G4VPZ5_SCHMA Loading...

Putative polyadenylate binding protein

AlphaFold DB (G4VPZ4), UniProt , Accession G4VPZ5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 223 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	49.9	Very low	61.3	Low	252 Å²	252	154.8 Å²	154.8	100%	1.241	84%	0.835	S	S	*	*				0	128.9	0	-96.4	140.4	169.9	0	0	106.5
2	S	61.1	Low	61.1	Low	106 Å²	106	153 Å²	153	74%	0.741	83%	0.832	S	S	*	*			trans	-72.6	142.2	-149.7	34.1	0	0	0	0	116.2
3	D	64.6	Low	61.1	Low	152 Å²	152	153.5 Å²	153.5	81%	0.813	83%	0.825	S	S	*	*			trans	-62.7	141.7	163	-65.3	-51.7	0	0	0	111.1
4	Y	72.4	Confident	60.6	Low	233 Å²	233	154.9 Å²	154.9	91%	0.914	82%	0.824	S	S	*	*			trans	-99.3	112.8	167	-88.3	-90	0	0	0	108.9
5	V	70.8	Confident	60.4	Low	122 Å²	122	153.6 Å²	153.6	74%	0.739	82%	0.817	S	S	*	*			trans	-94.8	125.2	170.7	179.9	0	0	0	0	107.7
6	L	55.7	Low	60.2	Low	165 Å²	165	153.8 Å²	153.8	86%	0.864	81%	0.812	S	S	*	*			trans	-77.6	124.9	164.7	-90	148.3	0	0	0	107.6
7	D	60.4	Low	59.5	Low	148 Å²	148	155.5 Å²	155.5	79%	0.791	81%	0.811	S	S	*	*			trans	-164.3	130	151.7	-80.5	-39.8	0	0	0	107.8
8	G	59.5	Low	59	Low	79 Å²	79	151.1 Å²	151.1	81%	0.814	81%	0.81	S	S	*	*			trans	-172.8	55.8	-174.9	0	0	0	0	0	111
9	D	59.7	Low	58.6	Low	149 Å²	149	150.5 Å²	150.5	80%	0.797	81%	0.807	S	S	*	*			trans	-61.9	132.8	163.7	-59.8	-52.4	0	0	0	109.6
10	H	60	Low	58.5	Low	168 Å²	168	152.4 Å²	152.4	78%	0.778	81%	0.811	S	S	*	*			trans	-153.6	96.1	150.8	-155.8	47.5	0	0	0	111.3
11	D	60.6	Low	58	Low	129 Å²	129	152.1 Å²	152.1	69%	0.69	81%	0.809	S	S	*	*			trans	57.3	104.4	132.1	-62.1	-40.9	0	0	0	120
12	V	58	Low	57.9	Low	133 Å²	133	143.7 Å²	143.7	81%	0.806	79%	0.787	S	S	*	*			trans	-79.7	119	154.9	-179.3	0	0	0	0	107.4	E14	V12-E14 HydrophobicContact CG1-CG 4.16Å
13	H	61.9	Low	57.5	Low	159 Å²	159	147.3 Å²	147.3	74%	0.736	79%	0.79	S	S	*	*			trans	-111	108	165.3	-141.6	-54	0	0	0	108.6	D15	H13-D15 IonicContact CE1-OD1 2.73Å; H13-D15 PolarHBondContact CE1-OD1 3.14Å; H13-D15 IonicContact CG-OD1 3.87Å; H13-D15 IonicContact ND1-OD1 3.96Å; H13-D15 PolarHBondContact ND1-OD1 3.33Å; H13-D15 IonicContact ND1-OD2 2.99Å
14	E	54.1	Low	57	Low	173 Å²	173	148.3 Å²	148.3	81%	0.808	79%	0.789	S	S	*	*			trans	-86.3	117.3	164.9	-64	-177.6	165	0	0	107.3	V12	V12-E14 HydrophobicContact CG1-CG 4.16Å
15	D	56.9	Low	55.9	Low	136 Å²	136	144 Å²	144	73%	0.727	78%	0.782	S	S	*	*			trans	-118.4	112.7	166.8	-66.3	-20.5	0	0	0	109.1	H13	H13-D15 IonicContact CE1-OD1 2.73Å; H13-D15 PolarHBondContact CE1-OD1 3.14Å; H13-D15 IonicContact CG-OD1 3.87Å; H13-D15 IonicContact ND1-OD1 3.96Å; H13-D15 PolarHBondContact ND1-OD1 3.33Å; H13-D15 IonicContact ND1-OD2 2.99Å
16	E	57.7	Low	54.7	Low	156 Å²	156	145.8 Å²	145.8	73%	0.729	79%	0.793	S	S	*	*			trans	-85.3	159.5	-178.5	-163.9	-176.8	-179.7	0	0	110.7
17	F	48	Very low	54.2	Low	183 Å²	183	141.5 Å²	141.5	80%	0.803	78%	0.777	S	S	*	*			trans	93.9	127	161	-66.6	-81.9	0	0	0	121
18	G	51	Low	53.9	Low	77 Å²	77	140 Å²	140	79%	0.794	77%	0.773	S	S	*	*			trans	143.5	77.2	141.7	0	0	0	0	0	116.3
19	D	50.3	Low	53.5	Low	139 Å²	139	140.6 Å²	140.6	74%	0.743	76%	0.761	S	S	*	*			trans	-56.5	132.8	166.2	-177.2	10	0	0	0	111.4
20	E	58.4	Low	53	Low	189 Å²	189	139 Å²	139	88%	0.883	75%	0.752	S	S	*	*			trans	-170	118.5	138.1	-104.8	172.7	-154.3	0	0	113.1
21	N	46.7	Very low	52.5	Low	147 Å²	147	138.2 Å²	138.2	79%	0.786	75%	0.749	S	S	*	*			trans	-35.1	129.7	173.6	-67.2	-79.8	0	0	0	118.2
22	G	49	Very low	52.1	Low	75 Å²	75	138.6 Å²	138.6	77%	0.773	75%	0.748	S	S	*	*			trans	-153.7	107.3	155.8	0	0	0	0	0	110
23	K	51.3	Low	51.9	Low	182 Å²	182	138 Å²	138	79%	0.791	74%	0.736	S	S	*	*			trans	-68.3	166.5	170	-69.1	-178.8	172.3	69.8	0	109.5
24	E	54.5	Low	51.6	Low	173 Å²	173	137.3 Å²	137.3	81%	0.808	73%	0.731	S	S	*	*			trans	91.3	111.7	169.4	-52.3	156.7	-149.2	0	0	110.8
25	D	48.4	Very low	52.2	Low	142 Å²	142	134.1 Å²	134.1	76%	0.759	72%	0.72	S	S	*	*			cis	-158.4	137	26	-68.5	-51.2	0	0	0	110.4	S27	D25-S27 PolarHBondContact O-N 3.44Å; D25-S27 VanDerWaalsContact O-N 3.16Å
26	V	46	Very low	53	Low	159 Å²	159	130.3 Å²	130.3	96%	0.964	71%	0.707	S	S	*	*			trans	-77.7	98.8	172.3	-177.4	0	0	0	0	107.7
27	S	46.6	Very low	53.6	Low	75 Å²	75	127.7 Å²	127.7	52%	0.524	70%	0.695	S	S	.	*			trans	-103.6	139.5	-179.4	67.1	0	0	0	0	111.2	D25 T29	D25-S27 PolarHBondContact O-N 3.44Å; D25-S27 VanDerWaalsContact O-N 3.16Å; S27-T29 PolarHBondContact O-N 3.19Å
28	V	52.6	Low	54.6	Low	117 Å²	117	122.9 Å²	122.9	71%	0.709	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	6.5	-167.3	174.9	0	0	0	0	114.7
29	T	51.7	Low	56	Low	92 Å²	92	125.9 Å²	125.9	56%	0.564	67%	0.67	S	S	*	*	H	α-helix	trans	-81.5	-27.6	-173.9	49.5	0	0	0	0	114.1	S27 H33	S27-T29 PolarHBondContact O-N 3.19Å; T29-H33 PolarHBondContact O-N 3.17Å
30	D	49.6	Very low	57.5	Low	115 Å²	115	122 Å²	122	62%	0.615	66%	0.658	S	S	*	*	H	α-helix	trans	-76.5	-33	179.5	-84.8	-16.4	0	0	0	112.8	M32 H33 F34	D30-M32 VanDerWaalsContact C-N 3.3Å; D30-M32 PolarHBondContact O-N 3.04Å; D30-H33 PolarHBondContact O-N 3.28Å; D30-H33 VanDerWaalsContact O-N 3.1Å; D30-F34 VanDerWaalsContact O-CD2 3.3Å; D30-F34 WeakPolarHBondContact O-CD2 3.46Å; D30-F34 PolarHBondContact O-N 2.81Å; D30-F34 VanDerWaalsContact O-N 3.1Å
31	E	49.6	Very low	58.4	Low	151 Å²	151	118.2 Å²	118.2	71%	0.706	64%	0.642	S	S	*	*	H	α-helix	trans	-65.9	-34.7	175.2	-67.9	-153.9	160.9	0	0	111.9	H33 F34 D35	E31-H33 VanDerWaalsContact C-N 3.25Å; E31-H33 PolarHBondContact O-N 2.75Å; E31-F34 PolarHBondContact O-N 2.72Å; E31-D35 WeakPolarHBondContact O-CB 3.46Å; E31-D35 PolarHBondContact O-N 3.22Å
32	M	51.9	Low	60.1	Low	137 Å²	137	117.4 Å²	117.4	68%	0.675	63%	0.632	S	S	*	*	H	α-helix	trans	-66.2	-26.4	173.4	-71.3	-171.2	52.1	0	0	113.2	D30 A36	D30-M32 VanDerWaalsContact C-N 3.3Å; D30-M32 PolarHBondContact O-N 3.04Å; M32-A36 WeakPolarHBondContact O-CB 3.3Å; M32-A36 PolarHBondContact O-N 3.06Å
33	H	54.2	Low	61.9	Low	122 Å²	122	119.7 Å²	119.7	57%	0.565	62%	0.622	S	S	*	*	H	α-helix	trans	-79.4	-41.8	177.3	-137.2	64.3	0	0	0	111.5	T29 D30 E31 D35 A36 E37	T29-H33 PolarHBondContact O-N 3.17Å; D30-H33 PolarHBondContact O-N 3.28Å; D30-H33 VanDerWaalsContact O-N 3.1Å; E31-H33 VanDerWaalsContact C-N 3.25Å; E31-H33 PolarHBondContact O-N 2.75Å; H33-D35 PolarHBondContact O-N 3.49Å; H33-A36 PolarHBondContact O-N 2.63Å; H33-E37 IonicContact CD2-OE1 2.89Å; H33-E37 WeakPolarHBondContact O-CG 3.28Å; H33-E37 PolarHBondContact O-N 3.2Å
34	F	54.3	Low	63.2	Low	144 Å²	144	119.3 Å²	119.3	63%	0.632	62%	0.616	S	S	*	*	H	α-helix	trans	-63.9	-38.6	174	-82.4	-75.8	0	0	0	112.8	D30 E31 E37 L38	D30-F34 VanDerWaalsContact O-CD2 3.3Å; D30-F34 WeakPolarHBondContact O-CD2 3.46Å; D30-F34 PolarHBondContact O-N 2.81Å; D30-F34 VanDerWaalsContact O-N 3.1Å; E31-F34 PolarHBondContact O-N 2.72Å; F34-E37 PolarHBondContact O-N 3.31Å; F34-L38 VanDerWaalsContact O-CB 3.29Å; F34-L38 WeakPolarHBondContact O-CB 3.19Å; F34-L38 PolarHBondContact O-N 3.31Å
35	D	66.6	Low	64.4	Low	106 Å²	106	117 Å²	117	57%	0.567	60%	0.603	S	S	*	*	H	α-helix	trans	-66.9	-39.7	177.4	-79.2	-18	0	0	0	112.1	E31 H33 L38 E39	E31-D35 WeakPolarHBondContact O-CB 3.46Å; E31-D35 PolarHBondContact O-N 3.22Å; H33-D35 PolarHBondContact O-N 3.49Å; D35-L38 PolarHBondContact O-N 2.65Å; D35-E39 WeakPolarHBondContact O-CB 3.2Å; D35-E39 PolarHBondContact O-N 3.33Å
36	A	75	Confident	66.1	Low	55 Å²	55	117.4 Å²	117.4	46%	0.455	60%	0.599	S	S	.	*	H	α-helix	trans	-66.6	-41.1	176.3	0	0	0	0	0	112.2	M32 H33 E39 A40	M32-A36 WeakPolarHBondContact O-CB 3.3Å; M32-A36 PolarHBondContact O-N 3.06Å; H33-A36 PolarHBondContact O-N 2.63Å; A36-E39 PolarHBondContact O-N 2.87Å; A36-A40 WeakPolarHBondContact O-CB 3.49Å; A36-A40 PolarHBondContact O-N 3.25Å
37	E	69.4	Low	67.8	Low	102 Å²	102	115.5 Å²	115.5	48%	0.477	58%	0.579	S	S	.	*	H	α-helix	trans	-65.6	-40	174	-73.1	-176.4	-178.4	0	0	111.9	H33 F34 A40 I41	H33-E37 IonicContact CD2-OE1 2.89Å; H33-E37 WeakPolarHBondContact O-CG 3.28Å; H33-E37 PolarHBondContact O-N 3.2Å; F34-E37 PolarHBondContact O-N 3.31Å; E37-A40 PolarHBondContact O-N 3.5Å; E37-I41 VanDerWaalsContact O-CG1 3.26Å; E37-I41 WeakPolarHBondContact O-CG1 3.43Å; E37-I41 PolarHBondContact O-N 3.49Å
38	L	69.8	Low	69.3	Low	81 Å²	81	116.1 Å²	116.1	42%	0.424	58%	0.575	S	S	.	*	H	α-helix	trans	-66.1	-38.2	177	-171.8	69.5	0	0	0	111.9	F34 D35 I41 K42	F34-L38 VanDerWaalsContact O-CB 3.29Å; F34-L38 WeakPolarHBondContact O-CB 3.19Å; F34-L38 PolarHBondContact O-N 3.31Å; D35-L38 PolarHBondContact O-N 2.65Å; L38-I41 PolarHBondContact O-N 3.17Å; L38-K42 HydrophobicContact CG-CD 4.45Å; L38-K42 WeakPolarHBondContact O-CB 3.28Å; L38-K42 VanDerWaalsContact O-CG 3.29Å; L38-K42 WeakPolarHBondContact O-CG 3.39Å; L38-K42 PolarHBondContact O-N 2.75Å
39	E	80.5	Confident	70.5	Confident	141 Å²	141	115.4 Å²	115.4	66%	0.659	56%	0.564	S	S	*	*	H	α-helix	trans	-66.7	-42.7	175.3	-166.3	164	-153.3	0	0	111.3	D35 A36 I41 K42 E43	D35-E39 WeakPolarHBondContact O-CB 3.2Å; D35-E39 PolarHBondContact O-N 3.33Å; A36-E39 PolarHBondContact O-N 2.87Å; E39-I41 PolarHBondContact O-N 3.43Å; E39-K42 PolarHBondContact O-N 2.92Å; E39-E43 WeakPolarHBondContact O-CB 3.49Å; E39-E43 PolarHBondContact O-N 2.96Å
40	A	82	Confident	71.8	Confident	58 Å²	58	113 Å²	113	48%	0.479	55%	0.554	S	S	.	*	H	α-helix	trans	-62.2	-39.3	174.1	0	0	0	0	0	112.7	A36 E37 R44	A36-A40 WeakPolarHBondContact O-CB 3.49Å; A36-A40 PolarHBondContact O-N 3.25Å; E37-A40 PolarHBondContact O-N 3.5Å; A40-R44 WeakPolarHBondContact O-CB 3.25Å; A40-R44 PolarHBondContact O-N 3.21Å
41	I	76.6	Confident	73	Confident	109 Å²	109	111.6 Å²	111.6	56%	0.559	55%	0.546	S	S	*	.	H	α-helix	trans	-67.2	-41.8	175.6	-68.6	165.3	0	0	0	111	E37 L38 E39 R44 F45	E37-I41 VanDerWaalsContact O-CG1 3.26Å; E37-I41 WeakPolarHBondContact O-CG1 3.43Å; E37-I41 PolarHBondContact O-N 3.49Å; L38-I41 PolarHBondContact O-N 3.17Å; E39-I41 PolarHBondContact O-N 3.43Å; I41-R44 PolarHBondContact O-N 2.98Å; I41-F45 WeakPolarHBondContact O-CB 3.3Å; I41-F45 PolarHBondContact O-N 3.34Å
42	K	81.7	Confident	74.4	Confident	129 Å²	129	106.9 Å²	106.9	56%	0.561	53%	0.534	S	S	*	.	H	α-helix	trans	-64.7	-41	176.4	-76.5	170.8	-178.5	167.1	0	111.9	L38 E39 F45 K46	L38-K42 HydrophobicContact CG-CD 4.45Å; L38-K42 WeakPolarHBondContact O-CB 3.28Å; L38-K42 VanDerWaalsContact O-CG 3.29Å; L38-K42 WeakPolarHBondContact O-CG 3.39Å; L38-K42 PolarHBondContact O-N 2.75Å; E39-K42 PolarHBondContact O-N 2.92Å; K42-F45 PolarHBondContact O-N 3.04Å; K42-K46 WeakPolarHBondContact O-CB 3.39Å; K42-K46 PolarHBondContact O-N 3.28Å
43	E	87.2	Confident	75.7	Confident	123 Å²	123	105.3 Å²	105.3	58%	0.575	53%	0.528	S	S	*	.	H	α-helix	trans	-63.3	-47	176.2	-172.3	169.5	-155.1	0	0	110.8	E39 F45 K46 E47	E39-E43 WeakPolarHBondContact O-CB 3.49Å; E39-E43 PolarHBondContact O-N 2.96Å; E43-F45 VanDerWaalsContact C-N 3.29Å; E43-F45 PolarHBondContact O-N 2.9Å; E43-K46 WeakPolarHBondContact O-CB 3.5Å; E43-K46 PolarHBondContact O-N 3.09Å; E43-K46 VanDerWaalsContact O-N 3.11Å; E43-E47 PolarHBondContact O-N 3.28Å
