A0A096NLL8_PAPAN Loading...

CSD domain-containing protein

AlphaFold DB (G7NPL7), UniProt , Accession A0A096NLL8, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 147 aa.

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(Predicted Aligned Error values between residue pairs)

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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	53.4	Low	63.5	Low	237 Å²	237	142 Å²	142	100%	1.167	84%	0.839	S	S	*	*				0	94.7	0	-63.7	167	174.5	0	0	105.6
2	S	56.2	Low	62.5	Low	133 Å²	133	138.8 Å²	138.8	93%	0.93	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-76.2	125.5	-169.5	-59.4	0	0	0	0	110.4
3	S	59.9	Low	61.8	Low	119 Å²	119	139.1 Å²	139.1	83%	0.832	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-87.9	130.5	178.8	-53.6	0	0	0	0	110.4
4	E	67.1	Low	60.6	Low	184 Å²	184	141.4 Å²	141.4	86%	0.86	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-78.3	143.5	175.5	-166.8	169.9	91.8	0	0	110.9
5	P	72.1	Confident	59.7	Low	108 Å²	108	144.3 Å²	144.3	70%	0.701	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-81	153.9	178	31.3	-33.6	0	0	0	113.1
6	P	70.4	Confident	58.4	Low	118 Å²	118	141.6 Å²	141.6	77%	0.766	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-76.7	158.4	-174.9	31	-35.3	0	0	0	114
7	P	70.3	Confident	57.7	Low	121 Å²	121	139.5 Å²	139.5	79%	0.786	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-73.7	158.4	-179.4	30.2	-35.3	0	0	0	113.5
8	P	70.7	Confident	57	Low	115 Å²	115	139.9 Å²	139.9	75%	0.747	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-75.8	157.2	-177.5	30.7	-34.8	0	0	0	113.5
9	P	63	Low	56.1	Low	129 Å²	129	136.3 Å²	136.3	84%	0.838	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-75.2	142.7	-175.4	29.8	-33.7	0	0	0	113
10	Q	59.3	Low	55.5	Low	185 Å²	185	138.2 Å²	138.2	86%	0.864	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-81.9	147.7	173.9	-65.7	-174.4	-27.4	0	0	111.6
11	P	56.1	Low	54.9	Low	113 Å²	113	139.2 Å²	139.2	73%	0.734	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-73.2	153.2	-179.9	29.4	-33.5	0	0	0	112.7	T13	P11-T13 PolarHBondContact O-N 3.17Å
12	P	51.1	Low	54.3	Low	104 Å²	104	135 Å²	135	68%	0.675	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-73.7	125.1	-174	28.6	-33.1	0	0	0	112.2	H14	P12-H14 PolarHBondContact O-N 3.02Å
13	T	53.8	Low	53.9	Low	142 Å²	142	133 Å²	133	87%	0.871	79%	0.792	S	S	*	*			trans	-70.3	102.6	163.2	41.7	0	0	0	0	109.6	P11 Q15	P11-T13 PolarHBondContact O-N 3.17Å; T13-Q15 PolarHBondContact O-N 2.96Å
14	H	44.8	Very low	53	Low	171 Å²	171	132.3 Å²	132.3	79%	0.792	78%	0.784	S	S	*	*			trans	-79.6	106.5	168.1	-89.5	-92.6	0	0	0	110.1	P12	P12-H14 PolarHBondContact O-N 3.02Å
15	Q	47	Very low	52	Low	185 Å²	185	134.7 Å²	134.7	86%	0.864	79%	0.786	S	S	*	*			trans	-59.9	129.9	151.5	-87.9	-179	-68	0	0	109	T13	T13-Q15 PolarHBondContact O-N 2.96Å
16	A	39.4	Very low	50.8	Low	102 Å²	102	134.9 Å²	134.9	84%	0.843	79%	0.785	S	S	*	*			trans	-126.5	103	160.1	0	0	0	0	0	108.2
17	S	47	Very low	49.7	Very low	106 Å²	106	139.2 Å²	139.2	74%	0.741	79%	0.786	S	S	*	*			trans	-82.1	125.4	154	-72.4	0	0	0	0	107.3
18	V	43.5	Very low	48.6	Very low	147 Å²	147	140.7 Å²	140.7	89%	0.891	78%	0.782	S	S	*	*				173.7	131.2	129.7	-81.4	0	0	0	0	110.9
19	G	40.5	Very low	47.8	Very low	70 Å²	70	144.4 Å²	144.4	72%	0.722	78%	0.781	S	S	*	*			trans	95.3	121.2	131.8	0	0	0	0	0	118.9
20	L	44.6	Very low	47.4	Very low	174 Å²	174	142.4 Å²	142.4	91%	0.911	77%	0.771	S	S	*	*			trans	81.4	108.3	152	-70.9	137.7	0	0	0	117.6	D22	L20-D22 PolarHBondContact O-N 3.49Å
21	L	42.1	Very low	46.7	Very low	160 Å²	160	138.6 Å²	138.6	84%	0.838	76%	0.762	S	S	*	*			trans	-49.6	103.5	157	-64.3	119.3	0	0	0	109.7	T23	L21-T23 HydrophobicContact CB-CG2 4.47Å; L21-T23 PolarHBondContact O-N 2.93Å
22	D	41.8	Very low	46.6	Very low	150 Å²	150	136.4 Å²	136.4	80%	0.802	75%	0.749	S	S	*	*			trans	-78.3	73.9	156	-158.9	-99.1	0	0	0	107.1	L20	L20-D22 PolarHBondContact O-N 3.49Å
23	T	48.1	Very low	46.7	Very low	89 Å²	89	136.6 Å²	136.6	55%	0.546	75%	0.751	S	S	.	*			trans	-52.7	127.1	152.1	48.5	0	0	0	0	105.6	L21 R25	L21-T23 HydrophobicContact CB-CG2 4.47Å; L21-T23 PolarHBondContact O-N 2.93Å; T23-R25 VanDerWaalsContact C-N 3.3Å; T23-R25 PolarHBondContact O-N 3.13Å
24	P	41.4	Very low	46.7	Very low	105 Å²	105	132.6 Å²	132.6	68%	0.682	72%	0.724	S	S	*	*			trans	-57.7	108.4	169.2	23.2	-29.2	0	0	0	104.5	T26	P24-T26 PolarHBondContact O-N 2.79Å
25	R	44.1	Very low	47.1	Very low	235 Å²	235	133.4 Å²	133.4	89%	0.887	72%	0.72	S	S	*	*			trans	-59.6	91	167.7	-98.3	-166.1	154.7	177.6	-3.8	103.9	T23 R27	T23-R25 VanDerWaalsContact C-N 3.3Å; T23-R25 PolarHBondContact O-N 3.13Å; R25-R27 PolarHBondContact O-N 2.84Å
26	T	48	Very low	47.9	Very low	111 Å²	111	128 Å²	128	68%	0.681	71%	0.713	S	S	*	*			trans	-57.7	91.7	160.6	-60.3	0	0	0	0	101.5	P24 E28	P24-T26 PolarHBondContact O-N 2.79Å; T26-E28 VanDerWaalsContact C-N 3.26Å; T26-E28 PolarHBondContact O-N 2.84Å
27	R	47.7	Very low	49.7	Very low	209 Å²	209	124.5 Å²	124.5	79%	0.789	68%	0.68	S	S	*	*			trans	-48.5	110	168.9	-179.6	171.5	179.6	169.3	0.5	102	R25 R29	R25-R27 PolarHBondContact O-N 2.84Å; R27-R29 WeakPolarHBondContact O-CB 3.36Å; R27-R29 PolarHBondContact O-N 2.92Å
28	E	46.9	Very low	51.2	Low	153 Å²	153	124.6 Å²	124.6	72%	0.715	68%	0.676	S	S	*	*			trans	-62.5	79.6	176.3	-134.6	-73.6	86	0	0	103.7	T26 S30	T26-E28 VanDerWaalsContact C-N 3.26Å; T26-E28 PolarHBondContact O-N 2.84Å; E28-S30 PolarHBondContact O-N 2.8Å; E28-S30 VanDerWaalsContact O-N 3.08Å
29	R	54.3	Low	53.2	Low	192 Å²	192	119.7 Å²	119.7	73%	0.725	65%	0.647	S	S	*	*			trans	-77.8	105.1	-172.9	-158.3	176.7	-152.9	-134.2	4.8	100.7	R27	R27-R29 WeakPolarHBondContact O-CB 3.36Å; R27-R29 PolarHBondContact O-N 2.92Å
30	S	53.9	Low	55.3	Low	87 Å²	87	116.5 Å²	116.5	61%	0.608	61%	0.613	S	S	*	*			trans	-23.9	131.5	-172.1	-50.1	0	0	0	0	112.3	E28 S32	E28-S30 PolarHBondContact O-N 2.8Å; E28-S30 VanDerWaalsContact O-N 3.08Å; S30-S32 PolarHBondContact O-N 2.79Å; S30-S32 PolarHBondContact O-OG 2.72Å
31	P	45.6	Very low	57.2	Low	106 Å²	106	113.8 Å²	113.8	69%	0.688	61%	0.609	S	S	*	*			trans	-63.1	87	-175.9	27.3	-34.2	0	0	0	108.9
32	S	52.1	Low	59.2	Low	66 Å²	66	111.8 Å²	111.8	46%	0.462	61%	0.605	S	S	.	*			trans	-76.9	128.4	174.7	-57.8	0	0	0	0	105.3	S30 L34 R35	S30-S32 PolarHBondContact O-N 2.79Å; S30-S32 PolarHBondContact O-OG 2.72Å; S32-L34 PolarHBondContact O-N 3.19Å; S32-R35 PolarHBondContact O-N 3.44Å
33	P	53.9	Low	61.2	Low	109 Å²	109	108 Å²	108	71%	0.708	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-9.3	176.3	-25.9	33.8	0	0	0	114.4
34	L	54.5	Low	63.2	Low	58 Å²	58	104.5 Å²	104.5	30%	0.304	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.8	3.2	178.8	-56.8	174.6	0	0	0	114.7	S32 G36 N37 F78	S32-L34 PolarHBondContact O-N 3.19Å; L34-G36 PolarHBondContact O-N 3.39Å; L34-N37 PolarHBondContact O-N 3Å; L34-N37 VanDerWaalsContact O-N 3.1Å; L34-F78 HydrophobicContact CD2-CD2 4.41Å; L34-F78 HydrophobicContact CD2-CE2 4.44Å
35	R	53	Low	65.8	Low	188 Å²	188	101 Å²	101	71%	0.709	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	110.6	-177.9	-111.1	-163.6	179.3	-135.6	5.4	110.5	S32	S32-R35 PolarHBondContact O-N 3.44Å
36	G	63.9	Low	68.2	Low	70 Å²	70	96.1 Å²	96.1	72%	0.722	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.9	-20.8	178.6	0	0	0	0	0	114.7	L34 V38	L34-G36 PolarHBondContact O-N 3.39Å; G36-V38 PolarHBondContact O-N 2.98Å
37	N	76.6	Confident	70.4	Confident	30 Å²	30	102.5 Å²	102.5	16%	0.16	53%	0.533	C	S	.	.			trans	-96.1	100.4	-173.3	-70.3	-14.4	0	0	0	111.4	L34 V39 F78 D87	L34-N37 PolarHBondContact O-N 3Å; L34-N37 VanDerWaalsContact O-N 3.1Å; N37-V39 PolarHBondContact O-N 3.37Å; N37-F78 HydrophobicContact CB-CD1 3.96Å; N37-F78 HydrophobicContact CB-CD2 3.83Å; N37-F78 HydrophobicContact CB-CE1 3.74Å; N37-F78 HydrophobicContact CB-CE2 3.61Å; N37-F78 HydrophobicContact CB-CG 4.01Å; N37-F78 HydrophobicContact CB-CZ 3.57Å; N37-D87 PolarHBondContact ND2-OD2 3.12Å; N37-D87 PolarHBondContact OD1-OD2 2.89Å; N37-D87 VanDerWaalsContact OD1-OD2 3.07Å
38	V	79.7	Confident	72.7	Confident	107 Å²	107	97.1 Å²	97.1	65%	0.648	52%	0.524	S	S	*	.			trans	-85	101.4	-175.6	-169.5	0	0	0	0	110.9	G36 K120	G36-V38 PolarHBondContact O-N 2.98Å; V38-K120 VanDerWaalsContact CG1-NZ 3.26Å; V38-K120 PolarHBondContact O-NZ 3.12Å
