A0A077ZLH3_TRITR Loading...

DNA polymerase delta subunit OB-fold domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZLH3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 153 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	48.3	Very low	70.9	Confident	241 Å²	241	166.7 Å²	166.7	100%	1.187	84%	0.836	S	S	*	*				0	89.2	0	-91.4	-175.2	-91.7	0	0	106.3
2	E	53.6	Low	71.7	Confident	197 Å²	197	164.8 Å²	164.8	92%	0.921	83%	0.829	S	S	*	*			trans	-90.5	116.4	175.6	-74	179.1	165.2	0	0	107.8	E4	E2-E4 PolarHBondContact O-N 2.92Å
3	T	62.6	Low	72.1	Confident	139 Å²	139	166.9 Å²	166.9	85%	0.853	83%	0.83	S	S	*	*			trans	-73	106.9	177.5	-35.2	0	0	0	0	107.7	S5	T3-S5 PolarHBondContact O-N 2.98Å
4	E	65.1	Low	72.7	Confident	184 Å²	184	164.9 Å²	164.9	86%	0.86	82%	0.823	S	S	*	*			trans	-58.5	111.6	173.9	-75	-171.1	158.2	0	0	109.5	E2 C6	E2-E4 PolarHBondContact O-N 2.92Å; E4-C6 PolarHBondContact O-N 3.07Å
5	S	71.8	Confident	73.5	Confident	95 Å²	95	165.5 Å²	165.5	66%	0.664	82%	0.823	S	S	*	*			trans	-71.3	108.6	174.3	65.1	0	0	0	0	109.2	T3 Q7	T3-S5 PolarHBondContact O-N 2.98Å; S5-Q7 PolarHBondContact O-N 3.05Å
6	C	72.9	Confident	74.3	Confident	125 Å²	125	166.6 Å²	166.6	85%	0.845	82%	0.816	S	S	*	*			trans	-68.6	111	169.4	-74.9	0	0	0	0	110	E4	E4-C6 PolarHBondContact O-N 3.07Å
7	Q	78.7	Confident	75.2	Confident	159 Å²	159	163.2 Å²	163.2	74%	0.743	80%	0.802	S	S	*	*			trans	-84.1	114.2	172	-65.6	-178	2.7	0	0	110.1	S5 R9	S5-Q7 PolarHBondContact O-N 3.05Å; Q7-R9 PolarHBondContact O-N 2.65Å
8	L	82.7	Confident	76	Confident	178 Å²	178	159.6 Å²	159.6	93%	0.932	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-69.4	126.3	167.7	-65.4	172.1	0	0	0	109.2
9	R	80.5	Confident	76.9	Confident	226 Å²	226	158.9 Å²	158.9	85%	0.853	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-99.4	135.6	172.2	-68.4	-175.1	179.1	169.5	1.1	109.8	Q7 S11	Q7-R9 PolarHBondContact O-N 2.65Å; R9-S11 PolarHBondContact O-N 3.35Å
10	R	82.6	Confident	77.8	Confident	213 Å²	213	155 Å²	155	80%	0.804	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-62.1	127.2	173	-171	175.9	72.4	159.1	2.6	109.3	L12	R10-L12 PolarHBondContact O-N 2.71Å
11	S	81.1	Confident	78.4	Confident	77 Å²	77	155 Å²	155	54%	0.538	77%	0.766	S	S	.	*	P	Polyproline II helix	trans	-61.8	126.7	168.2	-177.6	0	0	0	0	109	R9 K13	R9-S11 PolarHBondContact O-N 3.35Å; S11-K13 PolarHBondContact OG-N 2.61Å
12	L	80.1	Confident	80.5	Confident	144 Å²	144	151.1 Å²	151.1	75%	0.754	75%	0.745	S	S	*	*			trans	-97.6	12.2	174.5	-63.2	176.1	0	0	0	111.9	R10	R10-L12 PolarHBondContact O-N 2.71Å
13	K	77	Confident	82.4	Confident	192 Å²	192	149 Å²	149	84%	0.835	73%	0.733	S	S	*	*			trans	-93.4	10.4	-170.4	-71	-171	175.7	-176.2	0	114.9	S11	S11-K13 PolarHBondContact OG-N 2.61Å
14	D	80.4	Confident	83.7	Confident	138 Å²	138	147.1 Å²	147.1	74%	0.738	72%	0.721	S	S	*	*			trans	-88.1	118.4	178.3	-61.6	-29.8	0	0	0	109.9	Y16	D14-Y16 PolarHBondContact O-N 2.68Å
15	E	85.8	Confident	84.9	Confident	175 Å²	175	145 Å²	145	82%	0.818	72%	0.715	S	S	*	*			trans	-79.7	113.4	173.2	-163.6	173.1	-158.3	0	0	108.8
16	Y	86.3	Confident	85.7	Confident	182 Å²	182	143.8 Å²	143.8	71%	0.714	71%	0.71	S	S	*	*			trans	-103.5	118.6	179.1	175.1	-103.4	0	0	0	110.6	D14 L18	D14-Y16 PolarHBondContact O-N 2.68Å; Y16-L18 HydrophobicContact CD1-CG 4.24Å; Y16-L18 HydrophobicContact CE1-CD2 3.46Å; Y16-L18 VanDerWaalsContact CE1-CD2 3.46Å; Y16-L18 HydrophobicContact CE1-CG 3.56Å
17	N	89	Confident	86.4	Confident	109 Å²	109	148.2 Å²	148.2	58%	0.583	72%	0.715	S	S	*	*			trans	-101.4	121.8	177.6	-71.8	-48.6	0	0	0	111.4	L19	N17-L19 PolarHBondContact O-N 3.24Å
18	L	90.2	Very high	87	Confident	99 Å²	99	147.9 Å²	147.9	52%	0.518	72%	0.718	S	S	.	*			trans	-78.9	99.4	175	-77.9	163.1	0	0	0	110.9	Y16	Y16-L18 HydrophobicContact CD1-CG 4.24Å; Y16-L18 HydrophobicContact CE1-CD2 3.46Å; Y16-L18 VanDerWaalsContact CE1-CD2 3.46Å; Y16-L18 HydrophobicContact CE1-CG 3.56Å
19	L	93.5	Very high	87.2	Confident	147 Å²	147	141 Å²	141	77%	0.77	69%	0.686	S	S	*	*			trans	-99.6	13.5	178	-58.1	179.4	0	0	0	113.5	N17 Q21	N17-L19 PolarHBondContact O-N 3.24Å; L19-Q21 VanDerWaalsContact C-N 3.33Å; L19-Q21 PolarHBondContact O-N 3.08Å
20	N	93.7	Very high	87.6	Confident	79 Å²	79	134.3 Å²	134.3	42%	0.422	67%	0.666	S	S	.	*			trans	-88.3	5.4	-176.3	71	-28.6	0	0	0	114.2	Q22 F23	N20-Q22 PolarHBondContact O-N 3.45Å; N20-Q22 VanDerWaalsContact O-N 3.13Å; N20-F23 HydrophobicContact CB-CD2 4.24Å; N20-F23 PolarHBondContact O-N 3.03Å
21	Q	91.6	Very high	87.9	Confident	156 Å²	156	132.8 Å²	132.8	73%	0.729	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-52.9	-38.2	-174	-65.9	-179.6	-4.4	0	0	112.8	L19 F23 V24	L19-Q21 VanDerWaalsContact C-N 3.33Å; L19-Q21 PolarHBondContact O-N 3.08Å; Q21-F23 PolarHBondContact O-N 2.98Å; Q21-V24 PolarHBondContact O-N 3Å
22	Q	91.2	Very high	88.4	Confident	160 Å²	160	137.7 Å²	137.7	75%	0.748	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-65.5	-18.9	177.6	66	-178.9	-20.6	0	0	114.9	N20	N20-Q22 PolarHBondContact O-N 3.45Å; N20-Q22 VanDerWaalsContact O-N 3.13Å
23	F	92.6	Very high	88.8	Confident	152 Å²	152	140.2 Å²	140.2	67%	0.667	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-97.7	-3.8	179.8	-53	-69.7	0	0	0	112.6	N20 Q21 L25	N20-F23 HydrophobicContact CB-CD2 4.24Å; N20-F23 PolarHBondContact O-N 3.03Å; Q21-F23 PolarHBondContact O-N 2.98Å; F23-L25 PolarHBondContact O-N 3.07Å
24	V	91.9	Very high	89.2	Confident	99 Å²	99	139 Å²	139	60%	0.6	68%	0.677	S	S	*	*			trans	-81.3	111.7	177.6	-178.5	0	0	0	0	109.1	Q21	Q21-V24 PolarHBondContact O-N 3Å
25	L	89.4	Confident	89.5	Confident	141 Å²	141	141.2 Å²	141.2	74%	0.738	68%	0.677	S	S	*	*			trans	-69.9	131.8	173.7	-66.2	176.7	0	0	0	110.5	F23	F23-L25 PolarHBondContact O-N 3.07Å
26	A	88.8	Confident	89.3	Confident	69 Å²	69	137.8 Å²	137.8	57%	0.57	66%	0.659	S	S	*	*			trans	-63.4	144.9	175.2	0	0	0	0	0	110.9	N28 S29	A26-N28 PolarHBondContact O-N 3.25Å; A26-S29 WeakPolarHBondContact O-CB 3.38Å; A26-S29 PolarHBondContact O-N 3.09Å; A26-S29 PolarHBondContact O-OG 2.99Å
27	K	88.1	Confident	89.1	Confident	217 Å²	217	131.2 Å²	131.2	94%	0.943	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-29.6	175.7	-68.4	-174.7	178.6	-178.7	0	112.9	S29	K27-S29 PolarHBondContact O-N 3.45Å
28	N	90.1	Very high	88.9	Confident	152 Å²	152	130.2 Å²	130.2	81%	0.813	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	38.2	-179.5	-56.2	-8.8	0	0	0	111.6	A26 N30	A26-N28 PolarHBondContact O-N 3.25Å; N28-N30 PolarHBondContact O-N 2.84Å
29	S	87	Confident	88.5	Confident	35 Å²	35	129.9 Å²	129.9	25%	0.245	63%	0.633	C	S	.	*			trans	-59.3	132.1	179.5	-72.5	0	0	0	0	111.1	A26 K27 F31	A26-S29 WeakPolarHBondContact O-CB 3.38Å; A26-S29 PolarHBondContact O-N 3.09Å; A26-S29 PolarHBondContact O-OG 2.99Å; K27-S29 PolarHBondContact O-N 3.45Å; S29-F31 VanDerWaalsContact O-CD2 3.26Å; S29-F31 WeakPolarHBondContact O-CD2 3.38Å; S29-F31 WeakPolarHBondContact O-CE2 3.24Å; S29-F31 PolarHBondContact O-N 2.81Å
30	N	88.9	Confident	87.9	Confident	84 Å²	84	128.8 Å²	128.8	45%	0.449	62%	0.619	S	S	.	*			trans	-88.1	108	179.9	-178.8	-11.4	0	0	0	110.5	N28 Q32	N28-N30 PolarHBondContact O-N 2.84Å; N30-Q32 WeakPolarHBondContact OD1-CA 3.24Å; N30-Q32 VanDerWaalsContact OD1-CB 3.28Å; N30-Q32 WeakPolarHBondContact OD1-CB 3.45Å; N30-Q32 PolarHBondContact OD1-N 2.97Å