44	R	78.5	Confident	76.8	Confident	174 Å²	174	105.3 Å²	105.3	66%	0.657	53%	0.526	S	S	*	.	H	α-helix	trans	-58.8	-40.2	173.9	-167.4	-165.5	179.6	-148	0.9	112.2	A40 I41 K46 E47 I48	A40-R44 WeakPolarHBondContact O-CB 3.25Å; A40-R44 PolarHBondContact O-N 3.21Å; I41-R44 PolarHBondContact O-N 2.98Å; R44-K46 VanDerWaalsContact C-N 3.34Å; R44-E47 PolarHBondContact O-N 3.45Å; R44-I48 HydrophobicContact CG-CD1 4.11Å; R44-I48 WeakPolarHBondContact O-CD1 3.47Å; R44-I48 VanDerWaalsContact O-CG1 3.24Å; R44-I48 WeakPolarHBondContact O-CG1 3.13Å; R44-I48 PolarHBondContact O-N 3.13Å
45	F	80	Confident	77.7	Confident	125 Å²	125	104.1 Å²	104.1	55%	0.548	53%	0.526	S	S	.	.	H	α-helix	trans	-64.8	-40.2	177.5	-156	-95.4	0	0	0	111.5	I41 K42 E43 I48 E49	I41-F45 WeakPolarHBondContact O-CB 3.3Å; I41-F45 PolarHBondContact O-N 3.34Å; K42-F45 PolarHBondContact O-N 3.04Å; E43-F45 VanDerWaalsContact C-N 3.29Å; E43-F45 PolarHBondContact O-N 2.9Å; F45-I48 PolarHBondContact O-N 3.41Å; F45-E49 HydrophobicContact CD1-CG 4.08Å; F45-E49 HydrophobicContact CE1-CG 4.09Å; F45-E49 WeakPolarHBondContact CE1-OE1 3.47Å; F45-E49 WeakPolarHBondContact O-CG 3.34Å; F45-E49 PolarHBondContact O-N 3.36Å
46	K	85.5	Confident	78.1	Confident	151 Å²	151	103.6 Å²	103.6	66%	0.657	52%	0.52	S	S	*	.	H	α-helix	trans	-65.6	-37.9	176.4	-171.1	-179.6	-179.9	-176	0	112.5	K42 E43 R44 E49 A50	K42-K46 WeakPolarHBondContact O-CB 3.39Å; K42-K46 PolarHBondContact O-N 3.28Å; E43-K46 WeakPolarHBondContact O-CB 3.5Å; E43-K46 PolarHBondContact O-N 3.09Å; E43-K46 VanDerWaalsContact O-N 3.11Å; R44-K46 VanDerWaalsContact C-N 3.34Å; K46-E49 PolarHBondContact O-N 3.08Å; K46-A50 WeakPolarHBondContact O-CB 3.27Å; K46-A50 PolarHBondContact O-N 3.29Å
47	E	81.6	Confident	78.2	Confident	119 Å²	119	105.1 Å²	105.1	56%	0.556	52%	0.52	S	S	*	.	H	α-helix	trans	-65.1	-45	173	-70.4	-174.6	160.5	0	0	111.6	E43 R44 E49 A50 D51	E43-E47 PolarHBondContact O-N 3.28Å; R44-E47 PolarHBondContact O-N 3.45Å; E47-E49 VanDerWaalsContact C-N 3.32Å; E47-E49 PolarHBondContact O-N 2.87Å; E47-A50 PolarHBondContact O-N 3.07Å; E47-D51 PolarHBondContact O-N 2.92Å
48	I	78.1	Confident	78.3	Confident	87 Å²	87	105.3 Å²	105.3	45%	0.446	52%	0.524	S	S	.	.	H	α-helix	trans	-61.1	-41.5	176.1	-68.3	165.2	0	0	0	110.9	R44 F45 D51 A52	R44-I48 HydrophobicContact CG-CD1 4.11Å; R44-I48 WeakPolarHBondContact O-CD1 3.47Å; R44-I48 VanDerWaalsContact O-CG1 3.24Å; R44-I48 WeakPolarHBondContact O-CG1 3.13Å; R44-I48 PolarHBondContact O-N 3.13Å; F45-I48 PolarHBondContact O-N 3.41Å; I48-D51 PolarHBondContact O-N 2.61Å; I48-A52 WeakPolarHBondContact O-CB 3.17Å; I48-A52 PolarHBondContact O-N 3.17Å
49	E	75.9	Confident	78.6	Confident	102 Å²	102	107.1 Å²	107.1	48%	0.477	53%	0.525	S	S	.	.	H	α-helix	trans	-65.4	-41.8	175.3	-76.6	-173.8	167.1	0	0	112.3	F45 K46 E47 D51 A52 N53	F45-E49 HydrophobicContact CD1-CG 4.08Å; F45-E49 HydrophobicContact CE1-CG 4.09Å; F45-E49 WeakPolarHBondContact CE1-OE1 3.47Å; F45-E49 WeakPolarHBondContact O-CG 3.34Å; F45-E49 PolarHBondContact O-N 3.36Å; K46-E49 PolarHBondContact O-N 3.08Å; E47-E49 VanDerWaalsContact C-N 3.32Å; E47-E49 PolarHBondContact O-N 2.87Å; E49-D51 VanDerWaalsContact C-N 3.31Å; E49-D51 PolarHBondContact O-N 3.28Å; E49-A52 PolarHBondContact O-N 3.32Å; E49-N53 WeakPolarHBondContact O-CB 3.47Å; E49-N53 VanDerWaalsContact O-CG 3.27Å; E49-N53 PolarHBondContact O-N 3.43Å; E49-N53 PolarHBondContact O-ND2 3.47Å; E49-N53 VanDerWaalsContact O-ND2 3.13Å
50	A	79.2	Confident	78.2	Confident	42 Å²	42	106.2 Å²	106.2	35%	0.347	52%	0.516	S	S	.	.	H	α-helix	trans	-62.9	-39.7	176.3	0	0	0	0	0	111.5	K46 E47 K54	K46-A50 WeakPolarHBondContact O-CB 3.27Å; K46-A50 PolarHBondContact O-N 3.29Å; E47-A50 PolarHBondContact O-N 3.07Å; A50-K54 VanDerWaalsContact O-CG 3.32Å; A50-K54 WeakPolarHBondContact O-CG 3.21Å; A50-K54 PolarHBondContact O-N 3.13Å; A50-K54 VanDerWaalsContact O-N 3.07Å
51	D	75.7	Confident	77.7	Confident	85 Å²	85	108.4 Å²	108.4	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-72.6	-37.1	176.9	-77.4	-6.6	0	0	0	112.5	E47 I48 E49 N53 K54 L55	E47-D51 PolarHBondContact O-N 2.92Å; I48-D51 PolarHBondContact O-N 2.61Å; E49-D51 VanDerWaalsContact C-N 3.31Å; E49-D51 PolarHBondContact O-N 3.28Å; D51-N53 VanDerWaalsContact C-N 3.33Å; D51-N53 PolarHBondContact O-N 2.96Å; D51-K54 PolarHBondContact O-N 3Å; D51-K54 IonicContact OD1-NZ 3.97Å; D51-K54 PolarHBondContact OD1-NZ 2.75Å; D51-L55 WeakPolarHBondContact O-CG 3.43Å; D51-L55 PolarHBondContact O-N 3.26Å
52	A	78.4	Confident	77.4	Confident	53 Å²	53	107.5 Å²	107.5	44%	0.438	52%	0.518	S	S	.	.	H	α-helix	trans	-62	-40.9	172.5	0	0	0	0	0	112	I48 E49 L55 H56	I48-A52 WeakPolarHBondContact O-CB 3.17Å; I48-A52 PolarHBondContact O-N 3.17Å; E49-A52 PolarHBondContact O-N 3.32Å; A52-L55 PolarHBondContact O-N 2.89Å; A52-H56 PolarHBondContact O-N 3.22Å
53	N	78.8	Confident	76.6	Confident	103 Å²	103	104.3 Å²	104.3	55%	0.551	51%	0.507	S	S	*	.	H	α-helix	trans	-65.5	-43.1	175.9	-73	-33	0	0	0	111.9	E49 D51 L55 H56 D57	E49-N53 WeakPolarHBondContact O-CB 3.47Å; E49-N53 VanDerWaalsContact O-CG 3.27Å; E49-N53 PolarHBondContact O-N 3.43Å; E49-N53 PolarHBondContact O-ND2 3.47Å; E49-N53 VanDerWaalsContact O-ND2 3.13Å; D51-N53 VanDerWaalsContact C-N 3.33Å; D51-N53 PolarHBondContact O-N 2.96Å; N53-L55 VanDerWaalsContact C-N 3.31Å; N53-L55 PolarHBondContact O-N 3.03Å; N53-H56 PolarHBondContact O-N 2.86Å; N53-D57 PolarHBondContact O-N 3.45Å; N53-D57 VanDerWaalsContact O-N 3.15Å
54	K	78.6	Confident	75.8	Confident	123 Å²	123	106.7 Å²	106.7	54%	0.535	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-42.2	173.1	-69.7	170.1	-158.1	156.3	0	111.6	A50 D51 H56 D57 L58	A50-K54 VanDerWaalsContact O-CG 3.32Å; A50-K54 WeakPolarHBondContact O-CG 3.21Å; A50-K54 PolarHBondContact O-N 3.13Å; A50-K54 VanDerWaalsContact O-N 3.07Å; D51-K54 PolarHBondContact O-N 3Å; D51-K54 IonicContact OD1-NZ 3.97Å; D51-K54 PolarHBondContact OD1-NZ 2.75Å; K54-H56 VanDerWaalsContact C-N 3.34Å; K54-H56 PolarHBondContact O-N 2.67Å; K54-D57 PolarHBondContact O-N 3.15Å; K54-L58 WeakPolarHBondContact O-CG 3.32Å; K54-L58 PolarHBondContact O-N 3.36Å
55	L	73.4	Confident	75.2	Confident	118 Å²	118	100.1 Å²	100.1	62%	0.618	50%	0.496	S	S	*	.	H	α-helix	trans	-64.5	-37.5	177.5	-74.1	174.2	0	0	0	112.2	D51 A52 N53 L58 R59	D51-L55 WeakPolarHBondContact O-CG 3.43Å; D51-L55 PolarHBondContact O-N 3.26Å; A52-L55 PolarHBondContact O-N 2.89Å; N53-L55 VanDerWaalsContact C-N 3.31Å; N53-L55 PolarHBondContact O-N 3.03Å; L55-L58 PolarHBondContact O-N 2.65Å; L55-R59 WeakPolarHBondContact O-CB 3.25Å; L55-R59 PolarHBondContact O-N 3.45Å
56	H	74.8	Confident	74.4	Confident	95 Å²	95	98.3 Å²	98.3	44%	0.44	50%	0.497	S	S	.	.	H	α-helix	trans	-64.8	-40.1	176.9	-168.6	46.3	0	0	0	112.2	A52 N53 K54 R59 R60	A52-H56 PolarHBondContact O-N 3.22Å; N53-H56 PolarHBondContact O-N 2.86Å; K54-H56 VanDerWaalsContact C-N 3.34Å; K54-H56 PolarHBondContact O-N 2.67Å; H56-R59 PolarHBondContact O-N 3Å; H56-R60 VanDerWaalsContact CD2-CZ 3.49Å; H56-R60 PolarHBondContact NE2-NE 3.09Å; H56-R60 PolarHBondContact NE2-NH2 3.29Å; H56-R60 WeakPolarHBondContact O-CG 3.16Å; H56-R60 PolarHBondContact O-N 3.1Å
57	D	76.6	Confident	73.5	Confident	88 Å²	88	97.5 Å²	97.5	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-70.4	-39.1	176.6	-71.8	-26.7	0	0	0	111.9	N53 K54 R59 R60 V61	N53-D57 PolarHBondContact O-N 3.45Å; N53-D57 VanDerWaalsContact O-N 3.15Å; K54-D57 PolarHBondContact O-N 3.15Å; D57-R59 VanDerWaalsContact C-N 3.31Å; D57-R59 PolarHBondContact O-N 2.8Å; D57-R60 PolarHBondContact O-N 3.06Å; D57-R60 IonicContact OD1-NH1 2.83Å; D57-R60 PolarHBondContact OD1-NH1 3.04Å; D57-V61 WeakPolarHBondContact O-CG2 3.4Å; D57-V61 PolarHBondContact O-N 2.94Å
58	L	72.4	Confident	72.4	Confident	105 Å²	105	92 Å²	92	55%	0.55	47%	0.474	S	S	.	.	H	α-helix	trans	-59.9	-41.9	170.2	-70.9	176.3	0	0	0	111.3	K54 L55 V61 I62	K54-L58 WeakPolarHBondContact O-CG 3.32Å; K54-L58 PolarHBondContact O-N 3.36Å; L55-L58 PolarHBondContact O-N 2.65Å; L58-V61 PolarHBondContact O-N 2.89Å; L58-I62 WeakPolarHBondContact O-CB 3.43Å; L58-I62 VanDerWaalsContact O-CG1 3.22Å; L58-I62 WeakPolarHBondContact O-CG1 3.22Å; L58-I62 PolarHBondContact O-N 2.9Å
59	R	74.4	Confident	71.6	Confident	120 Å²	120	91.3 Å²	91.3	45%	0.453	47%	0.473	S	S	.	.	H	α-helix	trans	-63.6	-43	177.1	-176	66.7	-159.7	-167.3	5.4	111.9	L55 H56 D57 V61 I62 D63	L55-R59 WeakPolarHBondContact O-CB 3.25Å; L55-R59 PolarHBondContact O-N 3.45Å; H56-R59 PolarHBondContact O-N 3Å; D57-R59 VanDerWaalsContact C-N 3.31Å; D57-R59 PolarHBondContact O-N 2.8Å; R59-V61 VanDerWaalsContact C-N 3.35Å; R59-V61 PolarHBondContact O-N 2.93Å; R59-I62 PolarHBondContact O-N 2.88Å; R59-D63 WeakPolarHBondContact CG-OD2 3.29Å; R59-D63 IonicContact CZ-OD1 3.49Å; R59-D63 VanDerWaalsContact CZ-OD1 3.29Å; R59-D63 IonicContact CZ-OD2 3.06Å; R59-D63 IonicContact NE-OD1 3.76Å; R59-D63 PolarHBondContact NE-OD1 2.84Å; R59-D63 IonicContact NE-OD2 3.73Å; R59-D63 PolarHBondContact NE-OD2 3.48Å; R59-D63 IonicContact NH2-OD1 2.83Å; R59-D63 PolarHBondContact NH2-OD1 2.87Å; R59-D63 IonicContact NH2-OD2 2.79Å; R59-D63 WeakPolarHBondContact O-CB 3.36Å; R59-D63 PolarHBondContact O-N 2.77Å
60	R	73.1	Confident	70.8	Confident	122 Å²	122	92.7 Å²	92.7	46%	0.46	48%	0.478	S	S	.	.	H	α-helix	trans	-61.5	-40.7	175.4	-76.4	170.7	171.4	164.3	-4.3	112.6	H56 D57 K64	H56-R60 VanDerWaalsContact CD2-CZ 3.49Å; H56-R60 PolarHBondContact NE2-NE 3.09Å; H56-R60 PolarHBondContact NE2-NH2 3.29Å; H56-R60 WeakPolarHBondContact O-CG 3.16Å; H56-R60 PolarHBondContact O-N 3.1Å; D57-R60 PolarHBondContact O-N 3.06Å; D57-R60 IonicContact OD1-NH1 2.83Å; D57-R60 PolarHBondContact OD1-NH1 3.04Å; R60-K64 WeakPolarHBondContact O-CB 3.35Å; R60-K64 WeakPolarHBondContact O-CG 3.25Å; R60-K64 PolarHBondContact O-N 3.47Å; R60-K64 VanDerWaalsContact O-N 3.09Å
61	V	71.8	Confident	70	Confident	104 Å²	104	99.3 Å²	99.3	63%	0.63	49%	0.494	S	S	*	.	H	α-helix	trans	-67.3	-42	176.1	173.5	0	0	0	0	110.3	D57 L58 R59 K64 S65	D57-V61 WeakPolarHBondContact O-CG2 3.4Å; D57-V61 PolarHBondContact O-N 2.94Å; L58-V61 PolarHBondContact O-N 2.89Å; R59-V61 VanDerWaalsContact C-N 3.35Å; R59-V61 PolarHBondContact O-N 2.93Å; V61-K64 PolarHBondContact O-N 2.76Å; V61-S65 PolarHBondContact O-N 2.97Å
62	I	69.4	Low	69.1	Low	89 Å²	89	98.4 Å²	98.4	46%	0.456	49%	0.489	S	S	.	.	H	α-helix	trans	-59.2	-57.3	175.1	-68.9	164.4	0	0	0	108.9	L58 R59 K64 S65 S68	L58-I62 WeakPolarHBondContact O-CB 3.43Å; L58-I62 VanDerWaalsContact O-CG1 3.22Å; L58-I62 WeakPolarHBondContact O-CG1 3.22Å; L58-I62 PolarHBondContact O-N 2.9Å; R59-I62 PolarHBondContact O-N 2.88Å; I62-K64 PolarHBondContact O-N 2.77Å; I62-K64 VanDerWaalsContact O-N 3.13Å; I62-S65 VanDerWaalsContact O-CB 3.28Å; I62-S65 WeakPolarHBondContact O-CB 3.38Å; I62-S65 PolarHBondContact O-N 3.42Å; I62-S65 PolarHBondContact O-OG 3.39Å; I62-S68 WeakPolarHBondContact O-CB 3.39Å; I62-S68 PolarHBondContact O-OG 3Å
