 4.23Å; I29-L100 HydrophobicContact CG1-CD2 3.98Å; I29-L100 HydrophobicContact CG2-CD2 3.85Å; L89-L100 HydrophobicContact CD2-CD1 3.89Å; L89-L100 HydrophobicContact CG-CD1 4.26Å; R98-L100 HydrophobicContact CB-CD2 4.34Å; L100-I102 HydrophobicContact CB-CD1 4.15Å; L100-I102 HydrophobicContact CB-CG1 3.92Å; L100-I102 HydrophobicContact CD1-CD1 4.34Å; L100-I124 CarbonylContact O-C 3.58Å; L100-I124 WeakPolarHBondContact O-CA 3.33Å; L100-F125 HydrophobicContact CB-CB 4.34Å; L100-F125 PolarHBondContact N-O 2.94Å; L100-F125 PolarHBondContact O-N 2.91Å
101	V	98.7	Very high	98.4	Very high	29 Å²	29	49.1 Å²	49.1	18%	0.176	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	106.7	167.3	-174.6	0	0	0	0	107.1	Q28 T122	Q28-V101 HydrophobicContact CB-CB 4.02Å; Q28-V101 HydrophobicContact CB-CG2 4.43Å; Q28-V101 HydrophobicContact CG-CB 4.31Å; Q28-V101 PolarHBondContact N-O 3.33Å; Q28-V101 PolarHBondContact O-N 3.5Å; V101-T122 HydrophobicContact CG1-CG2 3.64Å
102	I	98.8	Very high	98.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	112	-168.3	-53.5	-178.9	0	0	0	108.5	L27 I82 L100 L106 T122 L123 F125	L27-I102 HydrophobicContact CD1-CB 4.39Å; L27-I102 HydrophobicContact CD1-CG1 3.77Å; I82-I102 HydrophobicContact CD1-CD1 3.79Å; I82-I102 HydrophobicContact CD1-CG2 4.4Å; L100-I102 HydrophobicContact CB-CD1 4.15Å; L100-I102 HydrophobicContact CB-CG1 3.92Å; L100-I102 HydrophobicContact CD1-CD1 4.34Å; I102-L106 HydrophobicContact CG2-CB 3.76Å; I102-T122 CarbonylContact O-C 3.59Å; I102-T122 WeakPolarHBondContact O-CA 3.42Å; I102-L123 HydrophobicContact CB-CB 4.33Å; I102-L123 PolarHBondContact N-O 2.74Å; I102-L123 PolarHBondContact O-N 2.81Å; I102-F125 HydrophobicContact CD1-CD2 3.57Å; I102-F125 HydrophobicContact CD1-CE2 3.91Å; I102-F125 HydrophobicContact CG1-CD2 4.35Å
103	P	98.4	Very high	98.3	Very high	4 Å²	4	49.8 Å²	49.8	3%	0.026	25%	0.25	C	S	.	.			trans	-66.7	157.6	175	34.2	-40.1	0	0	0	110.6	K25 E105 L106 G107	K25-P103 HydrophobicContact CB-CB 3.74Å; K25-P103 WeakPolarHBondContact O-CB 3.5Å; K25-P103 VanDerWaalsContact O-CG 3.22Å; K25-P103 WeakPolarHBondContact O-CG 3.22Å; P103-E105 WeakPolarHBondContact CB-OE2 3.34Å; P103-E105 PolarHBondContact O-N 3.45Å; P103-E105 VanDerWaalsContact O-N 3.13Å; P103-L106 HydrophobicContact CG-CB 4.22Å; P103-L106 HydrophobicContact CG-CD1 3.93Å; P103-L106 HydrophobicContact CG-CG 4.09Å; P103-L106 CarbonylContact O-C 3.46Å; P103-L106 PolarHBondContact O-N 3.35Å; P103-G107 PolarHBondContact O-N 2.84Å; P103-G107 VanDerWaalsContact O-N 3.13Å