31	F	90	Very high	87.4	Confident	182 Å²	182	133.4 Å²	133.4	80%	0.798	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	2.1	178.3	-60	-79.5	0	0	0	114.4	S29 R33	S29-F31 VanDerWaalsContact O-CD2 3.26Å; S29-F31 WeakPolarHBondContact O-CD2 3.38Å; S29-F31 WeakPolarHBondContact O-CE2 3.24Å; S29-F31 PolarHBondContact O-N 2.81Å; F31-R33 VanDerWaalsContact C-N 3.26Å
32	Q	90.8	Very high	86.8	Confident	179 Å²	179	131.1 Å²	131.1	84%	0.836	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-8.4	175.2	-59.1	-179.8	-31.9	0	0	112.5	N30	N30-Q32 WeakPolarHBondContact OD1-CA 3.24Å; N30-Q32 VanDerWaalsContact OD1-CB 3.28Å; N30-Q32 WeakPolarHBondContact OD1-CB 3.45Å; N30-Q32 PolarHBondContact OD1-N 2.97Å
33	R	87.5	Confident	85.9	Confident	198 Å²	198	125 Å²	125	75%	0.747	59%	0.588	S	S	*	*	S	Bend	trans	-73.6	138.4	179.4	-63.9	-174.9	177.4	-161	0.1	110.8	F31	F31-R33 VanDerWaalsContact C-N 3.26Å
34	Q	87.2	Confident	85	Confident	166 Å²	166	123.5 Å²	123.5	78%	0.776	58%	0.583	S	S	*	*			trans	-79.2	151.1	173.2	-62.3	-177.4	-1.7	0	0	111.3	F36 G37	Q34-F36 PolarHBondContact O-N 2.84Å; Q34-F36 VanDerWaalsContact O-N 3.13Å; Q34-G37 PolarHBondContact O-N 2.63Å
35	Y	85.2	Confident	83.9	Confident	185 Å²	185	123.2 Å²	123.2	73%	0.725	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-20.6	-178.3	-68.6	-68.8	0	0	0	114.4	G37 I38 Y39	Y35-G37 PolarHBondContact O-N 3.1Å; Y35-G37 VanDerWaalsContact O-N 3.11Å; Y35-I38 HydrophobicContact CD1-CD1 4.09Å; Y35-I38 WeakPolarHBondContact O-CB 3.33Å; Y35-I38 PolarHBondContact O-N 2.88Å; Y35-Y39 WeakPolarHBondContact O-CD2 3.46Å
36	F	82.4	Confident	82.5	Confident	102 Å²	102	117.9 Å²	117.9	45%	0.447	56%	0.561	S	S	.	*	H	α-helix	trans	-51.7	-35.3	178.8	176.6	-103.1	0	0	0	113.2	Q34 I38 Y39 R40	Q34-F36 PolarHBondContact O-N 2.84Å; Q34-F36 VanDerWaalsContact O-N 3.13Å; F36-I38 PolarHBondContact O-N 3.38Å; F36-I38 VanDerWaalsContact O-N 3.17Å; F36-Y39 PolarHBondContact O-N 2.78Å; F36-Y39 VanDerWaalsContact O-N 3.08Å; F36-R40 HydrophobicContact CE1-CB 4.12Å; F36-R40 HydrophobicContact CE1-CG 4.48Å; F36-R40 HydrophobicContact CZ-CB 4.32Å; F36-R40 PolarHBondContact O-N 3.33Å
37	G	81.9	Confident	81.1	Confident	45 Å²	45	117.2 Å²	117.2	46%	0.464	55%	0.552	S	S	.	*	H	α-helix	trans	-59.2	-29.5	178.7	0	0	0	0	0	114.2	Q34 Y35 Y41	Q34-G37 PolarHBondContact O-N 2.63Å; Y35-G37 PolarHBondContact O-N 3.1Å; Y35-G37 VanDerWaalsContact O-N 3.11Å; G37-Y41 WeakPolarHBondContact O-CB 3.48Å; G37-Y41 PolarHBondContact O-N 2.96Å; G37-Y41 VanDerWaalsContact O-N 3.11Å
38	I	85.5	Confident	80	Confident	87 Å²	87	113.9 Å²	113.9	45%	0.446	55%	0.545	S	S	.	.	H	α-helix	trans	-69.1	-45.1	176.4	-58.7	175.2	0	0	0	110.2	Y35 F36 R42	Y35-I38 HydrophobicContact CD1-CD1 4.09Å; Y35-I38 WeakPolarHBondContact O-CB 3.33Å; Y35-I38 PolarHBondContact O-N 2.88Å; F36-I38 PolarHBondContact O-N 3.38Å; F36-I38 VanDerWaalsContact O-N 3.17Å; I38-R42 WeakPolarHBondContact O-CB 3.42Å; I38-R42 VanDerWaalsContact O-CG 3.32Å; I38-R42 WeakPolarHBondContact O-CG 3.4Å; I38-R42 PolarHBondContact O-N 2.86Å; I38-R42 VanDerWaalsContact O-N 3.13Å
39	Y	81.4	Confident	78.8	Confident	92 Å²	92	109.9 Å²	109.9	36%	0.361	53%	0.526	S	S	.	.	H	α-helix	trans	-66.3	-42.3	179	-63.3	-74	0	0	0	111.4	Y35 F36 R42 L43 T68	Y35-Y39 WeakPolarHBondContact O-CD2 3.46Å; F36-Y39 PolarHBondContact O-N 2.78Å; F36-Y39 VanDerWaalsContact O-N 3.08Å; Y39-R42 WeakPolarHBondContact O-CB 3.5Å; Y39-R42 PolarHBondContact O-N 2.66Å; Y39-L43 PolarHBondContact O-N 2.82Å; Y39-T68 HydrophobicContact CD1-CG2 3.77Å; Y39-T68 HydrophobicContact CE1-CG2 3.97Å
40	R	80.7	Confident	78	Confident	125 Å²	125	117.8 Å²	117.8	47%	0.472	56%	0.556	S	S	.	*	H	α-helix	trans	-59.3	-48.9	176.1	-171.5	172.1	-166.3	-158.1	-4.2	112.5	F36 R42 L43 H44 E112	F36-R40 HydrophobicContact CE1-CB 4.12Å; F36-R40 HydrophobicContact CE1-CG 4.48Å; F36-R40 HydrophobicContact CZ-CB 4.32Å; F36-R40 PolarHBondContact O-N 3.33Å; R40-R42 VanDerWaalsContact C-N 3.33Å; R40-R42 PolarHBondContact O-N 2.8Å; R40-L43 PolarHBondContact O-N 3.4Å; R40-H44 PolarHBondContact O-N 3.27Å; R40-H44 PolarHBondContact O-ND1 2.81Å; R40-E112 WeakPolarHBondContact CG-OE1 3.41Å; R40-E112 IonicContact NE-OE1 3.09Å; R40-E112 PolarHBondContact NE-OE1 3.36Å; R40-E112 VanDerWaalsContact NE-OE1 3.09Å
41	Y	82.5	Confident	77.4	Confident	175 Å²	175	116 Å²	116	69%	0.686	55%	0.548	S	S	*	.	H	α-helix	trans	-59.8	-45.3	178.5	-179.2	-96.6	0	0	0	111.5	G37 L43 H44 T45	G37-Y41 WeakPolarHBondContact O-CB 3.48Å; G37-Y41 PolarHBondContact O-N 2.96Å; G37-Y41 VanDerWaalsContact O-N 3.11Å; Y41-L43 VanDerWaalsContact C-N 3.35Å; Y41-L43 PolarHBondContact O-N 2.83Å; Y41-H44 PolarHBondContact O-N 2.78Å; Y41-T45 HydrophobicContact CD1-CG2 4.4Å; Y41-T45 HydrophobicContact CE1-CG2 4Å; Y41-T45 HydrophobicContact CE2-CG2 4.34Å; Y41-T45 WeakPolarHBondContact O-CG2 3.37Å; Y41-T45 PolarHBondContact O-N 2.88Å; Y41-T45 PolarHBondContact O-OG1 3.09Å
42	R	79.6	Confident	76.8	Confident	108 Å²	108	109.8 Å²	109.8	41%	0.408	52%	0.521	S	S	.	.	H	α-helix	trans	-56.4	-46.5	176.3	-82.6	179.9	-177.9	-168.3	3.3	112.1	I38 Y39 R40 H44 T45 G130 L132	I38-R42 WeakPolarHBondContact O-CB 3.42Å; I38-R42 VanDerWaalsContact O-CG 3.32Å; I38-R42 WeakPolarHBondContact O-CG 3.4Å; I38-R42 PolarHBondContact O-N 2.86Å; I38-R42 VanDerWaalsContact O-N 3.13Å; Y39-R42 WeakPolarHBondContact O-CB 3.5Å; Y39-R42 PolarHBondContact O-N 2.66Å; R40-R42 VanDerWaalsContact C-N 3.33Å; R40-R42 PolarHBondContact O-N 2.8Å; R42-H44 PolarHBondContact O-N 2.8Å; R42-T45 PolarHBondContact O-N 2.8Å; R42-T45 PolarHBondContact O-OG1 2.96Å; R42-G130 PolarHBondContact NH1-O 2.89Å; R42-L132 HydrophobicContact CB-CD1 3.86Å; R42-L132 HydrophobicContact CB-CD2 4.45Å; R42-L132 HydrophobicContact CB-CG 4.4Å; R42-L132 HydrophobicContact CG-CD1 4.44Å; R42-L132 WeakPolarHBondContact O-CD1 3.26Å
43	L	73.1	Confident	76.5	Confident	31 Å²	31	104.4 Å²	104.4	16%	0.162	50%	0.5	C	S	.	.	H	α-helix	trans	-62.8	-39.5	-178.3	-163.4	71.7	0	0	0	112.8	Y39 R40 Y41 V66 G67 E112 L132	Y39-L43 PolarHBondContact O-N 2.82Å; R40-L43 PolarHBondContact O-N 3.4Å; Y41-L43 VanDerWaalsContact C-N 3.35Å; Y41-L43 PolarHBondContact O-N 2.83Å; L43-V66 HydrophobicContact CD1-CG1 3.84Å; L43-G67 VanDerWaalsContact CD1-CA 3.49Å; L43-E112 HydrophobicContact CD2-CG 3.99Å; L43-L132 HydrophobicContact CD1-CD2 4.37Å
44	H	72.8	Confident	76.3	Confident	121 Å²	121	95.3 Å²	95.3	56%	0.56	47%	0.466	S	S	*	.	H	α-helix	trans	-75.3	-24.8	-176.5	-74.4	72	0	0	0	113.9	R40 Y41 R42 G46 E112	R40-H44 PolarHBondContact O-N 3.27Å; R40-H44 PolarHBondContact O-ND1 2.81Å; Y41-H44 PolarHBondContact O-N 2.78Å; R42-H44 PolarHBondContact O-N 2.8Å; H44-G46 PolarHBondContact O-N 3.48Å; H44-E112 IonicContact CE1-OE1 3.29Å; H44-E112 PolarHBondContact CE1-OE1 3.49Å; H44-E112 VanDerWaalsContact CE1-OE1 3.29Å
45	T	69.1	Low	76.3	Confident	93 Å²	93	89.5 Å²	89.5	57%	0.571	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	7.6	-177.7	53.6	0	0	0	0	114.6	Y41 R42	Y41-T45 HydrophobicContact CD1-CG2 4.4Å; Y41-T45 HydrophobicContact CE1-CG2 4Å; Y41-T45 HydrophobicContact CE2-CG2 4.34Å; Y41-T45 WeakPolarHBondContact O-CG2 3.37Å; Y41-T45 PolarHBondContact O-N 2.88Å; Y41-T45 PolarHBondContact O-OG1 3.09Å; R42-T45 PolarHBondContact O-N 2.8Å; R42-T45 PolarHBondContact O-OG1 2.96Å