63	D	65.9	Low	68.1	Low	62 Å²	62	101.6 Å²	101.6	33%	0.332	50%	0.498	S	S	.	.	H	α-helix	trans	-61.4	-22.8	-177.1	-71.7	-34	0	0	0	114	R59 S68 N72	R59-D63 WeakPolarHBondContact CG-OD2 3.29Å; R59-D63 IonicContact CZ-OD1 3.49Å; R59-D63 VanDerWaalsContact CZ-OD1 3.29Å; R59-D63 IonicContact CZ-OD2 3.06Å; R59-D63 IonicContact NE-OD1 3.76Å; R59-D63 PolarHBondContact NE-OD1 2.84Å; R59-D63 IonicContact NE-OD2 3.73Å; R59-D63 PolarHBondContact NE-OD2 3.48Å; R59-D63 IonicContact NH2-OD1 2.83Å; R59-D63 PolarHBondContact NH2-OD1 2.87Å; R59-D63 IonicContact NH2-OD2 2.79Å; R59-D63 WeakPolarHBondContact O-CB 3.36Å; R59-D63 PolarHBondContact O-N 2.77Å; D63-S68 WeakPolarHBondContact CA-OG 3.5Å; D63-S68 PolarHBondContact O-OG 2.83Å; D63-S68 VanDerWaalsContact O-OG 3.11Å; D63-N72 PolarHBondContact OD1-ND2 3.49Å
64	K	70.4	Confident	67.1	Low	174 Å²	174	103.5 Å²	103.5	76%	0.757	50%	0.502	S	S	*	.	H	α-helix	trans	-87.2	-14.4	172.7	-72	175.5	-177.2	-179.3	0	113.9	R60 V61 I62	R60-K64 WeakPolarHBondContact O-CB 3.35Å; R60-K64 WeakPolarHBondContact O-CG 3.25Å; R60-K64 PolarHBondContact O-N 3.47Å; R60-K64 VanDerWaalsContact O-N 3.09Å; V61-K64 PolarHBondContact O-N 2.76Å; I62-K64 PolarHBondContact O-N 2.77Å; I62-K64 VanDerWaalsContact O-N 3.13Å
65	S	64.6	Low	66	Low	35 Å²	35	100.3 Å²	100.3	25%	0.245	50%	0.495	C	S	.	.	S	Bend	trans	-72.6	140	175.5	74.6	0	0	0	0	109.9	V61 I62 I67 S68 T69	V61-S65 PolarHBondContact O-N 2.97Å; I62-S65 VanDerWaalsContact O-CB 3.28Å; I62-S65 WeakPolarHBondContact O-CB 3.38Å; I62-S65 PolarHBondContact O-N 3.42Å; I62-S65 PolarHBondContact O-OG 3.39Å; S65-I67 PolarHBondContact O-N 3.32Å; S65-I67 VanDerWaalsContact O-N 3.13Å; S65-S68 PolarHBondContact O-N 2.8Å; S65-S68 PolarHBondContact O-OG 2.83Å; S65-S68 PolarHBondContact OG-N 3.29Å; S65-T69 PolarHBondContact O-N 3.26Å; S65-T69 PolarHBondContact O-OG1 3.48Å; S65-T69 VanDerWaalsContact O-OG1 3.13Å
66	P	64.3	Low	65	Low	87 Å²	87	97.5 Å²	97.5	57%	0.565	49%	0.488	S	S	*	.	H	α-helix	trans	-57.5	-33.3	179.6	23.3	-33.5	0	0	0	111.4	S68 T69 F70	P66-S68 VanDerWaalsContact C-N 3.33Å; P66-S68 PolarHBondContact O-N 2.8Å; P66-T69 WeakPolarHBondContact O-CB 3.4Å; P66-T69 PolarHBondContact O-N 2.8Å; P66-T69 VanDerWaalsContact O-N 3.16Å; P66-T69 PolarHBondContact O-OG1 3.15Å; P66-F70 HydrophobicContact CB-CE2 4.48Å; P66-F70 WeakPolarHBondContact O-CD2 3.06Å; P66-F70 PolarHBondContact O-N 3.22Å
67	I	66.7	Low	63.9	Low	135 Å²	135	96.2 Å²	96.2	69%	0.692	49%	0.494	S	S	*	.	H	α-helix	trans	-62	-38.2	178.6	-66.2	162.3	0	0	0	111.8	S65 R71	S65-I67 PolarHBondContact O-N 3.32Å; S65-I67 VanDerWaalsContact O-N 3.13Å; I67-R71 WeakPolarHBondContact O-CB 3.39Å; I67-R71 PolarHBondContact O-N 3.04Å
68	S	58.5	Low	62.7	Low	4 Å²	4	98.9 Å²	98.9	3%	0.028	50%	0.504	C	S	.	.	H	α-helix	trans	-73.7	-30.9	176.2	75.7	0	0	0	0	112.8	I62 D63 S65 P66 F70 R71 N72	I62-S68 WeakPolarHBondContact O-CB 3.39Å; I62-S68 PolarHBondContact O-OG 3Å; D63-S68 WeakPolarHBondContact CA-OG 3.5Å; D63-S68 PolarHBondContact O-OG 2.83Å; D63-S68 VanDerWaalsContact O-OG 3.11Å; S65-S68 PolarHBondContact O-N 2.8Å; S65-S68 PolarHBondContact O-OG 2.83Å; S65-S68 PolarHBondContact OG-N 3.29Å; P66-S68 VanDerWaalsContact C-N 3.33Å; P66-S68 PolarHBondContact O-N 2.8Å; S68-F70 VanDerWaalsContact C-N 3.31Å; S68-R71 PolarHBondContact O-N 3.42Å; S68-N72 VanDerWaalsContact O-CB 3.25Å; S68-N72 WeakPolarHBondContact O-CB 3.27Å; S68-N72 VanDerWaalsContact O-CG 3.29Å; S68-N72 PolarHBondContact O-N 3.42Å; S68-N72 PolarHBondContact O-ND2 3.44Å
69	T	60.3	Low	61.6	Low	72 Å²	72	98 Å²	98	44%	0.442	51%	0.506	S	S	.	.	H	α-helix	trans	-66.3	-42.7	177.4	-29.5	0	0	0	0	108.6	S65 P66 L73	S65-T69 PolarHBondContact O-N 3.26Å; S65-T69 PolarHBondContact O-OG1 3.48Å; S65-T69 VanDerWaalsContact O-OG1 3.13Å; P66-T69 WeakPolarHBondContact O-CB 3.4Å; P66-T69 PolarHBondContact O-N 2.8Å; P66-T69 VanDerWaalsContact O-N 3.16Å; P66-T69 PolarHBondContact O-OG1 3.15Å; T69-L73 WeakPolarHBondContact O-CB 3.45Å; T69-L73 WeakPolarHBondContact O-CD1 3.29Å; T69-L73 PolarHBondContact O-N 3.37Å
70	F	59.3	Low	60.6	Low	130 Å²	130	95.8 Å²	95.8	57%	0.57	50%	0.504	S	S	*	.	H	α-helix	trans	-59.5	-51.6	168	-69.3	-68.4	0	0	0	111.4	P66 S68 N72 L73 F74	P66-F70 HydrophobicContact CB-CE2 4.48Å; P66-F70 WeakPolarHBondContact O-CD2 3.06Å; P66-F70 PolarHBondContact O-N 3.22Å; S68-F70 VanDerWaalsContact C-N 3.31Å; F70-N72 PolarHBondContact O-N 2.97Å; F70-L73 WeakPolarHBondContact O-CB 3.42Å; F70-L73 PolarHBondContact O-N 2.8Å; F70-F74 HydrophobicContact CB-CD2 4.28Å; F70-F74 HydrophobicContact CB-CE2 4.25Å; F70-F74 HydrophobicContact CD1-CE2 4.43Å; F70-F74 WeakPolarHBondContact O-CD2 3.38Å; F70-F74 PolarHBondContact O-N 3.17Å
71	R	62.9	Low	59.7	Low	182 Å²	182	93.4 Å²	93.4	69%	0.687	50%	0.5	S	S	*	.	H	α-helix	trans	-61.3	-41.3	-178.1	-172.5	-179.9	-179.5	127	1.1	113.5	I67 S68 F74 S75	I67-R71 WeakPolarHBondContact O-CB 3.39Å; I67-R71 PolarHBondContact O-N 3.04Å; S68-R71 PolarHBondContact O-N 3.42Å; R71-F74 PolarHBondContact O-N 2.96Å; R71-S75 WeakPolarHBondContact O-CB 3.2Å; R71-S75 PolarHBondContact O-N 3.15Å; R71-S75 PolarHBondContact O-OG 2.8Å
72	N	57.6	Low	59.1	Low	66 Å²	66	92.8 Å²	92.8	35%	0.353	50%	0.5	S	S	.	.	H	α-helix	trans	-70.7	-34.9	178.6	-72.4	-21.1	0	0	0	110.6	D63 S68 F70 A76	D63-N72 PolarHBondContact OD1-ND2 3.49Å; S68-N72 VanDerWaalsContact O-CB 3.25Å; S68-N72 WeakPolarHBondContact O-CB 3.27Å; S68-N72 VanDerWaalsContact O-CG 3.29Å; S68-N72 PolarHBondContact O-N 3.42Å; S68-N72 PolarHBondContact O-ND2 3.44Å; F70-N72 PolarHBondContact O-N 2.97Å; N72-A76 WeakPolarHBondContact O-CB 3.04Å; N72-A76 PolarHBondContact O-N 3.27Å
73	L	57.1	Low	58.9	Low	120 Å²	120	94.3 Å²	94.3	63%	0.628	51%	0.51	S	S	*	.	H	α-helix	trans	-62.8	-47.9	169	-102.4	66.4	0	0	0	111.6	T69 F70 A77	T69-L73 WeakPolarHBondContact O-CB 3.45Å; T69-L73 WeakPolarHBondContact O-CD1 3.29Å; T69-L73 PolarHBondContact O-N 3.37Å; F70-L73 WeakPolarHBondContact O-CB 3.42Å; F70-L73 PolarHBondContact O-N 2.8Å; L73-A77 PolarHBondContact O-N 2.89Å
74	F	56.2	Low	59	Low	143 Å²	143	94.2 Å²	94.2	63%	0.627	51%	0.508	S	S	*	.	H	α-helix	trans	-66.4	-41.2	178.8	-77.2	-68.7	0	0	0	112.2	F70 R71 A77	F70-F74 HydrophobicContact CB-CD2 4.28Å; F70-F74 HydrophobicContact CB-CE2 4.25Å; F70-F74 HydrophobicContact CD1-CE2 4.43Å; F70-F74 WeakPolarHBondContact O-CD2 3.38Å; F70-F74 PolarHBondContact O-N 3.17Å; R71-F74 PolarHBondContact O-N 2.96Å; F74-A77 PolarHBondContact O-N 3.38Å
75	S	55.7	Low	59.6	Low	56 Å²	56	88.5 Å²	88.5	39%	0.392	49%	0.49	S	S	.	.	H	α-helix	trans	-75	-30.1	-178.8	-56.6	0	0	0	0	112.9	R71	R71-S75 WeakPolarHBondContact O-CB 3.2Å; R71-S75 PolarHBondContact O-N 3.15Å; R71-S75 PolarHBondContact O-OG 2.8Å
76	A	53.2	Low	60.5	Low	58 Å²	58	92.8 Å²	92.8	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-70.9	-31.8	174	0	0	0	0	0	112.4	N72	N72-A76 WeakPolarHBondContact O-CB 3.04Å; N72-A76 PolarHBondContact O-N 3.27Å
77	A	52.2	Low	61.5	Low	68 Å²	68	95.9 Å²	95.9	56%	0.562	52%	0.518	S	S	*	.	H	α-helix	trans	-70.1	-31.3	179.7	0	0	0	0	0	113.1	L73 F74 R123	L73-A77 PolarHBondContact O-N 2.89Å; F74-A77 PolarHBondContact O-N 3.38Å; A77-R123 PolarHBondContact O-NH1 3.06Å
78	E	51.1	Low	62.4	Low	144 Å²	144	92.8 Å²	92.8	67%	0.673	50%	0.503	S	S	*	.	H	α-helix	trans	-82.9	-23.4	-174.7	-95.9	161	153.1	0	0	114.8
79	S	49.9	Very low	63.8	Low	86 Å²	86	95.6 Å²	95.6	60%	0.601	51%	0.514	S	S	*	.	H	α-helix	trans	-105.9	-7.6	-163.5	-59.3	0	0	0	0	117.5
80	N	51.7	Low	65.1	Low	75 Å²	75	95 Å²	95	40%	0.401	51%	0.511	S	S	.	.			trans	-130.5	34.7	-156.6	-71.3	-32.9	0	0	0	118.3	S82 N83	N80-S82 PolarHBondContact O-N 3.3Å; N80-N83 PolarHBondContact O-N 3.5Å
81	N	55.7	Low	66.5	Low	72 Å²	72	93.3 Å²	93.3	39%	0.385	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-10	170.3	-140.8	-16.4	0	0	0	113.1	L84	N81-L84 WeakPolarHBondContact OD1-CD1 3.39Å
82	S	59.1	Low	67.9	Low	90 Å²	90	85.3 Å²	85.3	63%	0.629	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-20.3	174.2	57.6	0	0	0	0	113.6	N80	N80-S82 PolarHBondContact O-N 3.3Å
83	N	65.1	Low	69.5	Low	122 Å²	122	83.2 Å²	83.2	65%	0.652	46%	0.464	S	S	*	.	S	Bend	trans	-107.3	1.8	-170.9	-64.2	-11.5	0	0	0	114	N80	N80-N83 PolarHBondContact O-N 3.5Å
84	L	68.3	Low	71.2	Confident	59 Å²	59	82 Å²	82	31%	0.309	46%	0.458	S	S	.	.	S	Bend	trans	-70.2	143.5	175.2	-67.3	-175.4	0	0	0	110.8	N81 D88 K89 V92	N81-L84 WeakPolarHBondContact OD1-CD1 3.39Å; L84-D88 HydrophobicContact CB-CB 4Å; L84-D88 HydrophobicContact CD1-CB 4.48Å; L84-D88 HydrophobicContact CD2-CB 4.38Å; L84-K89 HydrophobicContact CB-CG 3.86Å; L84-K89 WeakPolarHBondContact O-CE 3.47Å; L84-K89 PolarHBondContact O-NZ 3.39Å; L84-V92 HydrophobicContact CD1-CG2 4.33Å
85	S	82.1	Confident	72.9	Confident	54 Å²	54	77.7 Å²	77.7	38%	0.378	44%	0.438	S	S	.	.			trans	-60	158.6	171.8	73.7	0	0	0	0	109.8	E87 D88 K89	S85-E87 PolarHBondContact O-N 2.85Å; S85-D88 WeakPolarHBondContact CB-OD2 3.5Å; S85-D88 PolarHBondContact N-OD2 3.34Å; S85-D88 PolarHBondContact O-N 3.24Å; S85-D88 PolarHBondContact OG-N 3.14Å; S85-D88 PolarHBondContact OG-OD2 3.44Å; S85-K89 WeakPolarHBondContact O-CG 3.45Å; S85-K89 PolarHBondContact O-N 3.47Å
86	D	83.8	Confident	74.8	Confident	125 Å²	125	75.2 Å²	75.2	67%	0.668	42%	0.42	S	S	*	.	H	α-helix	trans	-62.3	-31	179.1	-66.1	-32.4	0	0	0	111.5	K89 T90	D86-K89 IonicContact OD1-NZ 3.52Å; D86-T90 VanDerWaalsContact O-CG2 3.28Å; D86-T90 WeakPolarHBondContact O-CG2 3.03Å; D86-T90 PolarHBondContact O-N 2.79Å
87	E	84.6	Confident	76.8	Confident	153 Å²	153	72.4 Å²	72.4	72%	0.715	40%	0.397	S	S	*	.	H	α-helix	trans	-64	-51.6	173.8	-62.8	-179.5	170.4	0	0	111	S85 K89 T90 E91	S85-E87 PolarHBondContact O-N 2.85Å; E87-K89 VanDerWaalsContact C-N 3.31Å; E87-K89 PolarHBondContact O-N 3.33Å; E87-T90 PolarHBondContact O-N 2.89Å; E87-T90 PolarHBondContact O-OG1 3.31Å; E87-E91 PolarHBondContact O-N 3.19Å
88	D	87	Confident	78.9	Confident	70 Å²	70	72.4 Å²	72.4	37%	0.374	38%	0.383	S	S	.	.	H	α-helix	trans	-59.4	-41.2	178.3	-61.4	-43	0	0	0	111.9	L84 S85 T90 E91 V92	L84-D88 HydrophobicContact CB-CB 4Å; L84-D88 HydrophobicContact CD1-CB 4.48Å; L84-D88 HydrophobicContact CD2-CB 4.38Å; S85-D88 WeakPolarHBondContact CB-OD2 3.5Å; S85-D88 PolarHBondContact N-OD2 3.34Å; S85-D88 PolarHBondContact O-N 3.24Å; S85-D88 PolarHBondContact OG-N 3.14Å; S85-D88 PolarHBondContact OG-OD2 3.44Å; D88-T90 VanDerWaalsContact C-N 3.31Å; D88-T90 PolarHBondContact O-N 3.39Å; D88-E91 PolarHBondContact O-N 2.84Å; D88-V92 WeakPolarHBondContact O-CB 3.49Å; D88-V92 VanDerWaalsContact O-CG2 3.3Å; D88-V92 WeakPolarHBondContact O-CG2 3.25Å; D88-V92 PolarHBondContact O-N 3.46Å
89	K	86.5	Confident	81.1	Confident	63 Å²	63	65.6 Å²	65.6	27%	0.274	35%	0.351	S	S	.	.	H	α-helix	trans	-60.6	-42.6	175.6	-71.4	171.8	-175.3	140.3	0	111.2	L84 S85 D86 E87 E91 V92 D93	L84-K89 HydrophobicContact CB-CG 3.86Å; L84-K89 WeakPolarHBondContact O-CE 3.47Å; L84-K89 PolarHBondContact O-NZ 3.39Å; S85-K89 WeakPolarHBondContact O-CG 3.45Å; S85-K89 PolarHBondContact O-N 3.47Å; D86-K89 IonicContact OD1-NZ 3.52Å; E87-K89 VanDerWaalsContact C-N 3.31Å; E87-K89 PolarHBondContact O-N 3.33Å; K89-E91 VanDerWaalsContact C-N 3.35Å; K89-V92 PolarHBondContact O-N 2.96Å; K89-D93 VanDerWaalsContact O-CB 3.27Å; K89-D93 WeakPolarHBondContact O-CB 3.13Å; K89-D93 PolarHBondContact O-N 3.29Å