104	A	98.2	Very high	98.2	Very high	6 Å²	6	54.6 Å²	54.6	5%	0.05	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-55	-38	-171.2	0	0	0	0	0	113.3	L106 G107 Y108 G109 G120 A121	A104-L106 PolarHBondContact O-N 2.75Å; A104-G107 CarbonylContact O-C 3.33Å; A104-G107 WeakPolarHBondContact O-CA 3.35Å; A104-G107 PolarHBondContact O-N 3.12Å; A104-Y108 PolarHBondContact O-N 2.89Å; A104-G109 VanDerWaalsContact O-CA 3.29Å; A104-G109 WeakPolarHBondContact O-CA 2.98Å; A104-G109 PolarHBondContact O-N 2.88Å; A104-G120 VanDerWaalsContact CB-C 3.48Å; A104-A121 WeakPolarHBondContact CA-O 3.32Å; A104-A121 WeakPolarHBondContact CB-O 3.48Å
105	E	97.8	Very high	98.2	Very high	111 Å²	111	56.7 Å²	56.7	52%	0.519	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-65.6	-20.4	-179	-54.9	78.5	-174.4	0	0	113.2	P103	P103-E105 WeakPolarHBondContact CB-OE2 3.34Å; P103-E105 PolarHBondContact O-N 3.45Å; P103-E105 VanDerWaalsContact O-N 3.13Å
106	L	98.4	Very high	98.1	Very high	30 Å²	30	61.9 Å²	61.9	16%	0.157	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-104.2	-2.6	173.7	-60.9	-179.7	0	0	0	112.6	L27 K83 G84 I102 P103 A104	L27-L106 HydrophobicContact CB-CD1 3.74Å; K83-L106 HydrophobicContact CB-CB 4.37Å; K83-L106 HydrophobicContact CB-CD2 3.86Å; K83-L106 HydrophobicContact CD-CD2 4.26Å; K83-L106 PolarHBondContact N-O 3.37Å; G84-L106 PolarHBondContact N-O 2.8Å; I102-L106 HydrophobicContact CG2-CB 3.76Å; P103-L106 HydrophobicContact CG-CB 4.22Å; P103-L106 HydrophobicContact CG-CD1 3.93Å; P103-L106 HydrophobicContact CG-CG 4.09Å; P103-L106 CarbonylContact O-C 3.46Å; P103-L106 PolarHBondContact O-N 3.35Å; A104-L106 PolarHBondContact O-N 2.75Å
107	G	98.4	Very high	98.1	Very high	18 Å²	18	61.9 Å²	61.9	19%	0.186	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-119.8	173.7	0	0	0	0	0	111.4	P103 A104	P103-G107 PolarHBondContact O-N 2.84Å; P103-G107 VanDerWaalsContact O-N 3.13Å; A104-G107 CarbonylContact O-C 3.33Å; A104-G107 WeakPolarHBondContact O-CA 3.35Å; A104-G107 PolarHBondContact O-N 3.12Å
108	Y	98.2	Very high	98.1	Very high	103 Å²	103	61.7 Å²	61.7	40%	0.404	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	4.9	-175.9	-65.5	-81	0	0	0	114.6	I82 A104 G112 A113 I117 L123	I82-Y108 HydrophobicContact CG2-CE1 4.17Å; I82-Y108 HydrophobicContact CG2-CE2 4.18Å; A104-Y108 PolarHBondContact O-N 2.89Å; Y108-G112 PolarHBondContact O-N 2.95Å; Y108-A113 HydrophobicContact CD1-CB 3.81Å; Y108-A113 HydrophobicContact CD2-CB 4.4Å; Y108-A113 HydrophobicContact CE1-CB 3.95Å; Y108-A113 HydrophobicContact CG-CB 4.05Å; Y108-I117 HydrophobicContact CD2-CD1 3.62Å; Y108-I117 HydrophobicContact CD2-CG2 4.02Å; Y108-I117 HydrophobicContact CE2-CD1 3.32Å; Y108-L123 HydrophobicContact CD2-CD1 3.74Å; Y108-L123 HydrophobicContact CE2-CD1 3.88Å