39	V	84.8	Confident	74.9	Confident	45 Å²	45	91.3 Å²	91.3	27%	0.273	50%	0.495	S	S	.	.			trans	-49.3	131.4	171.4	-177.4	0	0	0	0	110.7	N37 L43 F78 F89 K120	N37-V39 PolarHBondContact O-N 3.37Å; V39-L43 HydrophobicContact CG1-CD2 3.33Å; V39-L43 HydrophobicContact CG1-CG 4.29Å; V39-F78 HydrophobicContact CG2-CE2 4.29Å; V39-F78 HydrophobicContact CG2-CZ 4.15Å; V39-F89 HydrophobicContact CG1-CE2 4.08Å; V39-K120 PolarHBondContact O-NZ 2.9Å; V39-K120 VanDerWaalsContact O-NZ 3.16Å
40	P	83.9	Confident	76.9	Confident	3 Å²	3	85.4 Å²	85.4	2%	0.019	48%	0.481	C	S	.	.			trans	-71.3	147.8	178.6	28.8	-34.1	0	0	0	112.2	L43 P44 F89 I114 K120	P40-L43 HydrophobicContact CG-CD2 4.27Å; P40-L43 WeakPolarHBondContact O-CD2 3.26Å; P40-P44 HydrophobicContact CG-CG 4.21Å; P40-F89 VanDerWaalsContact CD-CD2 3.46Å; P40-F89 HydrophobicContact CG-CB 4.49Å; P40-F89 HydrophobicContact CG-CD1 3.58Å; P40-F89 HydrophobicContact CG-CD2 4.12Å; P40-F89 HydrophobicContact CG-CE1 3.76Å; P40-F89 HydrophobicContact CG-CE2 4.28Å; P40-F89 HydrophobicContact CG-CG 3.79Å; P40-F89 HydrophobicContact CG-CZ 4.14Å; P40-I114 HydrophobicContact CB-CD1 3.7Å; P40-I114 HydrophobicContact CG-CD1 3.77Å; P40-K120 HydrophobicContact CB-CD 3.91Å
41	S	84.7	Confident	78.9	Confident	117 Å²	117	89.5 Å²	89.5	82%	0.818	49%	0.488	S	S	*	.	S	Bend	trans	-131.8	125.1	174.6	-65.4	0	0	0	0	109.4
42	P	84.6	Confident	81.2	Confident	117 Å²	117	87.8 Å²	87.8	76%	0.76	48%	0.478	S	S	*	.	S	Bend	cis	-64.4	154.4	-7.5	30.3	-35.3	0	0	0	111.6	P44	P42-P44 WeakPolarHBondContact O-CD 3.5Å
43	L	83.8	Confident	83.3	Confident	70 Å²	70	84.7 Å²	84.7	37%	0.366	46%	0.457	S	S	.	.			trans	-67.1	111.4	176.3	-80	170.8	0	0	0	109.9	V39 P40 T45 F89	V39-L43 HydrophobicContact CG1-CD2 3.33Å; V39-L43 HydrophobicContact CG1-CG 4.29Å; P40-L43 HydrophobicContact CG-CD2 4.27Å; P40-L43 WeakPolarHBondContact O-CD2 3.26Å; L43-T45 PolarHBondContact O-N 3.46Å; L43-F89 HydrophobicContact CD2-CE1 4.1Å; L43-F89 HydrophobicContact CD2-CE2 3.99Å; L43-F89 HydrophobicContact CD2-CZ 3.4Å
44	P	89.6	Confident	85.3	Confident	17 Å²	17	82 Å²	82	11%	0.11	44%	0.438	C	S	.	.			trans	-75.6	126.4	178.6	29.8	-28.8	0	0	0	109.7	P40 P42 F89 I114 Q122	P40-P44 HydrophobicContact CG-CG 4.21Å; P42-P44 WeakPolarHBondContact O-CD 3.5Å; P44-F89 HydrophobicContact CG-CE1 4.5Å; P44-I114 HydrophobicContact CB-CG2 4.35Å; P44-I114 HydrophobicContact CG-CD1 3.68Å; P44-I114 HydrophobicContact CG-CG1 3.84Å; P44-I114 HydrophobicContact CG-CG2 3.93Å; P44-Q122 VanDerWaalsContact CB-OE1 3.25Å; P44-Q122 PolarHBondContact O-NE2 2.91Å
45	T	95.6	Very high	87.4	Confident	31 Å²	31	81.3 Å²	81.3	19%	0.19	44%	0.437	C	S	.	.			trans	-114.7	165.1	177.2	76.7	0	0	0	0	109.4	L43 R47 T48 R49 H91	L43-T45 PolarHBondContact O-N 3.46Å; T45-R47 PolarHBondContact O-N 3.42Å; T45-R47 PolarHBondContact OG1-N 3.27Å; T45-T48 PolarHBondContact N-OG1 2.81Å; T45-T48 PolarHBondContact O-N 3.12Å; T45-T48 VanDerWaalsContact O-N 3.1Å; T45-T48 PolarHBondContact O-OG1 3.34Å; T45-T48 PolarHBondContact OG1-N 3.35Å; T45-T48 PolarHBondContact OG1-OG1 3.41Å; T45-R49 WeakPolarHBondContact O-CB 3.07Å; T45-R49 PolarHBondContact O-N 2.9Å; T45-H91 WeakPolarHBondContact CG2-CE1 3.46Å
46	R	95.9	Very high	89.5	Confident	133 Å²	133	79.1 Å²	79.1	50%	0.502	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-38.5	176.5	-173.5	177	176.7	170.3	8.7	113	S93 E96	R46-S93 WeakPolarHBondContact CB-O 3.38Å; R46-S93 WeakPolarHBondContact CD-O 3.27Å; R46-S93 PolarHBondContact N-OG 3.42Å; R46-E96 IonicContact CZ-OE1 3.87Å; R46-E96 IonicContact NH1-OE1 3.56Å; R46-E96 PolarHBondContact NH1-OE1 2.84Å; R46-E96 IonicContact NH1-OE2 3.93Å; R46-E96 IonicContact NH2-OE1 3.25Å
47	R	94.3	Very high	91.1	Very high	244 Å²	244	76 Å²	76	92%	0.921	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-22.7	-179.3	-67.2	-175.3	-179.2	166.9	1	113.9	T45	T45-R47 PolarHBondContact O-N 3.42Å; T45-R47 PolarHBondContact OG1-N 3.27Å
48	T	94.2	Very high	92	Very high	96 Å²	96	76.8 Å²	76.8	59%	0.589	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-7.7	-177.2	57.6	0	0	0	0	113.2	T45	T45-T48 PolarHBondContact N-OG1 2.81Å; T45-T48 PolarHBondContact O-N 3.12Å; T45-T48 VanDerWaalsContact O-N 3.1Å; T45-T48 PolarHBondContact O-OG1 3.34Å; T45-T48 PolarHBondContact OG1-N 3.35Å; T45-T48 PolarHBondContact OG1-OG1 3.41Å
49	R	95	Very high	92.9	Very high	32 Å²	32	79 Å²	79	12%	0.121	41%	0.407	C	S	.	.	S	Bend	trans	-65.8	137.8	173.5	-171.6	177.5	-59.2	113.4	13	110.6	T45 A53 T54 D94 Q122	T45-R49 WeakPolarHBondContact O-CB 3.07Å; T45-R49 PolarHBondContact O-N 2.9Å; R49-A53 HydrophobicContact CG-CB 3.9Å; R49-T54 WeakPolarHBondContact CD-OG1 3.42Å; R49-D94 IonicContact CZ-OD1 3.73Å; R49-D94 VanDerWaalsContact CZ-OD1 3.25Å; R49-D94 IonicContact CZ-OD2 2.74Å; R49-D94 IonicContact NH1-OD1 2.75Å; R49-D94 PolarHBondContact NH1-OD1 3.48Å; R49-D94 IonicContact NH2-OD1 2.87Å; R49-D94 PolarHBondContact NH2-OD1 2.91Å; R49-D94 IonicContact NH2-OD2 2.82Å; R49-D94 PolarHBondContact NH2-OD2 3.49Å; R49-Q122 VanDerWaalsContact NH2-CD 3.25Å
50	T	94.9	Very high	93.5	Very high	68 Å²	68	78.1 Å²	78.1	42%	0.417	41%	0.406	S	S	.	.			trans	-64.6	149.9	177.3	66.5	0	0	0	0	111	S52 A53 T54	T50-S52 VanDerWaalsContact C-N 3.32Å; T50-S52 PolarHBondContact O-N 2.88Å; T50-A53 PolarHBondContact O-N 2.8Å; T50-A53 VanDerWaalsContact OG1-CB 3.24Å; T50-A53 WeakPolarHBondContact OG1-CB 3.4Å; T50-A53 PolarHBondContact OG1-N 2.74Å; T50-T54 PolarHBondContact O-N 2.99Å; T50-T54 PolarHBondContact O-OG1 2.92Å
51	F	95.4	Very high	94.2	Very high	173 Å²	173	81.9 Å²	81.9	76%	0.759	43%	0.431	S	S	*	.	H	α-helix	trans	-54.8	-47.6	177.8	176.2	-100.1	0	0	0	111.9	A53 T54 V55	F51-A53 VanDerWaalsContact C-N 3.34Å; F51-A53 PolarHBondContact O-N 3.17Å; F51-T54 WeakPolarHBondContact O-CB 3.45Å; F51-T54 PolarHBondContact O-N 2.84Å; F51-T54 VanDerWaalsContact O-N 3.16Å; F51-V55 HydrophobicContact CD1-CG2 4.15Å; F51-V55 HydrophobicContact CD2-CG2 4.32Å; F51-V55 HydrophobicContact CE1-CG2 3.7Å; F51-V55 HydrophobicContact CE2-CG2 3.89Å; F51-V55 HydrophobicContact CG-CG2 4.45Å; F51-V55 HydrophobicContact CZ-CG2 3.56Å; F51-V55 WeakPolarHBondContact O-CG2 3.34Å; F51-V55 PolarHBondContact O-N 3.41Å
52	S	95.8	Very high	94.8	Very high	69 Å²	69	80.7 Å²	80.7	48%	0.483	42%	0.418	S	S	.	.	H	α-helix	trans	-65	-33.7	-179.8	58.5	0	0	0	0	113.6	T50 R56	T50-S52 VanDerWaalsContact C-N 3.32Å; T50-S52 PolarHBondContact O-N 2.88Å; S52-R56 WeakPolarHBondContact O-CB 3.48Å; S52-R56 VanDerWaalsContact O-CG 3.3Å; S52-R56 WeakPolarHBondContact O-CG 3.42Å; S52-R56 PolarHBondContact O-N 3.3Å; S52-R56 VanDerWaalsContact O-N 3.13Å; S52-R56 PolarHBondContact O-NE 3.13Å
53	A	95.8	Very high	95.5	Very high	1 Å²	1	78.6 Å²	78.6	1%	0.008	40%	0.396	C	S	.	.	H	α-helix	trans	-68.2	-42.1	173.4	0	0	0	0	0	111.1	R49 T50 F51 A57	R49-A53 HydrophobicContact CG-CB 3.9Å; T50-A53 PolarHBondContact O-N 2.8Å; T50-A53 VanDerWaalsContact OG1-CB 3.24Å; T50-A53 WeakPolarHBondContact OG1-CB 3.4Å; T50-A53 PolarHBondContact OG1-N 2.74Å; F51-A53 VanDerWaalsContact C-N 3.34Å; F51-A53 PolarHBondContact O-N 3.17Å; A53-A57 WeakPolarHBondContact O-CB 3.47Å; A53-A57 PolarHBondContact O-N 3.1Å
54	T	96.1	Very high	96.2	Very high	53 Å²	53	82.2 Å²	82.2	33%	0.325	41%	0.409	S	S	.	.	H	α-helix	trans	-60.3	-49.5	176.1	-53.8	0	0	0	0	111.4	R49 T50 F51 R56 A57 S58	R49-T54 WeakPolarHBondContact CD-OG1 3.42Å; T50-T54 PolarHBondContact O-N 2.99Å; T50-T54 PolarHBondContact O-OG1 2.92Å; F51-T54 WeakPolarHBondContact O-CB 3.45Å; F51-T54 PolarHBondContact O-N 2.84Å; F51-T54 VanDerWaalsContact O-N 3.16Å; T54-R56 PolarHBondContact O-N 3.21Å; T54-A57 PolarHBondContact O-N 3.26Å; T54-S58 WeakPolarHBondContact O-CB 3.29Å; T54-S58 PolarHBondContact O-N 3.21Å; T54-S58 PolarHBondContact O-OG 3.46Å
55	V	97.5	Very high	96.6	Very high	44 Å²	44	81.6 Å²	81.6	27%	0.267	41%	0.406	S	S	.	.	H	α-helix	trans	-60.9	-48.6	179.8	173	0	0	0	0	111.3	F51 A57 S58 Q59	F51-V55 HydrophobicContact CD1-CG2 4.15Å; F51-V55 HydrophobicContact CD2-CG2 4.32Å; F51-V55 HydrophobicContact CE1-CG2 3.7Å; F51-V55 HydrophobicContact CE2-CG2 3.89Å; F51-V55 HydrophobicContact CG-CG2 4.45Å; F51-V55 HydrophobicContact CZ-CG2 3.56Å; F51-V55 WeakPolarHBondContact O-CG2 3.34Å; F51-V55 PolarHBondContact O-N 3.41Å; V55-A57 PolarHBondContact O-N 3.37Å; V55-S58 PolarHBondContact O-N 2.8Å; V55-S58 PolarHBondContact O-OG 3.19Å; V55-Q59 WeakPolarHBondContact O-CG 3.42Å; V55-Q59 PolarHBondContact O-N 2.76Å; V55-Q59 VanDerWaalsContact O-N 3.12Å
