A0A5K4F2Z6_SCHMA Loading...

Threonylcarbamoyl-AMP synthase

AlphaFold DB , UniProt , Accession A0A5K4F2Z6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 166 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	34.8	Very low	35.4	Very low	236 Å²	236	133.8 Å²	133.8	100%	1.163	72%	0.719	S	S	*	*				0	81.4	0	-73.7	-74.9	172.4	0	0	108.9
2	P	34.8	Very low	36	Very low	129 Å²	129	135.8 Å²	135.8	84%	0.838	72%	0.717	S	S	*	*			trans	-78.3	133.6	170.1	30.2	-23.5	0	0	0	109
3	S	36.7	Very low	36.6	Very low	83 Å²	83	138.4 Å²	138.4	58%	0.58	71%	0.713	S	S	*	*			trans	-52.5	134.3	-169.5	52.2	0	0	0	0	114.6	L5 C6	S3-L5 PolarHBondContact O-N 3.33Å; S3-C6 PolarHBondContact O-N 2.79Å
4	K	37.3	Very low	36.7	Very low	197 Å²	197	134.4 Å²	134.4	86%	0.857	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.6	3.2	166.6	-71.1	177.9	173.3	-179.5	0	115.5
5	L	38.7	Very low	37.1	Very low	124 Å²	124	133.9 Å²	133.9	65%	0.649	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-30.2	179.5	-147.3	77.9	0	0	0	112.8	S3 H7 L8	S3-L5 PolarHBondContact O-N 3.33Å; L5-H7 VanDerWaalsContact C-N 3.3Å; L5-H7 PolarHBondContact O-N 3.31Å; L5-L8 PolarHBondContact O-N 3.46Å
6	C	35.6	Very low	37.8	Very low	89 Å²	89	132.4 Å²	132.4	60%	0.601	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-20.5	-176.1	70.8	0	0	0	0	114	S3	S3-C6 PolarHBondContact O-N 2.79Å
7	H	33.4	Very low	38.7	Very low	140 Å²	140	128.6 Å²	128.6	65%	0.648	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-13	176.8	-100.2	51.1	0	0	0	113.8	L5 T10	L5-H7 VanDerWaalsContact C-N 3.3Å; L5-H7 PolarHBondContact O-N 3.31Å; H7-T10 PolarHBondContact O-OG1 3.2Å
8	L	32.6	Very low	39.6	Very low	118 Å²	118	131.5 Å²	131.5	62%	0.618	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-20.1	-179.7	-121.8	136.6	0	0	0	112.6	L5	L5-L8 PolarHBondContact O-N 3.46Å
9	L	34.4	Very low	40.9	Very low	132 Å²	132	130.7 Å²	130.7	69%	0.691	69%	0.688	S	S	*	*	S	Bend	trans	-81.9	-15.8	176.4	-65.7	176	0	0	0	113.7
10	T	39.9	Very low	42.8	Very low	90 Å²	90	134.5 Å²	134.5	55%	0.552	70%	0.698	S	S	*	*	S	Bend	trans	-86.2	-11	177.2	30.7	0	0	0	0	114.1	H7	H7-T10 PolarHBondContact O-OG1 3.2Å
11	N	31.4	Very low	44.9	Very low	134 Å²	134	135 Å²	135	72%	0.717	70%	0.7	S	S	*	*	S	Bend	trans	-113.3	10.9	-170.6	-76.3	-20.2	0	0	0	115.8
12	F	42.4	Very low	47.4	Very low	158 Å²	158	126.3 Å²	126.3	69%	0.693	66%	0.658	S	S	*	*	S	Bend	trans	-106.8	16.7	167.7	-105.1	-82.5	0	0	0	113.4	P14	F12-P14 VanDerWaalsContact C-CD 3.49Å; F12-P14 WeakPolarHBondContact O-CD 3.08Å
13	Y	43.4	Very low	49.9	Very low	169 Å²	169	124.3 Å²	124.3	66%	0.663	64%	0.641	S	S	*	*			trans	-96.8	91.6	162.1	-67.6	-78.5	0	0	0	108	T15	Y13-T15 PolarHBondContact O-N 3.09Å; Y13-T15 VanDerWaalsContact O-N 3.09Å
14	P	38.6	Very low	52.2	Low	83 Å²	83	125.1 Å²	125.1	54%	0.539	64%	0.642	S	S	.	*			trans	-61.1	117.6	150.9	29.9	-27.4	0	0	0	104.7	F12 I16	F12-P14 VanDerWaalsContact C-CD 3.49Å; F12-P14 WeakPolarHBondContact O-CD 3.08Å; P14-I16 PolarHBondContact O-N 3.17Å
15	T	42.3	Very low	54.5	Low	126 Å²	126	122.9 Å²	122.9	77%	0.773	63%	0.632	S	S	*	*	S	Bend	trans	-0.8	113.7	143.9	-30.2	0	0	0	0	111.6	Y13	Y13-T15 PolarHBondContact O-N 3.09Å; Y13-T15 VanDerWaalsContact O-N 3.09Å
16	I	47.9	Very low	56.8	Low	110 Å²	110	120 Å²	120	56%	0.564	62%	0.617	S	S	*	*			trans	177.1	126	149.6	-80.9	136.4	0	0	0	107.6	P14 A33	P14-I16 PolarHBondContact O-N 3.17Å; I16-A33 HydrophobicContact CB-CB 4.15Å; I16-A33 HydrophobicContact CG2-CB 3.36Å
17	M	54	Low	59.1	Low	68 Å²	68	117 Å²	117	34%	0.335	60%	0.599	S	S	.	*			trans	87.6	79.1	-175.7	-63.2	158.6	19.9	0	0	115.9	N19 I22 N30 I34	M17-N19 PolarHBondContact O-N 2.66Å; M17-N19 VanDerWaalsContact O-N 3.15Å; M17-I22 HydrophobicContact CE-CD1 3.62Å; M17-I22 HydrophobicContact CG-CD1 3.79Å; M17-I22 HydrophobicContact SD-CD1 3.21Å; M17-I22 WeakPolarHBondContact SD-CD1 3.44Å; M17-I22 HydrophobicContact SD-CG1 4.45Å; M17-N30 HydrophobicContact SD-CB 4.42Å; M17-I34 HydrophobicContact SD-CG1 4.38Å
18	N	55.4	Low	61.6	Low	181 Å²	181	114.1 Å²	114.1	97%	0.968	60%	0.595	S	S	*	*	S	Bend	trans	-58.5	-17.2	165.4	-81.3	-14.2	0	0	0	113.6
19	N	62.7	Low	64.1	Low	116 Å²	116	115.3 Å²	115.3	62%	0.62	60%	0.601	S	S	*	*	S	Bend	trans	-122	123.4	179.2	-132.3	8	0	0	0	109.4	M17 I21	M17-N19 PolarHBondContact O-N 2.66Å; M17-N19 VanDerWaalsContact O-N 3.15Å; N19-I21 PolarHBondContact O-N 3.27Å
20	K	80.7	Confident	66.5	Low	207 Å²	207	111.4 Å²	111.4	90%	0.9	58%	0.581	S	S	*	*	S	Bend	trans	-68.9	-14.9	178.2	-71.4	-176.4	178.7	177	0	113.2
21	I	86.4	Confident	68.8	Low	144 Å²	144	111.8 Å²	111.8	74%	0.738	58%	0.579	S	S	*	*			trans	-112.1	122.6	-178.8	-55.4	175.1	0	0	0	107.5	N19	N19-I21 PolarHBondContact O-N 3.27Å
22	I	86.3	Confident	71.4	Confident	54 Å²	54	112 Å²	112	28%	0.277	58%	0.58	S	S	.	*			trans	-123.4	139.6	177.4	-50.1	170	0	0	0	106.8	M17 D26	M17-I22 HydrophobicContact CE-CD1 3.62Å; M17-I22 HydrophobicContact CG-CD1 3.79Å; M17-I22 HydrophobicContact SD-CD1 3.21Å; M17-I22 WeakPolarHBondContact SD-CD1 3.44Å; M17-I22 HydrophobicContact SD-CG1 4.45Å; I22-D26 HydrophobicContact CG2-CB 3.86Å
23	N	87.1	Confident	73.5	Confident	88 Å²	88	105.3 Å²	105.3	47%	0.471	55%	0.554	S	S	.	*			trans	-72	144.2	172.6	-169	-70.9	0	0	0	109.6	K25 D26 A27	N23-K25 HydrophobicContact CB-CD 4.43Å; N23-K25 HydrophobicContact CB-CG 4.08Å; N23-K25 PolarHBondContact O-N 2.81Å; N23-K25 VanDerWaalsContact O-N 3.09Å; N23-K25 WeakPolarHBondContact OD1-CB 3.47Å; N23-K25 WeakPolarHBondContact OD1-CD 3.46Å; N23-K25 WeakPolarHBondContact OD1-CG 3.38Å; N23-K25 PolarHBondContact OD1-N 3.39Å; N23-D26 WeakPolarHBondContact CB-OD2 3.44Å; N23-D26 PolarHBondContact O-N 2.59Å; N23-A27 PolarHBondContact O-N 3.25Å
24	V	86	Confident	75.7	Confident	100 Å²	100	99 Å²	99	61%	0.606	53%	0.531	S	S	*	.	H	α-helix	trans	-50.9	-37.3	177	173.5	0	0	0	0	112	D26 A27 P48	V24-D26 PolarHBondContact O-N 2.94Å; V24-A27 WeakPolarHBondContact O-CB 3.3Å; V24-A27 PolarHBondContact O-N 3.06Å; V24-P48 HydrophobicContact CG2-CG 3.8Å
25	K	85.5	Confident	78.1	Confident	149 Å²	149	98.7 Å²	98.7	65%	0.648	53%	0.528	S	S	*	.	H	α-helix	trans	-62.8	-27.7	178.4	78.9	-166	178.5	170.2	0	113.7	N23	N23-K25 HydrophobicContact CB-CD 4.43Å; N23-K25 HydrophobicContact CB-CG 4.08Å; N23-K25 PolarHBondContact O-N 2.81Å; N23-K25 VanDerWaalsContact O-N 3.09Å; N23-K25 WeakPolarHBondContact OD1-CB 3.47Å; N23-K25 WeakPolarHBondContact OD1-CD 3.46Å; N23-K25 WeakPolarHBondContact OD1-CG 3.38Å; N23-K25 PolarHBondContact OD1-N 3.39Å
26	D	85.9	Confident	80.3	Confident	63 Å²	63	96.6 Å²	96.6	34%	0.337	51%	0.509	S	S	.	.	H	α-helix	trans	-98.1	-6.4	-177.3	-53.9	-46	0	0	0	111.9	I22 N23 V24 S28 L29 N30	I22-D26 HydrophobicContact CG2-CB 3.86Å; N23-D26 WeakPolarHBondContact CB-OD2 3.44Å; N23-D26 PolarHBondContact O-N 2.59Å; V24-D26 PolarHBondContact O-N 2.94Å; D26-S28 VanDerWaalsContact C-N 3.29Å; D26-S28 PolarHBondContact O-N 3.33Å; D26-L29 PolarHBondContact O-N 3.31Å; D26-N30 PolarHBondContact O-ND2 3.47Å
27	A	85.4	Confident	82.3	Confident	28 Å²	28	94.2 Å²	94.2	23%	0.231	50%	0.497	C	S	.	.	H	α-helix	trans	-65.1	-33.7	-178.8	0	0	0	0	0	112.1	N23 V24 L29 N30 L31 I34	N23-A27 PolarHBondContact O-N 3.25Å; V24-A27 WeakPolarHBondContact O-CB 3.3Å; V24-A27 PolarHBondContact O-N 3.06Å; A27-L29 VanDerWaalsContact C-N 3.27Å; A27-L29 PolarHBondContact O-N 3.3Å; A27-N30 CarbonylContact O-C 3.36Å; A27-N30 PolarHBondContact O-N 3.47Å; A27-L31 PolarHBondContact O-N 3.44Å; A27-L31 VanDerWaalsContact O-N 3.08Å; A27-I34 HydrophobicContact CB-CD1 4.11Å
28	S	84.3	Confident	84	Confident	78 Å²	78	92.7 Å²	92.7	55%	0.545	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-58.7	-37.7	177	55.5	0	0	0	0	112.7	D26 N30	D26-S28 VanDerWaalsContact C-N 3.29Å; D26-S28 PolarHBondContact O-N 3.33Å; S28-N30 PolarHBondContact O-N 3.36Å