109	G	97.8	Very high	98.1	Very high	22 Å²	22	62.7 Å²	62.7	23%	0.227	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	57.4	-156.1	178.7	0	0	0	0	0	113.9	A104 R111 G112 G120	A104-G109 VanDerWaalsContact O-CA 3.29Å; A104-G109 WeakPolarHBondContact O-CA 2.98Å; A104-G109 PolarHBondContact O-N 2.88Å; G109-R111 PolarHBondContact O-N 2.87Å; G109-G112 PolarHBondContact O-N 3.33Å; G109-G120 PolarHBondContact O-N 3.02Å
110	D	97.8	Very high	98	Very high	148 Å²	148	61 Å²	61	79%	0.791	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-68.4	-18.7	-177.5	-57.1	-31	0	0	0	113.5	G119	D110-G119 WeakPolarHBondContact O-CA 3.38Å
111	R	97.7	Very high	98	Very high	229 Å²	229	61.8 Å²	61.8	86%	0.864	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-80	-27	178.1	-66.2	-176.6	-176.3	145.4	0.8	112.5	G109	G109-R111 PolarHBondContact O-N 2.87Å
112	G	98	Very high	98	Very high	12 Å²	12	60.8 Å²	60.8	12%	0.124	35%	0.348	C	S	.	.			trans	62.5	-159.9	-172.9	0	0	0	0	0	112.6	Y108 G109 I117	Y108-G112 PolarHBondContact O-N 2.95Å; G109-G112 PolarHBondContact O-N 3.33Å; G112-I117 CarbonylContact C-O 3.6Å; G112-I117 WeakPolarHBondContact CA-O 3.36Å
113	A	98.1	Very high	98	Very high	32 Å²	32	60.8 Å²	60.8	26%	0.264	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-136.4	82.2	169.4	0	0	0	0	0	109.1	Y108 K116 I117	Y108-A113 HydrophobicContact CD1-CB 3.81Å; Y108-A113 HydrophobicContact CD2-CB 4.4Å; Y108-A113 HydrophobicContact CE1-CB 3.95Å; Y108-A113 HydrophobicContact CG-CB 4.05Å; A113-K116 PolarHBondContact O-N 2.81Å; A113-I117 CarbonylContact C-O 3.52Å; A113-I117 HydrophobicContact CB-CB 4.05Å; A113-I117 HydrophobicContact CB-CD1 4.25Å; A113-I117 HydrophobicContact CB-CG1 4.47Å; A113-I117 PolarHBondContact N-O 3.48Å; A113-I117 PolarHBondContact O-N 3.08Å
114	P	95.9	Very high	98	Very high	109 Å²	109	62.3 Å²	62.3	71%	0.708	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	148.8	-178.5	-24.1	34.8	0	0	0	112.6
115	P	97	Very high	98	Very high	133 Å²	133	62.4 Å²	62.4	86%	0.864	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.3	-5.7	0.8	34.7	-36.1	0	0	0	114.1
116	K	97.9	Very high	98.1	Very high	129 Å²	129	61.7 Å²	61.7	56%	0.561	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-30.8	-164.8	-59.4	-173.3	176.7	-174.9	0	114.6	F62 A113	F62-K116 HydrophobicContact CB-CB 4.12Å; F62-K116 WeakPolarHBondContact O-CD 3.21Å; F62-K116 PolarHBondContact O-NZ 2.86Å; A113-K116 PolarHBondContact O-N 2.81Å