56	R	96.9	Very high	96.8	Very high	141 Å²	141	83 Å²	83	53%	0.532	41%	0.414	S	S	.	.	H	α-helix	trans	-60.8	-44.4	178.8	-73.1	-175.5	-60.7	154.8	3	112.3	S52 T54 Q59 G60	S52-R56 WeakPolarHBondContact O-CB 3.48Å; S52-R56 VanDerWaalsContact O-CG 3.3Å; S52-R56 WeakPolarHBondContact O-CG 3.42Å; S52-R56 PolarHBondContact O-N 3.3Å; S52-R56 VanDerWaalsContact O-N 3.13Å; S52-R56 PolarHBondContact O-NE 3.13Å; T54-R56 PolarHBondContact O-N 3.21Å; R56-Q59 PolarHBondContact O-N 2.89Å; R56-G60 PolarHBondContact O-N 2.79Å
57	A	97.2	Very high	96.9	Very high	6 Å²	6	76.7 Å²	76.7	5%	0.05	39%	0.39	C	S	.	.	H	α-helix	trans	-62.8	-44.1	177.4	0	0	0	0	0	111.1	A53 T54 V55 Q59 G60 K110 C112 V124	A53-A57 WeakPolarHBondContact O-CB 3.47Å; A53-A57 PolarHBondContact O-N 3.1Å; T54-A57 PolarHBondContact O-N 3.26Å; V55-A57 PolarHBondContact O-N 3.37Å; A57-Q59 VanDerWaalsContact C-N 3.26Å; A57-Q59 PolarHBondContact O-N 2.82Å; A57-G60 PolarHBondContact O-N 3.22Å; A57-K110 WeakPolarHBondContact O-CD 3.3Å; A57-C112 HydrophobicContact CB-CB 3.84Å; A57-V124 HydrophobicContact CB-CG2 3.78Å
58	S	97.3	Very high	97.1	Very high	45 Å²	45	68.9 Å²	68.9	32%	0.315	36%	0.363	S	S	.	.	H	α-helix	trans	-63.2	-28.5	-179.9	73.3	0	0	0	0	113.9	T54 V55 K110 E125	T54-S58 WeakPolarHBondContact O-CB 3.29Å; T54-S58 PolarHBondContact O-N 3.21Å; T54-S58 PolarHBondContact O-OG 3.46Å; V55-S58 PolarHBondContact O-N 2.8Å; V55-S58 PolarHBondContact O-OG 3.19Å; S58-K110 PolarHBondContact O-NZ 3.13Å; S58-E125 WeakPolarHBondContact CB-OE1 3.21Å
59	Q	97.9	Very high	97.2	Very high	155 Å²	155	65.1 Å²	65.1	72%	0.724	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-8.9	175.9	-67.1	172.8	0.9	0	0	112.9	V55 R56 A57	V55-Q59 WeakPolarHBondContact O-CG 3.42Å; V55-Q59 PolarHBondContact O-N 2.76Å; V55-Q59 VanDerWaalsContact O-N 3.12Å; R56-Q59 PolarHBondContact O-N 2.89Å; A57-Q59 VanDerWaalsContact C-N 3.26Å; A57-Q59 PolarHBondContact O-N 2.82Å
60	G	97.1	Very high	97.3	Very high	25 Å²	25	65.2 Å²	65.2	26%	0.258	34%	0.341	S	S	.	.	S	Bend	trans	-73.8	166.3	178.1	0	0	0	0	0	113.1	R56 A57	R56-G60 PolarHBondContact O-N 2.79Å; A57-G60 PolarHBondContact O-N 3.22Å
61	P	98.1	Very high	97.4	Very high	82 Å²	82	64.3 Å²	64.3	53%	0.532	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-65.8	157	175.9	29.5	-35.2	0	0	0	111.6	Y63	P61-Y63 HydrophobicContact CB-CE2 4.43Å; P61-Y63 HydrophobicContact CG-CE1 4.42Å; P61-Y63 HydrophobicContact CG-CE2 3.67Å; P61-Y63 VanDerWaalsContact CG-OH 3.26Å; P61-Y63 WeakPolarHBondContact CG-OH 3.49Å; P61-Y63 WeakPolarHBondContact O-CD2 3.46Å; P61-Y63 WeakPolarHBondContact O-CE2 3.47Å
62	V	98.5	Very high	97.4	Very high	92 Å²	92	61.1 Å²	61.1	56%	0.558	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-89.3	130.8	171.6	179.4	0	0	0	0	108.7	T108 K110	V62-T108 HydrophobicContact CG1-CG2 4.15Å; V62-K110 HydrophobicContact CG2-CG 4.33Å
63	Y	98.6	Very high	97.3	Very high	73 Å²	73	63.8 Å²	63.8	29%	0.286	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	161.2	177.5	-62	-86.4	0	0	0	110.7	P61 T108 Y109 M111	P61-Y63 HydrophobicContact CB-CE2 4.43Å; P61-Y63 HydrophobicContact CG-CE1 4.42Å; P61-Y63 HydrophobicContact CG-CE2 3.67Å; P61-Y63 VanDerWaalsContact CG-OH 3.26Å; P61-Y63 WeakPolarHBondContact CG-OH 3.49Å; P61-Y63 WeakPolarHBondContact O-CD2 3.46Å; P61-Y63 WeakPolarHBondContact O-CE2 3.47Å; Y63-T108 CarbonylContact O-C 3.52Å; Y63-T108 VanDerWaalsContact O-CA 3.22Å; Y63-T108 WeakPolarHBondContact O-CA 3.45Å; Y63-Y109 PolarHBondContact N-O 3.2Å; Y63-Y109 PolarHBondContact O-N 3.3Å; Y63-M111 HydrophobicContact CD1-CE 3.94Å; Y63-M111 HydrophobicContact CD2-CB 4.49Å; Y63-M111 HydrophobicContact CD2-CE 4.01Å; Y63-M111 HydrophobicContact CD2-CG 3.75Å; Y63-M111 HydrophobicContact CD2-SD 4.18Å; Y63-M111 HydrophobicContact CE1-CE 4.06Å; Y63-M111 HydrophobicContact CE1-SD 4.42Å; Y63-M111 HydrophobicContact CE2-CB 4.11Å; Y63-M111 HydrophobicContact CE2-CE 4.12Å; Y63-M111 HydrophobicContact CE2-CG 3.66Å; Y63-M111 HydrophobicContact CE2-SD 3.8Å; Y63-M111 HydrophobicContact CG-CE 3.9Å
64	K	98.8	Very high	97.3	Very high	147 Å²	147	69.8 Å²	69.8	64%	0.639	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	154	171	-66.7	-176.4	178.3	-174	0	110.5	A82 V107 T108	K64-A82 HydrophobicContact CB-CB 3.97Å; K64-A82 WeakPolarHBondContact O-CB 3.4Å; K64-A82 PolarHBondContact O-N 3.11Å; K64-V107 WeakPolarHBondContact CA-O 3.31Å; K64-T108 HydrophobicContact CG-CG2 4.14Å
65	G	98.6	Very high	97.3	Very high	4 Å²	4	67.8 Å²	67.8	4%	0.041	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	-176.4	173.5	0	0	0	0	0	111.8	T80 V107	G65-T80 CarbonylContact C-O 3.57Å; G65-T80 WeakPolarHBondContact CA-O 3.4Å; G65-V107 PolarHBondContact N-O 3.39Å; G65-V107 WeakPolarHBondContact O-CG2 3.41Å; G65-V107 PolarHBondContact O-N 3.27Å
66	V	98.7	Very high	97.3	Very high	60 Å²	60	66.8 Å²	66.8	36%	0.364	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	133.1	177.6	-178.8	0	0	0	0	108.8	K68 I79 T80 D105	V66-K68 PolarHBondContact O-N 3.37Å; V66-K68 VanDerWaalsContact O-N 3.08Å; V66-I79 CarbonylContact O-C 3.6Å; V66-I79 WeakPolarHBondContact O-CA 3.45Å; V66-T80 PolarHBondContact N-O 2.86Å; V66-T80 PolarHBondContact O-N 3.31Å; V66-D105 CarbonylContact C-O 3.56Å; V66-D105 VanDerWaalsContact CA-O 3.29Å; V66-D105 WeakPolarHBondContact CA-O 3.37Å
67	C	98.4	Very high	97.4	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	113.6	170.6	-177.4	0	0	0	0	108.6	V102 E103 G104 D105	C67-V102 WeakPolarHBondContact CB-O 3.2Å; C67-V102 PolarHBondContact SG-O 2.88Å; C67-E103 WeakPolarHBondContact O-CA 3.45Å; C67-G104 PolarHBondContact O-N 3.44Å; C67-D105 HydrophobicContact CB-CB 3.97Å; C67-D105 PolarHBondContact N-O 3.12Å
68	K	97.7	Very high	97.4	Very high	80 Å²	80	60.2 Å²	60.2	35%	0.348	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-40.9	-179.7	-178.3	177.7	-172.8	160	0	111.4	V66 F78 D87 E103	V66-K68 PolarHBondContact O-N 3.37Å; V66-K68 VanDerWaalsContact O-N 3.08Å; K68-F78 WeakPolarHBondContact CB-O 3.34Å; K68-F78 PolarHBondContact N-O 2.75Å; K68-D87 WeakPolarHBondContact CD-OD2 3.4Å; K68-D87 WeakPolarHBondContact CE-OD2 3.36Å; K68-D87 IonicContact NZ-OD1 3.68Å; K68-D87 IonicContact NZ-OD2 2.65Å; K68-D87 PolarHBondContact NZ-OD2 2.75Å; K68-E103 VanDerWaalsContact O-CG 3.31Å; K68-E103 WeakPolarHBondContact O-CG 3.43Å
69	C	96.8	Very high	97.5	Very high	17 Å²	17	58 Å²	58	12%	0.115	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	148.7	176.4	60.6	0	0	0	0	109.3	G77 F78	C69-G77 CarbonylContact O-C 3.42Å; C69-G77 WeakPolarHBondContact O-CA 3.3Å; C69-F78 PolarHBondContact N-O 2.75Å; C69-F78 PolarHBondContact O-N 3.41Å
70	F	97.8	Very high	97.5	Very high	34 Å²	34	53 Å²	53	15%	0.149	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	136.8	172.3	-172.9	-97.2	0	0	0	109.9	R72 L90 I92 V100 P101 W140	F70-R72 HydrophobicContact CE1-CB 4.47Å; F70-L90 HydrophobicContact CD2-CD2 3.95Å; F70-L90 HydrophobicContact CD2-CG 4.36Å; F70-L90 HydrophobicContact CE2-CD2 4.34Å; F70-L90 HydrophobicContact CE2-CG 4.41Å; F70-I92 HydrophobicContact CE2-CB 4.42Å; F70-I92 HydrophobicContact CZ-CB 3.91Å; F70-I92 HydrophobicContact CZ-CD1 4.36Å; F70-I92 HydrophobicContact CZ-CG1 4.07Å; F70-V100 HydrophobicContact CD1-CG1 3.9Å; F70-V100 HydrophobicContact CE1-CG1 3.75Å; F70-P101 HydrophobicContact CB-CB 4.1Å; F70-P101 WeakPolarHBondContact CB-O 3.29Å; F70-P101 HydrophobicContact CD1-CB 4.31Å; F70-P101 HydrophobicContact CD1-CG 4.43Å; F70-P101 WeakPolarHBondContact CD1-O 3.26Å; F70-P101 HydrophobicContact CD2-CB 4.32Å; F70-P101 HydrophobicContact CD2-CG 4.3Å; F70-P101 HydrophobicContact CE2-CG 4.42Å; F70-P101 HydrophobicContact CG-CB 4Å; F70-P101 HydrophobicContact CG-CG 4.3Å; F70-W140 AromaticContact CE1-CH2 3.86Å; F70-W140 HydrophobicContact CE1-CH2 3.86Å; F70-W140 HydrophobicContact CE1-CZ3 4.27Å; F70-W140 AromaticContact CZ-CH2 3.89Å; F70-W140 HydrophobicContact CZ-CH2 3.89Å
71	C	96.1	Very high	97.6	Very high	49 Å²	49	52.4 Å²	52.4	33%	0.331	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	105.4	177.5	-178.4	0	0	0	0	109.7	S73 K74 G75 H76	C71-S73 VanDerWaalsContact C-N 3.3Å; C71-S73 PolarHBondContact O-N 2.9Å; C71-K74 HydrophobicContact CB-CB 4.05Å; C71-K74 HydrophobicContact CB-CD 4.19Å; C71-K74 HydrophobicContact CB-CG 4.28Å; C71-K74 CarbonylContact O-C 3.58Å; C71-K74 PolarHBondContact O-N 3.39Å; C71-G75 PolarHBondContact O-N 2.99Å; C71-H76 PolarHBondContact N-O 2.73Å