90	T	87.4	Confident	83.2	Confident	60 Å²	60	61.5 Å²	61.5	37%	0.368	32%	0.323	S	S	.	.	H	α-helix	trans	-65.4	-39.1	176.8	62.4	0	0	0	0	111.7	D86 E87 D88 D93 L94 T172	D86-T90 VanDerWaalsContact O-CG2 3.28Å; D86-T90 WeakPolarHBondContact O-CG2 3.03Å; D86-T90 PolarHBondContact O-N 2.79Å; E87-T90 PolarHBondContact O-N 2.89Å; E87-T90 PolarHBondContact O-OG1 3.31Å; D88-T90 VanDerWaalsContact C-N 3.31Å; D88-T90 PolarHBondContact O-N 3.39Å; T90-D93 PolarHBondContact O-N 3.46Å; T90-L94 WeakPolarHBondContact O-CB 3.25Å; T90-L94 WeakPolarHBondContact O-CG 3.1Å; T90-L94 PolarHBondContact O-N 2.88Å; T90-T172 HydrophobicContact CG2-CG2 4.21Å
91	E	89.8	Confident	85.3	Confident	94 Å²	94	61.6 Å²	61.6	44%	0.439	32%	0.323	S	S	.	.	H	α-helix	trans	-66.7	-41	177	-67.6	-167.1	165.7	0	0	113	E87 D88 K89 L94 R95	E87-E91 PolarHBondContact O-N 3.19Å; D88-E91 PolarHBondContact O-N 2.84Å; K89-E91 VanDerWaalsContact C-N 3.35Å; E91-L94 PolarHBondContact O-N 3.42Å; E91-R95 PolarHBondContact O-N 3.25Å; E91-R95 VanDerWaalsContact O-N 3.13Å
92	V	91.1	Very high	87.1	Confident	13 Å²	13	58.2 Å²	58.2	8%	0.079	31%	0.306	C	S	.	.	H	α-helix	trans	-62.4	-44.6	172.7	169.4	0	0	0	0	110.4	L84 D88 K89 L94 R95 S96 E142	L84-V92 HydrophobicContact CD1-CG2 4.33Å; D88-V92 WeakPolarHBondContact O-CB 3.49Å; D88-V92 VanDerWaalsContact O-CG2 3.3Å; D88-V92 WeakPolarHBondContact O-CG2 3.25Å; D88-V92 PolarHBondContact O-N 3.46Å; K89-V92 PolarHBondContact O-N 2.96Å; V92-L94 VanDerWaalsContact C-N 3.32Å; V92-L94 PolarHBondContact O-N 3.18Å; V92-R95 CarbonylContact O-C 3.44Å; V92-R95 PolarHBondContact O-N 3.18Å; V92-R95 VanDerWaalsContact O-N 3.15Å; V92-S96 WeakPolarHBondContact O-CB 3.41Å; V92-S96 PolarHBondContact O-N 2.95Å; V92-S96 VanDerWaalsContact O-N 3.09Å; V92-S96 PolarHBondContact O-OG 3.41Å; V92-E142 HydrophobicContact CG1-CG 4.02Å
93	D	91	Very high	88.8	Confident	22 Å²	22	55.6 Å²	55.6	12%	0.118	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-37.5	177.3	-76.2	-17.8	0	0	0	112	K89 T90 R95 S96 K170 T172	K89-D93 VanDerWaalsContact O-CB 3.27Å; K89-D93 WeakPolarHBondContact O-CB 3.13Å; K89-D93 PolarHBondContact O-N 3.29Å; T90-D93 PolarHBondContact O-N 3.46Å; D93-R95 VanDerWaalsContact C-N 3.29Å; D93-R95 PolarHBondContact O-N 3.12Å; D93-S96 WeakPolarHBondContact O-CB 3.33Å; D93-S96 PolarHBondContact O-N 3.27Å; D93-S96 VanDerWaalsContact O-N 3.1Å; D93-K170 HydrophobicContact CB-CD 4.49Å; D93-K170 WeakPolarHBondContact OD1-CD 3.3Å; D93-K170 WeakPolarHBondContact OD1-CE 3.43Å; D93-K170 IonicContact OD1-NZ 2.65Å; D93-K170 PolarHBondContact OD1-NZ 3.47Å; D93-T172 HydrophobicContact CB-CG2 3.71Å; D93-T172 WeakPolarHBondContact OD2-CA 3.37Å
94	L	92.6	Very high	90.1	Very high	94 Å²	94	56.5 Å²	56.5	49%	0.492	28%	0.28	S	S	.	.	H	α-helix	trans	-66.9	-29.1	175.2	-72.9	171.4	0	0	0	113	T90 E91 V92 S96	T90-L94 WeakPolarHBondContact O-CB 3.25Å; T90-L94 WeakPolarHBondContact O-CG 3.1Å; T90-L94 PolarHBondContact O-N 2.88Å; E91-L94 PolarHBondContact O-N 3.42Å; V92-L94 VanDerWaalsContact C-N 3.32Å; V92-L94 PolarHBondContact O-N 3.18Å; L94-S96 VanDerWaalsContact C-N 3.3Å
95	R	93.9	Very high	91.2	Very high	53 Å²	53	55.6 Å²	55.6	20%	0.2	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	7.3	172.7	-66.9	-172.1	-69.1	156.6	4.3	113.1	E91 V92 D93 F143 D144 R146 V149	E91-R95 PolarHBondContact O-N 3.25Å; E91-R95 VanDerWaalsContact O-N 3.13Å; V92-R95 CarbonylContact O-C 3.44Å; V92-R95 PolarHBondContact O-N 3.18Å; V92-R95 VanDerWaalsContact O-N 3.15Å; D93-R95 VanDerWaalsContact C-N 3.29Å; D93-R95 PolarHBondContact O-N 3.12Å; R95-F143 WeakPolarHBondContact CB-O 3.36Å; R95-F143 PolarHBondContact O-N 3.41Å; R95-D144 WeakPolarHBondContact CD-O 3.35Å; R95-D144 PolarHBondContact NH1-O 2.86Å; R95-D144 IonicContact NH1-OD1 3.26Å; R95-D144 PolarHBondContact NH1-OD1 2.83Å; R95-R146 HydrophobicContact CG-CG 3.68Å; R95-V149 VanDerWaalsContact C-CG2 3.43Å; R95-V149 WeakPolarHBondContact O-CG2 3.46Å
96	S	94.9	Very high	91.7	Very high	4 Å²	4	53.6 Å²	53.6	3%	0.028	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	149.4	-176.9	-65.9	0	0	0	0	112.8	V92 D93 L94 I141 K170	V92-S96 WeakPolarHBondContact O-CB 3.41Å; V92-S96 PolarHBondContact O-N 2.95Å; V92-S96 VanDerWaalsContact O-N 3.09Å; V92-S96 PolarHBondContact O-OG 3.41Å; D93-S96 WeakPolarHBondContact O-CB 3.33Å; D93-S96 PolarHBondContact O-N 3.27Å; D93-S96 VanDerWaalsContact O-N 3.1Å; L94-S96 VanDerWaalsContact C-N 3.3Å; S96-I141 CarbonylContact C-O 3.59Å; S96-I141 WeakPolarHBondContact CA-O 3.33Å; S96-K170 WeakPolarHBondContact O-CB 3.43Å; S96-K170 PolarHBondContact O-N 2.92Å
97	V	95.8	Very high	92.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139.8	179.6	172.7	0	0	0	0	110	V99 Y140 I141 F143 V149 A152 V167	V97-V99 HydrophobicContact CG1-CG2 4.16Å; V97-Y140 VanDerWaalsContact O-CA 3.32Å; V97-Y140 WeakPolarHBondContact O-CA 3.19Å; V97-I141 PolarHBondContact N-O 2.97Å; V97-I141 PolarHBondContact O-N 2.83Å; V97-F143 HydrophobicContact CB-CE2 4.03Å; V97-F143 HydrophobicContact CG2-CD2 4.09Å; V97-F143 HydrophobicContact CG2-CE2 3.65Å; V97-V149 HydrophobicContact CG2-CB 4.1Å; V97-V149 HydrophobicContact CG2-CG1 3.68Å; V97-V149 HydrophobicContact CG2-CG2 4.14Å; V97-A152 HydrophobicContact CG2-CB 4.06Å; V97-V167 HydrophobicContact CG1-CG1 3.21Å
98	Y	96.2	Very high	92.6	Very high	68 Å²	68	45.1 Å²	45.1	27%	0.267	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	126.2	165.9	170.4	-96.2	0	0	0	109.8	F138 Y140 V167 L168	Y98-F138 HydrophobicContact CE2-CB 3.7Å; Y98-F138 AromaticContact CE2-CD2 3.88Å; Y98-F138 HydrophobicContact CE2-CD2 3.88Å; Y98-F138 AromaticContact CE2-CG 3.98Å; Y98-F138 HydrophobicContact CE2-CG 3.98Å; Y98-Y140 HydrophobicContact CD2-CD1 4.3Å; Y98-Y140 AromaticContact CD2-CE1 3.65Å; Y98-Y140 HydrophobicContact CD2-CE1 3.65Å; Y98-Y140 HydrophobicContact CG-CE1 4.38Å; Y98-V167 WeakPolarHBondContact O-CA 3.47Å; Y98-L168 WeakPolarHBondContact CA-O 3.42Å; Y98-L168 WeakPolarHBondContact CB-O 3.43Å; Y98-L168 HydrophobicContact CD1-CB 4.2Å; Y98-L168 HydrophobicContact CD1-CD1 4.41Å; Y98-L168 PolarHBondContact N-O 3.38Å; Y98-L168 PolarHBondContact O-N 3Å
99	V	95.7	Very high	93	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	112.6	173.7	-170.8	0	0	0	0	108.3	V97 V102 F115 F138 A139 I141 L165 K166	V97-V99 HydrophobicContact CG1-CG2 4.16Å; V99-V102 HydrophobicContact CB-CG2 4.12Å; V99-V102 HydrophobicContact CG1-CG2 3.56Å; V99-F115 HydrophobicContact CG1-CE2 4.16Å; V99-F115 HydrophobicContact CG1-CZ 4.13Å; V99-F115 HydrophobicContact CG2-CE2 3.88Å; V99-F115 HydrophobicContact CG2-CZ 3.79Å; V99-F138 CarbonylContact O-C 3.5Å; V99-F138 WeakPolarHBondContact O-CA 3.25Å; V99-F138 WeakPolarHBondContact O-CB 3.47Å; V99-A139 PolarHBondContact N-O 3.33Å; V99-A139 PolarHBondContact O-N 2.89Å; V99-I141 HydrophobicContact CG2-CD1 3.79Å; V99-I141 HydrophobicContact CG2-CG1 4.17Å; V99-L165 HydrophobicContact CG1-CB 4.28Å; V99-L165 HydrophobicContact CG1-CD1 4.11Å; V99-L165 HydrophobicContact CG1-CD2 4.18Å; V99-L165 HydrophobicContact CG1-CG 4.43Å; V99-K166 CarbonylContact C-O 3.53Å
100	G	95.6	Very high	93.4	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	167.3	177.1	0	0	0	0	0	112.8	V102 K166	G100-V102 PolarHBondContact O-N 3.46Å; G100-K166 PolarHBondContact N-O 3.23Å; G100-K166 PolarHBondContact O-N 3.01Å
101	N	95.1	Very high	93.7	Very high	76 Å²	76	44.9 Å²	44.9	41%	0.406	24%	0.235	S	C	.	.	S	Bend	trans	60.3	25.8	-177.9	-161.6	37.1	0	0	0	114.1	G137 R163 Q164	N101-G137 PolarHBondContact N-O 3.21Å; N101-R163 PolarHBondContact O-NE 3.01Å; N101-R163 PolarHBondContact O-NH2 2.92Å; N101-R163 PolarHBondContact OD1-NE 3.39Å; N101-R163 PolarHBondContact OD1-NH2 3.39Å; N101-Q164 WeakPolarHBondContact CB-O 3.02Å; N101-Q164 PolarHBondContact ND2-O 2.73Å
102	V	94.1	Very high	94	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.012	23%	0.233	C	C	.	.			trans	-67	143.4	176.8	-176.7	0	0	0	0	109.4	V99 G100 S106 L111 G137 F160 L165	V99-V102 HydrophobicContact CB-CG2 4.12Å; V99-V102 HydrophobicContact CG1-CG2 3.56Å; G100-V102 PolarHBondContact O-N 3.46Å; V102-S106 WeakPolarHBondContact CG1-OG 3.46Å; V102-L111 HydrophobicContact CG1-CD1 4.27Å; V102-L111 HydrophobicContact CG1-CD2 4.01Å; V102-L111 HydrophobicContact CG2-CD2 4.43Å; V102-G137 PolarHBondContact N-O 3.3Å; V102-G137 WeakPolarHBondContact O-CA 3.46Å; V102-F160 HydrophobicContact CG1-CE1 4.45Å; V102-L165 HydrophobicContact CG2-CD2 4.1Å
103	D	94	Very high	94.1	Very high	35 Å²	35	47.1 Å²	47.1	19%	0.187	26%	0.257	C	S	.	.			trans	-62.7	145	176.4	-171.2	47.2	0	0	0	112.3	G105 S106 R161 R163	D103-G105 PolarHBondContact O-N 2.76Å; D103-G105 PolarHBondContact OD2-N 2.86Å; D103-S106 WeakPolarHBondContact O-CB 3.21Å; D103-S106 PolarHBondContact O-N 2.88Å; D103-S106 PolarHBondContact O-OG 2.77Å; D103-R161 HydrophobicContact CB-CB 4.11Å; D103-R161 IonicContact OD2-CZ 3.67Å; D103-R161 IonicContact OD2-NE 2.88Å; D103-R161 PolarHBondContact OD2-NE 2.76Å; D103-R161 IonicContact OD2-NH2 3.71Å; D103-R161 PolarHBondContact OD2-NH2 3.07Å; D103-R163 IonicContact OD1-NH1 3.44Å; D103-R163 PolarHBondContact OD1-NH1 3.49Å
104	Y	93.2	Very high	94.2	Very high	140 Å²	140	48.5 Å²	48.5	55%	0.549	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-22.3	-179.2	-62.2	-67.5	0	0	0	112.5	P135	Y104-P135 HydrophobicContact CD1-CB 4.31Å; Y104-P135 HydrophobicContact CD1-CG 4.05Å; Y104-P135 WeakPolarHBondContact CD1-O 3.44Å; Y104-P135 WeakPolarHBondContact CE1-O 3.47Å; Y104-P135 WeakPolarHBondContact O-CG 3.38Å
105	G	91.6	Very high	94.3	Very high	41 Å²	41	44 Å²	44	42%	0.423	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	7.7	175.3	0	0	0	0	0	114.4	D103	D103-G105 PolarHBondContact O-N 2.76Å; D103-G105 PolarHBondContact OD2-N 2.86Å
106	S	92	Very high	94.3	Very high	12 Å²	12	50.4 Å²	50.4	8%	0.084	26%	0.263	C	S	.	.			trans	-70.8	135.9	-178.8	69.2	0	0	0	0	111.6	V102 D103	V102-S106 WeakPolarHBondContact CG1-OG 3.46Å; D103-S106 WeakPolarHBondContact O-CB 3.21Å; D103-S106 PolarHBondContact O-N 2.88Å; D103-S106 PolarHBondContact O-OG 2.77Å
107	T	94.1	Very high	94.2	Very high	63 Å²	63	54 Å²	54	39%	0.387	30%	0.301	S	S	.	.			trans	-93.3	163.6	170.9	62.2	0	0	0	0	111.2	D109 E110 L111	T107-D109 VanDerWaalsContact C-N 3.27Å; T107-D109 PolarHBondContact O-N 3.19Å; T107-E110 PolarHBondContact O-N 2.62Å; T107-E110 WeakPolarHBondContact OG1-CG 2.9Å; T107-E110 PolarHBondContact OG1-N 3.11Å; T107-L111 PolarHBondContact O-N 2.75Å
108	A	93.5	Very high	94	Very high	37 Å²	37	55 Å²	55	31%	0.306	31%	0.308	S	S	.	.	H	α-helix	trans	-60	-41.5	174.2	0	0	0	0	0	110.9	E110 L111 E112 V124 I126	A108-E110 VanDerWaalsContact C-N 3.33Å; A108-E110 PolarHBondContact O-N 3.13Å; A108-L111 PolarHBondContact O-N 3.46Å; A108-E112 WeakPolarHBondContact O-CB 3.35Å; A108-E112 PolarHBondContact O-N 3.32Å; A108-V124 HydrophobicContact CB-CB 4.26Å; A108-V124 HydrophobicContact CB-CG1 4.1Å; A108-I126 HydrophobicContact CB-CD1 4.4Å