29	L	86.2	Confident	85.4	Confident	143 Å²	143	87.3 Å²	87.3	75%	0.749	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-70.1	-19.3	177.5	-60.6	173.4	0	0	0	112.8	D26 A27	D26-L29 PolarHBondContact O-N 3.31Å; A27-L29 VanDerWaalsContact C-N 3.27Å; A27-L29 PolarHBondContact O-N 3.3Å
30	N	85.5	Confident	86.2	Confident	50 Å²	50	88 Å²	88	27%	0.267	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-115.6	12.5	-175.5	-64.6	-82	0	0	0	112.9	M17 D26 A27 S28 N32 A33 I34	M17-N30 HydrophobicContact SD-CB 4.42Å; D26-N30 PolarHBondContact O-ND2 3.47Å; A27-N30 CarbonylContact O-C 3.36Å; A27-N30 PolarHBondContact O-N 3.47Å; S28-N30 PolarHBondContact O-N 3.36Å; N30-N32 VanDerWaalsContact C-N 3.33Å; N30-N32 PolarHBondContact O-N 2.91Å; N30-A33 PolarHBondContact O-N 2.91Å; N30-I34 HydrophobicContact CB-CD1 4.2Å; N30-I34 HydrophobicContact CB-CG1 4.45Å; N30-I34 WeakPolarHBondContact O-CG1 3.47Å; N30-I34 PolarHBondContact O-N 3.26Å
31	L	86.7	Confident	86.1	Confident	98 Å²	98	80.9 Å²	80.9	51%	0.513	44%	0.438	S	S	.	.	H	α-helix	trans	-52.3	-46.6	-172.2	-95.1	169.3	0	0	0	113.2	A27 A33 I34 V35	A27-L31 PolarHBondContact O-N 3.44Å; A27-L31 VanDerWaalsContact O-N 3.08Å; L31-A33 VanDerWaalsContact C-N 3.32Å; L31-A33 PolarHBondContact O-N 3.35Å; L31-I34 PolarHBondContact O-N 3.29Å; L31-V35 WeakPolarHBondContact O-CB 3.43Å; L31-V35 VanDerWaalsContact O-CG2 3.3Å; L31-V35 WeakPolarHBondContact O-CG2 3.35Å; L31-V35 PolarHBondContact O-N 3.35Å
32	N	86.9	Confident	86	Confident	138 Å²	138	77.3 Å²	77.3	74%	0.738	42%	0.42	S	S	*	.	H	α-helix	trans	-60.6	-41.2	-179.6	-72.7	-24.5	0	0	0	112.6	N30 V35 Q36	N30-N32 VanDerWaalsContact C-N 3.33Å; N30-N32 PolarHBondContact O-N 2.91Å; N32-V35 PolarHBondContact O-N 2.96Å; N32-Q36 WeakPolarHBondContact O-CB 3.19Å; N32-Q36 WeakPolarHBondContact O-CG 3.44Å; N32-Q36 PolarHBondContact O-N 2.91Å
33	A	86.7	Confident	86.2	Confident	18 Å²	18	74.9 Å²	74.9	15%	0.149	41%	0.409	C	S	.	.	H	α-helix	trans	-70.2	-38.4	178.4	0	0	0	0	0	111.7	I16 N30 L31 Q36 L37	I16-A33 HydrophobicContact CB-CB 4.15Å; I16-A33 HydrophobicContact CG2-CB 3.36Å; N30-A33 PolarHBondContact O-N 2.91Å; L31-A33 VanDerWaalsContact C-N 3.32Å; L31-A33 PolarHBondContact O-N 3.35Å; A33-Q36 PolarHBondContact O-N 3.41Å; A33-L37 WeakPolarHBondContact O-CB 3.48Å; A33-L37 PolarHBondContact O-N 3.27Å
34	I	89	Confident	86.5	Confident	36 Å²	36	72 Å²	72	19%	0.185	39%	0.394	C	S	.	.	H	α-helix	trans	-63.4	-45.6	174.9	-65.5	167.4	0	0	0	110.4	M17 A27 N30 L31 L37 I38	M17-I34 HydrophobicContact SD-CG1 4.38Å; A27-I34 HydrophobicContact CB-CD1 4.11Å; N30-I34 HydrophobicContact CB-CD1 4.2Å; N30-I34 HydrophobicContact CB-CG1 4.45Å; N30-I34 WeakPolarHBondContact O-CG1 3.47Å; N30-I34 PolarHBondContact O-N 3.26Å; L31-I34 PolarHBondContact O-N 3.29Å; I34-L37 WeakPolarHBondContact O-CB 3.14Å; I34-L37 PolarHBondContact O-N 3.44Å; I34-I38 HydrophobicContact CG2-CD1 3.76Å; I34-I38 WeakPolarHBondContact O-CG1 3.49Å; I34-I38 PolarHBondContact O-N 3.14Å
35	V	88.7	Confident	86.8	Confident	77 Å²	77	68.5 Å²	68.5	47%	0.467	37%	0.373	S	S	.	.	H	α-helix	trans	-63.5	-45.1	177.6	171.3	0	0	0	0	111	L31 N32 L37 I38 S39	L31-V35 WeakPolarHBondContact O-CB 3.43Å; L31-V35 VanDerWaalsContact O-CG2 3.3Å; L31-V35 WeakPolarHBondContact O-CG2 3.35Å; L31-V35 PolarHBondContact O-N 3.35Å; N32-V35 PolarHBondContact O-N 2.96Å; V35-L37 VanDerWaalsContact C-N 3.32Å; V35-L37 PolarHBondContact O-N 2.92Å; V35-I38 PolarHBondContact O-N 2.97Å; V35-S39 VanDerWaalsContact O-CB 3.23Å; V35-S39 WeakPolarHBondContact O-CB 3.33Å; V35-S39 PolarHBondContact O-N 3.08Å; V35-S39 PolarHBondContact O-OG 3.47Å
36	Q	88.7	Confident	87.2	Confident	83 Å²	83	64.3 Å²	64.3	39%	0.388	37%	0.366	S	S	.	.	H	α-helix	trans	-59.6	-43.6	174.7	-80.2	-176.4	-16.2	0	0	111.8	N32 A33 I38 Q40	N32-Q36 WeakPolarHBondContact O-CB 3.19Å; N32-Q36 WeakPolarHBondContact O-CG 3.44Å; N32-Q36 PolarHBondContact O-N 2.91Å; A33-Q36 PolarHBondContact O-N 3.41Å; Q36-I38 PolarHBondContact O-N 2.92Å; Q36-Q40 WeakPolarHBondContact O-CB 3.42Å; Q36-Q40 PolarHBondContact O-N 3.29Å
37	L	89.4	Confident	87.4	Confident	60 Å²	60	65.4 Å²	65.4	31%	0.314	37%	0.371	S	S	.	.	H	α-helix	trans	-58.2	-48.8	176.8	-180	131.5	0	0	0	111.6	A33 I34 V35 N41 G43 V45	A33-L37 WeakPolarHBondContact O-CB 3.48Å; A33-L37 PolarHBondContact O-N 3.27Å; I34-L37 WeakPolarHBondContact O-CB 3.14Å; I34-L37 PolarHBondContact O-N 3.44Å; V35-L37 VanDerWaalsContact C-N 3.32Å; V35-L37 PolarHBondContact O-N 2.92Å; L37-N41 PolarHBondContact O-N 3.43Å; L37-G43 WeakPolarHBondContact O-CA 3.46Å; L37-G43 PolarHBondContact O-N 3.33Å; L37-G43 VanDerWaalsContact O-N 3.08Å; L37-V45 HydrophobicContact CD2-CG1 3.57Å
38	I	89.9	Confident	87.6	Confident	35 Å²	35	67 Å²	67	18%	0.179	38%	0.38	C	S	.	.	H	α-helix	trans	-71.4	-42.7	-177.3	-64.7	168.5	0	0	0	111.9	I34 V35 Q36 V45	I34-I38 HydrophobicContact CG2-CD1 3.76Å; I34-I38 WeakPolarHBondContact O-CG1 3.49Å; I34-I38 PolarHBondContact O-N 3.14Å; V35-I38 PolarHBondContact O-N 2.97Å; Q36-I38 PolarHBondContact O-N 2.92Å; I38-V45 HydrophobicContact CD1-CG1 4.03Å; I38-V45 HydrophobicContact CD1-CG2 3.78Å; I38-V45 HydrophobicContact CG1-CG1 3.84Å; I38-V45 HydrophobicContact CG1-CG2 4.18Å
39	S	85.7	Confident	87.6	Confident	68 Å²	68	66.7 Å²	66.7	48%	0.476	38%	0.375	S	S	.	.	H	α-helix	trans	-86.7	-32.8	-170.5	-62.2	0	0	0	0	113.9	V35	V35-S39 VanDerWaalsContact O-CB 3.23Å; V35-S39 WeakPolarHBondContact O-CB 3.33Å; V35-S39 PolarHBondContact O-N 3.08Å; V35-S39 PolarHBondContact O-OG 3.47Å
40	Q	79.3	Confident	87.3	Confident	132 Å²	132	66.4 Å²	66.4	62%	0.617	37%	0.374	S	S	*	.	H	α-helix	trans	-111.7	-22.5	-170.1	-59.5	179.4	-16.7	0	0	113.7	Q36	Q36-Q40 WeakPolarHBondContact O-CB 3.42Å; Q36-Q40 PolarHBondContact O-N 3.29Å
41	N	77.5	Confident	86.9	Confident	57 Å²	57	67.5 Å²	67.5	31%	0.305	38%	0.382	S	S	.	.	S	Bend	trans	-121.9	32.2	-166.3	-65.1	-21.3	0	0	0	114	L37 G43	L37-N41 PolarHBondContact O-N 3.43Å; N41-G43 PolarHBondContact O-N 3.32Å
42	D	85.8	Confident	86.8	Confident	68 Å²	68	69.2 Å²	69.2	36%	0.364	39%	0.391	S	S	.	.			trans	48.4	34.5	-177.3	-47.1	-28.1	0	0	0	112.6	V44 N61 E63 A64 R67	D42-V44 PolarHBondContact O-N 2.92Å; D42-N61 WeakPolarHBondContact CA-ND2 3.21Å; D42-N61 PolarHBondContact OD1-ND2 3.46Å; D42-N61 PolarHBondContact OD1-OD1 3.15Å; D42-E63 HydrophobicContact CB-CB 4.4Å; D42-A64 HydrophobicContact CB-CB 4.3Å; D42-R67 PolarHBondContact O-NH1 2.96Å; D42-R67 VanDerWaalsContact O-NH1 3.14Å
43	G	90.7	Very high	86.9	Confident	3 Å²	3	70.1 Å²	70.1	3%	0.031	39%	0.385	C	S	.	.			trans	-71.3	128.7	-169.5	0	0	0	0	0	111.9	L37 N41 C57	L37-G43 WeakPolarHBondContact O-CA 3.46Å; L37-G43 PolarHBondContact O-N 3.33Å; L37-G43 VanDerWaalsContact O-N 3.08Å; N41-G43 PolarHBondContact O-N 3.32Å; G43-C57 WeakPolarHBondContact O-CB 3.48Å
44	V	93.1	Very high	87.1	Confident	29 Å²	29	70.4 Å²	70.4	18%	0.176	39%	0.389	C	S	.	.			trans	-111.1	126.1	170.5	178.7	0	0	0	0	107.9	D42 L55 A56 C57 A64 R67 I68 I71	D42-V44 PolarHBondContact O-N 2.92Å; V44-L55 HydrophobicContact CG1-CB 4.27Å; V44-L55 HydrophobicContact CG1-CD2 4.41Å; V44-A56 WeakPolarHBondContact CA-O 3.3Å; V44-C57 HydrophobicContact CG2-CB 4.26Å; V44-A64 HydrophobicContact CG2-CB 4.33Å; V44-R67 HydrophobicContact CG2-CB 4.29Å; V44-R67 HydrophobicContact CG2-CG 4.29Å; V44-I68 HydrophobicContact CB-CG1 4.41Å; V44-I68 HydrophobicContact CG1-CD1 4.09Å; V44-I68 HydrophobicContact CG1-CG1 3.64Å; V44-I68 HydrophobicContact CG2-CD1 4.45Å; V44-I68 HydrophobicContact CG2-CG1 3.83Å; V44-I71 HydrophobicContact CG1-CD1 4.47Å
45	V	92.8	Very high	87.4	Confident	26 Å²	26	71.2 Å²	71.2	16%	0.158	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	150.1	-179.9	-64	0	0	0	0	110.7	L37 I38 L47 L55 A56	L37-V45 HydrophobicContact CD2-CG1 3.57Å; I38-V45 HydrophobicContact CD1-CG1 4.03Å; I38-V45 HydrophobicContact CD1-CG2 3.78Å; I38-V45 HydrophobicContact CG1-CG1 3.84Å; I38-V45 HydrophobicContact CG1-CG2 4.18Å; V45-L47 HydrophobicContact CG2-CD1 4.37Å; V45-L47 HydrophobicContact CG2-CD2 4.12Å; V45-L47 HydrophobicContact CG2-CG 4.02Å; V45-L55 CarbonylContact O-C 3.53Å; V45-L55 WeakPolarHBondContact O-CA 3.33Å; V45-A56 HydrophobicContact CG2-CB 4.18Å; V45-A56 PolarHBondContact N-O 3.2Å; V45-A56 PolarHBondContact O-N 3.16Å