72	R	95.6	Very high	97.6	Very high	107 Å²	107	51.7 Å²	51.7	40%	0.404	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-51.7	-46.3	-179.9	-176.3	178.8	179.9	165.9	4.8	112.5	F70 K74 G75 V100 W140	F70-R72 HydrophobicContact CE1-CB 4.47Å; R72-K74 VanDerWaalsContact C-N 3.29Å; R72-K74 PolarHBondContact O-N 2.87Å; R72-G75 PolarHBondContact O-N 3.04Å; R72-G75 VanDerWaalsContact O-N 3.12Å; R72-V100 HydrophobicContact CB-CG1 4.32Å; R72-W140 HydrophobicContact CG-CZ3 4.49Å; R72-W140 PolarHBondContact NH2-O 3.08Å
73	S	94.6	Very high	97.4	Very high	124 Å²	124	54.3 Å²	54.3	87%	0.867	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-65.5	-30.5	-179.2	-47.6	0	0	0	0	113.4	C71	C71-S73 VanDerWaalsContact C-N 3.3Å; C71-S73 PolarHBondContact O-N 2.9Å
74	K	95	Very high	97.1	Very high	127 Å²	127	52.7 Å²	52.7	55%	0.552	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-88.7	-14.1	175.3	-66.4	179.5	-178.7	175.7	0	112.9	C71 R72 H76	C71-K74 HydrophobicContact CB-CB 4.05Å; C71-K74 HydrophobicContact CB-CD 4.19Å; C71-K74 HydrophobicContact CB-CG 4.28Å; C71-K74 CarbonylContact O-C 3.58Å; C71-K74 PolarHBondContact O-N 3.39Å; R72-K74 VanDerWaalsContact C-N 3.29Å; R72-K74 PolarHBondContact O-N 2.87Å; K74-H76 VanDerWaalsContact C-N 3.29Å; K74-H76 PolarHBondContact O-N 2.9Å; K74-H76 PolarHBondContact O-ND1 3.28Å
75	G	96.6	Very high	96.7	Very high	11 Å²	11	48.6 Å²	48.6	11%	0.113	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	17.6	179.4	0	0	0	0	0	114.9	C71 R72 I92	C71-G75 PolarHBondContact O-N 2.99Å; R72-G75 PolarHBondContact O-N 3.04Å; R72-G75 VanDerWaalsContact O-N 3.12Å; G75-I92 WeakPolarHBondContact O-CB 3.41Å; G75-I92 VanDerWaalsContact O-CG2 3.3Å; G75-I92 WeakPolarHBondContact O-CG2 3.22Å; G75-I92 PolarHBondContact O-N 2.94Å
76	H	97.7	Very high	96.5	Very high	24 Å²	24	53.2 Å²	53.2	11%	0.111	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	167.2	-178.3	64.5	-93.8	0	0	0	113.6	C71 K74 F89 L90	C71-H76 PolarHBondContact N-O 2.73Å; K74-H76 VanDerWaalsContact C-N 3.29Å; K74-H76 PolarHBondContact O-N 2.9Å; K74-H76 PolarHBondContact O-ND1 3.28Å; H76-F89 HydrophobicContact CB-CE2 3.61Å; H76-F89 HydrophobicContact CB-CZ 3.67Å; H76-F89 AromaticContact CD2-CE2 3.96Å; H76-F89 AromaticContact CG-CE2 3.93Å; H76-L90 CarbonylContact C-O 3.55Å; H76-L90 WeakPolarHBondContact CA-O 3.29Å; H76-L90 VanDerWaalsContact CB-O 3.26Å; H76-L90 WeakPolarHBondContact CB-O 3.15Å
77	G	97.9	Very high	96.4	Very high	2 Å²	2	51.9 Å²	51.9	2%	0.021	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	-162.5	-176.4	0	0	0	0	0	112	C69 L90	C69-G77 CarbonylContact O-C 3.42Å; C69-G77 WeakPolarHBondContact O-CA 3.3Å; G77-L90 PolarHBondContact N-O 2.9Å; G77-L90 PolarHBondContact O-N 2.87Å
78	F	98.3	Very high	96.3	Very high	6 Å²	6	52.1 Å²	52.1	3%	0.026	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	147.9	178.4	-70.3	-88.8	0	0	0	111.3	L34 N37 V39 K68 C69 D87 I88 F89	L34-F78 HydrophobicContact CD2-CD2 4.41Å; L34-F78 HydrophobicContact CD2-CE2 4.44Å; N37-F78 HydrophobicContact CB-CD1 3.96Å; N37-F78 HydrophobicContact CB-CD2 3.83Å; N37-F78 HydrophobicContact CB-CE1 3.74Å; N37-F78 HydrophobicContact CB-CE2 3.61Å; N37-F78 HydrophobicContact CB-CG 4.01Å; N37-F78 HydrophobicContact CB-CZ 3.57Å; V39-F78 HydrophobicContact CG2-CE2 4.29Å; V39-F78 HydrophobicContact CG2-CZ 4.15Å; K68-F78 WeakPolarHBondContact CB-O 3.34Å; K68-F78 PolarHBondContact N-O 2.75Å; C69-F78 PolarHBondContact N-O 2.75Å; C69-F78 PolarHBondContact O-N 3.41Å; F78-D87 HydrophobicContact CB-CB 4.22Å; F78-D87 HydrophobicContact CD1-CB 4.17Å; F78-I88 CarbonylContact C-O 3.57Å; F78-I88 VanDerWaalsContact CA-O 3.27Å; F78-I88 WeakPolarHBondContact CA-O 3.39Å; F78-F89 HydrophobicContact CD1-CB 4.48Å; F78-F89 HydrophobicContact CE1-CB 4.07Å; F78-F89 AromaticContact CE1-CD2 3.98Å; F78-F89 HydrophobicContact CE1-CD2 3.98Å; F78-F89 HydrophobicContact CE2-CD2 4.5Å; F78-F89 AromaticContact CZ-CD2 3.88Å; F78-F89 HydrophobicContact CZ-CD2 3.88Å
79	I	98.6	Very high	96.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	131.2	174.3	-66.5	161.2	0	0	0	108.4	V66 D87 I88 L90 V107 Y109 A123 V126	V66-I79 CarbonylContact O-C 3.6Å; V66-I79 WeakPolarHBondContact O-CA 3.45Å; I79-D87 WeakPolarHBondContact O-CA 3.43Å; I79-I88 PolarHBondContact N-O 3.02Å; I79-I88 PolarHBondContact O-N 2.82Å; I79-L90 HydrophobicContact CD1-CB 4.27Å; I79-L90 HydrophobicContact CD1-CD1 4.18Å; I79-L90 HydrophobicContact CD1-CD2 4.09Å; I79-L90 HydrophobicContact CD1-CG 4.42Å; I79-L90 HydrophobicContact CG1-CB 4.39Å; I79-L90 HydrophobicContact CG1-CD2 4.15Å; I79-V107 HydrophobicContact CD1-CG2 3.85Å; I79-V107 HydrophobicContact CG1-CG2 4.01Å; I79-V107 HydrophobicContact CG2-CG2 3.83Å; I79-Y109 HydrophobicContact CD1-CD1 4.34Å; I79-Y109 HydrophobicContact CD1-CG 4.48Å; I79-Y109 HydrophobicContact CG2-CD1 4.17Å; I79-Y109 HydrophobicContact CG2-CE1 3.72Å; I79-A123 HydrophobicContact CD1-CB 3.6Å; I79-V126 HydrophobicContact CD1-CG1 3.99Å; I79-V126 HydrophobicContact CD1-CG2 4.41Å
80	T	98.3	Very high	96.4	Very high	50 Å²	50	47.8 Å²	47.8	31%	0.307	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.6	166.8	-62.2	0	0	0	0	108.5	G65 V66 D87	G65-T80 CarbonylContact C-O 3.57Å; G65-T80 WeakPolarHBondContact CA-O 3.4Å; V66-T80 PolarHBondContact N-O 2.86Å; V66-T80 PolarHBondContact O-N 3.31Å; T80-D87 PolarHBondContact OG1-OD1 2.98Å
81	P	98.4	Very high	96.4	Very high	12 Å²	12	47.3 Å²	47.3	8%	0.078	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	144.9	178.2	-18.5	30	0	0	0	111.9	D83 G84 I88 Y109	P81-D83 VanDerWaalsContact C-N 3.26Å; P81-D83 PolarHBondContact O-N 2.85Å; P81-G84 VanDerWaalsContact CB-O 3.32Å; P81-G84 WeakPolarHBondContact CB-O 3.35Å; P81-G84 WeakPolarHBondContact CG-O 3.21Å; P81-G84 PolarHBondContact O-N 3.01Å; P81-G84 VanDerWaalsContact O-N 3.08Å; P81-I88 HydrophobicContact CG-CD1 4.28Å; P81-I88 HydrophobicContact CG-CG1 3.85Å; P81-Y109 WeakPolarHBondContact CB-OH 3.47Å
82	A	97.9	Very high	96.6	Very high	67 Å²	67	47.6 Å²	47.6	55%	0.554	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-33.3	177.8	0	0	0	0	0	112.4	K64 G84	K64-A82 HydrophobicContact CB-CB 3.97Å; K64-A82 WeakPolarHBondContact O-CB 3.4Å; K64-A82 PolarHBondContact O-N 3.11Å; A82-G84 PolarHBondContact O-N 3Å
83	D	94.6	Very high	96.7	Very high	146 Å²	146	44.2 Å²	44.2	78%	0.781	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	6.7	177.5	-54.9	-47.9	0	0	0	112.9	P81	P81-D83 VanDerWaalsContact C-N 3.26Å; P81-D83 PolarHBondContact O-N 2.85Å
84	G	92	Very high	96.8	Very high	39 Å²	39	38.4 Å²	38.4	40%	0.402	24%	0.244	S	C	.	.			trans	78.6	-164.9	-175.2	0	0	0	0	0	113.8	P81 A82	P81-G84 VanDerWaalsContact CB-O 3.32Å; P81-G84 WeakPolarHBondContact CB-O 3.35Å; P81-G84 WeakPolarHBondContact CG-O 3.21Å; P81-G84 PolarHBondContact O-N 3.01Å; P81-G84 VanDerWaalsContact O-N 3.08Å; A82-G84 PolarHBondContact O-N 3Å
85	G	91.8	Very high	97	Very high	61 Å²	61	33 Å²	33	63%	0.629	22%	0.221	S	C	*	.	S	Bend	trans	92.2	-169.1	-175.4	0	0	0	0	0	113.7
86	P	93.9	Very high	97.1	Very high	102 Å²	102	35.6 Å²	35.6	66%	0.662	23%	0.23	S	C	*	.	S	Bend	trans	-71	147.5	-175.8	29.3	-34.2	0	0	0	111.8	I88	P86-I88 WeakPolarHBondContact O-CD1 3.46Å
87	D	96.7	Very high	97	Very high	32 Å²	32	37.3 Å²	37.3	17%	0.171	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-62.2	139.8	174.2	-67.6	-29.4	0	0	0	111.4	N37 K68 F78 I79 T80	N37-D87 PolarHBondContact ND2-OD2 3.12Å; N37-D87 PolarHBondContact OD1-OD2 2.89Å; N37-D87 VanDerWaalsContact OD1-OD2 3.07Å; K68-D87 WeakPolarHBondContact CD-OD2 3.4Å; K68-D87 WeakPolarHBondContact CE-OD2 3.36Å; K68-D87 IonicContact NZ-OD1 3.68Å; K68-D87 IonicContact NZ-OD2 2.65Å; K68-D87 PolarHBondContact NZ-OD2 2.75Å; F78-D87 HydrophobicContact CB-CB 4.22Å; F78-D87 HydrophobicContact CD1-CB 4.17Å; I79-D87 WeakPolarHBondContact O-CA 3.43Å; T80-D87 PolarHBondContact OG1-OD1 2.98Å
88	I	97.2	Very high	97	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.9	-175.7	-48.5	-59.8	0	0	0	109.2	F78 I79 P81 P86 L90 Y109 L121 A123	F78-I88 CarbonylContact C-O 3.57Å; F78-I88 VanDerWaalsContact CA-O 3.27Å; F78-I88 WeakPolarHBondContact CA-O 3.39Å; I79-I88 PolarHBondContact N-O 3.02Å; I79-I88 PolarHBondContact O-N 2.82Å; P81-I88 HydrophobicContact CG-CD1 4.28Å; P81-I88 HydrophobicContact CG-CG1 3.85Å; P86-I88 WeakPolarHBondContact O-CD1 3.46Å; I88-L90 PolarHBondContact O-N 2.81Å; I88-Y109 HydrophobicContact CG1-CE2 4.4Å; I88-L121 HydrophobicContact CD1-CB 3.9Å; I88-L121 HydrophobicContact CD1-CD1 3.81Å; I88-L121 HydrophobicContact CG2-CB 4.08Å; I88-A123 HydrophobicContact CG2-CB 3.96Å; I88-A123 VanDerWaalsContact CG2-N 3.34Å