109	D	95.1	Very high	93.9	Very high	119 Å²	119	52.5 Å²	52.5	64%	0.636	30%	0.302	S	S	*	.	H	α-helix	trans	-59.7	-40.1	179.1	-51.1	-9.3	0	0	0	112.6	T107 E112 A113	T107-D109 VanDerWaalsContact C-N 3.27Å; T107-D109 PolarHBondContact O-N 3.19Å; D109-E112 PolarHBondContact O-N 3.06Å; D109-A113 WeakPolarHBondContact O-CB 3.17Å; D109-A113 PolarHBondContact O-N 3.39Å
110	E	94.6	Very high	93.9	Very high	69 Å²	69	56.1 Å²	56.1	32%	0.322	33%	0.326	S	S	.	.	H	α-helix	trans	-66.9	-40.3	177.7	-74.7	176.3	-178	0	0	111.9	T107 A108 H114 F160 R161	T107-E110 PolarHBondContact O-N 2.62Å; T107-E110 WeakPolarHBondContact OG1-CG 2.9Å; T107-E110 PolarHBondContact OG1-N 3.11Å; A108-E110 VanDerWaalsContact C-N 3.33Å; A108-E110 PolarHBondContact O-N 3.13Å; E110-H114 PolarHBondContact O-N 3.23Å; E110-H114 VanDerWaalsContact O-N 3.12Å; E110-F160 HydrophobicContact CB-CE2 4.04Å; E110-F160 HydrophobicContact CB-CZ 3.8Å; E110-R161 VanDerWaalsContact CD-NH1 3.26Å; E110-R161 IonicContact OE1-NH1 3.41Å; E110-R161 PolarHBondContact OE1-NH1 3Å; E110-R161 WeakPolarHBondContact OE2-CD 3.48Å; E110-R161 IonicContact OE2-CZ 3.29Å; E110-R161 IonicContact OE2-NE 3.19Å; E110-R161 IonicContact OE2-NH1 2.77Å; E110-R161 PolarHBondContact OE2-NH1 3.02Å
111	L	94	Very high	93.9	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-43.6	174.8	-69.8	175	0	0	0	110.8	V102 T107 A108 A113 H114 F115 V124 I126 A139 I141 F160	V102-L111 HydrophobicContact CG1-CD1 4.27Å; V102-L111 HydrophobicContact CG1-CD2 4.01Å; V102-L111 HydrophobicContact CG2-CD2 4.43Å; T107-L111 PolarHBondContact O-N 2.75Å; A108-L111 PolarHBondContact O-N 3.46Å; L111-A113 VanDerWaalsContact C-N 3.35Å; L111-A113 PolarHBondContact O-N 3.13Å; L111-H114 PolarHBondContact O-N 3.13Å; L111-F115 VanDerWaalsContact O-CD2 3.29Å; L111-F115 WeakPolarHBondContact O-CD2 3.38Å; L111-F115 PolarHBondContact O-N 2.93Å; L111-V124 HydrophobicContact CB-CG1 4.23Å; L111-V124 HydrophobicContact CD1-CG1 4.14Å; L111-I126 HydrophobicContact CD1-CD1 4Å; L111-I126 HydrophobicContact CD1-CG1 3.92Å; L111-A139 HydrophobicContact CD1-CB 3.71Å; L111-I141 HydrophobicContact CB-CD1 4.48Å; L111-F160 HydrophobicContact CD2-CE1 4.27Å; L111-F160 HydrophobicContact CD2-CE2 4.47Å; L111-F160 HydrophobicContact CD2-CZ 4.1Å
112	E	95	Very high	93.8	Very high	83 Å²	83	58.7 Å²	58.7	39%	0.388	34%	0.339	S	S	.	.	H	α-helix	trans	-58.2	-48.9	176.6	-166.6	-172.8	149	0	0	110.6	A108 D109 H114 F115 R116 I121 V124	A108-E112 WeakPolarHBondContact O-CB 3.35Å; A108-E112 PolarHBondContact O-N 3.32Å; D109-E112 PolarHBondContact O-N 3.06Å; E112-H114 VanDerWaalsContact C-N 3.3Å; E112-H114 PolarHBondContact O-N 2.86Å; E112-F115 PolarHBondContact O-N 3.16Å; E112-R116 VanDerWaalsContact O-CB 3.25Å; E112-R116 WeakPolarHBondContact O-CB 2.96Å; E112-R116 PolarHBondContact O-N 3.41Å; E112-I121 HydrophobicContact CB-CD1 4.29Å; E112-I121 HydrophobicContact CG-CB 4.33Å; E112-I121 HydrophobicContact CG-CD1 3.65Å; E112-I121 HydrophobicContact CG-CG2 4.43Å; E112-I121 WeakPolarHBondContact O-CD1 3.48Å; E112-V124 HydrophobicContact CB-CG2 4.25Å
113	A	94.4	Very high	93.7	Very high	70 Å²	70	62.8 Å²	62.8	58%	0.579	35%	0.354	S	S	*	.	H	α-helix	trans	-58.8	-39.3	178.2	0	0	0	0	0	112.9	D109 L111	D109-A113 WeakPolarHBondContact O-CB 3.17Å; D109-A113 PolarHBondContact O-N 3.39Å; L111-A113 VanDerWaalsContact C-N 3.35Å; L111-A113 PolarHBondContact O-N 3.13Å
114	H	93.5	Very high	93.8	Very high	51 Å²	51	62.4 Å²	62.4	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-67.2	-42.2	177.9	-178	-78.8	0	0	0	112.3	E110 L111 E112 S158 F160	E110-H114 PolarHBondContact O-N 3.23Å; E110-H114 VanDerWaalsContact O-N 3.12Å; L111-H114 PolarHBondContact O-N 3.13Å; E112-H114 VanDerWaalsContact C-N 3.3Å; E112-H114 PolarHBondContact O-N 2.86Å; H114-S158 PolarHBondContact CE1-OG 3.11Å; H114-S158 PolarHBondContact NE2-OG 3.32Å; H114-F160 HydrophobicContact CB-CD2 4.4Å
115	F	94.7	Very high	93.8	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-91.3	-7.1	-176.9	-72.8	-77.6	0	0	0	114.4	V99 L111 E112 G117 C118 I121 I141 F143 A152 L165 V167	V99-F115 HydrophobicContact CG1-CE2 4.16Å; V99-F115 HydrophobicContact CG1-CZ 4.13Å; V99-F115 HydrophobicContact CG2-CE2 3.88Å; V99-F115 HydrophobicContact CG2-CZ 3.79Å; L111-F115 VanDerWaalsContact O-CD2 3.29Å; L111-F115 WeakPolarHBondContact O-CD2 3.38Å; L111-F115 PolarHBondContact O-N 2.93Å; E112-F115 PolarHBondContact O-N 3.16Å; F115-G117 PolarHBondContact O-N 3.28Å; F115-G117 VanDerWaalsContact O-N 3.15Å; F115-C118 WeakPolarHBondContact O-CB 3.39Å; F115-C118 PolarHBondContact O-N 3.15Å; F115-I121 HydrophobicContact CB-CD1 3.89Å; F115-I141 HydrophobicContact CB-CD1 4.19Å; F115-I141 HydrophobicContact CD2-CD1 3.14Å; F115-I141 HydrophobicContact CE2-CD1 3.55Å; F115-I141 HydrophobicContact CG-CD1 3.71Å; F115-I141 HydrophobicContact CZ-CD1 4.39Å; F115-F143 HydrophobicContact CB-CE1 4.27Å; F115-F143 HydrophobicContact CB-CZ 4.05Å; F115-F143 HydrophobicContact CD1-CZ 4.34Å; F115-F143 HydrophobicContact CG-CZ 4.44Å; F115-A152 HydrophobicContact CD1-CB 4.02Å; F115-A152 HydrophobicContact CE1-CB 4.2Å; F115-L165 HydrophobicContact CE2-CD1 4.17Å; F115-L165 HydrophobicContact CZ-CD1 4.17Å; F115-V167 HydrophobicContact CE1-CG1 4.4Å; F115-V167 HydrophobicContact CE1-CG2 4.11Å; F115-V167 HydrophobicContact CZ-CG2 3.92Å
116	R	93.5	Very high	93.9	Very high	188 Å²	188	58.7 Å²	58.7	71%	0.709	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-28.4	178.4	-171.8	172.9	-175.9	-179	3.5	113.3	E112 C118	E112-R116 VanDerWaalsContact O-CB 3.25Å; E112-R116 WeakPolarHBondContact O-CB 2.96Å; E112-R116 PolarHBondContact O-N 3.41Å; R116-C118 VanDerWaalsContact C-N 3.26Å; R116-C118 PolarHBondContact O-N 3.37Å
117	G	92	Very high	93.9	Very high	79 Å²	79	60.5 Å²	60.5	81%	0.814	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-21.5	175.7	0	0	0	0	0	114.2	F115	F115-G117 PolarHBondContact O-N 3.28Å; F115-G117 VanDerWaalsContact O-N 3.15Å
118	C	93	Very high	93.9	Very high	22 Å²	22	60.4 Å²	60.4	15%	0.149	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-31.7	179.3	-57.5	0	0	0	0	112.4	F115 R116 F143 A151 A152 L155	F115-C118 WeakPolarHBondContact O-CB 3.39Å; F115-C118 PolarHBondContact O-N 3.15Å; R116-C118 VanDerWaalsContact C-N 3.26Å; R116-C118 PolarHBondContact O-N 3.37Å; C118-F143 HydrophobicContact CB-CE1 4.44Å; C118-A151 HydrophobicContact CB-CB 3.87Å; C118-A152 HydrophobicContact CB-CB 4.37Å; C118-L155 WeakPolarHBondContact SG-CD1 3.22Å
119	G	94.1	Very high	93.8	Very high	15 Å²	15	61.1 Å²	61.1	16%	0.155	34%	0.343	C	S	.	.	S	Bend	trans	165	176.9	-179.8	0	0	0	0	0	113.9	I121	G119-I121 PolarHBondContact O-N 3.44Å
120	P	94.8	Very high	93.6	Very high	75 Å²	75	65 Å²	65	49%	0.487	35%	0.354	S	S	.	.			trans	-65.6	129.2	175.6	27	-33.9	0	0	0	111.3	D144	P120-D144 HydrophobicContact CB-CB 4.3Å; P120-D144 HydrophobicContact CG-CB 3.89Å; P120-D144 PolarHBondContact O-N 3.42Å
121	I	95.5	Very high	93.4	Very high	34 Å²	34	70.9 Å²	70.9	17%	0.174	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	129.8	-178.6	-64.1	167.1	0	0	0	108.6	E112 F115 G119 V124 I141 F143	E112-I121 HydrophobicContact CB-CD1 4.29Å; E112-I121 HydrophobicContact CG-CB 4.33Å; E112-I121 HydrophobicContact CG-CD1 3.65Å; E112-I121 HydrophobicContact CG-CG2 4.43Å; E112-I121 WeakPolarHBondContact O-CD1 3.48Å; F115-I121 HydrophobicContact CB-CD1 3.89Å; G119-I121 PolarHBondContact O-N 3.44Å; I121-V124 HydrophobicContact CG2-CG2 3.8Å; I121-I141 HydrophobicContact CD1-CG2 4.33Å; I121-I141 HydrophobicContact CG1-CG2 4.17Å; I121-I141 HydrophobicContact CG2-CG2 3.89Å; I121-F143 HydrophobicContact CD1-CE1 4.24Å; I121-F143 HydrophobicContact CG1-CD1 3.79Å; I121-F143 HydrophobicContact CG1-CE1 3.6Å
122	N	93.6	Very high	93.3	Very high	98 Å²	98	74.4 Å²	74.4	52%	0.524	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-44.9	175.4	-164.5	15.7	0	0	0	110.7	E142	N122-E142 HydrophobicContact CB-CB 4.46Å; N122-E142 HydrophobicContact CB-CG 4.11Å; N122-E142 PolarHBondContact N-O 3.33Å; N122-E142 PolarHBondContact ND2-OE1 3.43Å
123	R	92	Very high	93.1	Very high	87 Å²	87	73 Å²	73	33%	0.328	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	141.4	-175.6	-170.9	175.6	177.1	144.8	6.1	112.9	A77 E142	A77-R123 PolarHBondContact O-NH1 3.06Å; R123-E142 HydrophobicContact CB-CB 4.15Å; R123-E142 PolarHBondContact N-O 3.13Å; R123-E142 PolarHBondContact O-N 2.62Å
124	V	95	Very high	92.8	Very high	27 Å²	27	75.7 Å²	75.7	16%	0.164	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	128.8	169.6	-177.8	0	0	0	0	109.3	A108 L111 E112 I121 I141	A108-V124 HydrophobicContact CB-CB 4.26Å; A108-V124 HydrophobicContact CB-CG1 4.1Å; L111-V124 HydrophobicContact CB-CG1 4.23Å; L111-V124 HydrophobicContact CD1-CG1 4.14Å; E112-V124 HydrophobicContact CB-CG2 4.25Å; I121-V124 HydrophobicContact CG2-CG2 3.8Å; V124-I141 HydrophobicContact CG1-CG1 4.4Å; V124-I141 HydrophobicContact CG2-CG1 4.46Å; V124-I141 HydrophobicContact CG2-CG2 4.47Å
125	T	93.8	Very high	92.7	Very high	52 Å²	52	74.8 Å²	74.8	32%	0.319	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	107.3	179.9	-55.1	0	0	0	0	110.3	L127 A139 Y140	T125-L127 HydrophobicContact CG2-CD1 4.01Å; T125-A139 CarbonylContact O-C 3.49Å; T125-A139 VanDerWaalsContact O-CA 3.27Å; T125-A139 WeakPolarHBondContact O-CA 3.38Å; T125-Y140 PolarHBondContact N-O 2.89Å; T125-Y140 PolarHBondContact O-N 2.81Å
126	I	94.1	Very high	92.6	Very high	51 Å²	51	79.8 Å²	79.8	26%	0.262	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	125.3	174.6	-59.3	174.7	0	0	0	108.7	A108 L111 A139	A108-I126 HydrophobicContact CB-CD1 4.4Å; L111-I126 HydrophobicContact CD1-CD1 4Å; L111-I126 HydrophobicContact CD1-CG1 3.92Å; I126-A139 HydrophobicContact CG1-CB 4.15Å
127	L	92.2	Very high	92.6	Very high	51 Å²	51	71.2 Å²	71.2	27%	0.267	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	119	-179.3	-88.4	81.7	0	0	0	111.4	T125 K136 F138 Y140	T125-L127 HydrophobicContact CG2-CD1 4.01Å; L127-K136 WeakPolarHBondContact O-CB 3.29Å; L127-K136 PolarHBondContact O-N 2.99Å; L127-F138 HydrophobicContact CB-CD2 4Å; L127-F138 HydrophobicContact CB-CE2 3.49Å; L127-F138 VanDerWaalsContact CB-CE2 3.49Å; L127-F138 HydrophobicContact CB-CZ 3.78Å; L127-F138 HydrophobicContact CD1-CD2 4.47Å; L127-F138 HydrophobicContact CD1-CE2 4.11Å; L127-F138 HydrophobicContact CD2-CE2 3.55Å; L127-F138 HydrophobicContact CD2-CZ 3.9Å; L127-F138 HydrophobicContact CG-CE2 3.86Å; L127-F138 HydrophobicContact CG-CZ 4.38Å; L127-F138 PolarHBondContact N-O 3.24Å; L127-F138 VanDerWaalsContact N-O 3.15Å; L127-Y140 HydrophobicContact CD1-CD2 3.37Å; L127-Y140 HydrophobicContact CD1-CE2 3.5Å; L127-Y140 VanDerWaalsContact CD1-CE2 3.5Å; L127-Y140 HydrophobicContact CD2-CE2 4.11Å; L127-Y140 HydrophobicContact CG-CE2 4.44Å
128	C	92.9	Very high	92.7	Very high	60 Å²	60	69.2 Å²	69.2	41%	0.405	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	155.4	172	-59.6	0	0	0	0	111.6	K130 G133 H134	C128-K130 PolarHBondContact O-N 2.85Å; C128-G133 WeakPolarHBondContact CB-O 3.28Å; C128-H134 WeakPolarHBondContact CA-O 3.32Å