117	I	98.4	Very high	98.1	Very high	9 Å²	9	60.5 Å²	60.5	5%	0.046	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-119.7	111.2	-176.2	-58	176.6	0	0	0	108	F62 Y108 G112 A113 A121 L123	F62-I117 HydrophobicContact CB-CG1 4.37Å; F62-I117 HydrophobicContact CD1-CG1 4.32Å; F62-I117 HydrophobicContact CD2-CD1 3.9Å; F62-I117 HydrophobicContact CD2-CG1 4.22Å; F62-I117 HydrophobicContact CE2-CD1 3.92Å; F62-I117 HydrophobicContact CG-CD1 4.23Å; F62-I117 HydrophobicContact CG-CG1 4.07Å; F62-I117 HydrophobicContact CZ-CD1 4.23Å; Y108-I117 HydrophobicContact CD2-CD1 3.62Å; Y108-I117 HydrophobicContact CD2-CG2 4.02Å; Y108-I117 HydrophobicContact CE2-CD1 3.32Å; G112-I117 CarbonylContact C-O 3.6Å; G112-I117 WeakPolarHBondContact CA-O 3.36Å; A113-I117 CarbonylContact C-O 3.52Å; A113-I117 HydrophobicContact CB-CB 4.05Å; A113-I117 HydrophobicContact CB-CD1 4.25Å; A113-I117 HydrophobicContact CB-CG1 4.47Å; A113-I117 PolarHBondContact N-O 3.48Å; A113-I117 PolarHBondContact O-N 3.08Å; I117-A121 HydrophobicContact CG2-CB 3.94Å; I117-L123 HydrophobicContact CD1-CD2 4.3Å; I117-L123 HydrophobicContact CG2-CD2 3.77Å
118	P	98.1	Very high	98.1	Very high	74 Å²	74	61.6 Å²	61.6	48%	0.481	35%	0.346	S	S	.	.			trans	-69.4	160.9	176.1	26.5	-29.4	0	0	0	111.5	A121	P118-A121 HydrophobicContact CG-CB 4.12Å; P118-A121 VanDerWaalsContact O-CB 3.27Å; P118-A121 WeakPolarHBondContact O-CB 3.45Å; P118-A121 PolarHBondContact O-N 2.94Å
119	G	98.3	Very high	98.1	Very high	41 Å²	41	56.7 Å²	56.7	42%	0.423	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	143	170.6	0	0	0	0	0	112	D110 A121	D110-G119 WeakPolarHBondContact O-CA 3.38Å; G119-A121 PolarHBondContact O-N 3.11Å
120	G	97.6	Very high	98.2	Very high	41 Å²	41	58.5 Å²	58.5	42%	0.423	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	6	179.1	0	0	0	0	0	114.8	A104 G109 T122	A104-G120 VanDerWaalsContact CB-C 3.48Å; G109-G120 PolarHBondContact O-N 3.02Å; G120-T122 PolarHBondContact O-N 2.86Å
121	A	98.1	Very high	98.2	Very high	17 Å²	17	53 Å²	53	14%	0.14	30%	0.303	C	S	.	.			trans	-66.3	133.4	-178.9	0	0	0	0	0	112.7	L56 A104 I117 P118 G119 L123	L56-A121 HydrophobicContact CD2-CB 4.16Å; A104-A121 WeakPolarHBondContact CA-O 3.32Å; A104-A121 WeakPolarHBondContact CB-O 3.48Å; I117-A121 HydrophobicContact CG2-CB 3.94Å; P118-A121 HydrophobicContact CG-CB 4.12Å; P118-A121 VanDerWaalsContact O-CB 3.27Å; P118-A121 WeakPolarHBondContact O-CB 3.45Å; P118-A121 PolarHBondContact O-N 2.94Å; G119-A121 PolarHBondContact O-N 3.11Å; A121-L123 HydrophobicContact CB-CD2 4.2Å