89	F	97.8	Very high	97	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	133.6	179.7	177.4	-107.3	0	0	0	111.5	V39 P40 L43 P44 H76 F78 H91 L121 Q122 A123	V39-F89 HydrophobicContact CG1-CE2 4.08Å; P40-F89 VanDerWaalsContact CD-CD2 3.46Å; P40-F89 HydrophobicContact CG-CB 4.49Å; P40-F89 HydrophobicContact CG-CD1 3.58Å; P40-F89 HydrophobicContact CG-CD2 4.12Å; P40-F89 HydrophobicContact CG-CE1 3.76Å; P40-F89 HydrophobicContact CG-CE2 4.28Å; P40-F89 HydrophobicContact CG-CG 3.79Å; P40-F89 HydrophobicContact CG-CZ 4.14Å; L43-F89 HydrophobicContact CD2-CE1 4.1Å; L43-F89 HydrophobicContact CD2-CE2 3.99Å; L43-F89 HydrophobicContact CD2-CZ 3.4Å; P44-F89 HydrophobicContact CG-CE1 4.5Å; H76-F89 HydrophobicContact CB-CE2 3.61Å; H76-F89 HydrophobicContact CB-CZ 3.67Å; H76-F89 AromaticContact CD2-CE2 3.96Å; H76-F89 AromaticContact CG-CE2 3.93Å; F78-F89 HydrophobicContact CD1-CB 4.48Å; F78-F89 HydrophobicContact CE1-CB 4.07Å; F78-F89 AromaticContact CE1-CD2 3.98Å; F78-F89 HydrophobicContact CE1-CD2 3.98Å; F78-F89 HydrophobicContact CE2-CD2 4.5Å; F78-F89 AromaticContact CZ-CD2 3.88Å; F78-F89 HydrophobicContact CZ-CD2 3.88Å; F89-H91 HydrophobicContact CE1-CB 3.9Å; F89-H91 HydrophobicContact CZ-CB 4.26Å; F89-L121 WeakPolarHBondContact CB-O 3.48Å; F89-L121 PolarHBondContact N-O 3.01Å; F89-Q122 HydrophobicContact CD1-CB 4.48Å; F89-Q122 HydrophobicContact CD1-CG 4.13Å; F89-Q122 CarbonylContact O-C 3.56Å; F89-Q122 WeakPolarHBondContact O-CA 3.44Å; F89-A123 PolarHBondContact O-N 2.82Å
90	L	98.4	Very high	96.9	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	126.6	177	174.4	60.5	0	0	0	110.1	F70 H76 G77 I79 I88 V95 P101 A123 V126	F70-L90 HydrophobicContact CD2-CD2 3.95Å; F70-L90 HydrophobicContact CD2-CG 4.36Å; F70-L90 HydrophobicContact CE2-CD2 4.34Å; F70-L90 HydrophobicContact CE2-CG 4.41Å; H76-L90 CarbonylContact C-O 3.55Å; H76-L90 WeakPolarHBondContact CA-O 3.29Å; H76-L90 VanDerWaalsContact CB-O 3.26Å; H76-L90 WeakPolarHBondContact CB-O 3.15Å; G77-L90 PolarHBondContact N-O 2.9Å; G77-L90 PolarHBondContact O-N 2.87Å; I79-L90 HydrophobicContact CD1-CB 4.27Å; I79-L90 HydrophobicContact CD1-CD1 4.18Å; I79-L90 HydrophobicContact CD1-CD2 4.09Å; I79-L90 HydrophobicContact CD1-CG 4.42Å; I79-L90 HydrophobicContact CG1-CB 4.39Å; I79-L90 HydrophobicContact CG1-CD2 4.15Å; I88-L90 PolarHBondContact O-N 2.81Å; L90-V95 HydrophobicContact CD1-CG2 3.86Å; L90-V95 HydrophobicContact CD2-CG2 4.3Å; L90-V95 HydrophobicContact CG-CG2 4.28Å; L90-P101 HydrophobicContact CD2-CG 4.4Å; L90-A123 HydrophobicContact CD1-CB 4.49Å; L90-V126 HydrophobicContact CD1-CB 4.1Å; L90-V126 HydrophobicContact CD1-CG1 4.16Å; L90-V126 HydrophobicContact CD1-CG2 3.64Å
91	H	98.3	Very high	96.9	Very high	24 Å²	24	43.6 Å²	43.6	11%	0.111	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	141.9	172.1	-170.2	-94.6	0	0	0	110.6	T45 F89 S93 D94	T45-H91 WeakPolarHBondContact CG2-CE1 3.46Å; F89-H91 HydrophobicContact CE1-CB 3.9Å; F89-H91 HydrophobicContact CZ-CB 4.26Å; H91-S93 WeakPolarHBondContact ND1-CB 3.41Å; H91-S93 PolarHBondContact ND1-N 2.99Å; H91-S93 PolarHBondContact ND1-OG 3.45Å; H91-S93 PolarHBondContact O-N 3.38Å; H91-S93 VanDerWaalsContact O-N 3.11Å; H91-D94 PolarHBondContact O-N 2.86Å
92	I	98.3	Very high	96.9	Very high	54 Å²	54	44.9 Å²	44.9	28%	0.277	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-52.5	-36.2	-178	-173.4	167.5	0	0	0	113.4	F70 G75 D94 V95 W140	F70-I92 HydrophobicContact CE2-CB 4.42Å; F70-I92 HydrophobicContact CZ-CB 3.91Å; F70-I92 HydrophobicContact CZ-CD1 4.36Å; F70-I92 HydrophobicContact CZ-CG1 4.07Å; G75-I92 WeakPolarHBondContact O-CB 3.41Å; G75-I92 VanDerWaalsContact O-CG2 3.3Å; G75-I92 WeakPolarHBondContact O-CG2 3.22Å; G75-I92 PolarHBondContact O-N 2.94Å; I92-D94 PolarHBondContact O-N 2.85Å; I92-D94 VanDerWaalsContact O-N 3.17Å; I92-V95 PolarHBondContact O-N 2.83Å; I92-W140 HydrophobicContact CD1-CE3 4.03Å; I92-W140 HydrophobicContact CD1-CH2 3.74Å; I92-W140 HydrophobicContact CD1-CZ3 3.33Å; I92-W140 HydrophobicContact CG1-CH2 3.6Å; I92-W140 HydrophobicContact CG1-CZ2 4.27Å; I92-W140 HydrophobicContact CG1-CZ3 3.76Å
93	S	97.9	Very high	96.9	Very high	37 Å²	37	48 Å²	48	26%	0.259	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-67.2	-14.7	-178.9	66.2	0	0	0	0	114.8	R46 H91	R46-S93 WeakPolarHBondContact CB-O 3.38Å; R46-S93 WeakPolarHBondContact CD-O 3.27Å; R46-S93 PolarHBondContact N-OG 3.42Å; H91-S93 WeakPolarHBondContact ND1-CB 3.41Å; H91-S93 PolarHBondContact ND1-N 2.99Å; H91-S93 PolarHBondContact ND1-OG 3.45Å; H91-S93 PolarHBondContact O-N 3.38Å; H91-S93 VanDerWaalsContact O-N 3.11Å
94	D	98.4	Very high	97.1	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.011	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-103.8	-0.8	-179.2	-69.5	-75.4	0	0	0	112.6	R49 H91 I92 Q122 V126	R49-D94 IonicContact CZ-OD1 3.73Å; R49-D94 VanDerWaalsContact CZ-OD1 3.25Å; R49-D94 IonicContact CZ-OD2 2.74Å; R49-D94 IonicContact NH1-OD1 2.75Å; R49-D94 PolarHBondContact NH1-OD1 3.48Å; R49-D94 IonicContact NH2-OD1 2.87Å; R49-D94 PolarHBondContact NH2-OD1 2.91Å; R49-D94 IonicContact NH2-OD2 2.82Å; R49-D94 PolarHBondContact NH2-OD2 3.49Å; H91-D94 PolarHBondContact O-N 2.86Å; I92-D94 PolarHBondContact O-N 2.85Å; I92-D94 VanDerWaalsContact O-N 3.17Å; D94-Q122 PolarHBondContact OD2-NE2 3.37Å; D94-V126 WeakPolarHBondContact O-CB 3.33Å; D94-V126 PolarHBondContact O-N 2.87Å
95	V	98.5	Very high	97.4	Very high	13 Å²	13	40.8 Å²	40.8	8%	0.079	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	126.2	170.9	-175.2	0	0	0	0	108.5	L90 I92 P101 W140	L90-V95 HydrophobicContact CD1-CG2 3.86Å; L90-V95 HydrophobicContact CD2-CG2 4.3Å; L90-V95 HydrophobicContact CG-CG2 4.28Å; I92-V95 PolarHBondContact O-N 2.83Å; V95-P101 HydrophobicContact CB-CG 4.42Å; V95-P101 HydrophobicContact CG1-CG 3.78Å; V95-P101 HydrophobicContact CG2-CG 3.77Å; V95-W140 HydrophobicContact CB-CZ2 4.15Å; V95-W140 HydrophobicContact CG1-CZ2 3.96Å
96	E	98.1	Very high	97.8	Very high	66 Å²	66	42.5 Å²	42.5	31%	0.308	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	160	173.8	-55.5	-65.1	162.9	0	0	110.2	R46 V126 V127	R46-E96 IonicContact CZ-OE1 3.87Å; R46-E96 IonicContact NH1-OE1 3.56Å; R46-E96 PolarHBondContact NH1-OE1 2.84Å; R46-E96 IonicContact NH1-OE2 3.93Å; R46-E96 IonicContact NH2-OE1 3.25Å; E96-V126 PolarHBondContact N-O 3.2Å; E96-V127 HydrophobicContact CB-CG2 4.21Å; E96-V127 HydrophobicContact CG-CG2 4.5Å
97	G	96.6	Very high	98	Very high	60 Å²	60	37.8 Å²	37.8	62%	0.619	21%	0.21	S	C	*	.	S	Bend	trans	85.3	-174.4	-179.2	0	0	0	0	0	114	W140	G97-W140 PolarHBondContact O-NE1 3.01Å
98	E	96.8	Very high	98.1	Very high	113 Å²	113	37.6 Å²	37.6	53%	0.528	21%	0.211	S	C	.	.	S	Bend	trans	-94.4	-22.9	-169.9	66	-174.6	129.5	0	0	114.5	T139 W140	E98-T139 HydrophobicContact CB-CG2 4.27Å; E98-T139 HydrophobicContact CG-CG2 3.98Å; E98-T139 CarbonylContact O-C 3.53Å; E98-T139 WeakPolarHBondContact O-CA 3.48Å; E98-T139 VanDerWaalsContact O-CB 3.27Å; E98-T139 WeakPolarHBondContact O-CB 3.36Å; E98-W140 PolarHBondContact O-N 3.08Å
99	Y	97.8	Very high	98.2	Very high	62 Å²	62	37.5 Å²	37.5	24%	0.243	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-82.2	142	-174.8	-64.6	-72.4	0	0	0	112.3	L131 H137 T139 W140 V145	Y99-L131 HydrophobicContact CD1-CD2 4.47Å; Y99-L131 HydrophobicContact CD2-CD2 4.09Å; Y99-L131 HydrophobicContact CE1-CD1 4.28Å; Y99-L131 HydrophobicContact CE2-CD1 4.36Å; Y99-L131 HydrophobicContact CG-CD2 4.05Å; Y99-H137 HydrophobicContact CD1-CB 4.1Å; Y99-H137 HydrophobicContact CE1-CB 4.43Å; Y99-T139 HydrophobicContact CD1-CG2 3.91Å; Y99-T139 HydrophobicContact CE1-CG2 3.95Å; Y99-W140 WeakPolarHBondContact O-CZ2 3.48Å; Y99-W140 PolarHBondContact O-NE1 2.91Å; Y99-V145 HydrophobicContact CE1-CB 4.33Å; Y99-V145 HydrophobicContact CE1-CG2 4.11Å