129	N	91.6	Very high	92.8	Very high	52 Å²	52	68.2 Å²	68.2	28%	0.278	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-69.6	127.3	171.3	-174.2	1.4	0	0	0	109.5	F131 T132 G133 H134 K136	N129-F131 PolarHBondContact O-N 3.44Å; N129-F131 PolarHBondContact OD1-N 2.92Å; N129-T132 WeakPolarHBondContact CB-OG1 3.42Å; N129-T132 PolarHBondContact ND2-OG1 3.49Å; N129-T132 VanDerWaalsContact ND2-OG1 3.14Å; N129-G133 VanDerWaalsContact O-CA 3.25Å; N129-G133 WeakPolarHBondContact O-CA 3.18Å; N129-G133 PolarHBondContact O-N 3.31Å; N129-H134 WeakPolarHBondContact CB-O 3.33Å; N129-H134 PolarHBondContact N-O 3.33Å; N129-K136 HydrophobicContact CB-CG 4.4Å
130	K	90.7	Very high	92.9	Very high	201 Å²	201	70.8 Å²	70.8	87%	0.874	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-26.2	-176.7	-58.9	-175.5	-176.3	-169.8	0	113.2	C128	C128-K130 PolarHBondContact O-N 2.85Å
131	F	90.5	Very high	92.9	Very high	193 Å²	193	67.2 Å²	67.2	85%	0.846	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-43.1	-177	-58	-73.3	0	0	0	112.9	N129	N129-F131 PolarHBondContact O-N 3.44Å; N129-F131 PolarHBondContact OD1-N 2.92Å
132	T	92.5	Very high	92.9	Very high	74 Å²	74	66.6 Å²	66.6	45%	0.454	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-11.7	-175.4	60.9	0	0	0	0	113.5	N129 H134	N129-T132 WeakPolarHBondContact CB-OG1 3.42Å; N129-T132 PolarHBondContact ND2-OG1 3.49Å; N129-T132 VanDerWaalsContact ND2-OG1 3.14Å; T132-H134 PolarHBondContact O-N 3.47Å; T132-H134 PolarHBondContact OG1-N 3.4Å
133	G	90.2	Very high	93.1	Very high	52 Å²	52	61.9 Å²	61.9	54%	0.536	31%	0.314	S	S	.	.			trans	69.2	-12.3	-171.1	0	0	0	0	0	114.4	C128 N129	C128-G133 WeakPolarHBondContact CB-O 3.28Å; N129-G133 VanDerWaalsContact O-CA 3.25Å; N129-G133 WeakPolarHBondContact O-CA 3.18Å; N129-G133 PolarHBondContact O-N 3.31Å
134	H	89.5	Confident	93.2	Very high	128 Å²	128	62.1 Å²	62.1	59%	0.593	32%	0.322	S	S	*	.			trans	-65.4	137.2	-178.8	-64.5	-46.5	0	0	0	111.8	C128 N129 T132	C128-H134 WeakPolarHBondContact CA-O 3.32Å; N129-H134 WeakPolarHBondContact CB-O 3.33Å; N129-H134 PolarHBondContact N-O 3.33Å; T132-H134 PolarHBondContact O-N 3.47Å; T132-H134 PolarHBondContact OG1-N 3.4Å
135	P	91.1	Very high	93.1	Very high	32 Å²	32	63.5 Å²	63.5	21%	0.208	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	139.6	175.7	15.9	-19.7	0	0	0	110.2	Y104 G137	Y104-P135 HydrophobicContact CD1-CB 4.31Å; Y104-P135 HydrophobicContact CD1-CG 4.05Å; Y104-P135 WeakPolarHBondContact CD1-O 3.44Å; Y104-P135 WeakPolarHBondContact CE1-O 3.47Å; Y104-P135 WeakPolarHBondContact O-CG 3.38Å; P135-G137 PolarHBondContact O-N 3.09Å
136	K	92.2	Very high	93.1	Very high	104 Å²	104	67.4 Å²	67.4	45%	0.452	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-6.2	-179.9	-65.4	-174.1	178	-173.7	0	113.2	L127 N129 F138	L127-K136 WeakPolarHBondContact O-CB 3.29Å; L127-K136 PolarHBondContact O-N 2.99Å; N129-K136 HydrophobicContact CB-CG 4.4Å; K136-F138 HydrophobicContact CB-CD1 3.5Å; K136-F138 HydrophobicContact CB-CE1 3.25Å; K136-F138 HydrophobicContact CB-CZ 4.16Å; K136-F138 HydrophobicContact CD-CD1 4.45Å; K136-F138 HydrophobicContact CD-CE1 3.38Å; K136-F138 HydrophobicContact CD-CZ 3.64Å; K136-F138 HydrophobicContact CG-CE1 3.96Å
137	G	93.3	Very high	93.1	Very high	8 Å²	8	70.7 Å²	70.7	8%	0.082	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	79.6	26	-175.4	0	0	0	0	0	113.7	N101 V102 P135	N101-G137 PolarHBondContact N-O 3.21Å; V102-G137 PolarHBondContact N-O 3.3Å; V102-G137 WeakPolarHBondContact O-CA 3.46Å; P135-G137 PolarHBondContact O-N 3.09Å
138	F	94.8	Very high	93.2	Very high	38 Å²	38	68.3 Å²	68.3	17%	0.167	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	152.7	171.1	67.2	-94.1	0	0	0	112.2	Y98 V99 L127 K136 Y140	Y98-F138 HydrophobicContact CE2-CB 3.7Å; Y98-F138 AromaticContact CE2-CD2 3.88Å; Y98-F138 HydrophobicContact CE2-CD2 3.88Å; Y98-F138 AromaticContact CE2-CG 3.98Å; Y98-F138 HydrophobicContact CE2-CG 3.98Å; V99-F138 CarbonylContact O-C 3.5Å; V99-F138 WeakPolarHBondContact O-CA 3.25Å; V99-F138 WeakPolarHBondContact O-CB 3.47Å; L127-F138 HydrophobicContact CB-CD2 4Å; L127-F138 HydrophobicContact CB-CE2 3.49Å; L127-F138 VanDerWaalsContact CB-CE2 3.49Å; L127-F138 HydrophobicContact CB-CZ 3.78Å; L127-F138 HydrophobicContact CD1-CD2 4.47Å; L127-F138 HydrophobicContact CD1-CE2 4.11Å; L127-F138 HydrophobicContact CD2-CE2 3.55Å; L127-F138 HydrophobicContact CD2-CZ 3.9Å; L127-F138 HydrophobicContact CG-CE2 3.86Å; L127-F138 HydrophobicContact CG-CZ 4.38Å; L127-F138 PolarHBondContact N-O 3.24Å; L127-F138 VanDerWaalsContact N-O 3.15Å; K136-F138 HydrophobicContact CB-CD1 3.5Å; K136-F138 HydrophobicContact CB-CE1 3.25Å; K136-F138 HydrophobicContact CB-CZ 4.16Å; K136-F138 HydrophobicContact CD-CD1 4.45Å; K136-F138 HydrophobicContact CD-CE1 3.38Å; K136-F138 HydrophobicContact CD-CZ 3.64Å; K136-F138 HydrophobicContact CG-CE1 3.96Å; F138-Y140 HydrophobicContact CE2-CE2 4.26Å
139	A	95.4	Very high	93.3	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	159.3	-178.6	0	0	0	0	0	111.1	V99 L111 T125 I126	V99-A139 PolarHBondContact N-O 3.33Å; V99-A139 PolarHBondContact O-N 2.89Å; L111-A139 HydrophobicContact CD1-CB 3.71Å; T125-A139 CarbonylContact O-C 3.49Å; T125-A139 VanDerWaalsContact O-CA 3.27Å; T125-A139 WeakPolarHBondContact O-CA 3.38Å; I126-A139 HydrophobicContact CG1-CB 4.15Å
140	Y	95.7	Very high	93.5	Very high	69 Å²	69	70.2 Å²	70.2	27%	0.271	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136.4	166.3	-62.1	-68	0	0	0	109.6	V97 Y98 T125 L127 F138 K170	V97-Y140 VanDerWaalsContact O-CA 3.32Å; V97-Y140 WeakPolarHBondContact O-CA 3.19Å; Y98-Y140 HydrophobicContact CD2-CD1 4.3Å; Y98-Y140 AromaticContact CD2-CE1 3.65Å; Y98-Y140 HydrophobicContact CD2-CE1 3.65Å; Y98-Y140 HydrophobicContact CG-CE1 4.38Å; T125-Y140 PolarHBondContact N-O 2.89Å; T125-Y140 PolarHBondContact O-N 2.81Å; L127-Y140 HydrophobicContact CD1-CD2 3.37Å; L127-Y140 HydrophobicContact CD1-CE2 3.5Å; L127-Y140 VanDerWaalsContact CD1-CE2 3.5Å; L127-Y140 HydrophobicContact CD2-CE2 4.11Å; L127-Y140 HydrophobicContact CG-CE2 4.44Å; F138-Y140 HydrophobicContact CE2-CE2 4.26Å; Y140-K170 HydrophobicContact CD1-CD 3.91Å; Y140-K170 HydrophobicContact CD1-CG 3.95Å; Y140-K170 HydrophobicContact CE1-CD 4.32Å; Y140-K170 HydrophobicContact CE1-CG 3.99Å; Y140-K170 HydrophobicContact CG-CD 4.44Å
141	I	95.6	Very high	93.7	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.2	176.3	-57.9	178.9	0	0	0	107.2	S96 V97 V99 L111 F115 I121 V124 F143	S96-I141 CarbonylContact C-O 3.59Å; S96-I141 WeakPolarHBondContact CA-O 3.33Å; V97-I141 PolarHBondContact N-O 2.97Å; V97-I141 PolarHBondContact O-N 2.83Å; V99-I141 HydrophobicContact CG2-CD1 3.79Å; V99-I141 HydrophobicContact CG2-CG1 4.17Å; L111-I141 HydrophobicContact CB-CD1 4.48Å; F115-I141 HydrophobicContact CB-CD1 4.19Å; F115-I141 HydrophobicContact CD2-CD1 3.14Å; F115-I141 HydrophobicContact CE2-CD1 3.55Å; F115-I141 HydrophobicContact CG-CD1 3.71Å; F115-I141 HydrophobicContact CZ-CD1 4.39Å; I121-I141 HydrophobicContact CD1-CG2 4.33Å; I121-I141 HydrophobicContact CG1-CG2 4.17Å; I121-I141 HydrophobicContact CG2-CG2 3.89Å; V124-I141 HydrophobicContact CG1-CG1 4.4Å; V124-I141 HydrophobicContact CG2-CG1 4.46Å; V124-I141 HydrophobicContact CG2-CG2 4.47Å; I141-F143 HydrophobicContact CB-CE2 4.28Å; I141-F143 HydrophobicContact CB-CZ 4.48Å; I141-F143 HydrophobicContact CG2-CD2 4.33Å; I141-F143 HydrophobicContact CG2-CE1 4.11Å; I141-F143 HydrophobicContact CG2-CE2 3.82Å; I141-F143 HydrophobicContact CG2-CZ 3.71Å
142	E	95.3	Very high	93.9	Very high	21 Å²	21	53.3 Å²	53.3	10%	0.098	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	122.8	175	-176.3	-174	155.4	0	0	108.6	V92 N122 R123	V92-E142 HydrophobicContact CG1-CG 4.02Å; N122-E142 HydrophobicContact CB-CB 4.46Å; N122-E142 HydrophobicContact CB-CG 4.11Å; N122-E142 PolarHBondContact N-O 3.33Å; N122-E142 PolarHBondContact ND2-OE1 3.43Å; R123-E142 HydrophobicContact CB-CB 4.15Å; R123-E142 PolarHBondContact N-O 3.13Å; R123-E142 PolarHBondContact O-N 2.62Å
143	F	96.3	Very high	94	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	159.3	175	-65	-81.5	0	0	0	111.2	R95 V97 F115 C118 I121 I141 A148 V149 A152	R95-F143 WeakPolarHBondContact CB-O 3.36Å; R95-F143 PolarHBondContact O-N 3.41Å; V97-F143 HydrophobicContact CB-CE2 4.03Å; V97-F143 HydrophobicContact CG2-CD2 4.09Å; V97-F143 HydrophobicContact CG2-CE2 3.65Å; F115-F143 HydrophobicContact CB-CE1 4.27Å; F115-F143 HydrophobicContact CB-CZ 4.05Å; F115-F143 HydrophobicContact CD1-CZ 4.34Å; F115-F143 HydrophobicContact CG-CZ 4.44Å; C118-F143 HydrophobicContact CB-CE1 4.44Å; I121-F143 HydrophobicContact CD1-CE1 4.24Å; I121-F143 HydrophobicContact CG1-CD1 3.79Å; I121-F143 HydrophobicContact CG1-CE1 3.6Å; I141-F143 HydrophobicContact CB-CE2 4.28Å; I141-F143 HydrophobicContact CB-CZ 4.48Å; I141-F143 HydrophobicContact CG2-CD2 4.33Å; I141-F143 HydrophobicContact CG2-CE1 4.11Å; I141-F143 HydrophobicContact CG2-CE2 3.82Å; I141-F143 HydrophobicContact CG2-CZ 3.71Å; F143-A148 HydrophobicContact CB-CB 3.74Å; F143-A148 HydrophobicContact CD1-CB 3.62Å; F143-A148 HydrophobicContact CD2-CB 4.41Å; F143-A148 HydrophobicContact CE1-CB 4.3Å; F143-A148 HydrophobicContact CG-CB 3.67Å; F143-V149 HydrophobicContact CD2-CG2 4.14Å; F143-A152 HydrophobicContact CE2-CB 3.88Å; F143-A152 HydrophobicContact CZ-CB 3.85Å
144	D	93.8	Very high	94.2	Very high	91 Å²	91	53.6 Å²	53.6	49%	0.487	28%	0.277	S	S	.	.	S	Bend	trans	-76.3	-31.1	173.7	-162.8	20.7	0	0	0	111.9	R95 P120	R95-D144 WeakPolarHBondContact CD-O 3.35Å; R95-D144 PolarHBondContact NH1-O 2.86Å; R95-D144 IonicContact NH1-OD1 3.26Å; R95-D144 PolarHBondContact NH1-OD1 2.83Å; P120-D144 HydrophobicContact CB-CB 4.3Å; P120-D144 HydrophobicContact CG-CB 3.89Å; P120-D144 PolarHBondContact O-N 3.42Å
145	T	93.8	Very high	94.3	Very high	56 Å²	56	50.6 Å²	50.6	34%	0.344	27%	0.265	S	S	.	.	S	Bend	trans	-115.1	152.5	-178.7	62.4	0	0	0	0	112.2	A148	T145-A148 WeakPolarHBondContact OG1-CB 3.26Å; T145-A148 PolarHBondContact OG1-N 3.46Å
146	R	93.2	Very high	94.4	Very high	134 Å²	134	53.3 Å²	53.3	51%	0.506	28%	0.277	S	S	.	.	H	α-helix	trans	-70.7	-33.8	172.9	-67.6	-179.1	-175.6	173.4	3.5	111.5	R95 A148 V149 E150	R95-R146 HydrophobicContact CG-CG 3.68Å; R146-A148 PolarHBondContact O-N 2.95Å; R146-V149 WeakPolarHBondContact O-CB 3.46Å; R146-V149 PolarHBondContact O-N 3.32Å; R146-E150 PolarHBondContact O-N 2.96Å
147	D	94.4	Very high	94.3	Very high	120 Å²	120	53 Å²	53	64%	0.642	28%	0.281	S	S	*	.	H	α-helix	trans	-60	-33.7	178.3	-53.6	-17	0	0	0	112.1	V149 E150 A151	D147-V149 PolarHBondContact O-N 3.38Å; D147-E150 PolarHBondContact O-N 3.42Å; D147-A151 PolarHBondContact O-N 2.93Å
148	A	94.7	Very high	94.3	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-64.7	-28.7	175.7	0	0	0	0	0	112.7	F143 T145 R146 A152	F143-A148 HydrophobicContact CB-CB 3.74Å; F143-A148 HydrophobicContact CD1-CB 3.62Å; F143-A148 HydrophobicContact CD2-CB 4.41Å; F143-A148 HydrophobicContact CE1-CB 4.3Å; F143-A148 HydrophobicContact CG-CB 3.67Å; T145-A148 WeakPolarHBondContact OG1-CB 3.26Å; T145-A148 PolarHBondContact OG1-N 3.46Å; R146-A148 PolarHBondContact O-N 2.95Å; A148-A152 VanDerWaalsContact O-CB 3.25Å; A148-A152 WeakPolarHBondContact O-CB 3.47Å; A148-A152 PolarHBondContact O-N 3.33Å