46	A	93.5	Very high	87.6	Confident	61 Å²	61	69 Å²	69	50%	0.504	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.7	168.2	0	0	0	0	0	108.7	Y53 G54 L55	A46-Y53 HydrophobicContact CB-CD1 4.28Å; A46-G54 CarbonylContact C-O 3.43Å; A46-G54 WeakPolarHBondContact CA-O 3.4Å; A46-L55 HydrophobicContact CB-CD2 4.06Å
47	L	90.6	Very high	87.9	Confident	85 Å²	85	66.4 Å²	66.4	45%	0.445	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.3	179.6	-62.3	176	0	0	0	109.8	V45 Y53 G54 A56	V45-L47 HydrophobicContact CG2-CD1 4.37Å; V45-L47 HydrophobicContact CG2-CD2 4.12Å; V45-L47 HydrophobicContact CG2-CG 4.02Å; L47-Y53 VanDerWaalsContact C-CD1 3.43Å; L47-Y53 CarbonylContact O-C 3.54Å; L47-Y53 VanDerWaalsContact O-CA 3.27Å; L47-Y53 WeakPolarHBondContact O-CA 3.23Å; L47-Y53 WeakPolarHBondContact O-CD1 3.41Å; L47-G54 PolarHBondContact N-O 3.04Å; L47-G54 PolarHBondContact O-N 2.94Å; L47-A56 HydrophobicContact CD1-CB 3.77Å; L47-A56 HydrophobicContact CG-CB 4.37Å
48	P	88	Confident	88	Confident	63 Å²	63	64.6 Å²	64.6	41%	0.409	37%	0.367	S	S	.	.			trans	-64.2	142	171.2	28.4	-32.9	0	0	0	109.7	V24 Y53	V24-P48 HydrophobicContact CG2-CG 3.8Å; P48-Y53 HydrophobicContact CB-CD1 4.4Å; P48-Y53 HydrophobicContact CB-CE1 3.85Å; P48-Y53 HydrophobicContact CB-CE2 4.44Å; P48-Y53 HydrophobicContact CG-CE1 4.39Å
49	T	84	Confident	87.9	Confident	71 Å²	71	66.7 Å²	66.7	44%	0.436	38%	0.381	S	S	.	.			trans	-123.6	176.5	165.1	76.9	0	0	0	0	108.6	T51 I52	T49-T51 PolarHBondContact O-N 3.11Å; T49-T51 PolarHBondContact OG1-N 3.24Å; T49-T51 VanDerWaalsContact OG1-N 3.15Å; T49-T51 PolarHBondContact OG1-OG1 3.35Å; T49-I52 WeakPolarHBondContact CB-O 3.41Å; T49-I52 WeakPolarHBondContact CG2-O 3.36Å; T49-I52 PolarHBondContact OG1-N 3.42Å; T49-I52 PolarHBondContact OG1-O 3.28Å
50	D	80.2	Confident	88	Confident	137 Å²	137	72 Å²	72	73%	0.733	40%	0.396	S	S	*	.	S	Bend	trans	-59.9	-20.3	170.8	62.9	-25.1	0	0	0	113.5
51	T	77.2	Confident	88.6	Confident	73 Å²	73	66.6 Å²	66.6	45%	0.448	37%	0.371	S	S	.	.	S	Bend	trans	-111	-76.1	-175.7	58.4	0	0	0	0	113	T49 I122	T49-T51 PolarHBondContact O-N 3.11Å; T49-T51 PolarHBondContact OG1-N 3.24Å; T49-T51 VanDerWaalsContact OG1-N 3.15Å; T49-T51 PolarHBondContact OG1-OG1 3.35Å; T51-I122 HydrophobicContact CG2-CD1 3.34Å; T51-I122 HydrophobicContact CG2-CG1 4.32Å
52	I	85.8	Confident	89.2	Confident	133 Å²	133	68.6 Å²	68.6	68%	0.682	39%	0.386	S	S	*	.	S	Bend	trans	-135.7	158	-179.1	60	168.2	0	0	0	109.1	T49 G54	T49-I52 WeakPolarHBondContact CB-O 3.41Å; T49-I52 WeakPolarHBondContact CG2-O 3.36Å; T49-I52 PolarHBondContact OG1-N 3.42Å; T49-I52 PolarHBondContact OG1-O 3.28Å; I52-G54 PolarHBondContact O-N 3.37Å
53	Y	88.9	Confident	89.6	Confident	157 Å²	157	70.7 Å²	70.7	62%	0.616	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-59.5	130.8	175.5	-81.7	-105.2	0	0	0	111.2	A46 L47 P48	A46-Y53 HydrophobicContact CB-CD1 4.28Å; L47-Y53 VanDerWaalsContact C-CD1 3.43Å; L47-Y53 CarbonylContact O-C 3.54Å; L47-Y53 VanDerWaalsContact O-CA 3.27Å; L47-Y53 WeakPolarHBondContact O-CA 3.23Å; L47-Y53 WeakPolarHBondContact O-CD1 3.41Å; P48-Y53 HydrophobicContact CB-CD1 4.4Å; P48-Y53 HydrophobicContact CB-CE1 3.85Å; P48-Y53 HydrophobicContact CB-CE2 4.44Å; P48-Y53 HydrophobicContact CG-CE1 4.39Å
54	G	91.4	Very high	89.7	Confident	24 Å²	24	70.5 Å²	70.5	25%	0.247	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	135.4	174	0	0	0	0	0	110.7	A46 L47 I52	A46-G54 CarbonylContact C-O 3.43Å; A46-G54 WeakPolarHBondContact CA-O 3.4Å; L47-G54 PolarHBondContact N-O 3.04Å; L47-G54 PolarHBondContact O-N 2.94Å; I52-G54 PolarHBondContact O-N 3.37Å
55	L	93.9	Very high	89.7	Confident	53 Å²	53	70.6 Å²	70.6	28%	0.277	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	129.3	163.7	-62.1	179.8	0	0	0	109.5	V44 V45 A46 I68 I71 K72	V44-L55 HydrophobicContact CG1-CB 4.27Å; V44-L55 HydrophobicContact CG1-CD2 4.41Å; V45-L55 CarbonylContact O-C 3.53Å; V45-L55 WeakPolarHBondContact O-CA 3.33Å; A46-L55 HydrophobicContact CB-CD2 4.06Å; L55-I68 HydrophobicContact CB-CD1 4.32Å; L55-I68 HydrophobicContact CB-CG1 4.39Å; L55-I68 HydrophobicContact CB-CG2 4.41Å; L55-I71 HydrophobicContact CD1-CB 4.24Å; L55-I71 HydrophobicContact CD1-CG2 3.55Å; L55-K72 HydrophobicContact CD1-CG 4.18Å
56	A	93.9	Very high	89.7	Confident	30 Å²	30	71.7 Å²	71.7	25%	0.248	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	151	-178.9	0	0	0	0	0	111.5	V44 V45 L47	V44-A56 WeakPolarHBondContact CA-O 3.3Å; V45-A56 HydrophobicContact CG2-CB 4.18Å; V45-A56 PolarHBondContact N-O 3.2Å; V45-A56 PolarHBondContact O-N 3.16Å; L47-A56 HydrophobicContact CD1-CB 3.77Å; L47-A56 HydrophobicContact CG-CB 4.37Å
57	C	93.8	Very high	89.7	Confident	30 Å²	30	74 Å²	74	20%	0.203	39%	0.39	C	S	.	.			trans	-150.5	175.6	172.2	67.5	0	0	0	0	109.3	G43 V44 A64 I68	G43-C57 WeakPolarHBondContact O-CB 3.48Å; V44-C57 HydrophobicContact CG2-CB 4.26Å; C57-A64 HydrophobicContact CB-CB 3.58Å; C57-I68 HydrophobicContact CB-CD1 3.89Å; C57-I68 VanDerWaalsContact SG-CD1 3.51Å
58	S	91.2	Very high	89.8	Confident	22 Å²	22	70.2 Å²	70.2	15%	0.154	37%	0.37	C	S	.	.			trans	-62.5	135.1	169.2	177.3	0	0	0	0	110.8	F60 N61	S58-F60 PolarHBondContact O-N 2.83Å; S58-F60 PolarHBondContact OG-N 2.91Å; S58-N61 PolarHBondContact O-N 3.33Å
59	V	88.9	Confident	90.1	Very high	78 Å²	78	69.5 Å²	69.5	47%	0.473	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-22.6	174.8	66	0	0	0	0	112.4	N61 I65 I82	V59-N61 VanDerWaalsContact C-N 3.26Å; V59-N61 PolarHBondContact O-N 2.89Å; V59-I65 WeakPolarHBondContact O-CD1 3.23Å; V59-I82 HydrophobicContact CG2-CD1 4.48Å
60	F	88.3	Confident	90.5	Very high	179 Å²	179	73.8 Å²	73.8	79%	0.785	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	0.8	179.2	-54.5	-68.7	0	0	0	112.9	S58	S58-F60 PolarHBondContact O-N 2.83Å; S58-F60 PolarHBondContact OG-N 2.91Å
61	N	90.7	Very high	91.2	Very high	20 Å²	20	71.9 Å²	71.9	11%	0.107	36%	0.356	C	S	.	.			trans	-112.1	96	-176	-168.1	-46.7	0	0	0	111.1	D42 S58 V59 E63 A64 I65	D42-N61 WeakPolarHBondContact CA-ND2 3.21Å; D42-N61 PolarHBondContact OD1-ND2 3.46Å; D42-N61 PolarHBondContact OD1-OD1 3.15Å; S58-N61 PolarHBondContact O-N 3.33Å; V59-N61 VanDerWaalsContact C-N 3.26Å; V59-N61 PolarHBondContact O-N 2.89Å; N61-E63 VanDerWaalsContact C-N 3.32Å; N61-E63 PolarHBondContact O-N 3.49Å; N61-E63 PolarHBondContact OD1-N 2.84Å; N61-A64 HydrophobicContact CB-CB 3.99Å; N61-A64 PolarHBondContact O-N 2.97Å; N61-A64 WeakPolarHBondContact OD1-CB 3.36Å; N61-A64 PolarHBondContact OD1-N 3.21Å; N61-I65 WeakPolarHBondContact O-CG1 3.43Å; N61-I65 PolarHBondContact O-N 3.31Å
62	T	91.4	Very high	91.8	Very high	99 Å²	99	73.1 Å²	73.1	61%	0.607	36%	0.355	S	S	*	.	H	α-helix	trans	-61.1	-37.9	-178.1	-48.1	0	0	0	0	112.6	I65 E66	T62-I65 WeakPolarHBondContact O-CB 3.36Å; T62-I65 PolarHBondContact O-N 2.93Å; T62-E66 PolarHBondContact O-N 3.47Å
63	E	92.8	Very high	92.1	Very high	111 Å²	111	70.2 Å²	70.2	52%	0.519	36%	0.358	S	S	.	.	H	α-helix	trans	-65.7	-41.4	178.4	-79.9	-60.6	155.1	0	0	112.3	D42 N61 I65 E66 R67 R70	D42-E63 HydrophobicContact CB-CB 4.4Å; N61-E63 VanDerWaalsContact C-N 3.32Å; N61-E63 PolarHBondContact O-N 3.49Å; N61-E63 PolarHBondContact OD1-N 2.84Å; E63-I65 VanDerWaalsContact C-N 3.35Å; E63-E66 PolarHBondContact O-N 2.99Å; E63-R67 VanDerWaalsContact O-CB 3.3Å; E63-R67 WeakPolarHBondContact O-CB 3.4Å; E63-R67 PolarHBondContact O-N 3.01Å; E63-R70 IonicContact OE2-NH2 3.55Å
64	A	93.6	Very high	91.8	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-65.8	-38.4	175.5	0	0	0	0	0	112	D42 V44 C57 N61 R67 I68	D42-A64 HydrophobicContact CB-CB 4.3Å; V44-A64 HydrophobicContact CG2-CB 4.33Å; C57-A64 HydrophobicContact CB-CB 3.58Å; N61-A64 HydrophobicContact CB-CB 3.99Å; N61-A64 PolarHBondContact O-N 2.97Å; N61-A64 WeakPolarHBondContact OD1-CB 3.36Å; N61-A64 PolarHBondContact OD1-N 3.21Å; A64-R67 WeakPolarHBondContact O-CB 3.44Å; A64-R67 PolarHBondContact O-N 3.24Å; A64-I68 PolarHBondContact O-N 3.36Å