122	T	98.6	Very high	98.2	Very high	9 Å²	9	42.8 Å²	42.8	6%	0.055	27%	0.266	C	S	.	.			trans	-80.8	134	160.5	-62.5	0	0	0	0	108.7	E57 V101 I102 G120	E57-T122 HydrophobicContact CG-CG2 4.14Å; V101-T122 HydrophobicContact CG1-CG2 3.64Å; I102-T122 CarbonylContact O-C 3.59Å; I102-T122 WeakPolarHBondContact O-CA 3.42Å; G120-T122 PolarHBondContact O-N 2.86Å
123	L	98.8	Very high	98.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.9	-177.4	-47.4	174.8	0	0	0	110.1	L56 F62 I82 I102 Y108 I117 A121 F125	L56-L123 HydrophobicContact CD2-CD2 4.19Å; F62-L123 HydrophobicContact CE1-CD2 3.94Å; F62-L123 HydrophobicContact CZ-CB 4.46Å; F62-L123 HydrophobicContact CZ-CD2 4.21Å; I82-L123 HydrophobicContact CD1-CD1 3.93Å; I102-L123 HydrophobicContact CB-CB 4.33Å; I102-L123 PolarHBondContact N-O 2.74Å; I102-L123 PolarHBondContact O-N 2.81Å; Y108-L123 HydrophobicContact CD2-CD1 3.74Å; Y108-L123 HydrophobicContact CE2-CD1 3.88Å; I117-L123 HydrophobicContact CD1-CD2 4.3Å; I117-L123 HydrophobicContact CG2-CD2 3.77Å; A121-L123 HydrophobicContact CB-CD2 4.2Å; L123-F125 HydrophobicContact CB-CD2 4.08Å; L123-F125 HydrophobicContact CB-CE2 3.64Å; L123-F125 HydrophobicContact CD1-CE2 3.84Å; L123-F125 HydrophobicContact CD1-CZ 4.37Å; L123-F125 HydrophobicContact CG-CE2 4.39Å
124	I	98.9	Very high	98	Very high	36 Å²	36	50.2 Å²	50.2	19%	0.185	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	114.4	175.7	-57.4	174.7	0	0	0	107.8	G54 K55 K99 L100	G54-I124 WeakPolarHBondContact CA-O 3.4Å; K55-I124 PolarHBondContact N-O 3.17Å; K55-I124 PolarHBondContact O-N 2.95Å; K99-I124 HydrophobicContact CD-CG2 4.46Å; K99-I124 VanDerWaalsContact CE-CG2 3.41Å; K99-I124 HydrophobicContact CG-CG2 4.31Å; L100-I124 CarbonylContact O-C 3.58Å; L100-I124 WeakPolarHBondContact O-CA 3.33Å
125	F	98.9	Very high	97.5	Very high	8 Å²	8	56.3 Å²	56.3	4%	0.035	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134.4	175.1	-72.6	-87.8	0	0	0	110.7	Y52 T53 F62 I82 W85 K99 L100 I102 L123 V127	Y52-F125 HydrophobicContact CD2-CD1 4.11Å; Y52-F125 HydrophobicContact CD2-CE1 4.11Å; Y52-F125 HydrophobicContact CE2-CE1 4.46Å; T53-F125 WeakPolarHBondContact O-CA 3.42Å; F62-F125 AromaticContact CE2-CE1 3.96Å; F62-F125 HydrophobicContact CE2-CE1 3.96Å; F62-F125 AromaticContact CE2-CZ 3.83Å; F62-F125 HydrophobicContact CE2-CZ 3.83Å; F62-F125 AromaticContact CZ-CE1 3.85Å; F62-F125 HydrophobicContact CZ-CE1 3.85Å; F62-F125 HydrophobicContact CZ-CE2 4.07Å; F62-F125 AromaticContact CZ-CZ 3.52Å; F62-F125 HydrophobicContact CZ-CZ 3.52Å; I82-F125 HydrophobicContact CD1-CE2 3.86Å; I82-F125 HydrophobicContact CD1-CZ 