149	V	94.9	Very high	94.1	Very high	10 Å²	10	56.6 Å²	56.6	6%	0.061	31%	0.31	C	S	.	.	H	α-helix	trans	-66.1	-44.8	174	177.2	0	0	0	0	110.2	R95 V97 F143 R146 D147 A152 I153	R95-V149 VanDerWaalsContact C-CG2 3.43Å; R95-V149 WeakPolarHBondContact O-CG2 3.46Å; V97-V149 HydrophobicContact CG2-CB 4.1Å; V97-V149 HydrophobicContact CG2-CG1 3.68Å; V97-V149 HydrophobicContact CG2-CG2 4.14Å; F143-V149 HydrophobicContact CD2-CG2 4.14Å; R146-V149 WeakPolarHBondContact O-CB 3.46Å; R146-V149 PolarHBondContact O-N 3.32Å; D147-V149 PolarHBondContact O-N 3.38Å; V149-A152 PolarHBondContact O-N 3.47Å; V149-I153 HydrophobicContact CG1-CD1 3.99Å; V149-I153 VanDerWaalsContact O-CG1 3.25Å; V149-I153 WeakPolarHBondContact O-CG1 3.37Å; V149-I153 PolarHBondContact O-N 3.07Å
150	E	95	Very high	93.9	Very high	143 Å²	143	57.4 Å²	57.4	67%	0.668	31%	0.313	S	S	*	.	H	α-helix	trans	-64.5	-43.3	177.8	-61.6	-172.5	171.7	0	0	111.3	R146 D147 A152 I153 A154	R146-E150 PolarHBondContact O-N 2.96Å; D147-E150 PolarHBondContact O-N 3.42Å; E150-A152 VanDerWaalsContact C-N 3.33Å; E150-A152 PolarHBondContact O-N 3.22Å; E150-I153 PolarHBondContact O-N 2.98Å; E150-A154 PolarHBondContact O-N 3.33Å; E150-A154 VanDerWaalsContact O-N 3.09Å
151	A	94.9	Very high	93.7	Very high	39 Å²	39	59.3 Å²	59.3	32%	0.322	32%	0.32	S	S	.	.	H	α-helix	trans	-63.3	-37	174.5	0	0	0	0	0	112.6	C118 D147 A154 L155	C118-A151 HydrophobicContact CB-CB 3.87Å; D147-A151 PolarHBondContact O-N 2.93Å; A151-A154 PolarHBondContact O-N 2.96Å; A151-L155 PolarHBondContact O-N 2.99Å
152	A	94.7	Very high	93.4	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-69	-38.1	175.7	0	0	0	0	0	112.1	V97 F115 C118 F143 A148 V149 E150 A154 L155 V167	V97-A152 HydrophobicContact CG2-CB 4.06Å; F115-A152 HydrophobicContact CD1-CB 4.02Å; F115-A152 HydrophobicContact CE1-CB 4.2Å; C118-A152 HydrophobicContact CB-CB 4.37Å; F143-A152 HydrophobicContact CE2-CB 3.88Å; F143-A152 HydrophobicContact CZ-CB 3.85Å; A148-A152 VanDerWaalsContact O-CB 3.25Å; A148-A152 WeakPolarHBondContact O-CB 3.47Å; A148-A152 PolarHBondContact O-N 3.33Å; V149-A152 PolarHBondContact O-N 3.47Å; E150-A152 VanDerWaalsContact C-N 3.33Å; E150-A152 PolarHBondContact O-N 3.22Å; A152-A154 PolarHBondContact O-N 3.44Å; A152-L155 PolarHBondContact O-N 3.25Å; A152-V167 WeakPolarHBondContact O-CG1 3.29Å
153	I	94.8	Very high	93.3	Very high	57 Å²	57	67.3 Å²	67.3	29%	0.292	37%	0.369	S	S	.	.	H	α-helix	trans	-62.4	-35.1	174.1	-68.7	162.7	0	0	0	110.7	V149 E150 L155 D156 P169	V149-I153 HydrophobicContact CG1-CD1 3.99Å; V149-I153 VanDerWaalsContact O-CG1 3.25Å; V149-I153 WeakPolarHBondContact O-CG1 3.37Å; V149-I153 PolarHBondContact O-N 3.07Å; E150-I153 PolarHBondContact O-N 2.98Å; I153-L155 PolarHBondContact O-N 3.3Å; I153-D156 VanDerWaalsContact O-CB 3.28Å; I153-D156 WeakPolarHBondContact O-CB 3.42Å; I153-D156 VanDerWaalsContact O-CG 3.27Å; I153-D156 PolarHBondContact O-N 2.92Å; I153-D156 VanDerWaalsContact O-N 3.08Å; I153-P169 HydrophobicContact CD1-CB 4.15Å; I153-P169 HydrophobicContact CD1-CG 4.2Å
154	A	94	Very high	93.2	Very high	74 Å²	74	73.1 Å²	73.1	61%	0.612	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-11.9	175	0	0	0	0	0	114.2	E150 A151 A152 D156	E150-A154 PolarHBondContact O-N 3.33Å; E150-A154 VanDerWaalsContact O-N 3.09Å; A151-A154 PolarHBondContact O-N 2.96Å; A152-A154 PolarHBondContact O-N 3.44Å; A154-D156 VanDerWaalsContact C-N 3.29Å
155	L	91.2	Very high	93.3	Very high	66 Å²	66	68.8 Å²	68.8	35%	0.346	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	24.2	168.6	-65.5	-174.5	0	0	0	112	C118 A151 A152 I153 S158	C118-L155 WeakPolarHBondContact SG-CD1 3.22Å; A151-L155 PolarHBondContact O-N 2.99Å; A152-L155 PolarHBondContact O-N 3.25Å; I153-L155 PolarHBondContact O-N 3.3Å; L155-S158 WeakPolarHBondContact O-CB 3.49Å; L155-S158 PolarHBondContact O-N 2.95Å
156	D	93.3	Very high	93.4	Very high	88 Å²	88	71.7 Å²	71.7	47%	0.471	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	144.7	169.6	63.5	-21.2	0	0	0	111.3	I153 A154 S158 V167	I153-D156 VanDerWaalsContact O-CB 3.28Å; I153-D156 WeakPolarHBondContact O-CB 3.42Å; I153-D156 VanDerWaalsContact O-CG 3.27Å; I153-D156 PolarHBondContact O-N 2.92Å; I153-D156 VanDerWaalsContact O-N 3.08Å; A154-D156 VanDerWaalsContact C-N 3.29Å; D156-S158 PolarHBondContact O-N 3.4Å; D156-S158 VanDerWaalsContact O-N 3.13Å; D156-V167 HydrophobicContact CB-CB 4.4Å
157	D	92	Very high	93.5	Very high	97 Å²	97	65.5 Å²	65.5	52%	0.519	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	17.6	-176.5	-60.7	-31.9	0	0	0	115.7	L165	D157-L165 VanDerWaalsContact CA-O 3.25Å; D157-L165 WeakPolarHBondContact CA-O 3.32Å; D157-L165 PolarHBondContact N-O 3.49Å
158	S	91.9	Very high	93.6	Very high	21 Å²	21	63.5 Å²	63.5	15%	0.147	35%	0.347	C	S	.	.			trans	-61	145.5	172.8	79.1	0	0	0	0	112	H114 L155 D156 F160 Q164 L165	H114-S158 PolarHBondContact CE1-OG 3.11Å; H114-S158 PolarHBondContact NE2-OG 3.32Å; L155-S158 WeakPolarHBondContact O-CB 3.49Å; L155-S158 PolarHBondContact O-N 2.95Å; D156-S158 PolarHBondContact O-N 3.4Å; D156-S158 VanDerWaalsContact O-N 3.13Å; S158-F160 PolarHBondContact O-N 2.94Å; S158-Q164 WeakPolarHBondContact O-CA 3.24Å; S158-L165 PolarHBondContact O-N 3.48Å
159	S	91.2	Very high	93.6	Very high	102 Å²	102	66.9 Å²	66.9	71%	0.713	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	115	179.1	60.4	0	0	0	0	111.4
160	F	91.4	Very high	93.5	Very high	17 Å²	17	68.8 Å²	68.8	8%	0.075	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	120.7	175.9	-178.2	-97.1	0	0	0	109.9	V102 E110 L111 H114 S158 S162 R163 L165	V102-F160 HydrophobicContact CG1-CE1 4.45Å; E110-F160 HydrophobicContact CB-CE2 4.04Å; E110-F160 HydrophobicContact CB-CZ 3.8Å; L111-F160 HydrophobicContact CD2-CE1 4.27Å; L111-F160 HydrophobicContact CD2-CE2 4.47Å; L111-F160 HydrophobicContact CD2-CZ 4.1Å; H114-F160 HydrophobicContact CB-CD2 4.4Å; S158-F160 PolarHBondContact O-N 2.94Å; F160-S162 VanDerWaalsContact C-N 3.25Å; F160-S162 PolarHBondContact O-N 2.89Å; F160-R163 PolarHBondContact N-O 2.79Å; F160-R163 PolarHBondContact O-N 3.22Å; F160-L165 HydrophobicContact CB-CD1 3.61Å; F160-L165 HydrophobicContact CB-CD2 3.85Å; F160-L165 HydrophobicContact CB-CG 3.58Å; F160-L165 HydrophobicContact CD1-CD2 4.07Å; F160-L165 HydrophobicContact CG-CD1 4.01Å; F160-L165 HydrophobicContact CG-CD2 4.21Å; F160-L165 HydrophobicContact CG-CG 4.3Å
161	R	90.5	Very high	93.1	Very high	109 Å²	109	72.8 Å²	72.8	41%	0.411	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	46.7	-178.3	-61.8	174.4	70.2	104.8	2.8	112.9	D103 E110 R163	D103-R161 HydrophobicContact CB-CB 4.11Å; D103-R161 IonicContact OD2-CZ 3.67Å; D103-R161 IonicContact OD2-NE 2.88Å; D103-R161 PolarHBondContact OD2-NE 2.76Å; D103-R161 IonicContact OD2-NH2 3.71Å; D103-R161 PolarHBondContact OD2-NH2 3.07Å; E110-R161 VanDerWaalsContact CD-NH1 3.26Å; E110-R161 IonicContact OE1-NH1 3.41Å; E110-R161 PolarHBondContact OE1-NH1 3Å; E110-R161 WeakPolarHBondContact OE2-CD 3.48Å; E110-R161 IonicContact OE2-CZ 3.29Å; E110-R161 IonicContact OE2-NE 3.19Å; E110-R161 IonicContact OE2-NH1 2.77Å; E110-R161 PolarHBondContact OE2-NH1 3.02Å; R161-R163 PolarHBondContact O-N 2.9Å
162	S	89.9	Confident	92.6	Very high	130 Å²	130	73.5 Å²	73.5	91%	0.909	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	14.9	-177.3	66	0	0	0	0	116.7	F160	F160-S162 VanDerWaalsContact C-N 3.25Å; F160-S162 PolarHBondContact O-N 2.89Å
163	R	93	Very high	91.8	Very high	58 Å²	58	80.5 Å²	80.5	22%	0.219	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	148.8	174.3	-64	171.1	64.9	169.6	-2	109.8	N101 D103 F160 R161	N101-R163 PolarHBondContact O-NE 3.01Å; N101-R163 PolarHBondContact O-NH2 2.92Å; N101-R163 PolarHBondContact OD1-NE 3.39Å; N101-R163 PolarHBondContact OD1-NH2 3.39Å; D103-R163 IonicContact OD1-NH1 3.44Å; D103-R163 PolarHBondContact OD1-NH1 3.49Å; F160-R163 PolarHBondContact N-O 2.79Å; F160-R163 PolarHBondContact O-N 3.22Å; R161-R163 PolarHBondContact O-N 2.9Å
164	Q	94.6	Very high	90.8	Very high	123 Å²	123	82 Å²	82	58%	0.575	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.9	174.2	-70.9	176.6	-32.3	0	0	109.9	N101 S158	N101-Q164 WeakPolarHBondContact CB-O 3.02Å; N101-Q164 PolarHBondContact ND2-O 2.73Å; S158-Q164 WeakPolarHBondContact O-CA 3.24Å
165	L	95.6	Very high	89.5	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	44%	0.443	C	S	.	.			trans	-78.7	140.3	178.1	-63.5	-177.6	0	0	0	110.9	V99 V102 F115 D157 S158 F160 V167	V99-L165 HydrophobicContact CG1-CB 4.28Å; V99-L165 HydrophobicContact CG1-CD1 4.11Å; V99-L165 HydrophobicContact CG1-CD2 4.18Å; V99-L165 HydrophobicContact CG1-CG 4.43Å; V102-L165 HydrophobicContact CG2-CD2 4.1Å; F115-L165 HydrophobicContact CE2-CD1 4.17Å; F115-L165 HydrophobicContact CZ-CD1 4.17Å; D157-L165 VanDerWaalsContact CA-O 3.25Å; D157-L165 WeakPolarHBondContact CA-O 3.32Å; D157-L165 PolarHBondContact N-O 3.49Å; S158-L165 PolarHBondContact O-N 3.48Å; F160-L165 HydrophobicContact CB-CD1 3.61Å; F160-L165 HydrophobicContact CB-CD2 3.85Å; F160-L165 HydrophobicContact CB-CG 3.58Å; F160-L165 HydrophobicContact CD1-CD2 4.07Å; F160-L165 HydrophobicContact CG-CD1 4.01Å; F160-L165 HydrophobicContact CG-CD2 4.21Å; F160-L165 HydrophobicContact CG-CG 4.3Å; L165-V167 HydrophobicContact CB-CG2 4.36Å
166	K	96	Very high	88.3	Confident	117 Å²	117	84.7 Å²	84.7	51%	0.509	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	106.8	171.6	-175.7	168.9	-173.3	167.3	0	109.9	V99 G100	V99-K166 CarbonylContact C-O 3.53Å; G100-K166 PolarHBondContact N-O 3.23Å; G100-K166 PolarHBondContact O-N 3.01Å
167	V	96.3	Very high	86.8	Confident	3 Å²	3	88.3 Å²	88.3	2%	0.018	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.1	-177.1	-168.2	0	0	0	0	110	V97 Y98 F115 A152 D156 L165	V97-V167 HydrophobicContact CG1-CG1 3.21Å; Y98-V167 WeakPolarHBondContact O-CA 3.47Å; F115-V167 HydrophobicContact CE1-CG1 4.4Å; F115-V167 HydrophobicContact CE1-CG2 4.11Å; F115-V167 HydrophobicContact CZ-CG2 3.92Å; A152-V167 WeakPolarHBondContact O-CG1 3.29Å; D156-V167 HydrophobicContact CB-CB 4.4Å; L165-V167 HydrophobicContact CB-CG2 4.36Å
168	L	95.2	Very high	85.3	Confident	79 Å²	79	87.2 Å²	87.2	41%	0.414	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	151.8	177.6	-67	175.4	0	0	0	110	Y98 K170	Y98-L168 WeakPolarHBondContact CA-O 3.42Å; Y98-L168 WeakPolarHBondContact CB-O 3.43Å; Y98-L168 HydrophobicContact CD1-CB 4.2Å; Y98-L168 HydrophobicContact CD1-CD1 4.41Å; Y98-L168 PolarHBondContact N-O 3.38Å; Y98-L168 PolarHBondContact O-N 3Å; L168-K170 PolarHBondContact O-N 3.45Å
169	P	94.3	Very high	83.8	Confident	71 Å²	71	95.6 Å²	95.6	46%	0.461	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	139.5	170.6	24.9	-32.4	0	0	0	110.6	I153	I153-P169 HydrophobicContact CD1-CB 4.15Å; I153-P169 HydrophobicContact CD1-CG 4.2Å