65	I	92.6	Very high	91.6	Very high	30 Å²	30	69.5 Å²	69.5	15%	0.154	36%	0.356	C	S	.	.	H	α-helix	trans	-59.4	-50.1	173	-74.6	165.4	0	0	0	110.4	V59 N61 T62 E63 R67 I68 R69 M80	V59-I65 WeakPolarHBondContact O-CD1 3.23Å; N61-I65 WeakPolarHBondContact O-CG1 3.43Å; N61-I65 PolarHBondContact O-N 3.31Å; T62-I65 WeakPolarHBondContact O-CB 3.36Å; T62-I65 PolarHBondContact O-N 2.93Å; E63-I65 VanDerWaalsContact C-N 3.35Å; I65-R67 VanDerWaalsContact C-N 3.25Å; I65-R67 PolarHBondContact O-N 2.93Å; I65-I68 PolarHBondContact O-N 2.86Å; I65-I68 VanDerWaalsContact O-N 3.16Å; I65-R69 VanDerWaalsContact CG2-NH1 3.27Å; I65-R69 PolarHBondContact O-N 2.82Å; I65-M80 HydrophobicContact CB-CE 4.13Å; I65-M80 HydrophobicContact CG1-CE 4.3Å; I65-M80 HydrophobicContact CG2-CE 3.29Å
66	E	92.4	Very high	91.1	Very high	50 Å²	50	73.9 Å²	73.9	23%	0.234	38%	0.375	C	S	.	.	H	α-helix	trans	-63.9	-34.5	178	-68.2	-49.2	152.1	0	0	112.6	T62 E63 R69 R70	T62-E66 PolarHBondContact O-N 3.47Å; E63-E66 PolarHBondContact O-N 2.99Å; E66-R69 PolarHBondContact O-N 3.05Å; E66-R69 IonicContact OE1-CZ 3.73Å; E66-R69 IonicContact OE1-NH1 2.59Å; E66-R69 PolarHBondContact OE1-NH1 3.22Å; E66-R69 IonicContact OE2-CZ 3.88Å; E66-R69 IonicContact OE2-NH1 2.81Å; E66-R69 PolarHBondContact OE2-NH1 3.26Å; E66-R70 WeakPolarHBondContact O-CB 3.42Å; E66-R70 WeakPolarHBondContact O-CG 3.42Å; E66-R70 PolarHBondContact O-N 3.01Å; E66-R70 PolarHBondContact O-NE 3.22Å
67	R	93.7	Very high	90.7	Very high	109 Å²	109	78.6 Å²	78.6	41%	0.411	40%	0.401	S	S	.	.	H	α-helix	trans	-64.3	-40.7	175.1	-168.6	177.3	166.7	-155.2	-1.4	111.4	D42 V44 E63 A64 I65 R70 I71	D42-R67 PolarHBondContact O-NH1 2.96Å; D42-R67 VanDerWaalsContact O-NH1 3.14Å; V44-R67 HydrophobicContact CG2-CB 4.29Å; V44-R67 HydrophobicContact CG2-CG 4.29Å; E63-R67 VanDerWaalsContact O-CB 3.3Å; E63-R67 WeakPolarHBondContact O-CB 3.4Å; E63-R67 PolarHBondContact O-N 3.01Å; A64-R67 WeakPolarHBondContact O-CB 3.44Å; A64-R67 PolarHBondContact O-N 3.24Å; I65-R67 VanDerWaalsContact C-N 3.25Å; I65-R67 PolarHBondContact O-N 2.93Å; R67-R70 PolarHBondContact O-N 3.34Å; R67-I71 HydrophobicContact CG-CD1 4.05Å; R67-I71 WeakPolarHBondContact O-CB 3.15Å; R67-I71 WeakPolarHBondContact O-CD1 3.47Å; R67-I71 WeakPolarHBondContact O-CG1 3.27Å; R67-I71 PolarHBondContact O-N 2.8Å
68	I	94	Very high	90.2	Very high	5 Å²	5	82.3 Å²	82.3	3%	0.026	41%	0.414	C	S	.	.	H	α-helix	trans	-62.1	-43.9	172	-69.3	-178.9	0	0	0	111.1	V44 L55 C57 A64 I65 R70 I71 K72 M80	V44-I68 HydrophobicContact CB-CG1 4.41Å; V44-I68 HydrophobicContact CG1-CD1 4.09Å; V44-I68 HydrophobicContact CG1-CG1 3.64Å; V44-I68 HydrophobicContact CG2-CD1 4.45Å; V44-I68 HydrophobicContact CG2-CG1 3.83Å; L55-I68 HydrophobicContact CB-CD1 4.32Å; L55-I68 HydrophobicContact CB-CG1 4.39Å; L55-I68 HydrophobicContact CB-CG2 4.41Å; C57-I68 HydrophobicContact CB-CD1 3.89Å; C57-I68 VanDerWaalsContact SG-CD1 3.51Å; A64-I68 PolarHBondContact O-N 3.36Å; I65-I68 PolarHBondContact O-N 2.86Å; I65-I68 VanDerWaalsContact O-N 3.16Å; I68-R70 PolarHBondContact O-N 3.34Å; I68-I71 PolarHBondContact O-N 3.22Å; I68-K72 HydrophobicContact CG2-CD 3.9Å; I68-K72 HydrophobicContact CG2-CG 4.33Å; I68-K72 WeakPolarHBondContact O-CB 3.47Å; I68-K72 PolarHBondContact O-N 3.31Å; I68-M80 HydrophobicContact CB-SD 4.47Å; I68-M80 HydrophobicContact CG2-SD 3.91Å
69	R	92.5	Very high	89.8	Confident	49 Å²	49	86.4 Å²	86.4	19%	0.185	44%	0.44	C	S	.	.	H	α-helix	trans	-59.5	-46.1	177.7	-68.4	-161.2	-168.9	92.6	-5.1	111.8	I65 E66 K72 G73 R74 M80	I65-R69 VanDerWaalsContact CG2-NH1 3.27Å; I65-R69 PolarHBondContact O-N 2.82Å; E66-R69 PolarHBondContact O-N 3.05Å; E66-R69 IonicContact OE1-CZ 3.73Å; E66-R69 IonicContact OE1-NH1 2.59Å; E66-R69 PolarHBondContact OE1-NH1 3.22Å; E66-R69 IonicContact OE2-CZ 3.88Å; E66-R69 IonicContact OE2-NH1 2.81Å; E66-R69 PolarHBondContact OE2-NH1 3.26Å; R69-K72 PolarHBondContact O-N 3.08Å; R69-G73 PolarHBondContact O-N 3.41Å; R69-R74 PolarHBondContact O-N 3.44Å; R69-R74 VanDerWaalsContact O-N 3.11Å; R69-M80 HydrophobicContact CG-CE 4.34Å; R69-M80 HydrophobicContact CG-SD 4.25Å
70	R	93.7	Very high	89.7	Confident	160 Å²	160	85.7 Å²	85.7	60%	0.604	43%	0.433	S	S	*	.	H	α-helix	trans	-59.4	-48.5	175.2	-78.9	178.7	-91.6	145.8	-10.1	112	E63 E66 R67 I68 K72 G73	E63-R70 IonicContact OE2-NH2 3.55Å; E66-R70 WeakPolarHBondContact O-CB 3.42Å; E66-R70 WeakPolarHBondContact O-CG 3.42Å; E66-R70 PolarHBondContact O-N 3.01Å; E66-R70 PolarHBondContact O-NE 3.22Å; R67-R70 PolarHBondContact O-N 3.34Å; I68-R70 PolarHBondContact O-N 3.34Å; R70-K72 VanDerWaalsContact C-N 3.34Å; R70-K72 PolarHBondContact O-N 3.09Å; R70-G73 PolarHBondContact O-N 2.87Å
71	I	93.8	Very high	89.6	Confident	97 Å²	97	82.2 Å²	82.2	50%	0.497	44%	0.437	S	S	.	.	H	α-helix	trans	-62.1	-41.5	179	-68	163.6	0	0	0	111.3	V44 L55 R67 I68 G73	V44-I71 HydrophobicContact CG1-CD1 4.47Å; L55-I71 HydrophobicContact CD1-CB 4.24Å; L55-I71 HydrophobicContact CD1-CG2 3.55Å; R67-I71 HydrophobicContact CG-CD1 4.05Å; R67-I71 WeakPolarHBondContact O-CB 3.15Å; R67-I71 WeakPolarHBondContact O-CD1 3.47Å; R67-I71 WeakPolarHBondContact O-CG1 3.27Å; R67-I71 PolarHBondContact O-N 2.8Å; I68-I71 PolarHBondContact O-N 3.22Å; I71-G73 VanDerWaalsContact C-N 3.34Å
72	K	89.6	Confident	89.3	Confident	100 Å²	100	86.3 Å²	86.3	44%	0.435	46%	0.457	S	S	.	.	H	α-helix	trans	-81	-9.5	-179.4	-71.6	-175.1	174.9	171.3	0	114	L55 I68 R69 R70 R74	L55-K72 HydrophobicContact CD1-CG 4.18Å; I68-K72 HydrophobicContact CG2-CD 3.9Å; I68-K72 HydrophobicContact CG2-CG 4.33Å; I68-K72 WeakPolarHBondContact O-CB 3.47Å; I68-K72 PolarHBondContact O-N 3.31Å; R69-K72 PolarHBondContact O-N 3.08Å; R70-K72 VanDerWaalsContact C-N 3.34Å; R70-K72 PolarHBondContact O-N 3.09Å; K72-R74 VanDerWaalsContact C-N 3.26Å; K72-R74 HydrophobicContact CB-CG 4.26Å; K72-R74 PolarHBondContact O-N 3.2Å
73	G	92.3	Very high	88.9	Confident	71 Å²	71	87.7 Å²	87.7	73%	0.732	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	35.6	-172.3	0	0	0	0	0	113.2	R69 R70 I71	R69-G73 PolarHBondContact O-N 3.41Å; R70-G73 PolarHBondContact O-N 2.87Å; I71-G73 VanDerWaalsContact C-N 3.34Å
74	R	83.8	Confident	88.2	Confident	103 Å²	103	85 Å²	85	39%	0.389	46%	0.459	S	S	.	.			trans	-96	146.3	-179.9	-85.7	-167.2	175.9	-167	2	111.6	R69 K72 K78 P79	R69-R74 PolarHBondContact O-N 3.44Å; R69-R74 VanDerWaalsContact O-N 3.11Å; K72-R74 VanDerWaalsContact C-N 3.26Å; K72-R74 HydrophobicContact CB-CG 4.26Å; K72-R74 PolarHBondContact O-N 3.2Å; R74-K78 HydrophobicContact CG-CD 4.26Å; R74-P79 PolarHBondContact NH1-O 2.89Å
75	S	86.2	Confident	87.3	Confident	64 Å²	64	90.1 Å²	90.1	45%	0.448	49%	0.486	S	S	.	.			trans	-67.7	155.6	167.4	71.1	0	0	0	0	111.5	T77 K78	S75-T77 PolarHBondContact O-N 3.24Å; S75-T77 PolarHBondContact OG-OG1 3.31Å; S75-K78 PolarHBondContact O-N 3.29Å
76	E	84.1	Confident	86.2	Confident	144 Å²	144	94.2 Å²	94.2	67%	0.673	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.3	175	-69.5	175.2	-172.5	0	0	113.1	K78	E76-K78 PolarHBondContact O-N 3.19Å
77	T	85	Confident	85	Confident	130 Å²	130	99.9 Å²	99.9	80%	0.798	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-14.1	179.3	56.5	0	0	0	0	113.6	S75	S75-T77 PolarHBondContact O-N 3.24Å; S75-T77 PolarHBondContact OG-OG1 3.31Å
78	K	82.8	Confident	84	Confident	107 Å²	107	100.4 Å²	100.4	47%	0.465	54%	0.536	S	S	.	.	S	Bend	trans	-90.1	122.4	-177.8	-163.9	166.4	-176.7	170.9	0	110	R74 S75 E76	R74-K78 HydrophobicContact CG-CD 4.26Å; S75-K78 PolarHBondContact O-N 3.29Å; E76-K78 PolarHBondContact O-N 3.19Å
79	P	83.8	Confident	83.3	Confident	109 Å²	109	102.5 Å²	102.5	71%	0.708	55%	0.552	S	S	*	*			trans	-63.3	150.6	-177.2	24.6	-33.2	0	0	0	112	R74	R74-P79 PolarHBondContact NH1-O 2.89Å