100	V	98.3	Very high	98.2	Very high	10 Å²	10	38.7 Å²	38.7	6%	0.061	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-77.8	124.7	167.5	-175.2	0	0	0	0	107.9	F70 R72 V102 E138 W140	F70-V100 HydrophobicContact CD1-CG1 3.9Å; F70-V100 HydrophobicContact CE1-CG1 3.75Å; R72-V100 HydrophobicContact CB-CG1 4.32Å; V100-V102 PolarHBondContact O-N 2.86Å; V100-E138 WeakPolarHBondContact CB-O 3.48Å; V100-E138 HydrophobicContact CG2-CB 4.45Å; V100-E138 WeakPolarHBondContact CG2-O 3.26Å; V100-E138 PolarHBondContact N-O 3.37Å; V100-W140 HydrophobicContact CB-CE3 4.4Å; V100-W140 HydrophobicContact CB-CH2 4.12Å; V100-W140 HydrophobicContact CB-CZ3 4.03Å; V100-W140 HydrophobicContact CG1-CH2 3.87Å; V100-W140 HydrophobicContact CG1-CZ3 3.77Å; V100-W140 HydrophobicContact CG2-CD2 3.9Å; V100-W140 HydrophobicContact CG2-CE3 3.48Å; V100-W140 VanDerWaalsContact CG2-CE3 3.48Å; V100-W140 HydrophobicContact CG2-CH2 4.07Å; V100-W140 HydrophobicContact CG2-CZ2 4.47Å; V100-W140 HydrophobicContact CG2-CZ3 3.55Å
101	P	98.4	Very high	98.2	Very high	4 Å²	4	41.3 Å²	41.3	3%	0.026	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-58.1	137.5	178.4	-22.9	30.9	0	0	0	111.8	F70 L90 V95 D105 I128	F70-P101 HydrophobicContact CB-CB 4.1Å; F70-P101 WeakPolarHBondContact CB-O 3.29Å; F70-P101 HydrophobicContact CD1-CB 4.31Å; F70-P101 HydrophobicContact CD1-CG 4.43Å; F70-P101 WeakPolarHBondContact CD1-O 3.26Å; F70-P101 HydrophobicContact CD2-CB 4.32Å; F70-P101 HydrophobicContact CD2-CG 4.3Å; F70-P101 HydrophobicContact CE2-CG 4.42Å; F70-P101 HydrophobicContact CG-CB 4Å; F70-P101 HydrophobicContact CG-CG 4.3Å; L90-P101 HydrophobicContact CD2-CG 4.4Å; V95-P101 HydrophobicContact CB-CG 4.42Å; V95-P101 HydrophobicContact CG1-CG 3.78Å; V95-P101 HydrophobicContact CG2-CG 3.77Å; P101-D105 WeakPolarHBondContact CA-OD2 2.98Å; P101-I128 HydrophobicContact CB-CD1 4.4Å; P101-I128 HydrophobicContact CG-CD1 4.18Å
102	V	98	Very high	98.1	Very high	39 Å²	39	40.5 Å²	40.5	24%	0.236	23%	0.225	C	C	.	.			trans	-121.9	156.8	173.7	-172.9	0	0	0	0	109.3	C67 V100 G104 D105 T135	C67-V102 WeakPolarHBondContact CB-O 3.2Å; C67-V102 PolarHBondContact SG-O 2.88Å; V100-V102 PolarHBondContact O-N 2.86Å; V102-G104 PolarHBondContact O-N 3.17Å; V102-D105 PolarHBondContact N-OD2 3Å; V102-D105 WeakPolarHBondContact O-CB 3.27Å; V102-D105 PolarHBondContact O-N 3.25Å; V102-T135 HydrophobicContact CG1-CG2 3.62Å
103	E	97.9	Very high	98	Very high	133 Å²	133	40 Å²	40	62%	0.621	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	131.5	173.4	179.2	172.6	176.2	0	0	110.7	C67 K68 A132	C67-E103 WeakPolarHBondContact O-CA 3.45Å; K68-E103 VanDerWaalsContact O-CG 3.31Å; K68-E103 WeakPolarHBondContact O-CG 3.43Å; E103-A132 WeakPolarHBondContact O-CB 3.34Å
104	G	98.2	Very high	97.8	Very high	34 Å²	34	39.1 Å²	39.1	35%	0.351	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.6	-10	-177.7	0	0	0	0	0	115	C67 V102 E106	C67-G104 PolarHBondContact O-N 3.44Å; V102-G104 PolarHBondContact O-N 3.17Å; G104-E106 PolarHBondContact O-N 3.39Å
105	D	98.7	Very high	97.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.236	C	C	.	.			trans	-63.7	129	176.7	-76.2	-19	0	0	0	111.1	V66 C67 P101 V102 V107 I128 L131 A132 H137	V66-D105 CarbonylContact C-O 3.56Å; V66-D105 VanDerWaalsContact CA-O 3.29Å; V66-D105 WeakPolarHBondContact CA-O 3.37Å; C67-D105 HydrophobicContact CB-CB 3.97Å; C67-D105 PolarHBondContact N-O 3.12Å; P101-D105 WeakPolarHBondContact CA-OD2 2.98Å; V102-D105 PolarHBondContact N-OD2 3Å; V102-D105 WeakPolarHBondContact O-CB 3.27Å; V102-D105 PolarHBondContact O-N 3.25Å; D105-V107 HydrophobicContact CB-CG1 4.46Å; D105-I128 HydrophobicContact CB-CG2 4.05Å; D105-L131 WeakPolarHBondContact OD1-CA 3.42Å; D105-A132 WeakPolarHBondContact OD1-CB 3.43Å; D105-A132 PolarHBondContact OD1-N 3.23Å; D105-H137 IonicContact OD1-CE1 3.66Å; D105-H137 PolarHBondContact OD1-CE1 2.65Å; D105-H137 IonicContact OD1-NE2 3Å; D105-H137 IonicContact OD2-CE1 2.72Å
106	E	98.7	Very high	96.9	Very high	96 Å²	96	46.9 Å²	46.9	45%	0.449	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	132	168.3	-61.7	-173.2	-167	0	0	109.4	G104 T129 H130	G104-E106 PolarHBondContact O-N 3.39Å; E106-T129 PolarHBondContact O-N 2.8Å; E106-T129 PolarHBondContact O-OG1 2.65Å; E106-T129 VanDerWaalsContact O-OG1 3.13Å; E106-H130 HydrophobicContact CB-CB 3.96Å; E106-H130 HydrophobicContact CG-CB 4.18Å; E106-H130 PolarHBondContact N-O 3.29Å; E106-H130 PolarHBondContact O-N 3.07Å; E106-H130 IonicContact OE2-CE1 3.68Å; E106-H130 IonicContact OE2-CG 3.34Å; E106-H130 IonicContact OE2-ND1 3.55Å; E106-H130 PolarHBondContact OE2-ND1 3.1Å
107	V	98.9	Very high	96.5	Very high	3 Å²	3	51 Å²	51	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	151.7	-176.9	-62.2	0	0	0	0	111.4	K64 G65 I79 D105 Y109 V126 V127 I128	K64-V107 WeakPolarHBondContact CA-O 3.31Å; G65-V107 PolarHBondContact N-O 3.39Å; G65-V107 WeakPolarHBondContact O-CG2 3.41Å; G65-V107 PolarHBondContact O-N 3.27Å; I79-V107 HydrophobicContact CD1-CG2 3.85Å; I79-V107 HydrophobicContact CG1-CG2 4.01Å; I79-V107 HydrophobicContact CG2-CG2 3.83Å; D105-V107 HydrophobicContact CB-CG1 4.46Å; V107-Y109 HydrophobicContact CG2-CD1 4.18Å; V107-V126 HydrophobicContact CB-CG1 4.1Å; V107-V126 HydrophobicContact CG1-CG1 4.23Å; V107-V127 CarbonylContact C-O 3.41Å; V107-V127 VanDerWaalsContact CA-O 3.29Å; V107-V127 WeakPolarHBondContact CA-O 3.46Å; V107-I128 HydrophobicContact CG1-CG1 4.04Å
108	T	98.8	Very high	96.2	Very high	29 Å²	29	51.7 Å²	51.7	18%	0.178	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	146.5	159.6	51.3	0	0	0	0	109.8	V62 Y63 K64 V126 V127 T129	V62-T108 HydrophobicContact CG1-CG2 4.15Å; Y63-T108 CarbonylContact O-C 3.52Å; Y63-T108 VanDerWaalsContact O-CA 3.22Å; Y63-T108 WeakPolarHBondContact O-CA 3.45Å; K64-T108 HydrophobicContact CG-CG2 4.14Å; T108-V126 CarbonylContact O-C 3.54Å; T108-V126 WeakPolarHBondContact O-CA 3.18Å; T108-V127 PolarHBondContact N-O 2.83Å; T108-V127 PolarHBondContact O-N 2.91Å; T108-V127 PolarHBondContact OG1-O 2.69Å; T108-T129 HydrophobicContact CG2-CG2 3.75Å
109	Y	98.8	Very high	95.9	Very high	1 Å²	1	53.4 Å²	53.4	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	165.2	-178.7	63	-82.9	0	0	0	111.3	Y63 I79 P81 I88 V107 M111 A123	Y63-Y109 PolarHBondContact N-O 3.2Å; Y63-Y109 PolarHBondContact O-N 3.3Å; I79-Y109 HydrophobicContact CD1-CD1 4.34Å; I79-Y109 HydrophobicContact CD1-CG 4.48Å; I79-Y109 HydrophobicContact CG2-CD1 4.17Å; I79-Y109 HydrophobicContact CG2-CE1 3.72Å; P81-Y109 WeakPolarHBondContact CB-OH 3.47Å; I88-Y109 HydrophobicContact CG1-CE2 4.4Å; V107-Y109 HydrophobicContact CG2-CD1 4.18Å; Y109-M111 HydrophobicContact CD2-CG 4.45Å; Y109-M111 HydrophobicContact CE2-CE 4Å; Y109-M111 HydrophobicContact CE2-CG 3.96Å; Y109-A123 HydrophobicContact CD2-CB 3.78Å; Y109-A123 HydrophobicContact CG-CB 4.01Å
110	K	98.6	Very high	95.5	Very high	31 Å²	31	53.9 Å²	53.9	14%	0.135	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	153.3	166.1	-62.6	-168.6	-175.7	150	0	111	A57 S58 V62 A123 V124 E125	A57-K110 WeakPolarHBondContact O-CD 3.3Å; S58-K110 PolarHBondContact O-NZ 3.13Å; V62-K110 HydrophobicContact CG2-CG 4.33Å; K110-A123 WeakPolarHBondContact O-CA 3.47Å; K110-V124 HydrophobicContact CB-CG2 3.93Å; K110-V124 PolarHBondContact N-O 2.96Å; K110-V124 PolarHBondContact O-N 3.35Å; K110-E125 WeakPolarHBondContact CD-OE2 3.24Å; K110-E125 VanDerWaalsContact CE-OE2 3.29Å; K110-E125 WeakPolarHBondContact CE-OE2 3.38Å; K110-E125 IonicContact NZ-OE1 3.56Å; K110-E125 IonicContact NZ-OE2 2.75Å; K110-E125 PolarHBondContact NZ-OE2 2.82Å
111	M	97.4	Very high	95.4	Very high	56 Å²	56	56.2 Å²	56.2	28%	0.276	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	131.4	179.6	-70	-175.2	-175.6	0	0	111.3	Y63 Y109 L121	Y63-M111 HydrophobicContact CD1-CE 3.94Å; Y63-M111 HydrophobicContact CD2-CB 4.49Å; Y63-M111 HydrophobicContact CD2-CE 4.01Å; Y63-M111 HydrophobicContact CD2-CG 3.75Å; Y63-M111 HydrophobicContact CD2-SD 4.18Å; Y63-M111 HydrophobicContact CE1-CE 4.06Å; Y63-M111 HydrophobicContact CE1-SD 4.42Å; Y63-M111 HydrophobicContact CE2-CB 4.11Å; Y63-M111 HydrophobicContact CE2-CE 4.12Å; Y63-M111 HydrophobicContact CE2-CG 3.66Å; Y63-M111 HydrophobicContact CE2-SD 3.8Å; Y63-M111 HydrophobicContact CG-CE 3.9Å; Y109-M111 HydrophobicContact CD2-CG 4.45Å; Y109-M111 HydrophobicContact CE2-CE 4Å; Y109-M111 HydrophobicContact CE2-CG 3.96Å; M111-L121 HydrophobicContact SD-CD1 4.27Å