46	G	60	Low	76.4	Confident	30 Å²	30	85.1 Å²	85.1	31%	0.309	43%	0.433	S	S	.	.	S	Bend	trans	-109.7	-16.9	-155.1	0	0	0	0	0	120.3	H44	H44-G46 PolarHBondContact O-N 3.48Å
47	S	58.5	Low	76.4	Confident	54 Å²	54	82.5 Å²	82.5	38%	0.378	42%	0.423	S	S	.	.			trans	-161.7	132.2	-172.9	64.7	0	0	0	0	117.7	V49	S47-V49 VanDerWaalsContact C-N 3.34Å
48	D	65.7	Low	76.4	Confident	148 Å²	148	84.3 Å²	84.3	79%	0.791	43%	0.425	S	S	*	.	S	Bend	trans	-89.9	9.1	162.9	-57.9	-46.5	0	0	0	113.3
49	V	65.6	Low	76.1	Confident	67 Å²	67	85.6 Å²	85.6	41%	0.406	43%	0.429	S	S	.	.	S	Bend	trans	-92.7	150.6	-175.7	-176.8	0	0	0	0	109.2	S47 V51	S47-V49 VanDerWaalsContact C-N 3.34Å; V49-V51 VanDerWaalsContact C-N 3.35Å; V49-V51 HydrophobicContact CB-CG2 4.49Å; V49-V51 WeakPolarHBondContact O-CG2 3.32Å; V49-V51 PolarHBondContact O-N 3.12Å
50	K	68.5	Low	75.8	Confident	202 Å²	202	87.8 Å²	87.8	88%	0.878	44%	0.441	S	S	*	.			trans	-65.8	96.2	170.1	-169.7	179.8	-178.5	-178.9	0	109.1
51	V	76.3	Confident	75.6	Confident	47 Å²	47	85.1 Å²	85.1	29%	0.285	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-96.1	136.4	179.9	173	0	0	0	0	108.8	V49 V64 V66	V49-V51 VanDerWaalsContact C-N 3.35Å; V49-V51 HydrophobicContact CB-CG2 4.49Å; V49-V51 WeakPolarHBondContact O-CG2 3.32Å; V49-V51 PolarHBondContact O-N 3.12Å; V51-V64 WeakPolarHBondContact CA-O 3.31Å; V51-V66 HydrophobicContact CB-CG2 4.38Å; V51-V66 HydrophobicContact CG1-CB 3.91Å; V51-V66 HydrophobicContact CG1-CG2 3.86Å; V51-V66 VanDerWaalsContact CG1-N 3.31Å; V51-V66 HydrophobicContact CG2-CB 4.43Å; V51-V66 HydrophobicContact CG2-CG2 3.56Å
52	K	79.3	Confident	75.2	Confident	51 Å²	51	86.1 Å²	86.1	22%	0.222	44%	0.436	C	S	.	.	B	Isolated β-bridge	trans	-87.6	141.6	167.2	-78.1	-165.1	165.6	-160.5	0	109.9	D56 E61 C63 V64	K52-D56 HydrophobicContact CD-CB 4.43Å; K52-D56 PolarHBondContact NZ-O 3.21Å; K52-D56 VanDerWaalsContact NZ-O 3.1Å; K52-E61 VanDerWaalsContact CE-OE1 3.24Å; K52-E61 WeakPolarHBondContact CE-OE1 3.37Å; K52-E61 IonicContact NZ-OE1 2.63Å; K52-E61 PolarHBondContact NZ-OE1 3.39Å; K52-E61 IonicContact NZ-OE2 3.62Å; K52-E61 PolarHBondContact NZ-OE2 3.47Å; K52-C63 HydrophobicContact CD-CB 3.95Å; K52-C63 HydrophobicContact CG-CB 4.34Å; K52-V64 PolarHBondContact N-O 2.9Å
53	V	82.9	Confident	74.9	Confident	66 Å²	66	82.7 Å²	82.7	40%	0.4	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-73.4	157.8	164.4	-65.9	0	0	0	0	109.7	S55 D56	V53-S55 VanDerWaalsContact CG2-OG 3.28Å; V53-S55 WeakPolarHBondContact CG2-OG 3.37Å; V53-S55 PolarHBondContact O-N 2.9Å; V53-D56 HydrophobicContact CG2-CB 3.93Å; V53-D56 WeakPolarHBondContact CG2-OD2 2.93Å; V53-D56 PolarHBondContact O-N 3.46Å; V53-D56 VanDerWaalsContact O-N 3.12Å
54	L	84.8	Confident	75	Confident	6 Å²	6	84.6 Å²	84.6	3%	0.031	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-63	-25.6	-179.1	-69.7	177.5	0	0	0	112.6	D56 L57 I65 L109 D111 L114 V116	L54-D56 VanDerWaalsContact C-N 3.28Å; L54-D56 PolarHBondContact O-N 3.4Å; L54-L57 HydrophobicContact CD2-CD1 3.79Å; L54-L57 VanDerWaalsContact O-CG 3.27Å; L54-L57 WeakPolarHBondContact O-CG 3.35Å; L54-I65 HydrophobicContact CD2-CD1 4.09Å; L54-I65 HydrophobicContact CD2-CG2 3.69Å; L54-I65 HydrophobicContact CG-CG2 4.19Å; L54-L109 HydrophobicContact CD2-CD2 4.27Å; L54-D111 WeakPolarHBondContact CB-OD2 3.44Å; L54-D111 HydrophobicContact CD1-CB 3.91Å; L54-D111 HydrophobicContact CG-CB 4.09Å; L54-D111 WeakPolarHBondContact CG-OD2 3.39Å; L54-D111 PolarHBondContact N-OD2 3.35Å; L54-L114 HydrophobicContact CB-CB 3.89Å; L54-L114 HydrophobicContact CB-CD1 4.32Å; L54-L114 HydrophobicContact CD1-CB 4.24Å; L54-L114 VanDerWaalsContact CD1-O 3.32Å; L54-L114 WeakPolarHBondContact CD1-O 3.47Å; L54-V116 HydrophobicContact CD1-CG1 4.46Å; L54-V116 HydrophobicContact CD1-CG2 4.22Å; L54-V116 HydrophobicContact CD2-CG1 4.15Å; L54-V116 HydrophobicContact CD2-CG2 3.55Å
55	S	86.9	Confident	75.2	Confident	44 Å²	44	79.9 Å²	79.9	31%	0.308	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-71.6	-21.4	177.4	39.1	0	0	0	0	113.4	V53 E113	V53-S55 VanDerWaalsContact CG2-OG 3.28Å; V53-S55 WeakPolarHBondContact CG2-OG 3.37Å; V53-S55 PolarHBondContact O-N 2.9Å; S55-E113 PolarHBondContact OG-OE2 3.24Å
56	D	86.8	Confident	75.7	Confident	94 Å²	94	76.7 Å²	76.7	50%	0.503	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-97	11.6	-177.4	-73	-16.5	0	0	0	113.8	K52 V53 L54 V58	K52-D56 HydrophobicContact CD-CB 4.43Å; K52-D56 PolarHBondContact NZ-O 3.21Å; K52-D56 VanDerWaalsContact NZ-O 3.1Å; V53-D56 HydrophobicContact CG2-CB 3.93Å; V53-D56 WeakPolarHBondContact CG2-OD2 2.93Å; V53-D56 PolarHBondContact O-N 3.46Å; V53-D56 VanDerWaalsContact O-N 3.12Å; L54-D56 VanDerWaalsContact C-N 3.28Å; L54-D56 PolarHBondContact O-N 3.4Å; D56-V58 PolarHBondContact O-N 2.95Å
57	L	83.1	Confident	76.6	Confident	47 Å²	47	75.2 Å²	75.2	25%	0.246	39%	0.385	C	S	.	.			trans	-70.3	129.1	-179.8	-62.8	179.1	0	0	0	111.2	L54 C63 I65 I145	L54-L57 HydrophobicContact CD2-CD1 3.79Å; L54-L57 VanDerWaalsContact O-CG 3.27Å; L54-L57 WeakPolarHBondContact O-CG 3.35Å; L57-C63 VanDerWaalsContact CD2-SG 3.58Å; L57-I65 HydrophobicContact CD1-CD1 4.02Å; L57-I65 HydrophobicContact CD2-CD1 3.45Å; L57-I65 VanDerWaalsContact CD2-CD1 3.45Å; L57-I65 HydrophobicContact CD2-CG1 3.87Å; L57-I65 HydrophobicContact CG-CD1 4.34Å; L57-I145 HydrophobicContact CB-CD1 4.11Å; L57-I145 HydrophobicContact CD1-CD1 3.9Å; L57-I145 HydrophobicContact CD2-CD1 3.96Å; L57-I145 HydrophobicContact CG-CD1 4.2Å
58	V	82.2	Confident	77.9	Confident	82 Å²	82	73.1 Å²	73.1	50%	0.497	37%	0.37	S	S	.	.			trans	-110.5	134.4	173.8	-175	0	0	0	0	107.8	D56 F60 E61	D56-V58 PolarHBondContact O-N 2.95Å; V58-F60 PolarHBondContact O-N 3.15Å; V58-E61 HydrophobicContact CB-CB 4.11Å; V58-E61 WeakPolarHBondContact CB-OE2 3.34Å; V58-E61 WeakPolarHBondContact CG2-OE2 3.45Å; V58-E61 WeakPolarHBondContact O-CB 3.15Å; V58-E61 PolarHBondContact O-N 3.49Å
59	E	77.5	Confident	78.9	Confident	115 Å²	115	66.1 Å²	66.1	54%	0.537	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	139.1	177	-62.8	-173.9	171.4	0	0	110.7	E61 L149	E59-E61 PolarHBondContact O-N 2.81Å; E59-E61 VanDerWaalsContact O-N 3.08Å; E59-L149 HydrophobicContact CG-CD1 4.46Å; E59-L149 WeakPolarHBondContact OE1-CD1 3.4Å
60	F	74.9	Confident	80.1	Confident	137 Å²	137	65.7 Å²	65.7	60%	0.601	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	3.1	179.3	-44.9	-74.4	0	0	0	116.6	V58 H146	V58-F60 PolarHBondContact O-N 3.15Å; F60-H146 AromaticContact CD1-CE1 3.66Å; F60-H146 AromaticContact CD1-ND1 3.81Å; F60-H146 AromaticContact CE1-CE1 3.56Å; F60-H146 AromaticContact CE1-ND1 3.86Å; F60-H146 AromaticContact CE1-NE2 3.94Å
61	E	78.2	Confident	81.2	Confident	69 Å²	69	56.6 Å²	56.6	32%	0.322	28%	0.284	S	S	.	.			trans	-82.7	135.9	173.1	-170.7	-172.3	165.8	0	0	111.5	K52 V58 E59	K52-E61 VanDerWaalsContact CE-OE1 3.24Å; K52-E61 WeakPolarHBondContact CE-OE1 3.37Å; K52-E61 IonicContact NZ-OE1 2.63Å; K52-E61 PolarHBondContact NZ-OE1 3.39Å; K52-E61 IonicContact NZ-OE2 3.62Å; K52-E61 PolarHBondContact NZ-OE2 3.47Å; V58-E61 HydrophobicContact CB-CB 4.11Å; V58-E61 WeakPolarHBondContact CB-OE2 3.34Å; V58-E61 WeakPolarHBondContact CG2-OE2 3.45Å; V58-E61 WeakPolarHBondContact O-CB 3.15Å; V58-E61 PolarHBondContact O-N 3.49Å; E59-E61 PolarHBondContact O-N 2.81Å; E59-E61 VanDerWaalsContact O-N 3.08Å