80	M	86.6	Confident	82.4	Confident	63 Å²	63	106.2 Å²	106.2	31%	0.31	57%	0.571	S	S	.	*			trans	-108	146.5	170.3	-65.3	-164.4	-71.6	0	0	109.4	I65 I68 R69	I65-M80 HydrophobicContact CB-CE 4.13Å; I65-M80 HydrophobicContact CG1-CE 4.3Å; I65-M80 HydrophobicContact CG2-CE 3.29Å; I68-M80 HydrophobicContact CB-SD 4.47Å; I68-M80 HydrophobicContact CG2-SD 3.91Å; R69-M80 HydrophobicContact CG-CE 4.34Å; R69-M80 HydrophobicContact CG-SD 4.25Å
81	A	86.2	Confident	81.8	Confident	105 Å²	105	101.1 Å²	101.1	87%	0.868	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-73.6	141.9	174.9	0	0	0	0	0	110
82	I	84.7	Confident	81.3	Confident	106 Å²	106	103.3 Å²	103.3	54%	0.544	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-103.1	127.3	170	-58.4	177.3	0	0	0	106.6	V59 L84	V59-I82 HydrophobicContact CG2-CD1 4.48Å; I82-L84 HydrophobicContact CG2-CD2 3.82Å; I82-L84 HydrophobicContact CG2-CG 3.98Å
83	C	82	Confident	81.1	Confident	129 Å²	129	104 Å²	104	87%	0.872	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-101.4	121	176.8	-152.7	0	0	0	0	108
84	L	78.5	Confident	80.8	Confident	54 Å²	54	105.1 Å²	105.1	28%	0.283	57%	0.572	S	S	.	*			trans	-120.5	151.5	178.5	-58.9	176.4	0	0	0	108.6	I82 F88 I91	I82-L84 HydrophobicContact CG2-CD2 3.82Å; I82-L84 HydrophobicContact CG2-CG 3.98Å; L84-F88 HydrophobicContact CD1-CB 4.2Å; L84-F88 HydrophobicContact CD1-CD1 3.18Å; L84-F88 HydrophobicContact CD1-CE1 3.63Å; L84-F88 HydrophobicContact CD1-CG 3.84Å; L84-I91 HydrophobicContact CD1-CD1 4.21Å; L84-I91 HydrophobicContact CD1-CG1 4.5Å
85	D	75.9	Confident	80.8	Confident	107 Å²	107	103.1 Å²	103.1	57%	0.572	57%	0.568	S	S	*	*	S	Bend	trans	-77.4	-40	-180	77.8	-36.5	0	0	0	111.9
86	Q	68.7	Low	81.1	Confident	116 Å²	116	108.3 Å²	108.3	54%	0.542	59%	0.591	S	S	.	*	S	Bend	trans	-127.6	146.4	-175.8	-68.1	170.5	44.8	0	0	108.8	F88 S89	Q86-F88 VanDerWaalsContact C-N 3.29Å; Q86-F88 PolarHBondContact O-N 3.2Å; Q86-S89 WeakPolarHBondContact CB-OG 3.45Å
87	E	68.1	Low	81.4	Confident	170 Å²	170	107.7 Å²	107.7	79%	0.794	59%	0.591	S	S	*	*	S	Bend	trans	-51.7	78	-169.5	-70.8	-173.1	146.1	0	0	115.1	S89 W92	E87-S89 PolarHBondContact O-N 3.25Å; E87-W92 PolarHBondContact O-NE1 3.21Å
88	F	72.4	Confident	81.2	Confident	119 Å²	119	105.6 Å²	105.6	52%	0.522	57%	0.574	S	S	.	*	S	Bend	trans	53.5	0.2	-176.2	-55.6	-85.1	0	0	0	115.8	L84 Q86 E90 I91 W92	L84-F88 HydrophobicContact CD1-CB 4.2Å; L84-F88 HydrophobicContact CD1-CD1 3.18Å; L84-F88 HydrophobicContact CD1-CE1 3.63Å; L84-F88 HydrophobicContact CD1-CG 3.84Å; Q86-F88 VanDerWaalsContact C-N 3.29Å; Q86-F88 PolarHBondContact O-N 3.2Å; F88-E90 PolarHBondContact O-N 3.11Å; F88-E90 VanDerWaalsContact O-N 3.11Å; F88-I91 HydrophobicContact CB-CG1 4.2Å; F88-I91 HydrophobicContact CD1-CD1 4.06Å; F88-I91 WeakPolarHBondContact O-CG1 3.18Å; F88-I91 PolarHBondContact O-N 2.85Å; F88-W92 VanDerWaalsContact C-NE1 3.33Å; F88-W92 PolarHBondContact O-N 3.26Å; F88-W92 PolarHBondContact O-NE1 3.45Å
89	S	78.2	Confident	81.3	Confident	50 Å²	50	107.5 Å²	107.5	35%	0.35	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-55.3	-39.6	-167	52.4	0	0	0	0	112.3	Q86 E87 I91 W92	Q86-S89 WeakPolarHBondContact CB-OG 3.45Å; E87-S89 PolarHBondContact O-N 3.25Å; S89-I91 PolarHBondContact O-N 2.98Å; S89-W92 PolarHBondContact O-N 3.43Å
90	E	74.9	Confident	81.1	Confident	127 Å²	127	108.7 Å²	108.7	59%	0.593	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-60.4	-27	179	-57.4	-166.9	142.8	0	0	113.8	F88	F88-E90 PolarHBondContact O-N 3.11Å; F88-E90 VanDerWaalsContact O-N 3.11Å
91	I	79.7	Confident	80.5	Confident	52 Å²	52	109.3 Å²	109.3	27%	0.267	61%	0.611	S	S	.	*	G	3₁₀ helix	trans	-109.4	-0.3	-176.8	64.1	166.8	0	0	0	113.4	L84 F88 S89 S93 S94 I95	L84-I91 HydrophobicContact CD1-CD1 4.21Å; L84-I91 HydrophobicContact CD1-CG1 4.5Å; F88-I91 HydrophobicContact CB-CG1 4.2Å; F88-I91 HydrophobicContact CD1-CD1 4.06Å; F88-I91 WeakPolarHBondContact O-CG1 3.18Å; F88-I91 PolarHBondContact O-N 2.85Å; S89-I91 PolarHBondContact O-N 2.98Å; I91-S93 PolarHBondContact O-N 2.8Å; I91-S94 PolarHBondContact O-N 2.65Å; I91-I95 HydrophobicContact CB-CD1 4.46Å; I91-I95 HydrophobicContact CD1-CD1 3.71Å; I91-I95 HydrophobicContact CD1-CG1 4.45Å; I91-I95 HydrophobicContact CG1-CD1 3.7Å; I91-I95 HydrophobicContact CG1-CG1 4.46Å; I91-I95 WeakPolarHBondContact O-CG1 3.34Å; I91-I95 PolarHBondContact O-N 3.15Å
92	W	83.9	Confident	79.9	Confident	143 Å²	143	105.5 Å²	105.5	54%	0.542	58%	0.582	S	S	.	*	G	3₁₀ helix	trans	-56	-37.7	-178.1	-78	13.7	0	0	0	112.9	E87 F88 S89 S94 I95 I98	E87-W92 PolarHBondContact O-NE1 3.21Å; F88-W92 VanDerWaalsContact C-NE1 3.33Å; F88-W92 PolarHBondContact O-N 3.26Å; F88-W92 PolarHBondContact O-NE1 3.45Å; S89-W92 PolarHBondContact O-N 3.43Å; W92-S94 PolarHBondContact O-N 3.15Å; W92-I95 PolarHBondContact O-N 2.57Å; W92-I98 HydrophobicContact CB-CD1 4.22Å; W92-I98 HydrophobicContact CD2-CD1 3.91Å; W92-I98 HydrophobicContact CG-CD1 3.6Å
93	S	84.8	Confident	79	Confident	114 Å²	114	105.8 Å²	105.8	80%	0.797	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-64.5	-22.7	178.2	59.4	0	0	0	0	113.7	I91	I91-S93 PolarHBondContact O-N 2.8Å
94	S	86.3	Confident	78.1	Confident	96 Å²	96	104.6 Å²	104.6	67%	0.671	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-98.8	-3.8	-179.4	-54.8	0	0	0	0	112.8	I91 W92	I91-S94 PolarHBondContact O-N 2.65Å; W92-S94 PolarHBondContact O-N 3.15Å
95	I	84.3	Confident	77.1	Confident	61 Å²	61	108.9 Å²	108.9	31%	0.313	59%	0.593	S	S	.	*			trans	-101.7	121.8	-179.7	-65.5	168.1	0	0	0	109.2	I91 W92 L97 I98	I91-I95 HydrophobicContact CB-CD1 4.46Å; I91-I95 HydrophobicContact CD1-CD1 3.71Å; I91-I95 HydrophobicContact CD1-CG1 4.45Å; I91-I95 HydrophobicContact CG1-CD1 3.7Å; I91-I95 HydrophobicContact CG1-CG1 4.46Å; I91-I95 WeakPolarHBondContact O-CG1 3.34Å; I91-I95 PolarHBondContact O-N 3.15Å; W92-I95 PolarHBondContact O-N 2.57Å; I95-L97 VanDerWaalsContact C-N 3.33Å; I95-L97 VanDerWaalsContact CG2-O 3.23Å; I95-L97 WeakPolarHBondContact CG2-O 3.47Å; I95-L97 PolarHBondContact O-N 3.22Å; I95-I98 HydrophobicContact CB-CG1 4.25Å; I95-I98 HydrophobicContact CD1-CD1 4.47Å; I95-I98 HydrophobicContact CD1-CG1 4.4Å; I95-I98 HydrophobicContact CG2-CG1 3.64Å
96	D	92.4	Very high	75.9	Confident	173 Å²	173	108.2 Å²	108.2	93%	0.925	60%	0.597	S	S	*	*	S	Bend	trans	-68.3	-30.1	179.1	-58.3	-68.5	0	0	0	113.4
97	L	89.2	Confident	75.1	Confident	130 Å²	130	107.2 Å²	107.2	68%	0.681	60%	0.595	S	S	*	*			trans	-151.4	124.8	-177.2	178.8	63.9	0	0	0	111.8	I95 I99	I95-L97 VanDerWaalsContact C-N 3.33Å; I95-L97 VanDerWaalsContact CG2-O 3.23Å; I95-L97 WeakPolarHBondContact CG2-O 3.47Å; I95-L97 PolarHBondContact O-N 3.22Å; L97-I99 HydrophobicContact CD2-CD1 4.35Å; L97-I99 HydrophobicContact CD2-CG1 4.18Å; L97-I99 HydrophobicContact CG-CG1 4.15Å
98	I	82.3	Confident	74.4	Confident	86 Å²	86	105.4 Å²	105.4	44%	0.441	59%	0.589	S	S	.	*			trans	-109.6	115	171	-60.7	173.1	0	0	0	108.4	W92 I95 N100	W92-I98 HydrophobicContact CB-CD1 4.22Å; W92-I98 HydrophobicContact CD2-CD1 3.91Å; W92-I98 HydrophobicContact CG-CD1 3.6Å; I95-I98 HydrophobicContact CB-CG1 4.25Å; I95-I98 HydrophobicContact CD1-CD1 4.47Å; I95-I98 HydrophobicContact CD1-CG1 4.4Å; I95-I98 HydrophobicContact CG2-CG1 3.64Å; I98-N100 PolarHBondContact O-N 3.24Å
99	I	83.8	Confident	73.5	Confident	147 Å²	147	109.4 Å²	109.4	75%	0.754	61%	0.607	S	S	*	*			trans	-90.7	98	172.1	-56.2	177	0	0	0	107.9	L97 G101	L97-I99 HydrophobicContact CD2-CD1 4.35Å; L97-I99 HydrophobicContact CD2-CG1 4.18Å; L97-I99 HydrophobicContact CG-CG1 4.15Å; I99-G101 PolarHBondContact O-N 3.21Å
100	N	79.4	Confident	72.1	Confident	135 Å²	135	109.6 Å²	109.6	72%	0.722	61%	0.609	S	S	*	*			trans	-76.2	111	175.6	-174.2	-4.9	0	0	0	110	I98 G102	I98-N100 PolarHBondContact O-N 3.24Å; N100-G102 PolarHBondContact O-N 3.31Å; N100-G102 WeakPolarHBondContact OD1-CA 3.46Å; N100-G102 PolarHBondContact OD1-N 2.87Å