170	K	93.3	Very high	82.6	Confident	51 Å²	51	94.5 Å²	94.5	22%	0.222	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-66.8	137.8	177.8	-171.8	-176.8	179.9	-163.3	0	109.4	D93 S96 Y140 L168	D93-K170 HydrophobicContact CB-CD 4.49Å; D93-K170 WeakPolarHBondContact OD1-CD 3.3Å; D93-K170 WeakPolarHBondContact OD1-CE 3.43Å; D93-K170 IonicContact OD1-NZ 2.65Å; D93-K170 PolarHBondContact OD1-NZ 3.47Å; S96-K170 WeakPolarHBondContact O-CB 3.43Å; S96-K170 PolarHBondContact O-N 2.92Å; Y140-K170 HydrophobicContact CD1-CD 3.91Å; Y140-K170 HydrophobicContact CD1-CG 3.95Å; Y140-K170 HydrophobicContact CE1-CD 4.32Å; Y140-K170 HydrophobicContact CE1-CG 3.99Å; Y140-K170 HydrophobicContact CG-CD 4.44Å; L168-K170 PolarHBondContact O-N 3.45Å
171	R	87.2	Confident	81.1	Confident	226 Å²	226	102 Å²	102	85%	0.853	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-86	135	175.5	-63.9	-178.3	177.8	-167.5	-2.2	109.6
172	T	84.7	Confident	80	Confident	55 Å²	55	104.1 Å²	104.1	34%	0.337	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-67.7	136.9	169.7	57.6	0	0	0	0	109.7	T90 D93 V174	T90-T172 HydrophobicContact CG2-CG2 4.21Å; D93-T172 HydrophobicContact CB-CG2 3.71Å; D93-T172 WeakPolarHBondContact OD2-CA 3.37Å; T172-V174 PolarHBondContact O-N 3.38Å
173	N	77.4	Confident	78.7	Confident	146 Å²	146	102.8 Å²	102.8	78%	0.781	55%	0.546	S	S	*	.			trans	-82.6	93.6	176.4	-172.5	3.8	0	0	0	109.5	P175	N173-P175 VanDerWaalsContact O-CD 3.3Å; N173-P175 WeakPolarHBondContact O-CD 3.44Å
174	V	73.3	Confident	77.1	Confident	88 Å²	88	105.1 Å²	105.1	53%	0.533	57%	0.568	S	S	.	*			trans	-79.6	113.1	173.6	-174.2	0	0	0	0	108.9	T172 G176 M177	T172-V174 PolarHBondContact O-N 3.38Å; V174-G176 PolarHBondContact O-N 3.03Å; V174-M177 HydrophobicContact CB-CB 4.48Å; V174-M177 PolarHBondContact O-N 3.44Å
175	P	67.4	Low	75.4	Confident	121 Å²	121	107 Å²	107	79%	0.786	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	126.2	178.4	24.5	-32.2	0	0	0	110	N173	N173-P175 VanDerWaalsContact O-CD 3.3Å; N173-P175 WeakPolarHBondContact O-CD 3.44Å
176	G	66.7	Low	73.4	Confident	77 Å²	77	112.6 Å²	112.6	79%	0.794	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	101.6	-9.9	177.4	0	0	0	0	0	116.1	V174 S178	V174-G176 PolarHBondContact O-N 3.03Å; G176-S178 PolarHBondContact O-N 2.86Å
177	M	62	Low	71.3	Confident	163 Å²	163	118.9 Å²	118.9	80%	0.803	63%	0.629	S	S	*	*			trans	-86.9	96.6	173.5	-146.7	74.2	-179.7	0	0	109.7	V174	V174-M177 HydrophobicContact CB-CB 4.48Å; V174-M177 PolarHBondContact O-N 3.44Å
178	S	58.8	Low	69	Low	74 Å²	74	122 Å²	122	52%	0.517	66%	0.662	S	S	.	*			trans	-64.6	137.3	176.2	-171.5	0	0	0	0	110.8	G176 T180	G176-S178 PolarHBondContact O-N 2.86Å; S178-T180 CarbonylContact C-O 3.5Å; S178-T180 CarbonylContact O-C 3.59Å; S178-T180 PolarHBondContact O-N 2.94Å; S178-T180 PolarHBondContact OG-N 2.99Å
179	M	61.1	Low	66.8	Low	197 Å²	197	129.2 Å²	129.2	97%	0.97	68%	0.684	S	S	*	*	S	Bend	trans	-62.5	-21.1	175.2	-40.9	-178.3	-179	0	0	112.7
180	T	66.5	Low	64.2	Low	79 Å²	79	130.3 Å²	130.3	49%	0.485	70%	0.698	S	S	.	*	S	Bend	trans	-84.4	131.4	169.8	-47.4	0	0	0	0	105.4	S178 R182	S178-T180 CarbonylContact C-O 3.5Å; S178-T180 CarbonylContact O-C 3.59Å; S178-T180 PolarHBondContact O-N 2.94Å; S178-T180 PolarHBondContact OG-N 2.99Å; T180-R182 HydrophobicContact CG2-CB 4.17Å; T180-R182 HydrophobicContact CG2-CG 3.99Å; T180-R182 PolarHBondContact O-N 2.99Å
181	N	60.1	Low	61.9	Low	176 Å²	176	140.1 Å²	140.1	94%	0.941	73%	0.734	S	S	*	*			trans	-60.6	31.4	169.8	-67	-59.4	0	0	0	113.5
182	R	66.3	Low	59.8	Low	152 Å²	152	132.3 Å²	132.3	57%	0.574	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-75.5	121.1	170.7	-101.1	172.7	166.5	164.2	-0.7	107	T180	T180-R182 HydrophobicContact CG2-CB 4.17Å; T180-R182 HydrophobicContact CG2-CG 3.99Å; T180-R182 PolarHBondContact O-N 2.99Å
183	P	62.2	Low	58	Low	103 Å²	103	141.8 Å²	141.8	67%	0.669	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-53.2	145.1	167.2	23	-31	0	0	0	108.4	F185	P183-F185 PolarHBondContact O-N 2.73Å
184	P	61.2	Low	56.2	Low	106 Å²	106	137.5 Å²	137.5	69%	0.688	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-50	124.6	177.5	21.5	-32.3	0	0	0	107.3	V186	P184-V186 PolarHBondContact O-N 3.16Å
185	F	57.5	Low	54.7	Low	163 Å²	163	141.5 Å²	141.5	72%	0.715	76%	0.759	S	S	*	*			trans	-61.2	96.8	175.2	-83.4	-84	0	0	0	106.8	P183 R187	P183-F185 PolarHBondContact O-N 2.73Å; F185-R187 PolarHBondContact O-N 2.8Å
186	V	53.5	Low	53.5	Low	118 Å²	118	141.9 Å²	141.9	72%	0.715	76%	0.764	S	S	*	*			trans	-65.7	84.2	163	-177.5	0	0	0	0	105.1	P184 G188	P184-V186 PolarHBondContact O-N 3.16Å; V186-G188 PolarHBondContact O-N 3.1Å
187	R	51.7	Low	52.4	Low	248 Å²	248	144.5 Å²	144.5	94%	0.936	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	86.9	168	-179.4	-175.8	-94.5	172.8	-7.4	105.7	F185	F185-R187 PolarHBondContact O-N 2.8Å
188	G	48.8	Very low	51.4	Low	68 Å²	68	140.3 Å²	140.3	70%	0.701	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	164.3	-3	-179.8	0	0	0	0	0	120.2	V186	V186-G188 PolarHBondContact O-N 3.1Å
189	R	47.9	Very low	50.8	Low	232 Å²	232	146 Å²	146	88%	0.875	77%	0.773	S	S	*	*			trans	-129.7	96.2	174.7	-73.4	-155.7	-173.3	-136	5.7	114.5
190	A	41.1	Very low	50	Low	93 Å²	93	148.1 Å²	148.1	77%	0.769	77%	0.77	S	S	*	*			trans	46.9	86.3	131.4	0	0	0	0	0	117	G192	A190-G192 PolarHBondContact O-N 3.1Å
191	R	44.6	Very low	49.2	Very low	257 Å²	257	150.3 Å²	150.3	97%	0.97	79%	0.786	S	S	*	*			trans	-82.8	67.9	132.3	-84.5	-167.3	171.4	99.6	-0.9	108.1	R193	R191-R193 VanDerWaalsContact C-N 3.3Å; R191-R193 PolarHBondContact O-N 3.42Å
192	G	43.4	Very low	48.4	Very low	63 Å²	63	145.4 Å²	145.4	65%	0.649	77%	0.77	S	S	*	*			trans	-62.2	100	155.7	0	0	0	0	0	106.8	A190 G194	A190-G192 PolarHBondContact O-N 3.1Å; G192-G194 PolarHBondContact O-N 3.49Å
193	R	46.4	Very low	47.5	Very low	254 Å²	254	148.8 Å²	148.8	96%	0.958	78%	0.784	S	S	*	*	S	Bend	trans	-68.3	103.7	165	-163.7	177.7	-168.6	153.9	-0.1	105.5	R191	R191-R193 VanDerWaalsContact C-N 3.3Å; R191-R193 PolarHBondContact O-N 3.42Å
194	G	38.7	Very low	46.8	Very low	55 Å²	55	148.9 Å²	148.9	57%	0.567	79%	0.793	S	S	*	*			trans	100.1	98.7	174.7	0	0	0	0	0	113.4	G192	G192-G194 PolarHBondContact O-N 3.49Å
195	M	42.3	Very low	46	Very low	173 Å²	173	147.5 Å²	147.5	85%	0.852	80%	0.799	S	S	*	*			trans	-147.1	100.2	137.9	-83.9	-50.1	157.5	0	0	108.2	I197	M195-I197 PolarHBondContact O-N 3.35Å
196	S	41.7	Very low	45.4	Very low	129 Å²	129	150.9 Å²	150.9	90%	0.902	81%	0.807	S	S	*	*			trans	-69.3	94	159.9	-60.7	0	0	0	0	107.8
197	I	45.5	Very low	44.9	Very low	131 Å²	131	153.2 Å²	153.2	67%	0.672	81%	0.812	S	S	*	*			trans	-130.9	112.6	163.4	-75	176.7	0	0	0	107.1	M195 F199	M195-I197 PolarHBondContact O-N 3.35Å; I197-F199 PolarHBondContact O-N 3.44Å
198	G	39.7	Very low	44.6	Very low	75 Å²	75	153 Å²	153	77%	0.773	81%	0.811	S	S	*	*			trans	-64.5	127.2	-178.2	0	0	0	0	0	111.8
199	F	46.4	Very low	44.5	Very low	194 Å²	194	158.6 Å²	158.6	85%	0.851	82%	0.816	S	S	*	*			trans	-123	100.5	153.8	-94.3	-89.9	0	0	0	107	I197	I197-F199 PolarHBondContact O-N 3.44Å
200	R	44.1	Very low	44.6	Very low	241 Å²	241	151.5 Å²	151.5	91%	0.909	80%	0.801	S	S	*	*			trans	-88.7	118.6	162.4	-75.8	179	148.3	-155.9	-4.4	107.3
201	P	50.9	Low	44.9	Very low	126 Å²	126	159.1 Å²	159.1	82%	0.818	81%	0.809	S	S	*	*			trans	-82	110	152.6	6	12.6	0	0	0	107
202	A	43.2	Very low	44.9	Very low	73 Å²	73	156.7 Å²	156.7	60%	0.603	80%	0.802	S	S	*	*			trans	-69.4	168.2	157.5	0	0	0	0	0	109.1
203	Y	46.5	Very low	45.2	Very low	223 Å²	223	165 Å²	165	88%	0.875	81%	0.814	S	S	*	*			trans	72.6	131.8	172.8	67.9	-99.9	0	0	0	118.9
204	A	48	Very low	45.2	Very low	104 Å²	104	165 Å²	165	86%	0.86	81%	0.813	S	S	*	*			trans	83.7	119.8	168.2	0	0	0	0	0	118.6
205	G	43.1	Very low	45.7	Very low	78 Å²	78	173.9 Å²	173.9	80%	0.804	83%	0.83	S	S	*	*			trans	100.8	83.6	144.3	0	0	0	0	0	116.5	M207	G205-M207 PolarHBondContact O-N 3.38Å
206	R	46.9	Very low	46	Very low	234 Å²	234	168.6 Å²	168.6	88%	0.883	82%	0.819	S	S	*	*			trans	-52.9	123.2	157.9	-65.1	-117.2	-150.8	-82.9	1.8	110.1
207	M	41.6	Very low	47	Very low	166 Å²	166	168.1 Å²	168.1	82%	0.818	82%	0.816	S	S	*	*			trans	-155.4	109.6	139.2	-81.3	-45.5	170.6	0	0	109.3	G205 F209	G205-M207 PolarHBondContact O-N 3.38Å; M207-F209 HydrophobicContact CB-CE2 4.17Å
208	R	45.8	Very low	47.3	Very low	243 Å²	243	171.3 Å²	171.3	92%	0.917	82%	0.821	S	S	*	*			trans	-97.5	97.4	179.7	-163.8	-172.2	-162	-162.9	6.2	106.4	P210	R208-P210 WeakPolarHBondContact O-CD 3.46Å
209	F	47.4	Very low	48.4	Very low	186 Å²	186	178.6 Å²	178.6	82%	0.816	83%	0.827	S	S	*	*			trans	-81.6	122	170.5	-72.6	-74.8	0	0	0	109.9	M207	M207-F209 HydrophobicContact CB-CE2 4.17Å
210	P	49.6	Very low	49	Very low	84 Å²	84	177.7 Å²	177.7	55%	0.545	82%	0.823	S	S	.	*			trans	-73.1	131.2	178	-10.8	25.9	0	0	0	111.3	R208 Y212	R208-P210 WeakPolarHBondContact O-CD 3.46Å; P210-Y212 HydrophobicContact CB-CD2 4.05Å; P210-Y212 HydrophobicContact CB-CE2 3.61Å; P210-Y212 HydrophobicContact CG-CE2 3.96Å; P210-Y212 PolarHBondContact O-N 3.34Å; P210-Y212 VanDerWaalsContact O-N 3.14Å
211	R	46.3	Very low	50.2	Low	252 Å²	252	171.8 Å²	171.8	95%	0.951	82%	0.818	S	S	*	*			trans	-67.4	103.6	162.7	-75	-179	178.7	167.2	-0.7	108.8
212	Y	45.1	Very low	51.1	Low	206 Å²	206	170.1 Å²	170.1	81%	0.808	81%	0.808	S	S	*	*			trans	-88.9	118	162.8	-73.4	-84	0	0	0	110.1	P210	P210-Y212 HydrophobicContact CB-CD2 4.05Å; P210-Y212 HydrophobicContact CB-CE2 3.61Å; P210-Y212 HydrophobicContact CG-CE2 3.96Å; P210-Y212 PolarHBondContact O-N 3.34Å; P210-Y212 VanDerWaalsContact O-N 3.14Å
213	R	49.8	Very low	52.2	Low	239 Å²	239	181.4 Å²	181.4	90%	0.902	84%	0.837	S	S	*	*			trans	-56.1	143.8	159.7	-67.4	173.7	168.2	-171.5	-3.6	109.9
214	R	46.7	Very low	52.4	Low	253 Å²	253	179.4 Å²	179.4	96%	0.955	84%	0.835	S	S	*	*				-154.3	126.7	129.2	-94.1	-57.5	-170.7	-169.4	-1.1	109.8
215	R	49.7	Very low	52.7	Low	242 Å²	242	183.3 Å²	183.3	91%	0.913	83%	0.834	S	S	*	*			trans	-105.3	136.2	174	-179.5	-168.2	-169.1	-158.3	5.2	105.8
216	G	48.4	Very low	53.2	Low	61 Å²	61	189.2 Å²	189.2	63%	0.629	84%	0.835	S	S	*	*			trans	85.4	123	158.1	0	0	0	0	0	116.4
217	S	62.9	Low	53.6	Low	119 Å²	119	186.5 Å²	186.5	83%	0.832	83%	0.832	S	S	*	*			trans	-165.9	108.3	131.9	-160.7	0	0	0	0	109
218	Y	52.1	Low	54.3	Low	199 Å²	199	187.8 Å²	187.8	78%	0.78	83%	0.833	S	S	*	*			trans	-93.4	141	160.1	-28.6	-91.5	0	0	0	105.9
219	Y	61	Low	54.9	Low	227 Å²	227	184.1 Å²	184.1	89%	0.89	83%	0.828	S	S	*	*			trans	148.9	106.3	162.2	-85.5	-68.4	0	0	0	107.5
220	F	59.9	Low	55.4	Low	176 Å²	176	184 Å²	184	77%	0.772	83%	0.829	S	S	*	*				81.3	108.9	99.6	-168.8	-95.8	0	0	0	112.9	P222	F220-P222 HydrophobicContact CE1-CB 4.19Å
221	S	69.1	Low	55.9	Low	116 Å²	116	191.7 Å²	191.7	81%	0.811	85%	0.85	S	S	*	*			trans	-109.2	129.5	166.7	-71	0	0	0	0	108.6
222	P	70.7	Confident	56.7	Low	92 Å²	92	186.7 Å²	186.7	60%	0.597	84%	0.842	S	S	*	*			trans	-88.7	137.3	176.7	34.3	-29.4	0	0	0	110.8	F220	F220-P222 HydrophobicContact CE1-CB 4.19Å
223	Y	64.9	Low	57.7	Low	310 Å²	310	184.9 Å²	184.9	100%	1.216	85%	0.845	S	S	*	*			trans	-152.9	0	135.1	-91	-73.6	0	0	0	107.4

Retrieved 223 of 223 residues in 92.5 ms (Link to these results)

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