62	R	73.6	Confident	82	Confident	197 Å²	197	57.9 Å²	57.9	74%	0.743	29%	0.289	S	S	*	.			trans	-81.5	121.7	168.6	-67.5	-176.5	-175.6	173.9	1.9	109.6
63	C	73.4	Confident	82.6	Confident	36 Å²	36	57.5 Å²	57.5	24%	0.243	29%	0.288	C	S	.	.			trans	-140.5	168.8	177.9	60	0	0	0	0	111.8	K52 L57	K52-C63 HydrophobicContact CD-CB 3.95Å; K52-C63 HydrophobicContact CG-CB 4.34Å; L57-C63 VanDerWaalsContact CD2-SG 3.58Å
64	V	75.5	Confident	83	Confident	70 Å²	70	61.2 Å²	61.2	42%	0.424	30%	0.301	S	S	.	.			trans	-111.8	131.3	169.9	179.3	0	0	0	0	107.6	V51 K52	V51-V64 WeakPolarHBondContact CA-O 3.31Å; K52-V64 PolarHBondContact N-O 2.9Å
65	I	77.4	Confident	83.3	Confident	23 Å²	23	66 Å²	66	12%	0.118	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-123.3	140.2	-179.5	-53.9	159	0	0	0	107.3	L54 L57 L109	L54-I65 HydrophobicContact CD2-CD1 4.09Å; L54-I65 HydrophobicContact CD2-CG2 3.69Å; L54-I65 HydrophobicContact CG-CG2 4.19Å; L57-I65 HydrophobicContact CD1-CD1 4.02Å; L57-I65 HydrophobicContact CD2-CD1 3.45Å; L57-I65 VanDerWaalsContact CD2-CD1 3.45Å; L57-I65 HydrophobicContact CD2-CG1 3.87Å; L57-I65 HydrophobicContact CG-CD1 4.34Å; I65-L109 HydrophobicContact CB-CD2 4.13Å; I65-L109 HydrophobicContact CG2-CD2 3.71Å
66	V	78.6	Confident	83.4	Confident	25 Å²	25	68 Å²	68	15%	0.152	33%	0.328	C	S	.	.			trans	-115.2	129.1	170.3	179.7	0	0	0	0	107.2	L43 V51	L43-V66 HydrophobicContact CD1-CG1 3.84Å; V51-V66 HydrophobicContact CB-CG2 4.38Å; V51-V66 HydrophobicContact CG1-CB 3.91Å; V51-V66 HydrophobicContact CG1-CG2 3.86Å; V51-V66 VanDerWaalsContact CG1-N 3.31Å; V51-V66 HydrophobicContact CG2-CB 4.43Å; V51-V66 HydrophobicContact CG2-CG2 3.56Å
67	G	79.8	Confident	83.5	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.327	C	S	.	.			trans	-158.1	175	-177.3	0	0	0	0	0	110.3	L43 E110 P133	L43-G67 VanDerWaalsContact CD1-CA 3.49Å; G67-E110 CarbonylContact C-O 3.57Å; G67-E110 WeakPolarHBondContact CA-O 3.41Å; G67-P133 WeakPolarHBondContact O-CD 3.49Å
68	T	84.5	Confident	83.7	Confident	10 Å²	10	66.7 Å²	66.7	6%	0.061	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	128.3	169.5	-58.6	0	0	0	0	109.1	Y39 Y70 E110	Y39-T68 HydrophobicContact CD1-CG2 3.77Å; Y39-T68 HydrophobicContact CE1-CG2 3.97Å; T68-Y70 PolarHBondContact O-N 2.9Å; T68-E110 PolarHBondContact N-O 3.09Å; T68-E110 PolarHBondContact O-N 3.08Å
69	V	88.3	Confident	83.9	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	126.7	170	175.5	0	0	0	0	109.3	I107 L109 L127 T129 G130 K131	V69-I107 HydrophobicContact CG1-CG2 3.86Å; V69-L109 HydrophobicContact CG2-CD1 4.36Å; V69-L127 HydrophobicContact CG1-CB 4.47Å; V69-T129 CarbonylContact O-C 3.59Å; V69-T129 WeakPolarHBondContact O-CA 3.38Å; V69-G130 PolarHBondContact O-N 3.31Å; V69-K131 WeakPolarHBondContact CB-O 3.42Å; V69-K131 WeakPolarHBondContact CG2-O 3.36Å; V69-K131 PolarHBondContact N-O 3.42Å; V69-K131 VanDerWaalsContact N-O 3.09Å
70	Y	90.4	Very high	84.4	Confident	57 Å²	57	65.9 Å²	65.9	22%	0.224	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.4	169	-178.4	-99.3	0	0	0	109.6	T68 L72 K76 V108 T129	T68-Y70 PolarHBondContact O-N 2.9Å; Y70-L72 HydrophobicContact CD1-CB 4.36Å; Y70-L72 HydrophobicContact CE1-CB 4.03Å; Y70-L72 HydrophobicContact CE1-CD1 3.91Å; Y70-K76 PolarHBondContact OH-NZ 2.78Å; Y70-V108 HydrophobicContact CD1-CB 4.39Å; Y70-V108 PolarHBondContact N-O 2.82Å; Y70-V108 PolarHBondContact O-N 3.23Å; Y70-T129 HydrophobicContact CD2-CG2 3.59Å; Y70-T129 HydrophobicContact CE2-CG2 4.1Å
71	K	91.6	Very high	84.9	Confident	11 Å²	11	64.6 Å²	64.6	5%	0.048	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	112.5	173.1	-171.8	167.2	172.3	169.4	0	108.6	Q73 D105 E106 I107 T124 L127 T129	K71-Q73 HydrophobicContact CB-CG 4.38Å; K71-Q73 HydrophobicContact CD-CG 4.32Å; K71-Q73 HydrophobicContact CG-CG 3.75Å; K71-Q73 PolarHBondContact O-N 3.45Å; K71-D105 HydrophobicContact CD-CB 4.49Å; K71-D105 WeakPolarHBondContact CE-OD2 3.33Å; K71-D105 HydrophobicContact CG-CB 4.16Å; K71-D105 IonicContact NZ-OD2 2.86Å; K71-E106 CarbonylContact C-O 3.32Å; K71-E106 WeakPolarHBondContact CA-O 3.1Å; K71-I107 HydrophobicContact CB-CD1 4.12Å; K71-I107 HydrophobicContact CD-CD1 4.12Å; K71-I107 HydrophobicContact CG-CD1 3.86Å; K71-T124 PolarHBondContact NZ-O 3.47Å; K71-L127 WeakPolarHBondContact CD-O 3.38Å; K71-T129 PolarHBondContact N-OG1 3.03Å
72	L	92.5	Very high	85.1	Confident	75 Å²	75	66.2 Å²	66.2	39%	0.393	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	111.2	175.4	-177	66.7	0	0	0	108.4	Y70 D105 E106	Y70-L72 HydrophobicContact CD1-CB 4.36Å; Y70-L72 HydrophobicContact CE1-CB 4.03Å; Y70-L72 HydrophobicContact CE1-CD1 3.91Å; L72-D105 WeakPolarHBondContact O-CA 3.28Å; L72-E106 HydrophobicContact CB-CB 4.22Å; L72-E106 PolarHBondContact N-O 3.33Å; L72-E106 PolarHBondContact O-N 3.44Å
73	Q	92.7	Very high	85.6	Confident	43 Å²	43	63.3 Å²	63.3	20%	0.201	33%	0.331	C	S	.	.			trans	-120	121.9	-173.3	-55.1	176.2	-101.8	0	0	109.2	K71 M75 K76 Y100 D105	K71-Q73 HydrophobicContact CB-CG 4.38Å; K71-Q73 HydrophobicContact CD-CG 4.32Å; K71-Q73 HydrophobicContact CG-CG 3.75Å; K71-Q73 PolarHBondContact O-N 3.45Å; Q73-M75 VanDerWaalsContact C-N 3.26Å; Q73-M75 PolarHBondContact O-N 2.74Å; Q73-K76 HydrophobicContact CB-CB 3.96Å; Q73-K76 WeakPolarHBondContact O-CB 3.47Å; Q73-K76 PolarHBondContact O-N 2.99Å; Q73-Y100 VanDerWaalsContact NE2-C 3.31Å; Q73-Y100 PolarHBondContact NE2-O 3.24Å; Q73-D105 WeakPolarHBondContact CA-OD1 3.35Å; Q73-D105 HydrophobicContact CG-CB 4.42Å
74	E	90.7	Very high	86.1	Confident	144 Å²	144	71 Å²	71	67%	0.673	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-36	179.4	-176.4	56.8	-149.2	0	0	111.4	K76 K81	E74-K76 PolarHBondContact O-N 2.79Å; E74-K81 IonicContact OE1-NZ 3.03Å
75	M	90.7	Very high	86.2	Confident	106 Å²	106	72.7 Å²	72.7	52%	0.522	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-5.2	-178.8	-62.8	-63	-68.5	0	0	113.5	Q73 Y100	Q73-M75 VanDerWaalsContact C-N 3.26Å; Q73-M75 PolarHBondContact O-N 2.74Å; M75-Y100 HydrophobicContact CB-CD1 4.43Å; M75-Y100 WeakPolarHBondContact O-CD1 3.31Å
76	K	90.2	Very high	85.5	Confident	87 Å²	87	80.2 Å²	80.2	38%	0.378	40%	0.396	S	S	.	.	S	Bend	trans	-67.2	129.5	-178.9	176.4	178.7	175.8	-177	0	110.3	Y70 Q73 E74	Y70-K76 PolarHBondContact OH-NZ 2.78Å; Q73-K76 HydrophobicContact CB-CB 3.96Å; Q73-K76 WeakPolarHBondContact O-CB 3.47Å; Q73-K76 PolarHBondContact O-N 2.99Å; E74-K76 PolarHBondContact O-N 2.79Å
77	P	88.3	Confident	84.7	Confident	72 Å²	72	83.3 Å²	83.3	47%	0.468	41%	0.411	S	S	.	.			trans	-61.7	144.4	178.9	25.6	-34.1	0	0	0	111.1	Y100	P77-Y100 HydrophobicContact CG-CE1 4.44Å
78	S	87.3	Confident	83.5	Confident	40 Å²	40	93.4 Å²	93.4	28%	0.28	46%	0.455	S	S	.	.			trans	-130.6	110.6	-176.9	175.1	0	0	0	0	110	V80 K81 E82	S78-V80 PolarHBondContact O-N 2.87Å; S78-V80 VanDerWaalsContact O-N 3.15Å; S78-V80 PolarHBondContact OG-N 3.23Å; S78-K81 PolarHBondContact O-N 3.26Å; S78-K81 PolarHBondContact OG-N 3.02Å; S78-E82 PolarHBondContact O-N 2.97Å