4.3Å; W85-F125 AromaticContact CZ2-CD1 3.65Å; W85-F125 HydrophobicContact CZ2-CD1 3.65Å; W85-F125 AromaticContact CZ2-CE1 3.82Å; W85-F125 HydrophobicContact CZ2-CE1 3.82Å; W85-F125 HydrophobicContact CZ2-CG 4.23Å; W85-F125 AromaticContact NE1-CD1 3.73Å; W85-F125 AromaticContact NE1-CD2 3.51Å; W85-F125 AromaticContact NE1-CE1 3.8Å; W85-F125 AromaticContact NE1-CE2 3.57Å; W85-F125 AromaticContact NE1-CG 3.57Å; W85-F125 AromaticContact NE1-CZ 3.7Å; K99-F125 CarbonylContact C-O 3.52Å; K99-F125 VanDerWaalsContact CA-O 3.23Å; K99-F125 WeakPolarHBondContact CA-O 3.38Å; L100-F125 HydrophobicContact CB-CB 4.34Å; L100-F125 PolarHBondContact N-O 2.94Å; L100-F125 PolarHBondContact O-N 2.91Å; I102-F125 HydrophobicContact CD1-CD2 3.57Å; I102-F125 HydrophobicContact CD1-CE2 3.91Å; I102-F125 HydrophobicContact CG1-CD2 4.35Å; L123-F125 HydrophobicContact CB-CD2 4.08Å; L123-F125 HydrophobicContact CB-CE2 3.64Å; L123-F125 HydrophobicContact CD1-CE2 3.84Å; L123-F125 HydrophobicContact CD1-CZ 4.37Å; L123-F125 HydrophobicContact CG-CE2 4.39Å; F125-V127 HydrophobicContact CB-CG1 4.07Å
126	E	98.8	Very high	96.6	Very high	96 Å²	96	54.7 Å²	54.7	45%	0.449	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	127.1	157.6	-64.2	-166.3	166.8	0	0	107.9	Y52 T53 R98 K99	Y52-E126 CarbonylContact C-O 3.46Å; Y52-E126 WeakPolarHBondContact CA-O 3.35Å; T53-E126 PolarHBondContact N-O 3.19Å; T53-E126 PolarHBondContact O-N 2.7Å; R98-E126 CarbonylContact O-C 3.59Å; R98-E126 WeakPolarHBondContact O-CA 3.37Å; K99-E126 HydrophobicContact CG-CG 4.44Å
127	V	98.8	Very high	94.8	Very high	5 Å²	5	55.8 Å²	55.8	3%	0.03	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	149.2	-173.3	-58.1	0	0	0	0	110.9	M50 H51 W85 L89 M92 K97 R98 F125	M50-V127 HydrophobicContact CE-CB 3.73Å; M50-V127 HydrophobicContact CE-CG2 3.89Å; H51-V127 CarbonylContact O-C 3.6Å; H51-V127 VanDerWaalsContact O-CA 3.31Å; H51-V127 WeakPolarHBondContact O-CA 3.45Å; W85-V127 HydrophobicContact CH2-CG1 4.31Å; W85-V127 HydrophobicContact CZ2-CG1 4.06Å; L89-V127 HydrophobicContact CD2-CG2 3.79Å; M92-V127 HydrophobicContact CE-CG2 4.36Å; K97-V127 CarbonylContact C-O 3.52Å; K97-V127 WeakPolarHBondContact CA-O 3.16Å; R98-V127 HydrophobicContact CB-CG2 3.79Å; R98-V127 PolarHBondContact N-O 2.8Å; R98-V127 PolarHBondContact O-N 2.79Å; F125-V127 HydrophobicContact CB-CG1 4.07Å