101	G	75.3	Confident	71.1	Confident	75 Å²	75	107.9 Å²	107.9	77%	0.773	63%	0.625	S	S	*	*			trans	-74.3	5.5	175.8	0	0	0	0	0	114.9	I99	I99-G101 PolarHBondContact O-N 3.21Å
102	G	72.8	Confident	69.6	Low	25 Å²	25	110.8 Å²	110.8	26%	0.258	64%	0.641	S	S	.	*			trans	82	174.4	-172.7	0	0	0	0	0	113.1	N100 R117	N100-G102 PolarHBondContact O-N 3.31Å; N100-G102 WeakPolarHBondContact OD1-CA 3.46Å; N100-G102 PolarHBondContact OD1-N 2.87Å; G102-R117 PolarHBondContact O-NH1 3.14Å; G102-R117 VanDerWaalsContact O-NH1 3.14Å
103	P	66	Low	68	Low	113 Å²	113	108.2 Å²	108.2	73%	0.734	64%	0.644	S	S	*	*			trans	-56.7	144.1	173.7	23.5	-31.6	0	0	0	110	Q105	P103-Q105 VanDerWaalsContact C-N 3.33Å; P103-Q105 PolarHBondContact O-N 3.42Å
104	I	64	Low	66.5	Low	104 Å²	104	107.9 Å²	107.9	53%	0.533	63%	0.634	S	S	.	*			trans	-61.6	105.4	165.4	-28.8	-141.5	0	0	0	104.2	S106 R117	I104-S106 PolarHBondContact O-N 3.28Å; I104-R117 HydrophobicContact CD1-CB 4.49Å; I104-R117 VanDerWaalsContact CG1-NH1 3.29Å; I104-R117 HydrophobicContact CG2-CB 3.9Å
105	Q	56.7	Low	65	Low	144 Å²	144	107 Å²	107	67%	0.673	63%	0.627	S	S	*	*			trans	-62.4	114.5	172.1	-88.9	176.6	-8.7	0	0	106.2	P103 D107	P103-Q105 VanDerWaalsContact C-N 3.33Å; P103-Q105 PolarHBondContact O-N 3.42Å; Q105-D107 PolarHBondContact O-N 2.92Å
106	S	51	Low	63.6	Low	93 Å²	93	109 Å²	109	65%	0.65	65%	0.646	S	S	*	*			trans	-70.9	116.6	153.9	50.6	0	0	0	0	105.3	I104 I108	I104-S106 PolarHBondContact O-N 3.28Å; S106-I108 VanDerWaalsContact C-N 3.27Å; S106-I108 PolarHBondContact O-N 3.35Å
107	D	50.6	Low	62	Low	94 Å²	94	107.4 Å²	107.4	50%	0.503	63%	0.627	S	S	.	*	S	Bend	trans	-63.2	86	-172.8	-10.9	-42.9	0	0	0	109.8	Q105	Q105-D107 PolarHBondContact O-N 2.92Å
108	I	54.8	Low	60.7	Low	132 Å²	132	103 Å²	103	68%	0.677	61%	0.61	S	S	*	*	S	Bend	trans	-101.6	-24.5	166.2	-60.7	178.8	0	0	0	109.9	S106	S106-I108 VanDerWaalsContact C-N 3.27Å; S106-I108 PolarHBondContact O-N 3.35Å
109	F	53	Low	60.4	Low	203 Å²	203	100.7 Å²	100.7	89%	0.89	61%	0.606	S	S	*	*	S	Bend	trans	-128.5	-5	-174.4	-72.4	-76.8	0	0	0	116.4
110	S	49.3	Very low	60.2	Low	55 Å²	55	97.8 Å²	97.8	39%	0.385	60%	0.599	S	S	.	*			trans	-102.1	112	172.4	-170.8	0	0	0	0	108.8	N112	S110-N112 PolarHBondContact O-N 2.89Å
111	G	53	Low	60.5	Low	90 Å²	90	92.5 Å²	92.5	93%	0.928	57%	0.572	S	S	*	*	S	Bend	trans	-67.5	20.4	175.4	0	0	0	0	0	114.5
112	N	48.7	Very low	61.1	Low	113 Å²	113	90.9 Å²	90.9	60%	0.604	55%	0.545	S	S	*	.	S	Bend	trans	-133.7	113	174.8	-126.9	-0.3	0	0	0	108.1	S110 D114	S110-N112 PolarHBondContact O-N 2.89Å; N112-D114 VanDerWaalsContact C-N 3.33Å; N112-D114 PolarHBondContact O-N 2.63Å
113	S	51.1	Low	61.8	Low	89 Å²	89	91.3 Å²	91.3	62%	0.622	54%	0.541	S	S	*	.			trans	-71.7	79.6	-178.2	44.2	0	0	0	0	111	C115	S113-C115 PolarHBondContact O-N 3.46Å
114	D	53	Low	62.9	Low	108 Å²	108	88.2 Å²	88.2	58%	0.578	52%	0.518	S	S	*	.			trans	-72.2	97.1	-179	-85.1	-20.6	0	0	0	111.4	N112 S116	N112-D114 VanDerWaalsContact C-N 3.33Å; N112-D114 PolarHBondContact O-N 2.63Å; D114-S116 PolarHBondContact O-N 3.04Å
115	C	54.8	Low	64	Low	77 Å²	77	86.7 Å²	86.7	52%	0.52	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-57.1	-3.1	170.6	59	0	0	0	0	115.4	S113 R117 A118	S113-C115 PolarHBondContact O-N 3.46Å; C115-R117 PolarHBondContact O-N 2.97Å; C115-A118 PolarHBondContact O-N 3.09Å
116	S	54	Low	65.2	Low	102 Å²	102	85 Å²	85	71%	0.713	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-55.5	-21.2	-171.9	-51.4	0	0	0	0	114.1	D114	D114-S116 PolarHBondContact O-N 3.04Å
117	R	58.7	Low	66.4	Low	141 Å²	141	84.2 Å²	84.2	53%	0.532	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-126.9	5.5	174.8	-60.9	-172.9	68	-176.5	1.2	114.2	G102 I104 C115 G119	G102-R117 PolarHBondContact O-NH1 3.14Å; G102-R117 VanDerWaalsContact O-NH1 3.14Å; I104-R117 HydrophobicContact CD1-CB 4.49Å; I104-R117 VanDerWaalsContact CG1-NH1 3.29Å; I104-R117 HydrophobicContact CG2-CB 3.9Å; C115-R117 PolarHBondContact O-N 2.97Å; R117-G119 PolarHBondContact O-N 2.96Å
118	A	63.5	Low	67	Low	38 Å²	38	82.7 Å²	82.7	31%	0.314	50%	0.498	S	S	.	.			trans	-71.7	119.8	-178.5	0	0	0	0	0	109.9	C115 S140	C115-A118 PolarHBondContact O-N 3.09Å; A118-S140 WeakPolarHBondContact O-CB 3.29Å; A118-S140 PolarHBondContact O-N 2.89Å; A118-S140 PolarHBondContact O-OG 2.95Å
119	G	75	Confident	67.8	Low	36 Å²	36	84.1 Å²	84.1	37%	0.371	51%	0.507	S	S	.	.			trans	-62.8	-169.9	176.3	0	0	0	0	0	112.8	R117 G139 S140	R117-G119 PolarHBondContact O-N 2.96Å; G119-G139 CarbonylContact O-C 3.58Å; G119-G139 WeakPolarHBondContact O-CA 3.17Å; G119-S140 PolarHBondContact O-N 2.93Å; G119-S140 PolarHBondContact O-OG 3.28Å
120	S	80.1	Confident	68.8	Low	87 Å²	87	81.8 Å²	81.8	61%	0.608	50%	0.497	S	S	*	.			trans	-56.6	143.5	180	-53.5	0	0	0	0	113.1	I122 R137	S120-I122 PolarHBondContact O-N 3.21Å; S120-R137 VanDerWaalsContact N-NH2 3.1Å; S120-R137 PolarHBondContact O-NH1 2.93Å; S120-R137 PolarHBondContact O-NH2 3.18Å
121	T	86.2	Confident	70.5	Confident	24 Å²	24	82.1 Å²	82.1	15%	0.147	50%	0.499	C	S	.	.			trans	-72.9	129.5	167.1	-56.1	0	0	0	0	108.8	I123 G139 A141 Y142	T121-I123 HydrophobicContact CG2-CD1 3.81Å; T121-I123 HydrophobicContact CG2-CG1 4.07Å; T121-G139 WeakPolarHBondContact OG1-CA 3.28Å; T121-G139 PolarHBondContact OG1-N 2.94Å; T121-G139 PolarHBondContact OG1-O 3.14Å; T121-A141 PolarHBondContact OG1-N 3.41Å; T121-Y142 HydrophobicContact CG2-CD2 4.05Å; T121-Y142 VanDerWaalsContact OG1-CA 3.28Å; T121-Y142 WeakPolarHBondContact OG1-CA 3.21Å; T121-Y142 PolarHBondContact OG1-N 2.94Å
122	I	86.2	Confident	72.3	Confident	41 Å²	41	79.4 Å²	79.4	21%	0.21	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	117.1	176.6	-52.3	170.3	0	0	0	107.6	T51 S120 V136 R137	T51-I122 HydrophobicContact CG2-CD1 3.34Å; T51-I122 HydrophobicContact CG2-CG1 4.32Å; S120-I122 PolarHBondContact O-N 3.21Å; I122-V136 HydrophobicContact CB-CB 4.05Å; I122-V136 HydrophobicContact CG2-CB 3.75Å; I122-V136 HydrophobicContact CG2-CG1 4.14Å; I122-V136 HydrophobicContact CG2-CG2 4.17Å; I122-V136 PolarHBondContact O-N 3.39Å; I122-R137 HydrophobicContact CB-CB 4.17Å; I122-R137 HydrophobicContact CD1-CB 3.99Å; I122-R137 HydrophobicContact CG1-CB 4.23Å; I122-R137 PolarHBondContact N-O 3.34Å; I122-R137 PolarHBondContact O-N 3.46Å; I122-R137 VanDerWaalsContact O-N 3.14Å
123	I	89.1	Confident	74.4	Confident	33 Å²	33	74.1 Å²	74.1	17%	0.169	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	130.8	175.3	-56.3	-61.1	0	0	0	107.5	T121 L125 Y133 S134 V135 T145 L149	T121-I123 HydrophobicContact CG2-CD1 3.81Å; T121-I123 HydrophobicContact CG2-CG1 4.07Å; I123-L125 HydrophobicContact CG2-CD2 3.73Å; I123-L125 HydrophobicContact CG2-CG 4Å; I123-Y133 HydrophobicContact CD1-CD2 4.19Å; I123-Y133 HydrophobicContact CD1-CE2 4.26Å; I123-Y133 HydrophobicContact CG2-CD2 3.63Å; I123-Y133 HydrophobicContact CG2-CG 4.07Å; I123-S134 WeakPolarHBondContact CA-O 3.28Å; I123-V135 HydrophobicContact CD1-CB 4.25Å; I123-V135 HydrophobicContact CD1-CG1 4.14Å; I123-V135 HydrophobicContact CD1-CG2 3.72Å; I123-T145 HydrophobicContact CD1-CG2 4.27Å; I123-T145 HydrophobicContact CG1-CG2 3.57Å; I123-L149 HydrophobicContact CB-CD1 4.45Å; I123-L149 HydrophobicContact CD1-CD1 4.44Å; I123-L149 HydrophobicContact CG1-CD1 4.04Å; I123-L149 HydrophobicContact CG2-CD1 3.85Å
124	D	87.9	Confident	76.3	Confident	48 Å²	48	71.1 Å²	71.1	26%	0.257	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	120.3	166.2	176.4	22.6	0	0	0	109.2	C126 Y133 S134 V136	D124-C126 WeakPolarHBondContact OD1-CB 3.4Å; D124-C126 PolarHBondContact OD1-N 2.84Å; D124-C126 PolarHBondContact OD1-SG 3Å; D124-Y133 WeakPolarHBondContact O-CA 3.47Å; D124-S134 WeakPolarHBondContact CB-OG 2.92Å; D124-S134 PolarHBondContact N-O 2.88Å; D124-S134 PolarHBondContact O-N 3.01Å; D124-V136 HydrophobicContact CB-CG2 3.56Å