79	V	86.4	Confident	82.3	Confident	98 Å²	98	96.3 Å²	96.3	59%	0.594	47%	0.473	S	S	*	.	H	α-helix	trans	-54.6	-34.4	173.9	179.6	0	0	0	0	110.9	E82 L83	V79-E82 PolarHBondContact O-N 3.42Å; V79-L83 HydrophobicContact CG1-CD1 3.85Å; V79-L83 HydrophobicContact CG1-CG 4.2Å; V79-L83 WeakPolarHBondContact O-CB 3.13Å; V79-L83 WeakPolarHBondContact O-CG 3.39Å; V79-L83 PolarHBondContact O-N 3.45Å
80	V	86.7	Confident	81	Confident	83 Å²	83	104.9 Å²	104.9	50%	0.503	51%	0.51	S	S	.	.	H	α-helix	trans	-69.2	-37.8	177.8	-180	0	0	0	0	112	S78 R84	S78-V80 PolarHBondContact O-N 2.87Å; S78-V80 VanDerWaalsContact O-N 3.15Å; S78-V80 PolarHBondContact OG-N 3.23Å; V80-R84 WeakPolarHBondContact O-CB 3.27Å; V80-R84 VanDerWaalsContact O-CG 3.24Å; V80-R84 WeakPolarHBondContact O-CG 3.43Å; V80-R84 PolarHBondContact O-N 3.44Å; V80-R84 VanDerWaalsContact O-N 3.16Å
81	K	86.1	Confident	79.7	Confident	110 Å²	110	108.4 Å²	108.4	48%	0.478	54%	0.54	S	S	.	.	H	α-helix	trans	-65.9	-45.8	173.7	-70.1	-177.1	179.2	178.3	0	109.7	E74 S78 L83 R84 D85	E74-K81 IonicContact OE1-NZ 3.03Å; S78-K81 PolarHBondContact O-N 3.26Å; S78-K81 PolarHBondContact OG-N 3.02Å; K81-L83 VanDerWaalsContact C-N 3.29Å; K81-L83 PolarHBondContact O-N 3.2Å; K81-R84 PolarHBondContact O-N 3.27Å; K81-R84 VanDerWaalsContact O-N 3.15Å; K81-D85 PolarHBondContact O-N 2.99Å
82	E	82.1	Confident	78.4	Confident	102 Å²	102	114.3 Å²	114.3	48%	0.477	57%	0.568	S	S	.	*	H	α-helix	trans	-61.6	-31.1	177.4	-68.7	169.1	-144.6	0	0	114.1	S78 V79 I87	S78-E82 PolarHBondContact O-N 2.97Å; V79-E82 PolarHBondContact O-N 3.42Å; E82-I87 WeakPolarHBondContact O-CG1 3.37Å
83	L	83.8	Confident	77	Confident	136 Å²	136	115.5 Å²	115.5	71%	0.712	58%	0.58	S	S	*	*	H	α-helix	trans	-82.2	-26	176.3	-72.6	172.8	0	0	0	113.2	V79 K81	V79-L83 HydrophobicContact CG1-CD1 3.85Å; V79-L83 HydrophobicContact CG1-CG 4.2Å; V79-L83 WeakPolarHBondContact O-CB 3.13Å; V79-L83 WeakPolarHBondContact O-CG 3.39Å; V79-L83 PolarHBondContact O-N 3.45Å; K81-L83 VanDerWaalsContact C-N 3.29Å; K81-L83 PolarHBondContact O-N 3.2Å
84	R	84.6	Confident	75.5	Confident	197 Å²	197	122.4 Å²	122.4	74%	0.743	62%	0.615	S	S	*	*	H	α-helix	trans	-79.4	-44.4	179.4	-79.2	175.7	-178.8	-170.7	1.5	112	V80 K81 E86	V80-R84 WeakPolarHBondContact O-CB 3.27Å; V80-R84 VanDerWaalsContact O-CG 3.24Å; V80-R84 WeakPolarHBondContact O-CG 3.43Å; V80-R84 PolarHBondContact O-N 3.44Å; V80-R84 VanDerWaalsContact O-N 3.16Å; K81-R84 PolarHBondContact O-N 3.27Å; K81-R84 VanDerWaalsContact O-N 3.15Å; R84-E86 PolarHBondContact O-N 2.92Å; R84-E86 VanDerWaalsContact O-N 3.11Å
85	D	77.9	Confident	74.2	Confident	106 Å²	106	122.3 Å²	122.3	57%	0.567	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	107.2	166.7	-58.5	-25.2	0	0	0	104	K81 I87	K81-D85 PolarHBondContact O-N 2.99Å; D85-I87 HydrophobicContact CB-CD1 4.27Å; D85-I87 HydrophobicContact CB-CG1 3.92Å; D85-I87 WeakPolarHBondContact O-CG1 3.32Å; D85-I87 PolarHBondContact O-N 3.23Å
86	E	63.5	Low	73.2	Confident	181 Å²	181	123.2 Å²	123.2	85%	0.846	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	71.9	-174.9	-69.3	-179.3	165.2	0	0	111.3	R84 K88	R84-E86 PolarHBondContact O-N 2.92Å; R84-E86 VanDerWaalsContact O-N 3.11Å; E86-K88 PolarHBondContact O-N 3.39Å
87	I	60.6	Low	72.1	Confident	91 Å²	91	125.7 Å²	125.7	47%	0.467	64%	0.644	S	S	.	*			trans	-81.5	99.1	-166.3	-14.5	-176.9	0	0	0	109.2	E82 D85 T89	E82-I87 WeakPolarHBondContact O-CG1 3.37Å; D85-I87 HydrophobicContact CB-CD1 4.27Å; D85-I87 HydrophobicContact CB-CG1 3.92Å; D85-I87 WeakPolarHBondContact O-CG1 3.32Å; D85-I87 PolarHBondContact O-N 3.23Å; I87-T89 HydrophobicContact CB-CG2 4.47Å; I87-T89 HydrophobicContact CG2-CG2 3.62Å; I87-T89 PolarHBondContact O-N 3.34Å
88	K	55	Low	71.6	Confident	211 Å²	211	125.9 Å²	125.9	92%	0.917	65%	0.646	S	S	*	*			trans	-50.6	47.9	143.8	-63.6	175.3	177.5	172.8	0	112.2	E86	E86-K88 PolarHBondContact O-N 3.39Å
89	T	58.2	Low	71.5	Confident	72 Å²	72	133.2 Å²	133.2	44%	0.442	67%	0.673	S	S	.	*			trans	-111.7	112.4	-172.7	95.3	0	0	0	0	108.1	I87	I87-T89 HydrophobicContact CB-CG2 4.47Å; I87-T89 HydrophobicContact CG2-CG2 3.62Å; I87-T89 PolarHBondContact O-N 3.34Å
90	K	61.8	Low	71.7	Confident	181 Å²	181	132.2 Å²	132.2	79%	0.787	66%	0.659	S	S	*	*			trans	-49.1	150.8	164.9	-65.9	177	178.7	177.1	0	108.1	Q92	K90-Q92 PolarHBondContact O-N 3.34Å
91	P	64.3	Low	71.8	Confident	131 Å²	131	131.2 Å²	131.2	85%	0.851	66%	0.659	S	S	*	*			trans	-43	112.9	172.1	-25.7	31.7	0	0	0	109.4
92	Q	62.5	Low	72	Confident	135 Å²	135	129 Å²	129	63%	0.631	65%	0.652	S	S	*	*			trans	-61.6	131.9	176.7	-74.6	-101.9	11.1	0	0	106.8	K90 M94	K90-Q92 PolarHBondContact O-N 3.34Å; Q92-M94 PolarHBondContact O-N 3.42Å
93	P	63.2	Low	72.3	Confident	99 Å²	99	128.5 Å²	128.5	64%	0.643	66%	0.661	S	S	*	*			trans	-56.4	139.3	171.9	24.1	-31.3	0	0	0	108.5	Q95	P93-Q95 VanDerWaalsContact C-N 3.26Å; P93-Q95 PolarHBondContact O-N 3Å
94	M	61.1	Low	72.7	Confident	189 Å²	189	130.3 Å²	130.3	93%	0.931	66%	0.663	S	S	*	*			trans	-61.6	88.8	177.8	-67.5	174.2	65.3	0	0	109.3	Q92	Q92-M94 PolarHBondContact O-N 3.42Å
95	Q	64	Low	73	Confident	142 Å²	142	121.4 Å²	121.4	66%	0.664	63%	0.63	S	S	*	*			trans	-65.2	154.3	166.2	-68.4	-173.4	-26.9	0	0	108.4	P93 L97	P93-Q95 VanDerWaalsContact C-N 3.26Å; P93-Q95 PolarHBondContact O-N 3Å; Q95-L97 PolarHBondContact O-N 3.25Å
96	P	69.7	Low	73.6	Confident	125 Å²	125	119.6 Å²	119.6	81%	0.812	62%	0.618	S	S	*	*			trans	-50.1	118.2	170.7	-22.6	31.9	0	0	0	108.7	P98	P96-P98 WeakPolarHBondContact O-CD 3.43Å
97	L	68	Low	74.9	Confident	138 Å²	138	111.1 Å²	111.1	72%	0.723	58%	0.578	S	S	*	*			trans	-56	115.6	-176	-72.4	164.2	0	0	0	108.3	Q95 Y100	Q95-L97 PolarHBondContact O-N 3.25Å; L97-Y100 WeakPolarHBondContact CD2-OH 3.11Å
98	P	78	Confident	76.2	Confident	76 Å²	76	107 Å²	107	49%	0.494	56%	0.558	S	S	.	*			trans	-63.7	152.4	-179.3	26.5	-32.9	0	0	0	109.5	P96 Y100	P96-P98 WeakPolarHBondContact O-CD 3.43Å; P98-Y100 HydrophobicContact CG-CE1 3.9Å; P98-Y100 PolarHBondContact O-N 3.32Å
99	K	85.2	Confident	77.7	Confident	195 Å²	195	97.4 Å²	97.4	85%	0.848	52%	0.516	S	S	*	.			trans	-64.8	120.8	169.5	-70.1	-178.3	179.7	179.1	0	108	A101	K99-A101 VanDerWaalsContact C-N 3.28Å
100	Y	89.4	Confident	79	Confident	76 Å²	76	96.7 Å²	96.7	30%	0.298	51%	0.508	S	S	.	.			trans	-84.5	-2	177.2	-54.2	-61.5	0	0	0	113.6	Q73 M75 P77 L97 P98	Q73-Y100 VanDerWaalsContact NE2-C 3.31Å; Q73-Y100 PolarHBondContact NE2-O 3.24Å; M75-Y100 HydrophobicContact CB-CD1 4.43Å; M75-Y100 WeakPolarHBondContact O-CD1 3.31Å; P77-Y100 HydrophobicContact CG-CE1 4.44Å; L97-Y100 WeakPolarHBondContact CD2-OH 3.11Å; P98-Y100 HydrophobicContact CG-CE1 3.9Å; P98-Y100 PolarHBondContact O-N 3.32Å
101	A	89.4	Confident	80	Confident	62 Å²	62	89.2 Å²	89.2	51%	0.512	48%	0.477	S	S	.	.			trans	-83	124.8	179.7	0	0	0	0	0	110.1	K99 D105	K99-A101 VanDerWaalsContact C-N 3.28Å; A101-D105 VanDerWaalsContact CA-OD2 3.32Å; A101-D105 WeakPolarHBondContact CA-OD2 3.49Å