128	E	98.8	Very high	92.3	Very high	41 Å²	41	66.9 Å²	66.9	19%	0.192	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	122.3	172.2	180	166.3	-150.4	0	0	108.7	M50 H51 E96 K97 L130	M50-E128 VanDerWaalsContact CA-O 3.32Å; M50-E128 WeakPolarHBondContact CA-O 3.47Å; H51-E128 HydrophobicContact CB-CB 4.35Å; H51-E128 PolarHBondContact N-O 2.87Å; H51-E128 PolarHBondContact O-N 2.77Å; E96-E128 WeakPolarHBondContact O-CA 3.47Å; K97-E128 WeakPolarHBondContact CE-OE1 3.33Å; K97-E128 WeakPolarHBondContact CE-OE2 3.4Å; K97-E128 HydrophobicContact CG-CB 4Å; K97-E128 HydrophobicContact CG-CG 4.04Å; K97-E128 IonicContact NZ-OE1 3.49Å; K97-E128 PolarHBondContact NZ-OE1 3.5Å; K97-E128 IonicContact NZ-OE2 2.77Å; K97-E128 PolarHBondContact NZ-OE2 2.87Å; E128-L130 HydrophobicContact CG-CD2 3.98Å
129	L	98.8	Very high	92	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	121.9	175	-179.7	56	0	0	0	109.1	L48 M50 M92 G95 E96 S131 I132	L48-L129 HydrophobicContact CB-CD1 4.01Å; L48-L129 HydrophobicContact CD1-CD1 4.3Å; L48-L129 HydrophobicContact CD2-CD1 4.07Å; L48-L129 HydrophobicContact CG-CD1 4.35Å; M50-L129 HydrophobicContact CE-CB 4.05Å; M50-L129 HydrophobicContact CE-CD1 4.45Å; M50-L129 HydrophobicContact CG-CD1 3.86Å; M50-L129 HydrophobicContact SD-CD1 4.39Å; M92-L129 HydrophobicContact CB-CD2 3.53Å; M92-L129 HydrophobicContact CE-CB 3.78Å; G95-L129 WeakPolarHBondContact CA-O 3.29Å; G95-L129 PolarHBondContact N-O 2.82Å; E96-L129 PolarHBondContact O-N 3.06Å; E96-L129 VanDerWaalsContact O-N 3.08Å; L129-S131 WeakPolarHBondContact CD1-O 3.35Å; L129-I132 HydrophobicContact CD1-CG1 4.46Å; L129-I132 HydrophobicContact CD2-CD1 3.96Å; L129-I132 HydrophobicContact CD2-CG1 3.8Å; L129-I132 HydrophobicContact CG-CG1 4.4Å
130	L	98.4	Very high	91.7	Very high	60 Å²	60	67.9 Å²	67.9	31%	0.314	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-46.7	-179.1	-54.1	179.9	0	0	0	111.4	N49 P71 E128	N49-L130 WeakPolarHBondContact O-CA 3.49Å; N49-L130 WeakPolarHBondContact O-CB 3.25Å; N49-L130 PolarHBondContact O-N 2.76Å; P71-L130 HydrophobicContact CB-CD1 3.76Å; P71-L130 HydrophobicContact CG-CD1 3.53Å; E128-L130 HydrophobicContact CG-CD2 3.98Å
131	S	98.1	Very high	91.4	Very high	31 Å²	31	69.4 Å²	69.4	22%	0.217	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	155.9	178	66.2	0	0	0	0	113.2	N49 E94 L129	N49-S131 VanDerWaalsContact CB-OG 3.25Å; N49-S131 WeakPolarHBondContact CB-OG 2.82Å; N49-S131 PolarHBondContact N-O 3.13Å; N49-S131 VanDerWaalsContact N-O 3.12Å; N49-S131 PolarHBondContact O-N 3.12Å; E94-S131 WeakPolarHBondContact OE1-CA 3.35Å; L129-S131 WeakPolarHBondContact CD1-O 3.35Å