112	C	97.5	Very high	95.3	Very high	7 Å²	7	56.1 Å²	56.1	5%	0.047	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124	171.5	-175.3	0	0	0	0	109.9	A57 Q122 V124	A57-C112 HydrophobicContact CB-CB 3.84Å; C112-Q122 PolarHBondContact N-O 3.36Å; C112-Q122 PolarHBondContact O-N 2.9Å; C112-V124 HydrophobicContact CB-CG1 3.64Å; C112-V124 HydrophobicContact CB-CG2 4.21Å
113	S	95.4	Very high	95.4	Very high	43 Å²	43	54.3 Å²	54.3	30%	0.301	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	145	168.5	-50	0	0	0	0	110.8	P115	S113-P115 WeakPolarHBondContact O-CD 3.46Å
114	I	93.2	Very high	95.4	Very high	20 Å²	20	48.1 Å²	48.1	10%	0.103	26%	0.258	C	S	.	.			trans	-95	111.9	179.9	-57.3	170.4	0	0	0	109.6	P40 P44 N118 K120 Q122	P40-I114 HydrophobicContact CB-CD1 3.7Å; P40-I114 HydrophobicContact CG-CD1 3.77Å; P44-I114 HydrophobicContact CB-CG2 4.35Å; P44-I114 HydrophobicContact CG-CD1 3.68Å; P44-I114 HydrophobicContact CG-CG1 3.84Å; P44-I114 HydrophobicContact CG-CG2 3.93Å; I114-N118 VanDerWaalsContact O-CA 3.27Å; I114-N118 WeakPolarHBondContact O-CA 3.33Å; I114-N118 PolarHBondContact O-N 3.16Å; I114-K120 HydrophobicContact CB-CB 4.43Å; I114-K120 HydrophobicContact CD1-CB 3.8Å; I114-K120 HydrophobicContact CG1-CB 4.45Å; I114-K120 PolarHBondContact N-O 3.49Å; I114-Q122 HydrophobicContact CD1-CB 4.07Å; I114-Q122 HydrophobicContact CG1-CB 4Å
115	P	90.3	Very high	95.4	Very high	58 Å²	58	49.9 Å²	49.9	38%	0.377	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	164.3	177	-18.9	33.2	0	0	0	112.6	S113	S113-P115 WeakPolarHBondContact O-CD 3.46Å
116	P	89.4	Confident	95.4	Very high	120 Å²	120	49.9 Å²	49.9	78%	0.779	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	cis	-82.9	-23.7	-1.4	31.3	-34.2	0	0	0	113.7	N118	P116-N118 PolarHBondContact O-ND2 2.97Å
117	K	89.1	Confident	95.4	Very high	153 Å²	153	48.4 Å²	48.4	67%	0.665	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-22.1	-173.3	-62.3	-172.1	177.5	-173.5	0	114.1	E119	K117-E119 HydrophobicContact CB-CG 3.97Å; K117-E119 PolarHBondContact O-N 3.37Å
118	N	90.8	Very high	95.4	Very high	74 Å²	74	49.7 Å²	49.7	40%	0.396	26%	0.261	S	S	.	.			trans	59.1	22.1	-179.4	-52.9	-50.8	0	0	0	114.6	I114 P116	I114-N118 VanDerWaalsContact O-CA 3.27Å; I114-N118 WeakPolarHBondContact O-CA 3.33Å; I114-N118 PolarHBondContact O-N 3.16Å; P116-N118 PolarHBondContact O-ND2 2.97Å
119	E	89.3	Confident	95.4	Very high	149 Å²	149	51.4 Å²	51.4	70%	0.696	27%	0.272	S	S	*	.			trans	-80.5	-24.5	-179.5	-68.6	167.6	174.5	0	0	113	K117	K117-E119 HydrophobicContact CB-CG 3.97Å; K117-E119 PolarHBondContact O-N 3.37Å
120	K	91	Very high	95.3	Very high	72 Å²	72	56.6 Å²	56.6	31%	0.313	30%	0.296	S	S	.	.	S	Bend	trans	-110.3	145.4	-177.8	-64	-174.1	178.3	-166.4	0	110.6	V38 V39 P40 I114	V38-K120 VanDerWaalsContact CG1-NZ 3.26Å; V38-K120 PolarHBondContact O-NZ 3.12Å; V39-K120 PolarHBondContact O-NZ 2.9Å; V39-K120 VanDerWaalsContact O-NZ 3.16Å; P40-K120 HydrophobicContact CB-CD 3.91Å; I114-K120 HydrophobicContact CB-CB 4.43Å; I114-K120 HydrophobicContact CD1-CB 3.8Å; I114-K120 HydrophobicContact CG1-CB 4.45Å; I114-K120 PolarHBondContact N-O 3.49Å
121	L	94.8	Very high	95.3	Very high	59 Å²	59	57.3 Å²	57.3	31%	0.309	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	143	177.3	-63.8	176.3	0	0	0	111	I88 F89 M111	I88-L121 HydrophobicContact CD1-CB 3.9Å; I88-L121 HydrophobicContact CD1-CD1 3.81Å; I88-L121 HydrophobicContact CG2-CB 4.08Å; F89-L121 WeakPolarHBondContact CB-O 3.48Å; F89-L121 PolarHBondContact N-O 3.01Å; M111-L121 HydrophobicContact SD-CD1 4.27Å
122	Q	97.5	Very high	95.3	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.009	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137.3	172.5	179.1	174	16.6	0	0	109.5	P44 R49 F89 D94 C112 I114 V124	P44-Q122 VanDerWaalsContact CB-OE1 3.25Å; P44-Q122 PolarHBondContact O-NE2 2.91Å; R49-Q122 VanDerWaalsContact NH2-CD 3.25Å; F89-Q122 HydrophobicContact CD1-CB 4.48Å; F89-Q122 HydrophobicContact CD1-CG 4.13Å; F89-Q122 CarbonylContact O-C 3.56Å; F89-Q122 WeakPolarHBondContact O-CA 3.44Å; D94-Q122 PolarHBondContact OD2-NE2 3.37Å; C112-Q122 PolarHBondContact N-O 3.36Å; C112-Q122 PolarHBondContact O-N 2.9Å; I114-Q122 HydrophobicContact CD1-CB 4.07Å; I114-Q122 HydrophobicContact CG1-CB 4Å; Q122-V124 HydrophobicContact CG-CG1 4.12Å
123	A	98.4	Very high	95.3	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	128.9	168.5	0	0	0	0	0	109.1	I79 I88 F89 L90 Y109 K110 V126	I79-A123 HydrophobicContact CD1-CB 3.6Å; I88-A123 HydrophobicContact CG2-CB 3.96Å; I88-A123 VanDerWaalsContact CG2-N 3.34Å; F89-A123 PolarHBondContact O-N 2.82Å; L90-A123 HydrophobicContact CD1-CB 4.49Å; Y109-A123 HydrophobicContact CD2-CB 3.78Å; Y109-A123 HydrophobicContact CG-CB 4.01Å; K110-A123 WeakPolarHBondContact O-CA 3.47Å; A123-V126 HydrophobicContact CB-CG2 3.74Å
124	V	98.6	Very high	95.2	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.018	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	160.7	178.3	-52.8	0	0	0	0	109.9	A57 K110 C112 Q122 V126	A57-V124 HydrophobicContact CB-CG2 3.78Å; K110-V124 HydrophobicContact CB-CG2 3.93Å; K110-V124 PolarHBondContact N-O 2.96Å; K110-V124 PolarHBondContact O-N 3.35Å; C112-V124 HydrophobicContact CB-CG1 3.64Å; C112-V124 HydrophobicContact CB-CG2 4.21Å; Q122-V124 HydrophobicContact CG-CG1 4.12Å; V124-V126 PolarHBondContact O-N 2.84Å
125	E	98.4	Very high	95.3	Very high	72 Å²	72	62.7 Å²	62.7	34%	0.336	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.9	47.2	-176.5	-60.7	175.9	-158	0	0	110.9	S58 K110	S58-E125 WeakPolarHBondContact CB-OE1 3.21Å; K110-E125 WeakPolarHBondContact CD-OE2 3.24Å; K110-E125 VanDerWaalsContact CE-OE2 3.29Å; K110-E125 WeakPolarHBondContact CE-OE2 3.38Å; K110-E125 IonicContact NZ-OE1 3.56Å; K110-E125 IonicContact NZ-OE2 2.75Å; K110-E125 PolarHBondContact NZ-OE2 2.82Å
126	V	98.8	Very high	95.5	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	122.5	-170.9	-175	0	0	0	0	109.8	I79 L90 D94 E96 V107 T108 A123 V124	I79-V126 HydrophobicContact CD1-CG1 3.99Å; I79-V126 HydrophobicContact CD1-CG2 4.41Å; L90-V126 HydrophobicContact CD1-CB 4.1Å; L90-V126 HydrophobicContact CD1-CG1 4.16Å; L90-V126 HydrophobicContact CD1-CG2 3.64Å; D94-V126 WeakPolarHBondContact O-CB 3.33Å; D94-V126 PolarHBondContact O-N 2.87Å; E96-V126 PolarHBondContact N-O 3.2Å; V107-V126 HydrophobicContact CB-CG1 4.1Å; V107-V126 HydrophobicContact CG1-CG1 4.23Å; T108-V126 CarbonylContact O-C 3.54Å; T108-V126 WeakPolarHBondContact O-CA 3.18Å; A123-V126 HydrophobicContact CB-CG2 3.74Å; V124-V126 PolarHBondContact O-N 2.84Å
127	V	98.8	Very high	95.9	Very high	65 Å²	65	61.5 Å²	61.5	39%	0.394	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124.4	179.8	-177.6	0	0	0	0	108.8	E96 V107 T108 T129	E96-V127 HydrophobicContact CB-CG2 4.21Å; E96-V127 HydrophobicContact CG-CG2 4.5Å; V107-V127 CarbonylContact C-O 3.41Å; V107-V127 VanDerWaalsContact CA-O 3.29Å; V107-V127 WeakPolarHBondContact CA-O 3.46Å; T108-V127 PolarHBondContact N-O 2.83Å; T108-V127 PolarHBondContact O-N 2.91Å; T108-V127 PolarHBondContact OG1-O 2.69Å; V127-T129 PolarHBondContact O-N 2.95Å
128	I	98.6	Very high	96.3	Very high	30 Å²	30	58.6 Å²	58.6	15%	0.154	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	120	171.6	-57	164.2	0	0	0	108.4	P101 D105 V107 L131	P101-I128 HydrophobicContact CB-CD1 4.4Å; P101-I128 HydrophobicContact CG-CD1 4.18Å; D105-I128 HydrophobicContact CB-CG2 4.05Å; V107-I128 HydrophobicContact CG1-CG1 4.04Å; I128-L131 HydrophobicContact CG2-CD2 3.88Å
129	T	98.4	Very high	96.5	Very high	64 Å²	64	55.1 Å²	55.1	39%	0.393	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-36.1	-178.8	52.8	0	0	0	0	112.5	E106 T108 V127	E106-T129 PolarHBondContact O-N 2.8Å; E106-T129 PolarHBondContact O-OG1 2.65Å; E106-T129 VanDerWaalsContact O-OG1 3.13Å; T108-T129 HydrophobicContact CG2-CG2 3.75Å; V127-T129 PolarHBondContact O-N 2.95Å
130	H	98.2	Very high	96.8	Very high	111 Å²	111	51.4 Å²	51.4	51%	0.514	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	128.4	174.7	-53.6	106.2	0	0	0	109.6	E106	E106-H130 HydrophobicContact CB-CB 3.96Å; E106-H130 HydrophobicContact CG-CB 4.18Å; E106-H130 PolarHBondContact N-O 3.29Å; E106-H130 PolarHBondContact O-N 3.07Å; E106-H130 IonicContact OE2-CE1 3.68Å; E106-H130 IonicContact OE2-CG 3.34Å; E106-H130 IonicContact OE2-ND1 3.55Å; E106-H130 PolarHBondContact OE2-ND1 3.1Å