125	L	88.5	Confident	77.9	Confident	73 Å²	73	68 Å²	68	38%	0.382	40%	0.4	S	S	.	.			trans	-109.3	10.3	177.8	-64	175.5	0	0	0	111.4	I123 N127 C128 L149 L155	I123-L125 HydrophobicContact CG2-CD2 3.73Å; I123-L125 HydrophobicContact CG2-CG 4Å; L125-N127 PolarHBondContact O-N 2.85Å; L125-C128 PolarHBondContact O-N 3.09Å; L125-C128 VanDerWaalsContact O-N 3.09Å; L125-C128 PolarHBondContact O-SG 2.91Å; L125-L149 HydrophobicContact CD2-CD2 4Å; L125-L155 HydrophobicContact CD2-CD1 4.03Å
126	C	81.4	Confident	79.4	Confident	108 Å²	108	68.7 Å²	68.7	73%	0.73	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-21.9	-176.4	-67.9	0	0	0	0	113.3	D124	D124-C126 WeakPolarHBondContact OD1-CB 3.4Å; D124-C126 PolarHBondContact OD1-N 2.84Å; D124-C126 PolarHBondContact OD1-SG 3Å
127	N	76.3	Confident	80.8	Confident	77 Å²	77	67.8 Å²	67.8	41%	0.412	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	31.5	176.8	-68.6	-48.8	0	0	0	113.8	L125 D129 K130 V132	L125-N127 PolarHBondContact O-N 2.85Å; N127-D129 PolarHBondContact O-N 3.15Å; N127-D129 VanDerWaalsContact O-N 3.11Å; N127-K130 PolarHBondContact O-N 3.28Å; N127-V132 HydrophobicContact CB-CG2 3.97Å
128	C	61.8	Low	82	Confident	61 Å²	61	65.8 Å²	65.8	41%	0.412	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-53.4	-31	178.5	-81.2	0	0	0	0	114.3	L125 K130 S131	L125-C128 PolarHBondContact O-N 3.09Å; L125-C128 VanDerWaalsContact O-N 3.09Å; L125-C128 PolarHBondContact O-SG 2.91Å; C128-K130 PolarHBondContact O-N 3.32Å; C128-K130 VanDerWaalsContact O-N 3.11Å; C128-S131 PolarHBondContact O-N 3.42Å
129	D	71.5	Confident	83	Confident	163 Å²	163	64.4 Å²	64.4	87%	0.872	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-61.1	-22.6	-179.7	-61.1	-22.4	0	0	0	113.1	N127	N127-D129 PolarHBondContact O-N 3.15Å; N127-D129 VanDerWaalsContact O-N 3.11Å
130	K	74.1	Confident	83.4	Confident	154 Å²	154	66.2 Å²	66.2	67%	0.67	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-97.7	8	178.2	-66	179.5	-171	176.3	0	112.5	N127 C128 V132	N127-K130 PolarHBondContact O-N 3.28Å; C128-K130 PolarHBondContact O-N 3.32Å; C128-K130 VanDerWaalsContact O-N 3.11Å; K130-V132 HydrophobicContact CB-CG2 3.81Å; K130-V132 PolarHBondContact O-N 3.17Å
131	S	85.2	Confident	83.7	Confident	62 Å²	62	64 Å²	64	43%	0.434	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	34	-171.9	-57.5	0	0	0	0	113.1	C128 L155 S156	C128-S131 PolarHBondContact O-N 3.42Å; S131-L155 CarbonylContact O-C 3.57Å; S131-L155 VanDerWaalsContact O-CA 3.28Å; S131-L155 WeakPolarHBondContact O-CA 3.28Å; S131-S156 PolarHBondContact O-N 3.42Å; S131-S156 PolarHBondContact O-OG 3.24Å
132	V	90.5	Very high	83.9	Confident	32 Å²	32	65.8 Å²	65.8	19%	0.194	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	150.4	178.6	-64	0	0	0	0	112.4	N127 K130 S156	N127-V132 HydrophobicContact CB-CG2 3.97Å; K130-V132 HydrophobicContact CB-CG2 3.81Å; K130-V132 PolarHBondContact O-N 3.17Å; V132-S156 CarbonylContact C-O 3.53Å; V132-S156 WeakPolarHBondContact CA-O 3.13Å; V132-S156 WeakPolarHBondContact CB-O 3.4Å
133	Y	93	Very high	84	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.008	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	154.8	173.1	73	-86.9	0	0	0	110.5	I123 D124 V135 L149 E150 L155 S156 L157 S158	I123-Y133 HydrophobicContact CD1-CD2 4.19Å; I123-Y133 HydrophobicContact CD1-CE2 4.26Å; I123-Y133 HydrophobicContact CG2-CD2 3.63Å; I123-Y133 HydrophobicContact CG2-CG 4.07Å; D124-Y133 WeakPolarHBondContact O-CA 3.47Å; Y133-V135 HydrophobicContact CD2-CG2 4.27Å; Y133-V135 HydrophobicContact CE2-CG2 3.85Å; Y133-L149 HydrophobicContact CD1-CB 4.33Å; Y133-L149 HydrophobicContact CD1-CD1 4.19Å; Y133-L149 HydrophobicContact CD2-CD1 3.85Å; Y133-L149 HydrophobicContact CE1-CB 4.22Å; Y133-L149 HydrophobicContact CE1-CD1 4.35Å; Y133-L149 HydrophobicContact CE2-CD1 4Å; Y133-L149 HydrophobicContact CG-CD1 3.94Å; Y133-E150 HydrophobicContact CE1-CG 4.2Å; Y133-E150 PolarHBondContact OH-OE1 2.86Å; Y133-L155 HydrophobicContact CD1-CB 3.91Å; Y133-S156 WeakPolarHBondContact CD1-O 3.28Å; Y133-S156 PolarHBondContact N-O 2.77Å; Y133-L157 HydrophobicContact CD2-CD1 3.96Å; Y133-L157 HydrophobicContact CE1-CB 4.22Å; Y133-L157 HydrophobicContact CE2-CB 4.45Å; Y133-L157 HydrophobicContact CE2-CD1 3.45Å; Y133-L157 VanDerWaalsContact CE2-CD1 3.45Å; Y133-L157 CarbonylContact O-C 3.39Å; Y133-S158 PolarHBondContact O-N 2.72Å; Y133-S158 PolarHBondContact O-OG 2.86Å
134	S	90.8	Very high	84.1	Confident	27 Å²	27	71.2 Å²	71.2	19%	0.189	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	147.7	171	84.6	0	0	0	0	110.8	I123 D124 S158	I123-S134 WeakPolarHBondContact CA-O 3.28Å; D124-S134 WeakPolarHBondContact CB-OG 2.92Å; D124-S134 PolarHBondContact N-O 2.88Å; D124-S134 PolarHBondContact O-N 3.01Å; S134-S158 WeakPolarHBondContact CB-OG 3.18Å
135	V	88.2	Confident	84.3	Confident	41 Å²	41	70.7 Å²	70.7	25%	0.248	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	107.3	-179.8	-176.3	0	0	0	0	108.1	I123 Y133 N138 Y142 L157	I123-V135 HydrophobicContact CD1-CB 4.25Å; I123-V135 HydrophobicContact CD1-CG1 4.14Å; I123-V135 HydrophobicContact CD1-CG2 3.72Å; Y133-V135 HydrophobicContact CD2-CG2 4.27Å; Y133-V135 HydrophobicContact CE2-CG2 3.85Å; V135-N138 WeakPolarHBondContact CG1-OD1 3.37Å; V135-Y142 HydrophobicContact CB-CE2 4.47Å; V135-Y142 HydrophobicContact CG1-CD2 4.28Å; V135-Y142 HydrophobicContact CG1-CE2 4Å; V135-Y142 HydrophobicContact CG2-CE2 3.74Å; V135-L157 HydrophobicContact CG2-CD1 3.56Å
136	V	85.9	Confident	84.5	Confident	93 Å²	93	68.1 Å²	68.1	56%	0.564	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	-40	177.4	-178.8	0	0	0	0	109.9	I122 D124	I122-V136 HydrophobicContact CB-CB 4.05Å; I122-V136 HydrophobicContact CG2-CB 3.75Å; I122-V136 HydrophobicContact CG2-CG1 4.14Å; I122-V136 HydrophobicContact CG2-CG2 4.17Å; I122-V136 PolarHBondContact O-N 3.39Å; D124-V136 HydrophobicContact CB-CG2 3.56Å
137	R	82.8	Confident	85.1	Confident	82 Å²	82	66 Å²	66	31%	0.309	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	128.9	176.8	-164.3	176.9	59.9	64	-5	111.9	S120 I122	S120-R137 VanDerWaalsContact N-NH2 3.1Å; S120-R137 PolarHBondContact O-NH1 2.93Å; S120-R137 PolarHBondContact O-NH2 3.18Å; I122-R137 HydrophobicContact CB-CB 4.17Å; I122-R137 HydrophobicContact CD1-CB 3.99Å; I122-R137 HydrophobicContact CG1-CB 4.23Å; I122-R137 PolarHBondContact N-O 3.34Å; I122-R137 PolarHBondContact O-N 3.46Å; I122-R137 VanDerWaalsContact O-N 3.14Å
138	N	84.6	Confident	85.9	Confident	99 Å²	99	66.7 Å²	66.7	53%	0.529	39%	0.388	S	S	.	.			trans	-68.2	140.5	169.3	-73.1	-16.6	0	0	0	110.7	V135 Y142	V135-N138 WeakPolarHBondContact CG1-OD1 3.37Å; N138-Y142 WeakPolarHBondContact OD1-CD2 3.46Å; N138-Y142 WeakPolarHBondContact OD1-CE2 3.46Å
139	G	84.2	Confident	87.4	Confident	10 Å²	10	64.4 Å²	64.4	10%	0.103	37%	0.371	C	S	.	.			trans	-148.9	-179.9	-175.3	0	0	0	0	0	112.7	G119 T121 A141 Y142	G119-G139 CarbonylContact O-C 3.58Å; G119-G139 WeakPolarHBondContact O-CA 3.17Å; T121-G139 WeakPolarHBondContact OG1-CA 3.28Å; T121-G139 PolarHBondContact OG1-N 2.94Å; T121-G139 PolarHBondContact OG1-O 3.14Å; G139-A141 PolarHBondContact O-N 2.94Å; G139-A141 VanDerWaalsContact O-N 3.09Å; G139-Y142 VanDerWaalsContact O-CB 3.28Å; G139-Y142 WeakPolarHBondContact O-CB 3.46Å; G139-Y142 PolarHBondContact O-N 3.21Å
140	S	83.7	Confident	88.5	Confident	73 Å²	73	60.7 Å²	60.7	51%	0.51	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.6	-178	40.2	0	0	0	0	114	A118 G119	A118-S140 WeakPolarHBondContact O-CB 3.29Å; A118-S140 PolarHBondContact O-N 2.89Å; A118-S140 PolarHBondContact O-OG 2.95Å; G119-S140 PolarHBondContact O-N 2.93Å; G119-S140 PolarHBondContact O-OG 3.28Å