132	I	98.3	Very high	91	Very high	15 Å²	15	72.5 Å²	72.5	8%	0.077	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	109.3	172.4	-56.9	171.5	0	0	0	108.1	I40 D46 L48 E94 L129	I40-I132 HydrophobicContact CB-CD1 4.47Å; I40-I132 HydrophobicContact CG2-CB 4.37Å; I40-I132 HydrophobicContact CG2-CD1 3.88Å; I40-I132 HydrophobicContact CG2-CG2 4.08Å; D46-I132 HydrophobicContact CB-CG2 3.86Å; D46-I132 WeakPolarHBondContact OD2-CG2 3.13Å; L48-I132 HydrophobicContact CD2-CB 4.41Å; L48-I132 HydrophobicContact CD2-CG1 3.98Å; L48-I132 HydrophobicContact CD2-CG2 4.23Å; E94-I132 HydrophobicContact CG-CD1 4.18Å; E94-I132 HydrophobicContact CG-CG1 3.94Å; E94-I132 PolarHBondContact OE1-N 3.36Å; L129-I132 HydrophobicContact CD1-CG1 4.46Å; L129-I132 HydrophobicContact CD2-CD1 3.96Å; L129-I132 HydrophobicContact CD2-CG1 3.8Å; L129-I132 HydrophobicContact CG-CG1 4.4Å
133	E	97.2	Very high	90.5	Very high	112 Å²	112	76.4 Å²	76.4	52%	0.523	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	108.7	171.3	-74.8	174.4	-134.7	0	0	109.4	V47	V47-E133 HydrophobicContact CB-CB 3.93Å; V47-E133 HydrophobicContact CG1-CB 4.36Å; V47-E133 PolarHBondContact N-O 3.1Å; V47-E133 PolarHBondContact O-N 2.92Å
134	R	94.8	Very high	89.9	Confident	88 Å²	88	81.5 Å²	81.5	33%	0.332	40%	0.402	S	S	.	.			trans	-110.2	117.1	176.1	-178.7	174.6	-65.5	153.8	9.3	108.7	K41 D46 S136	K41-R134 PolarHBondContact O-NH2 3.41Å; D46-R134 IonicContact OD1-CZ 3.79Å; D46-R134 IonicContact OD1-NE 3.48Å; D46-R134 PolarHBondContact OD1-NE 3.26Å; D46-R134 IonicContact OD1-NH2 2.71Å; D46-R134 PolarHBondContact OD1-NH2 3Å; D46-R134 IonicContact OD2-CZ 2.91Å; D46-R134 IonicContact OD2-NE 3.27Å; D46-R134 IonicContact OD2-NH2 3.33Å; D46-R134 PolarHBondContact OD2-NH2 3.19Å; R134-S136 PolarHBondContact O-N 3.13Å; R134-S136 VanDerWaalsContact O-N 3.13Å
135	R	85.6	Confident	89.3	Confident	237 Å²	237	84.8 Å²	84.8	89%	0.894	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-64.1	117.5	163.1	-83.1	-153.9	-91.1	172.7	-7.9	107.9
136	S	77.6	Confident	88.6	Confident	99 Å²	99	90.7 Å²	90.7	69%	0.692	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-65.1	127	163.3	48.5	0	0	0	0	107.5	R134 L138	R134-S136 PolarHBondContact O-N 3.13Å; R134-S136 VanDerWaalsContact O-N 3.13Å; S136-L138 PolarHBondContact O-N 3.22Å
137	D	60.8	Low	87.7	Confident	152 Å²	152	90.3 Å²	90.3	81%	0.813	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-55.8	123.8	167.6	-56.6	-46.8	0	0	0	107.3
138	L	45.4	Very low	86.7	Confident	243 Å²	243	98 Å²	98	100%	1.272	48%	0.484	S	S	*	.			trans	-66.9	0	172.8	-75	168.7	0	0	0	110.3	S136	S136-L138 PolarHBondContact O-N 3.22Å

Retrieved 138 of 138 residues in 76.4 ms (Link to these results)

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