131	L	97.9	Very high	97	Very high	45 Å²	45	53.1 Å²	53.1	24%	0.236	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-70.9	139.2	174.6	-62.3	-178.5	0	0	0	110	Y99 D105 I128 P133	Y99-L131 HydrophobicContact CD1-CD2 4.47Å; Y99-L131 HydrophobicContact CD2-CD2 4.09Å; Y99-L131 HydrophobicContact CE1-CD1 4.28Å; Y99-L131 HydrophobicContact CE2-CD1 4.36Å; Y99-L131 HydrophobicContact CG-CD2 4.05Å; D105-L131 WeakPolarHBondContact OD1-CA 3.42Å; I128-L131 HydrophobicContact CG2-CD2 3.88Å; L131-P133 WeakPolarHBondContact O-CD 3.18Å
132	A	97.6	Very high	97	Very high	4 Å²	4	52.2 Å²	52.2	3%	0.033	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-57.6	116.7	176.7	0	0	0	0	0	110.3	E103 D105 T135 H137 S147	E103-A132 WeakPolarHBondContact O-CB 3.34Å; D105-A132 WeakPolarHBondContact OD1-CB 3.43Å; D105-A132 PolarHBondContact OD1-N 3.23Å; A132-T135 WeakPolarHBondContact O-CB 3.04Å; A132-T135 PolarHBondContact O-N 2.99Å; A132-H137 PolarHBondContact N-NE2 3.08Å; A132-H137 PolarHBondContact O-NE2 2.61Å; A132-S147 PolarHBondContact O-OG 3.01Å
133	P	96.3	Very high	96.9	Very high	109 Å²	109	58.1 Å²	58.1	71%	0.708	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	145.9	-174.4	27	-34.8	0	0	0	111.5	L131 T135	L131-P133 WeakPolarHBondContact O-CD 3.18Å; P133-T135 PolarHBondContact O-N 3.03Å
134	G	94.7	Very high	96.7	Very high	77 Å²	77	61.4 Å²	61.4	79%	0.794	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	10.2	178.4	0	0	0	0	0	114	S147	G134-S147 PolarHBondContact N-O 3Å
135	T	94.4	Very high	96.4	Very high	50 Å²	50	63.3 Å²	63.3	31%	0.307	37%	0.365	S	S	.	.	S	Bend	trans	-112.3	145	178.7	-52	0	0	0	0	110.4	V102 A132 P133 H137 S147	V102-T135 HydrophobicContact CG1-CG2 3.62Å; A132-T135 WeakPolarHBondContact O-CB 3.04Å; A132-T135 PolarHBondContact O-N 2.99Å; P133-T135 PolarHBondContact O-N 3.03Å; T135-H137 PolarHBondContact O-CD2 2.79Å; T135-S147 PolarHBondContact O-OG 3.34Å; T135-S147 VanDerWaalsContact O-OG 3.12Å
136	K	95.3	Very high	95.7	Very high	153 Å²	153	64.6 Å²	64.6	67%	0.665	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	127.8	170.8	-70.6	-175.5	179.1	-177.8	0	108.9	V144	K136-V144 HydrophobicContact CB-CG1 4.23Å; K136-V144 HydrophobicContact CD-CG1 4.35Å
137	H	97	Very high	94.5	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	143.3	174.8	-76.3	-80.4	0	0	0	110.4	Y99 D105 A132 T135 V144 V145 S147	Y99-H137 HydrophobicContact CD1-CB 4.1Å; Y99-H137 HydrophobicContact CE1-CB 4.43Å; D105-H137 IonicContact OD1-CE1 3.66Å; D105-H137 PolarHBondContact OD1-CE1 2.65Å; D105-H137 IonicContact OD1-NE2 3Å; D105-H137 IonicContact OD2-CE1 2.72Å; A132-H137 PolarHBondContact N-NE2 3.08Å; A132-H137 PolarHBondContact O-NE2 2.61Å; T135-H137 PolarHBondContact O-CD2 2.79Å; H137-V144 CarbonylContact O-C 3.52Å; H137-V144 VanDerWaalsContact O-CA 3.26Å; H137-V144 WeakPolarHBondContact O-CA 3.27Å; H137-V145 PolarHBondContact N-O 2.74Å; H137-V145 PolarHBondContact O-N 2.64Å; H137-S147 PolarHBondContact CD2-OG 3.2Å; H137-S147 PolarHBondContact NE2-OG 3.45Å
138	E	96.6	Very high	94.3	Very high	91 Å²	91	68.5 Å²	68.5	43%	0.425	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	148.6	170.6	-58.8	-168.6	117.3	0	0	109	V100 H143 V144	V100-E138 WeakPolarHBondContact CB-O 3.48Å; V100-E138 HydrophobicContact CG2-CB 4.45Å; V100-E138 WeakPolarHBondContact CG2-O 3.26Å; V100-E138 PolarHBondContact N-O 3.37Å; E138-H143 CarbonylContact C-O 3.49Å; E138-H143 WeakPolarHBondContact CA-O 3.32Å; E138-V144 HydrophobicContact CG-CG2 4.19Å
139	T	96.9	Very high	94.1	Very high	2 Å²	2	70.5 Å²	70.5	1%	0.012	42%	0.422	C	S	.	.	B	Isolated β-bridge	trans	-91.3	163.7	168.3	56.6	0	0	0	0	111.1	E98 Y99 S141 G142 H143	E98-T139 HydrophobicContact CB-CG2 4.27Å; E98-T139 HydrophobicContact CG-CG2 3.98Å; E98-T139 CarbonylContact O-C 3.53Å; E98-T139 WeakPolarHBondContact O-CA 3.48Å; E98-T139 VanDerWaalsContact O-CB 3.27Å; E98-T139 WeakPolarHBondContact O-CB 3.36Å; Y99-T139 HydrophobicContact CD1-CG2 3.91Å; Y99-T139 HydrophobicContact CE1-CG2 3.95Å; T139-S141 PolarHBondContact O-N 3.16Å; T139-S141 PolarHBondContact OG1-OG 3.45Å; T139-G142 PolarHBondContact O-N 2.79Å; T139-G142 PolarHBondContact OG1-N 2.68Å; T139-H143 HydrophobicContact CG2-CB 4.47Å; T139-H143 PolarHBondContact N-O 3.17Å; T139-H143 WeakPolarHBondContact OG1-CA 3.36Å; T139-H143 WeakPolarHBondContact OG1-CB 3.48Å; T139-H143 PolarHBondContact OG1-N 3.38Å; T139-H143 PolarHBondContact OG1-O 3.32Å; T139-H143 VanDerWaalsContact OG1-O 3.13Å
140	W	94.9	Very high	93.8	Very high	71 Å²	71	70.8 Å²	70.8	27%	0.269	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.7	174.5	-57.1	116.5	0	0	0	112.7	F70 R72 I92 V95 G97 E98 Y99 V100 G142	F70-W140 AromaticContact CE1-CH2 3.86Å; F70-W140 HydrophobicContact CE1-CH2 3.86Å; F70-W140 HydrophobicContact CE1-CZ3 4.27Å; F70-W140 AromaticContact CZ-CH2 3.89Å; F70-W140 HydrophobicContact CZ-CH2 3.89Å; R72-W140 HydrophobicContact CG-CZ3 4.49Å; R72-W140 PolarHBondContact NH2-O 3.08Å; I92-W140 HydrophobicContact CD1-CE3 4.03Å; I92-W140 HydrophobicContact CD1-CH2 3.74Å; I92-W140 HydrophobicContact CD1-CZ3 3.33Å; I92-W140 HydrophobicContact CG1-CH2 3.6Å; I92-W140 HydrophobicContact CG1-CZ2 4.27Å; I92-W140 HydrophobicContact CG1-CZ3 3.76Å; V95-W140 HydrophobicContact CB-CZ2 4.15Å; V95-W140 HydrophobicContact CG1-CZ2 3.96Å; G97-W140 PolarHBondContact O-NE1 3.01Å; E98-W140 PolarHBondContact O-N 3.08Å; Y99-W140 WeakPolarHBondContact O-CZ2 3.48Å; Y99-W140 PolarHBondContact O-NE1 2.91Å; V100-W140 HydrophobicContact CB-CE3 4.4Å; V100-W140 HydrophobicContact CB-CH2 4.12Å; V100-W140 HydrophobicContact CB-CZ3 4.03Å; V100-W140 HydrophobicContact CG1-CH2 3.87Å; V100-W140 HydrophobicContact CG1-CZ3 3.77Å; V100-W140 HydrophobicContact CG2-CD2 3.9Å; V100-W140 HydrophobicContact CG2-CE3 3.48Å; V100-W140 VanDerWaalsContact CG2-CE3 3.48Å; V100-W140 HydrophobicContact CG2-CH2 4.07Å; V100-W140 HydrophobicContact CG2-CZ2 4.47Å; V100-W140 HydrophobicContact CG2-CZ3 3.55Å; W140-G142 VanDerWaalsContact C-N 3.33Å
141	S	94.8	Very high	93.6	Very high	108 Å²	108	68.5 Å²	68.5	76%	0.755	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-8.9	175.5	58.9	0	0	0	0	114.1	T139	T139-S141 PolarHBondContact O-N 3.16Å; T139-S141 PolarHBondContact OG1-OG 3.45Å
142	G	93.9	Very high	93.3	Very high	40 Å²	40	69.9 Å²	69.9	41%	0.412	43%	0.43	S	S	.	.			trans	94.5	8.1	176.7	0	0	0	0	0	115.4	T139 W140	T139-G142 PolarHBondContact O-N 2.79Å; T139-G142 PolarHBondContact OG1-N 2.68Å; W140-G142 VanDerWaalsContact C-N 3.33Å
143	H	95.4	Very high	93	Very high	125 Å²	125	74.3 Å²	74.3	58%	0.579	46%	0.456	S	S	*	.			trans	-74.4	130	170.6	-174.2	-174	0	0	0	110.1	E138 T139	E138-H143 CarbonylContact C-O 3.49Å; E138-H143 WeakPolarHBondContact CA-O 3.32Å; T139-H143 HydrophobicContact CG2-CB 4.47Å; T139-H143 PolarHBondContact N-O 3.17Å; T139-H143 WeakPolarHBondContact OG1-CA 3.36Å; T139-H143 WeakPolarHBondContact OG1-CB 3.48Å; T139-H143 PolarHBondContact OG1-N 3.38Å; T139-H143 PolarHBondContact OG1-O 3.32Å; T139-H143 VanDerWaalsContact OG1-O 3.13Å
144	V	94.8	Very high	92.8	Very high	69 Å²	69	71.9 Å²	71.9	42%	0.418	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	128.1	177.1	-170.6	0	0	0	0	110.8	K136 H137 E138	K136-V144 HydrophobicContact CB-CG1 4.23Å; K136-V144 HydrophobicContact CD-CG1 4.35Å; H137-V144 CarbonylContact O-C 3.52Å; H137-V144 VanDerWaalsContact O-CA 3.26Å; H137-V144 WeakPolarHBondContact O-CA 3.27Å; E138-V144 HydrophobicContact CG-CG2 4.19Å
145	V	91.6	Very high	92.6	Very high	43 Å²	43	71.5 Å²	71.5	26%	0.261	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	142.1	176.3	-173.7	0	0	0	0	108.7	Y99 H137	Y99-V145 HydrophobicContact CE1-CB 4.33Å; Y99-V145 HydrophobicContact CE1-CG2 4.11Å; H137-V145 PolarHBondContact N-O 2.74Å; H137-V145 PolarHBondContact O-N 2.64Å
146	S	84.4	Confident	92.5	Very high	99 Å²	99	73.3 Å²	73.3	69%	0.692	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.7	171.8	-58.8	0	0	0	0	109
147	S	73.9	Confident	92.2	Very high	78 Å²	78	66 Å²	66	55%	0.545	40%	0.397	S	S	.	.			trans	-110.6	0	177.2	56.4	0	0	0	0	112.7	A132 G134 T135 H137	A132-S147 PolarHBondContact O-OG 3.01Å; G134-S147 PolarHBondContact N-O 3Å; T135-S147 PolarHBondContact O-OG 3.34Å; T135-S147 VanDerWaalsContact O-OG 3.12Å; H137-S147 PolarHBondContact CD2-OG 3.2Å; H137-S147 PolarHBondContact NE2-OG 3.45Å

Retrieved 147 of 147 residues in 26.1 ms (Link to these results)

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