102	D	90.3	Very high	80.7	Confident	63 Å²	63	87.2 Å²	87.2	34%	0.337	46%	0.456	S	S	.	.			trans	-117.8	156.1	174.9	-162.6	-77.8	0	0	0	110.8	K104 D105	D102-K104 PolarHBondContact O-N 3.44Å; D102-K104 WeakPolarHBondContact OD1-CB 3.21Å; D102-K104 WeakPolarHBondContact OD1-CG 3.33Å; D102-K104 PolarHBondContact OD1-N 3.18Å; D102-D105 WeakPolarHBondContact CB-OD1 3.46Å; D102-D105 VanDerWaalsContact N-CG 3.3Å; D102-D105 PolarHBondContact N-OD1 2.77Å; D102-D105 PolarHBondContact N-OD2 2.92Å; D102-D105 WeakPolarHBondContact O-CB 3.32Å; D102-D105 PolarHBondContact O-N 2.85Å
103	S	88.4	Confident	81.5	Confident	93 Å²	93	87.4 Å²	87.4	65%	0.65	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-24.2	169.3	52.3	0	0	0	0	114.1	D105	S103-D105 VanDerWaalsContact C-N 3.35Å
104	K	90.8	Very high	82.6	Confident	174 Å²	174	84.8 Å²	84.8	76%	0.757	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.4	179.7	-62.4	177.8	-177.6	178.9	0	113.2	D102	D102-K104 PolarHBondContact O-N 3.44Å; D102-K104 WeakPolarHBondContact OD1-CB 3.21Å; D102-K104 WeakPolarHBondContact OD1-CG 3.33Å; D102-K104 PolarHBondContact OD1-N 3.18Å
105	D	92	Very high	83.9	Confident	9 Å²	9	80.6 Å²	80.6	5%	0.048	41%	0.411	C	S	.	.			trans	-58.9	142.5	177.3	-67.1	-17.2	0	0	0	110.4	K71 L72 Q73 A101 D102 S103 T124	K71-D105 HydrophobicContact CD-CB 4.49Å; K71-D105 WeakPolarHBondContact CE-OD2 3.33Å; K71-D105 HydrophobicContact CG-CB 4.16Å; K71-D105 IonicContact NZ-OD2 2.86Å; L72-D105 WeakPolarHBondContact O-CA 3.28Å; Q73-D105 WeakPolarHBondContact CA-OD1 3.35Å; Q73-D105 HydrophobicContact CG-CB 4.42Å; A101-D105 VanDerWaalsContact CA-OD2 3.32Å; A101-D105 WeakPolarHBondContact CA-OD2 3.49Å; D102-D105 WeakPolarHBondContact CB-OD1 3.46Å; D102-D105 VanDerWaalsContact N-CG 3.3Å; D102-D105 PolarHBondContact N-OD1 2.77Å; D102-D105 PolarHBondContact N-OD2 2.92Å; D102-D105 WeakPolarHBondContact O-CB 3.32Å; D102-D105 PolarHBondContact O-N 2.85Å; S103-D105 VanDerWaalsContact C-N 3.35Å; D105-T124 HydrophobicContact CB-CG2 3.82Å; D105-T124 WeakPolarHBondContact O-CG2 3.21Å
106	E	90.7	Very high	84.9	Confident	68 Å²	68	75.7 Å²	75.7	32%	0.318	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	148.2	179.9	-48.8	-169.4	158.8	0	0	110.4	K71 L72 K117	K71-E106 CarbonylContact C-O 3.32Å; K71-E106 WeakPolarHBondContact CA-O 3.1Å; L72-E106 HydrophobicContact CB-CB 4.22Å; L72-E106 PolarHBondContact N-O 3.33Å; L72-E106 PolarHBondContact O-N 3.44Å; E106-K117 VanDerWaalsContact CD-CE 3.46Å; E106-K117 IonicContact OE1-NZ 3.63Å; E106-K117 PolarHBondContact OE1-NZ 3.13Å; E106-K117 WeakPolarHBondContact OE2-CD 3.46Å; E106-K117 WeakPolarHBondContact OE2-CE 3.32Å; E106-K117 IonicContact OE2-NZ 2.66Å; E106-K117 PolarHBondContact OE2-NZ 3.11Å
107	I	89.6	Confident	85.7	Confident	4 Å²	4	74.1 Å²	74.1	2%	0.021	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	126.6	175.6	-57.3	-61.1	0	0	0	108.4	V69 K71 L118 I122 T124 L127	V69-I107 HydrophobicContact CG1-CG2 3.86Å; K71-I107 HydrophobicContact CB-CD1 4.12Å; K71-I107 HydrophobicContact CD-CD1 4.12Å; K71-I107 HydrophobicContact CG-CD1 3.86Å; I107-L118 HydrophobicContact CB-CB 4.45Å; I107-L118 HydrophobicContact CG2-CB 4.29Å; I107-L118 HydrophobicContact CG2-CD1 3.79Å; I107-L118 HydrophobicContact CG2-CG 4.24Å; I107-L118 PolarHBondContact O-N 3.17Å; I107-I122 HydrophobicContact CG1-CG2 4.13Å; I107-T124 HydrophobicContact CD1-CG2 3.92Å; I107-T124 HydrophobicContact CG1-CG2 4.09Å; I107-L127 HydrophobicContact CD1-CB 3.82Å; I107-L127 HydrophobicContact CD1-CD1 4.09Å; I107-L127 HydrophobicContact CG1-CD1 3.98Å; I107-L127 HydrophobicContact CG2-CD1 3.93Å
108	V	89.3	Confident	86.5	Confident	5 Å²	5	68.3 Å²	68.3	3%	0.03	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	139.6	176.9	178.8	0	0	0	0	107.9	Y70 E110 R115 V116	Y70-V108 HydrophobicContact CD1-CB 4.39Å; Y70-V108 PolarHBondContact N-O 2.82Å; Y70-V108 PolarHBondContact O-N 3.23Å; V108-E110 HydrophobicContact CG1-CG 4.05Å; V108-R115 HydrophobicContact CG1-CB 3.8Å; V108-V116 CarbonylContact C-O 3.52Å; V108-V116 VanDerWaalsContact CA-O 3.31Å; V108-V116 WeakPolarHBondContact CA-O 3.43Å; V108-V116 WeakPolarHBondContact CG1-O 3.44Å
109	L	86.9	Confident	86.7	Confident	8 Å²	8	67.6 Å²	67.6	4%	0.042	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	129	169.2	-173	67.7	0	0	0	108.4	L54 I65 V69 R115 V116 L118	L54-L109 HydrophobicContact CD2-CD2 4.27Å; I65-L109 HydrophobicContact CB-CD2 4.13Å; I65-L109 HydrophobicContact CG2-CD2 3.71Å; V69-L109 HydrophobicContact CG2-CD1 4.36Å; L109-R115 CarbonylContact O-C 3.38Å; L109-R115 VanDerWaalsContact O-CA 3.31Å; L109-R115 WeakPolarHBondContact O-CA 2.98Å; L109-V116 HydrophobicContact CB-CG2 4.03Å; L109-V116 PolarHBondContact N-O 2.96Å; L109-V116 PolarHBondContact O-N 3.11Å; L109-L118 HydrophobicContact CB-CD1 4.15Å; L109-L118 HydrophobicContact CB-CD2 3.78Å; L109-L118 HydrophobicContact CB-CG 4.02Å; L109-L118 HydrophobicContact CD2-CD2 4.36Å
110	E	84.8	Confident	86.4	Confident	57 Å²	57	61.5 Å²	61.5	27%	0.266	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.7	-178	-56.4	-177.2	160.4	0	0	109.9	G67 T68 V108 L114 R115	G67-E110 CarbonylContact C-O 3.57Å; G67-E110 WeakPolarHBondContact CA-O 3.41Å; T68-E110 PolarHBondContact N-O 3.09Å; T68-E110 PolarHBondContact O-N 3.08Å; V108-E110 HydrophobicContact CG1-CG 4.05Å; E110-L114 WeakPolarHBondContact CA-O 3.41Å; E110-R115 HydrophobicContact CG-CB 4.01Å
111	D	81.5	Confident	85.9	Confident	25 Å²	25	63.1 Å²	63.1	13%	0.134	35%	0.349	C	S	.	.			trans	-115.5	-159.5	165.6	75.4	1.4	0	0	0	110.7	L54 E113 L114	L54-D111 WeakPolarHBondContact CB-OD2 3.44Å; L54-D111 HydrophobicContact CD1-CB 3.91Å; L54-D111 HydrophobicContact CG-CB 4.09Å; L54-D111 WeakPolarHBondContact CG-OD2 3.39Å; L54-D111 PolarHBondContact N-OD2 3.35Å; D111-E113 VanDerWaalsContact C-N 3.26Å; D111-E113 PolarHBondContact O-N 3.44Å; D111-E113 PolarHBondContact OD1-N 3.29Å; D111-L114 PolarHBondContact N-O 2.72Å; D111-L114 PolarHBondContact OD1-N 3.48Å
112	E	79.2	Confident	85.4	Confident	89 Å²	89	61.6 Å²	61.6	42%	0.416	33%	0.331	S	S	.	.	S	Bend	trans	-69.1	-22.3	179.8	-62.7	-163.9	140.5	0	0	113.5	R40 L43 H44	R40-E112 WeakPolarHBondContact CG-OE1 3.41Å; R40-E112 IonicContact NE-OE1 3.09Å; R40-E112 PolarHBondContact NE-OE1 3.36Å; R40-E112 VanDerWaalsContact NE-OE1 3.09Å; L43-E112 HydrophobicContact CD2-CG 3.99Å; H44-E112 IonicContact CE1-OE1 3.29Å; H44-E112 PolarHBondContact CE1-OE1 3.49Å; H44-E112 VanDerWaalsContact CE1-OE1 3.29Å
113	E	80.5	Confident	85.2	Confident	138 Å²	138	64.7 Å²	64.7	65%	0.645	34%	0.344	S	S	*	.	S	Bend	trans	-120.3	-32.6	-168.6	-60.9	-173.1	156.8	0	0	113.4	S55 D111	S55-E113 PolarHBondContact OG-OE2 3.24Å; D111-E113 VanDerWaalsContact C-N 3.26Å; D111-E113 PolarHBondContact O-N 3.44Å; D111-E113 PolarHBondContact OD1-N 3.29Å
114	L	86	Confident	85	Confident	45 Å²	45	61.9 Å²	61.9	24%	0.236	32%	0.323	C	S	.	.			trans	-139.9	166.4	-167.3	-67.6	177.2	0	0	0	112.6	L54 E110 D111	L54-L114 HydrophobicContact CB-CB 3.89Å; L54-L114 HydrophobicContact CB-CD1 4.32Å; L54-L114 HydrophobicContact CD1-CB 4.24Å; L54-L114 VanDerWaalsContact CD1-O 3.32Å; L54-L114 WeakPolarHBondContact CD1-O 3.47Å; E110-L114 WeakPolarHBondContact CA-O 3.41Å; D111-L114 PolarHBondContact N-O 2.72Å; D111-L114 PolarHBondContact OD1-N 3.48Å
115	R	88	Confident	84.7	Confident	100 Å²	100	63.5 Å²	63.5	38%	0.377	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135.9	172.5	57.8	-178	163.6	-175	-6.2	110.1	V108 L109 E110 L152 C153	V108-R115 HydrophobicContact CG1-CB 3.8Å; L109-R115 CarbonylContact O-C 3.38Å; L109-R115 VanDerWaalsContact O-CA 3.31Å; L109-R115 WeakPolarHBondContact O-CA 2.98Å; E110-R115 HydrophobicContact CG-CB 4.01Å; R115-L152 HydrophobicContact CG-CB 4.23Å; R115-L152 PolarHBondContact NE-O 3.46Å; R115-C153 PolarHBondContact NH2-O 3.13Å; R115-C153 PolarHBondContact NH2-OXT 2.99Å
116	V	84.8	Confident	84.2	Confident	39 Å²	39	70.1 Å²	70.1	24%	0.236	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137.4	178.8	-62.3	0	0	0	0	110	L54 V108 L109 L118	L54-V116 HydrophobicContact CD1-CG1 4.46Å; L54-V116 HydrophobicContact CD1-CG2 4.22Å; L54-V116 HydrophobicContact CD2-CG1 4.15Å; L54-V116 HydrophobicContact CD2-CG2 3.55Å; V108-V116 CarbonylContact C-O 3.52Å; V108-V116 VanDerWaalsContact CA-O 3.31Å; V108-V116 WeakPolarHBondContact CA-O 3.43Å; V108-V116 WeakPolarHBondContact CG1-O 3.44Å; L109-V116 HydrophobicContact CB-CG2 4.03Å; L109-V116 PolarHBondContact N-O 2.96Å; L109-V116 PolarHBondContact O-N 3.11Å; V116-L118 HydrophobicContact CG2-CD2 4.27Å
117	K	87	Confident	84	Confident	92 Å²	92	67.7 Å²	67.7	40%	0.4	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	128.6	172.1	-178.3	174.8	177.5	167.8	0	108.9	E106 V119	E106-K117 VanDerWaalsContact CD-CE 3.46Å; E106-K117 IonicContact OE1-NZ 3.63Å; E106-K117 PolarHBondContact OE1-NZ 3.13Å; E106-K117 WeakPolarHBondContact OE2-CD 3.46Å; E106-K117 WeakPolarHBondContact OE2-CE 3.32Å; E106-K117 IonicContact OE2-NZ 2.66Å; E106-K117 PolarHBondContact OE2-NZ 3.11Å; K117-V119 HydrophobicContact CG-CG1 4.29Å
118	L	84.8	Confident	83.9	Confident	16 Å²	16	71 Å²	71	8%	0.084	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	134.3	173.5	-54.2	-174.2	0	0	0	109.7	I107 L109 V116 I122 L143	I107-L118 HydrophobicContact CB-CB 4.45Å; I107-L118 HydrophobicContact CG2-CB 4.29Å; I107-L118 HydrophobicContact CG2-CD1 3.79Å; I107-L118 HydrophobicContact CG2-CG 4.24Å; I107-L118 PolarHBondContact O-N 3.17Å; L109-L118 HydrophobicContact CB-CD1 4.15Å; L109-L118 HydrophobicContact CB-CD2 3.78Å; L109-L118 HydrophobicContact CB-CG 4.02Å; L109-L118 HydrophobicContact CD2-CD2 4.36Å; V116-L118 HydrophobicContact CG2-CD2 4.27Å; L118-I122 HydrophobicContact CB-CD1 3.3Å; L118-I122 HydrophobicContact CD1-CD1 4.32Å; L118-I122 HydrophobicContact CG-CD1 4.45Å; L118-L143 HydrophobicContact CD2-CD1 4.32Å; L118-L143 HydrophobicContact CD2-CD2 4.2Å
119	V	82.4	Confident	83.9	Confident	61 Å²	61	73.2 Å²	73.2	37%	0.37	38%	0.38	S	S	.	.			trans	-132.6	157.9	179.2	-64.6	0	0	0	0	109.7	K117 A147	K117-V119 HydrophobicContact CG-CG1 4.29Å; V119-A147 HydrophobicContact CG2-CB 4.22Å
120	G	77.8	Confident	83.7	Confident	68 Å²	68	73.5 Å²	73.5	70%	0.701	39%	0.385	S	S	*	.	S	Bend	trans	113.6	-151.2	-180	0	0	0	0	0	113.1	I122	G120-I122 VanDerWaalsContact C-N 3.29Å; G120-I122 PolarHBondContact O-N 2.88Å
121	C	79.3	Confident	83.4	Confident	110 Å²	110	74.1 Å²	74.1	74%	0.743	39%	0.387	S	S	*	.	S	Bend	trans	-77.1	80.4	180	-59	0	0	0	0	110.1	T141	C121-T141 HydrophobicContact CB-CG2 3.71Å; C121-T141 WeakPolarHBondContact O-CG2 3.48Å; C121-T141 PolarHBondContact O-OG1 2.63Å; C121-T141 VanDerWaalsContact O-OG1 3.05Å
122	I	80	Confident	82.6	Confident	29 Å²	29	74.4 Å²	74.4	15%	0.149	39%	0.389	C	S	.	.			trans	-125.6	119.8	-178.8	-59.4	176.6	0	0	0	108.5	I107 L118 G120 T124 L127 L139	I107-I122 HydrophobicContact CG1-CG2 4.13Å; L118-I122 HydrophobicContact CB-CD1 3.3Å; L118-I122 HydrophobicContact CD1-CD1 4.32Å; L118-I122 HydrophobicContact CG-CD1 4.45Å; G120-I122 VanDerWaalsContact C-N 3.29Å; G120-I122 PolarHBondContact O-N 2.88Å; I122-T124 PolarHBondContact O-N 3.13Å; I122-L127 HydrophobicContact CG2-CD1 3.52Å; I122-L139 HydrophobicContact CB-CD2 4.45Å; I122-L139 HydrophobicContact CG1-CD2 4.02Å; I122-L139 HydrophobicContact CG2-CD2 4.03Å
123	E	84.3	Confident	81.7	Confident	128 Å²	128	71.7 Å²	71.7	60%	0.598	38%	0.379	S	S	*	.			trans	-81	85.3	175	-75	-66.1	176.4	0	0	110.9	R125 E126	E123-R125 PolarHBondContact O-N 3.24Å; E123-E126 HydrophobicContact CB-CB 4.4Å; E123-E126 HydrophobicContact CB-CG 4.15Å; E123-E126 PolarHBondContact O-N 3.39Å
124	T	84.2	Confident	80	Confident	34 Å²	34	70.5 Å²	70.5	21%	0.209	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-28.6	-178.9	-58.9	0	0	0	0	113.4	K71 D105 I107 I122	K71-T124 PolarHBondContact NZ-O 3.47Å; D105-T124 HydrophobicContact CB-CG2 3.82Å; D105-T124 WeakPolarHBondContact O-CG2 3.21Å; I107-T124 HydrophobicContact CD1-CG2 3.92Å; I107-T124 HydrophobicContact CG1-CG2 4.09Å; I122-T124 PolarHBondContact O-N 3.13Å
125	R	85.1	Confident	77.9	Confident	209 Å²	209	75.5 Å²	75.5	79%	0.789	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-28.4	179.5	-69.4	-178.3	177.2	169.9	1.1	113.6	E123	E123-R125 PolarHBondContact O-N 3.24Å
126	E	83	Confident	75.3	Confident	147 Å²	147	78.4 Å²	78.4	69%	0.687	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-5.9	-179	-59.7	-169	162.9	0	0	113.3	E123 K131	E123-E126 HydrophobicContact CB-CB 4.4Å; E123-E126 HydrophobicContact CB-CG 4.15Å; E123-E126 PolarHBondContact O-N 3.39Å; E126-K131 PolarHBondContact O-NZ 2.99Å
127	L	85.2	Confident	73.1	Confident	17 Å²	17	82.1 Å²	82.1	9%	0.089	43%	0.433	C	S	.	.			trans	-102	141.7	177.8	-63.9	177.9	0	0	0	111.1	V69 K71 I107 I122 K131 L139	V69-L127 HydrophobicContact CG1-CB 4.47Å; K71-L127 WeakPolarHBondContact CD-O 3.38Å; I107-L127 HydrophobicContact CD1-CB 3.82Å; I107-L127 HydrophobicContact CD1-CD1 4.09Å; I107-L127 HydrophobicContact CG1-CD1 3.98Å; I107-L127 HydrophobicContact CG2-CD1 3.93Å; I122-L127 HydrophobicContact CG2-CD1 3.52Å; L127-K131 HydrophobicContact CD2-CD 4.1Å; L127-L139 HydrophobicContact CD1-CD1 4.14Å; L127-L139 HydrophobicContact CD1-CD2 4.37Å; L127-L139 HydrophobicContact CD2-CD1 4.19Å
128	C	87.3	Confident	70.8	Confident	74 Å²	74	81.8 Å²	81.8	50%	0.5	44%	0.435	S	S	.	.			trans	-136	154.5	175.5	61.5	0	0	0	0	109.7	G130 K131	C128-G130 PolarHBondContact O-N 3.15Å; C128-K131 WeakPolarHBondContact O-CB 3.24Å; C128-K131 PolarHBondContact O-N 2.88Å
129	T	89.2	Confident	68.9	Low	51 Å²	51	83.1 Å²	83.1	31%	0.313	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	136.1	177.3	-60.1	0	0	0	0	111.2	V69 Y70 K71	V69-T129 CarbonylContact O-C 3.59Å; V69-T129 WeakPolarHBondContact O-CA 3.38Å; Y70-T129 HydrophobicContact CD2-CG2 3.59Å; Y70-T129 HydrophobicContact CE2-CG2 4.1Å; K71-T129 PolarHBondContact N-OG1 3.03Å
130	G	83.3	Confident	66.7	Low	15 Å²	15	84.7 Å²	84.7	16%	0.155	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	-1.2	178.1	0	0	0	0	0	114.9	R42 V69 C128 L132	R42-G130 PolarHBondContact NH1-O 2.89Å; V69-G130 PolarHBondContact O-N 3.31Å; C128-G130 PolarHBondContact O-N 3.15Å; G130-L132 PolarHBondContact O-N 2.98Å
131	K	78.3	Confident	64.6	Low	70 Å²	70	83.8 Å²	83.8	30%	0.304	44%	0.437	S	S	.	.			trans	-70.8	124	171.8	-163.8	175.7	-175.1	-179.5	0	108.7	V69 E126 L127 C128	V69-K131 WeakPolarHBondContact CB-O 3.42Å; V69-K131 WeakPolarHBondContact CG2-O 3.36Å; V69-K131 PolarHBondContact N-O 3.42Å; V69-K131 VanDerWaalsContact N-O 3.09Å; E126-K131 PolarHBondContact O-NZ 2.99Å; L127-K131 HydrophobicContact CD2-CD 4.1Å; C128-K131 WeakPolarHBondContact O-CB 3.24Å; C128-K131 PolarHBondContact O-N 2.88Å
132	L	64.9	Low	62.6	Low	31 Å²	31	82.7 Å²	82.7	16%	0.162	43%	0.429	C	S	.	.			trans	-81.3	134.7	163.7	-70.2	164.6	0	0	0	107.7	R42 L43 G130 L134	R42-L132 HydrophobicContact CB-CD1 3.86Å; R42-L132 HydrophobicContact CB-CD2 4.45Å; R42-L132 HydrophobicContact CB-CG 4.4Å; R42-L132 HydrophobicContact CG-CD1 4.44Å; R42-L132 WeakPolarHBondContact O-CD1 3.26Å; L43-L132 HydrophobicContact CD1-CD2 4.37Å; G130-L132 PolarHBondContact O-N 2.98Å; L132-L134 VanDerWaalsContact C-N 3.33Å; L132-L134 PolarHBondContact O-N 3.31Å
133	P	59.3	Low	60.9	Low	32 Å²	32	83.5 Å²	83.5	21%	0.208	43%	0.433	C	S	.	.			trans	-65.2	96	167.2	25.8	-27.9	0	0	0	108.5	G67	G67-P133 WeakPolarHBondContact O-CD 3.49Å
134	L	45.6	Very low	58.9	Low	113 Å²	113	80.1 Å²	80.1	59%	0.592	42%	0.424	S	S	*	.			trans	-79.3	150.1	176.4	-70.7	170.2	0	0	0	110.5	L132 N136 N137 I138	L132-L134 VanDerWaalsContact C-N 3.33Å; L132-L134 PolarHBondContact O-N 3.31Å; L134-N136 PolarHBondContact O-N 3.15Å; L134-N137 CarbonylContact O-C 3.54Å; L134-N137 VanDerWaalsContact O-C 3.32Å; L134-N137 PolarHBondContact O-N 3.16Å; L134-I138 PolarHBondContact O-N 3.4Å; L134-I138 VanDerWaalsContact O-N 3.09Å
135	R	42.8	Very low	57.2	Low	150 Å²	150	80.6 Å²	80.6	57%	0.566	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.3	-25.5	-177.3	-106.1	-179.8	172.1	163.6	0.3	117.5	I138	R135-I138 VanDerWaalsContact O-CD1 3.24Å; R135-I138 WeakPolarHBondContact O-CD1 3.28Å; R135-I138 WeakPolarHBondContact O-CG1 3.46Å
136	N	33.6	Very low	55.2	Low	161 Å²	161	76.9 Å²	76.9	86%	0.861	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-1.3	-176.8	-61.7	-13.4	0	0	0	114.1	L134	L134-N136 PolarHBondContact O-N 3.15Å
137	N	37.3	Very low	53.1	Low	116 Å²	116	72.5 Å²	72.5	62%	0.62	41%	0.405	S	S	*	.	S	Bend	trans	-132.3	31.1	172.2	-110.6	-13.6	0	0	0	108.8	L134 L139	L134-N137 CarbonylContact O-C 3.54Å; L134-N137 VanDerWaalsContact O-C 3.32Å; L134-N137 PolarHBondContact O-N 3.16Å; N137-L139 PolarHBondContact O-N 3.45Å
138	I	39.8	Very low	51.1	Low	86 Å²	86	77.8 Å²	77.8	44%	0.441	43%	0.432	S	S	.	.			trans	-47.1	123	169.4	-62.9	168.8	0	0	0	103.4	L134 R135 S140	L134-I138 PolarHBondContact O-N 3.4Å; L134-I138 VanDerWaalsContact O-N 3.09Å; R135-I138 VanDerWaalsContact O-CD1 3.24Å; R135-I138 WeakPolarHBondContact O-CD1 3.28Å; R135-I138 WeakPolarHBondContact O-CG1 3.46Å; I138-S140 PolarHBondContact O-N 3.22Å
139	L	44.1	Very low	48.9	Very low	44 Å²	44	80.1 Å²	80.1	23%	0.23	44%	0.439	C	S	.	.			trans	-58.2	75.3	153.9	-87.2	135.8	0	0	0	104.8	I122 L127 N137 T141	I122-L139 HydrophobicContact CB-CD2 4.45Å; I122-L139 HydrophobicContact CG1-CD2 4.02Å; I122-L139 HydrophobicContact CG2-CD2 4.03Å; L127-L139 HydrophobicContact CD1-CD1 4.14Å; L127-L139 HydrophobicContact CD1-CD2 4.37Å; L127-L139 HydrophobicContact CD2-CD1 4.19Å; N137-L139 PolarHBondContact O-N 3.45Å; L139-T141 PolarHBondContact O-N 2.75Å
140	S	36.2	Very low	47	Very low	93 Å²	93	84.6 Å²	84.6	65%	0.65	46%	0.456	S	S	*	.			trans	-87	23.4	175	68.7	0	0	0	0	107.6	I138 C142	I138-S140 PolarHBondContact O-N 3.22Å; S140-C142 PolarHBondContact O-N 2.88Å
141	T	34.7	Very low	45.4	Very low	49 Å²	49	91.4 Å²	91.4	30%	0.301	48%	0.477	S	S	.	.	S	Bend	trans	-55.3	107.6	140.8	-21.1	0	0	0	0	104.5	C121 L139 L143	C121-T141 HydrophobicContact CB-CG2 3.71Å; C121-T141 WeakPolarHBondContact O-CG2 3.48Å; C121-T141 PolarHBondContact O-OG1 2.63Å; C121-T141 VanDerWaalsContact O-OG1 3.05Å; L139-T141 PolarHBondContact O-N 2.75Å; T141-L143 PolarHBondContact O-N 3.11Å
142	C	36	Very low	44.1	Very low	87 Å²	87	91.8 Å²	91.8	59%	0.588	48%	0.482	S	S	*	.			trans	-45.6	101.6	164.2	-71	0	0	0	0	106.3	S140 S144	S140-C142 PolarHBondContact O-N 2.88Å; C142-S144 PolarHBondContact O-N 2.85Å
143	L	44.9	Very low	42.9	Very low	46 Å²	46	98.5 Å²	98.5	24%	0.241	53%	0.529	C	S	.	.			trans	-68.3	75.6	165.5	-89	149.7	0	0	0	104.1	L118 T141 I145	L118-L143 HydrophobicContact CD2-CD1 4.32Å; L118-L143 HydrophobicContact CD2-CD2 4.2Å; T141-L143 PolarHBondContact O-N 3.11Å; L143-I145 PolarHBondContact O-N 3.07Å; L143-I145 VanDerWaalsContact O-N 3.07Å
144	S	42.7	Very low	42.1	Very low	57 Å²	57	101.8 Å²	101.8	40%	0.399	55%	0.546	S	S	.	.			trans	-61.5	104.4	145.8	-48.2	0	0	0	0	101.3	C142 H146	C142-S144 PolarHBondContact O-N 2.85Å; S144-H146 PolarHBondContact O-N 3.48Å
145	I	47.8	Very low	41.9	Very low	45 Å²	45	101.2 Å²	101.2	23%	0.231	54%	0.543	C	S	.	.			trans	-66.1	69.7	170	-57.5	170.3	0	0	0	105.6	L57 L143	L57-I145 HydrophobicContact CB-CD1 4.11Å; L57-I145 HydrophobicContact CD1-CD1 3.9Å; L57-I145 HydrophobicContact CD2-CD1 3.96Å; L57-I145 HydrophobicContact CG-CD1 4.2Å; L143-I145 PolarHBondContact O-N 3.07Å; L143-I145 VanDerWaalsContact O-N 3.07Å
146	H	42.7	Very low	41.9	Very low	131 Å²	131	98.5 Å²	98.5	61%	0.606	54%	0.542	S	S	*	.			trans	-90.6	117.1	159.1	-104.9	76.2	0	0	0	102.8	F60 S144	F60-H146 AromaticContact CD1-CE1 3.66Å; F60-H146 AromaticContact CD1-ND1 3.81Å; F60-H146 AromaticContact CE1-CE1 3.56Å; F60-H146 AromaticContact CE1-ND1 3.86Å; F60-H146 AromaticContact CE1-NE2 3.94Å; S144-H146 PolarHBondContact O-N 3.48Å
147	A	38.9	Very low	42.4	Very low	55 Å²	55	94.8 Å²	94.8	46%	0.455	52%	0.523	S	S	.	.	S	Bend	trans	94.5	95.9	173.9	0	0	0	0	0	116.5	V119	V119-A147 HydrophobicContact CG2-CB 4.22Å
148	I	43.5	Very low	42.7	Very low	128 Å²	128	93.5 Å²	93.5	66%	0.656	52%	0.517	S	S	*	.				93	87.7	129.8	-55.4	160.2	0	0	0	115.4	H150	I148-H150 HydrophobicContact CG2-CB 3.93Å; I148-H150 PolarHBondContact O-N 3.05Å
149	L	42.2	Very low	42.9	Very low	122 Å²	122	94 Å²	94	64%	0.639	52%	0.522	S	S	*	.			trans	-57	62	148.2	-94.3	157.5	0	0	0	111.4	E59 R151	E59-L149 HydrophobicContact CG-CD1 4.46Å; E59-L149 WeakPolarHBondContact OE1-CD1 3.4Å; L149-R151 VanDerWaalsContact C-N 3.32Å; L149-R151 HydrophobicContact CD2-CG 4.22Å; L149-R151 PolarHBondContact O-N 2.67Å
150	H	48.1	Very low	42.8	Very low	145 Å²	145	97.6 Å²	97.6	67%	0.671	54%	0.543	S	S	*	.			trans	-87.3	87.2	149.5	-101.8	-88.1	0	0	0	105.8	I148 L152	I148-H150 HydrophobicContact CG2-CB 3.93Å; I148-H150 PolarHBondContact O-N 3.05Å; H150-L152 PolarHBondContact O-N 3.49Å
151	R	51	Low	43.3	Very low	159 Å²	159	97.9 Å²	97.9	60%	0.6	54%	0.535	S	S	*	.			trans	-55	109.6	161.6	-78.7	-174.2	-176	-141.5	-0.3	106.2	L149 C153	L149-R151 VanDerWaalsContact C-N 3.32Å; L149-R151 HydrophobicContact CD2-CG 4.22Å; L149-R151 PolarHBondContact O-N 2.67Å; R151-C153 PolarHBondContact O-N 3.41Å; R151-C153 VanDerWaalsContact O-N 3.15Å
152	L	49.7	Very low	44	Very low	78 Å²	78	102 Å²	102	41%	0.408	55%	0.554	S	S	.	*			trans	-77.7	97.5	170.7	-67.4	170.7	0	0	0	106.2	R115 H150	R115-L152 HydrophobicContact CG-CB 4.23Å; R115-L152 PolarHBondContact NE-O 3.46Å; H150-L152 PolarHBondContact O-N 3.49Å
153	C	40.5	Very low	44.7	Very low	171 Å²	171	103.4 Å²	103.4	100%	1.155	55%	0.551	S	S	*	*			trans	-56.7	0	167.3	-67.4	0	0	0	0	109.9	R115 R151	R115-C153 PolarHBondContact NH2-O 3.13Å; R115-C153 PolarHBondContact NH2-OXT 2.99Å; R151-C153 PolarHBondContact O-N 3.41Å; R151-C153 VanDerWaalsContact O-N 3.15Å

Retrieved 153 of 153 residues in 734.8 ms (Link to these results)

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