141	A	86.6	Confident	89.3	Confident	40 Å²	40	56.6 Å²	56.6	33%	0.331	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	9.4	179	0	0	0	0	0	113.5	T121 G139 N143 A144 T145	T121-A141 PolarHBondContact OG1-N 3.41Å; G139-A141 PolarHBondContact O-N 2.94Å; G139-A141 VanDerWaalsContact O-N 3.09Å; A141-N143 PolarHBondContact O-N 3.11Å; A141-A144 PolarHBondContact O-N 2.82Å; A141-T145 WeakPolarHBondContact O-CB 3.37Å; A141-T145 PolarHBondContact O-N 3.06Å; A141-T145 PolarHBondContact O-OG1 2.81Å
142	Y	89.2	Confident	89.7	Confident	63 Å²	63	63.1 Å²	63.1	25%	0.247	37%	0.365	C	S	.	.	H	α-helix	trans	-54.6	-56.3	-167.6	175.4	-104.6	0	0	0	112.8	T121 V135 N138 G139 A144 T145 V146	T121-Y142 HydrophobicContact CG2-CD2 4.05Å; T121-Y142 VanDerWaalsContact OG1-CA 3.28Å; T121-Y142 WeakPolarHBondContact OG1-CA 3.21Å; T121-Y142 PolarHBondContact OG1-N 2.94Å; V135-Y142 HydrophobicContact CB-CE2 4.47Å; V135-Y142 HydrophobicContact CG1-CD2 4.28Å; V135-Y142 HydrophobicContact CG1-CE2 4Å; V135-Y142 HydrophobicContact CG2-CE2 3.74Å; N138-Y142 WeakPolarHBondContact OD1-CD2 3.46Å; N138-Y142 WeakPolarHBondContact OD1-CE2 3.46Å; G139-Y142 VanDerWaalsContact O-CB 3.28Å; G139-Y142 WeakPolarHBondContact O-CB 3.46Å; G139-Y142 PolarHBondContact O-N 3.21Å; Y142-A144 VanDerWaalsContact C-N 3.32Å; Y142-A144 PolarHBondContact O-N 2.98Å; Y142-T145 PolarHBondContact O-N 3.11Å; Y142-V146 HydrophobicContact CD1-CG2 4.47Å; Y142-V146 HydrophobicContact CD2-CG2 4Å; Y142-V146 HydrophobicContact CE1-CG2 4.11Å; Y142-V146 HydrophobicContact CE2-CG2 3.57Å; Y142-V146 HydrophobicContact CG-CG2 4.43Å; Y142-V146 WeakPolarHBondContact O-CG2 3.42Å; Y142-V146 PolarHBondContact O-N 3.07Å
143	N	89.7	Confident	89.6	Confident	126 Å²	126	68.4 Å²	68.4	67%	0.674	38%	0.383	S	S	*	.	H	α-helix	trans	-59.5	-42.4	-179.4	-65.2	-17.6	0	0	0	112.3	A141 A147	A141-N143 PolarHBondContact O-N 3.11Å; N143-A147 VanDerWaalsContact O-CB 3.32Å; N143-A147 WeakPolarHBondContact O-CB 3.19Å; N143-A147 PolarHBondContact O-N 3.05Å
144	A	91	Very high	89.6	Confident	61 Å²	61	74.9 Å²	74.9	50%	0.504	42%	0.417	S	S	.	.	H	α-helix	trans	-65.7	-41.6	178.8	0	0	0	0	0	111.6	A141 Y142 I148	A141-A144 PolarHBondContact O-N 2.82Å; Y142-A144 VanDerWaalsContact C-N 3.32Å; Y142-A144 PolarHBondContact O-N 2.98Å; A144-I148 WeakPolarHBondContact O-CD1 3.46Å; A144-I148 VanDerWaalsContact O-CG1 3.28Å; A144-I148 WeakPolarHBondContact O-CG1 3.41Å; A144-I148 PolarHBondContact O-N 3.43Å; A144-I148 VanDerWaalsContact O-N 3.15Å
145	T	91.7	Very high	89.6	Confident	37 Å²	37	74.6 Å²	74.6	23%	0.227	41%	0.413	C	S	.	.	H	α-helix	trans	-65.1	-48.7	177.4	-61.1	0	0	0	0	111.1	I123 A141 Y142 A147 I148 L149	I123-T145 HydrophobicContact CD1-CG2 4.27Å; I123-T145 HydrophobicContact CG1-CG2 3.57Å; A141-T145 WeakPolarHBondContact O-CB 3.37Å; A141-T145 PolarHBondContact O-N 3.06Å; A141-T145 PolarHBondContact O-OG1 2.81Å; Y142-T145 PolarHBondContact O-N 3.11Å; T145-A147 PolarHBondContact O-N 2.92Å; T145-I148 PolarHBondContact O-N 2.99Å; T145-L149 HydrophobicContact CG2-CD1 3.79Å; T145-L149 HydrophobicContact CG2-CG 4.25Å; T145-L149 VanDerWaalsContact O-CG 3.29Å; T145-L149 WeakPolarHBondContact O-CG 3.46Å; T145-L149 PolarHBondContact O-N 3.11Å
146	V	92.5	Very high	89.7	Confident	20 Å²	20	75.8 Å²	75.8	12%	0.121	42%	0.424	C	S	.	.	H	α-helix	trans	-58.2	-47.8	177.8	169.7	0	0	0	0	111	Y142 I148 L149 E150	Y142-V146 HydrophobicContact CD1-CG2 4.47Å; Y142-V146 HydrophobicContact CD2-CG2 4Å; Y142-V146 HydrophobicContact CE1-CG2 4.11Å; Y142-V146 HydrophobicContact CE2-CG2 3.57Å; Y142-V146 HydrophobicContact CG-CG2 4.43Å; Y142-V146 WeakPolarHBondContact O-CG2 3.42Å; Y142-V146 PolarHBondContact O-N 3.07Å; V146-I148 VanDerWaalsContact C-N 3.25Å; V146-I148 PolarHBondContact O-N 2.96Å; V146-L149 PolarHBondContact O-N 2.96Å; V146-L149 VanDerWaalsContact O-N 3.13Å; V146-E150 HydrophobicContact CG1-CG 4.4Å; V146-E150 WeakPolarHBondContact CG1-OE1 3.47Å; V146-E150 PolarHBondContact O-N 2.92Å
147	A	93.5	Very high	90	Very high	63 Å²	63	74.7 Å²	74.7	52%	0.521	41%	0.414	S	S	.	.	H	α-helix	trans	-58.6	-36.5	178.1	0	0	0	0	0	112.9	N143 T145 G151	N143-A147 VanDerWaalsContact O-CB 3.32Å; N143-A147 WeakPolarHBondContact O-CB 3.19Å; N143-A147 PolarHBondContact O-N 3.05Å; T145-A147 PolarHBondContact O-N 2.92Å; A147-G151 WeakPolarHBondContact O-CA 3.32Å; A147-G151 PolarHBondContact O-N 3.02Å
148	I	93.8	Very high	90.1	Very high	92 Å²	92	71.9 Å²	71.9	47%	0.472	41%	0.407	S	S	.	.	H	α-helix	trans	-71.2	-45.8	175.5	-69.6	166.7	0	0	0	111.1	A144 T145 V146 R152 Y153	A144-I148 WeakPolarHBondContact O-CD1 3.46Å; A144-I148 VanDerWaalsContact O-CG1 3.28Å; A144-I148 WeakPolarHBondContact O-CG1 3.41Å; A144-I148 PolarHBondContact O-N 3.43Å; A144-I148 VanDerWaalsContact O-N 3.15Å; T145-I148 PolarHBondContact O-N 2.99Å; V146-I148 VanDerWaalsContact C-N 3.25Å; V146-I148 PolarHBondContact O-N 2.96Å; I148-R152 WeakPolarHBondContact O-CA 3.26Å; I148-R152 WeakPolarHBondContact O-CB 3.36Å; I148-R152 PolarHBondContact O-N 2.86Å; I148-Y153 HydrophobicContact CG2-CD2 4.01Å; I148-Y153 HydrophobicContact CG2-CE2 3.7Å; I148-Y153 PolarHBondContact O-N 2.95Å
149	L	93.1	Very high	89.4	Confident	13 Å²	13	74 Å²	74	7%	0.068	42%	0.419	C	S	.	.	H	α-helix	trans	-63.7	-46.8	-177.7	-67.4	171.7	0	0	0	111.7	I123 L125 Y133 T145 V146 Y153 N154 L155	I123-L149 HydrophobicContact CB-CD1 4.45Å; I123-L149 HydrophobicContact CD1-CD1 4.44Å; I123-L149 HydrophobicContact CG1-CD1 4.04Å; I123-L149 HydrophobicContact CG2-CD1 3.85Å; L125-L149 HydrophobicContact CD2-CD2 4Å; Y133-L149 HydrophobicContact CD1-CB 4.33Å; Y133-L149 HydrophobicContact CD1-CD1 4.19Å; Y133-L149 HydrophobicContact CD2-CD1 3.85Å; Y133-L149 HydrophobicContact CE1-CB 4.22Å; Y133-L149 HydrophobicContact CE1-CD1 4.35Å; Y133-L149 HydrophobicContact CE2-CD1 4Å; Y133-L149 HydrophobicContact CG-CD1 3.94Å; T145-L149 HydrophobicContact CG2-CD1 3.79Å; T145-L149 HydrophobicContact CG2-CG 4.25Å; T145-L149 VanDerWaalsContact O-CG 3.29Å; T145-L149 WeakPolarHBondContact O-CG 3.46Å; T145-L149 PolarHBondContact O-N 3.11Å; V146-L149 PolarHBondContact O-N 2.96Å; V146-L149 VanDerWaalsContact O-N 3.13Å; L149-Y153 CarbonylContact O-C 3.57Å; L149-Y153 WeakPolarHBondContact O-CA 3.18Å; L149-Y153 WeakPolarHBondContact O-CB 3.17Å; L149-Y153 PolarHBondContact O-N 3.43Å; L149-N154 PolarHBondContact O-N 2.91Å; L149-L155 HydrophobicContact CD2-CD1 3.87Å; L149-L155 PolarHBondContact O-N 3.13Å; L149-L155 VanDerWaalsContact O-N 3.11Å
150	E	93.8	Very high	88.1	Confident	85 Å²	85	79.6 Å²	79.6	40%	0.397	45%	0.446	S	S	.	.	H	α-helix	trans	-76.4	-46.7	-179.1	-70.8	173	-171	0	0	111.4	Y133 V146 N154 L155	Y133-E150 HydrophobicContact CE1-CG 4.2Å; Y133-E150 PolarHBondContact OH-OE1 2.86Å; V146-E150 HydrophobicContact CG1-CG 4.4Å; V146-E150 WeakPolarHBondContact CG1-OE1 3.47Å; V146-E150 PolarHBondContact O-N 2.92Å; E150-N154 VanDerWaalsContact O-CA 3.31Å; E150-N154 WeakPolarHBondContact O-CA 3.11Å; E150-N154 PolarHBondContact O-N 3.28Å; E150-L155 VanDerWaalsContact CG-O 3.26Å; E150-L155 WeakPolarHBondContact CG-O 3.31Å
151	G	92.5	Very high	86.3	Confident	68 Å²	68	86.7 Å²	86.7	70%	0.701	47%	0.468	S	S	*	.	H	α-helix	trans	-76	-41.1	-174.7	0	0	0	0	0	114.3	A147	A147-G151 WeakPolarHBondContact O-CA 3.32Å; A147-G151 PolarHBondContact O-N 3.02Å
152	R	92.2	Very high	83.9	Confident	198 Å²	198	89.3 Å²	89.3	75%	0.747	48%	0.484	S	S	*	.	H	α-helix	trans	-97	-36.6	-173.8	-169.3	177	179.9	123.4	0.6	113	I148	I148-R152 WeakPolarHBondContact O-CA 3.26Å; I148-R152 WeakPolarHBondContact O-CB 3.36Å; I148-R152 PolarHBondContact O-N 2.86Å
153	Y	89.6	Confident	81.2	Confident	144 Å²	144	92.9 Å²	92.9	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-106.3	-4.2	-175.6	-61.4	-74.4	0	0	0	113.4	I148 L149 L155	I148-Y153 HydrophobicContact CG2-CD2 4.01Å; I148-Y153 HydrophobicContact CG2-CE2 3.7Å; I148-Y153 PolarHBondContact O-N 2.95Å; L149-Y153 CarbonylContact O-C 3.57Å; L149-Y153 WeakPolarHBondContact O-CA 3.18Å; L149-Y153 WeakPolarHBondContact O-CB 3.17Å; L149-Y153 PolarHBondContact O-N 3.43Å; Y153-L155 PolarHBondContact O-N 3.49Å
154	N	91.3	Very high	78.4	Confident	137 Å²	137	93.8 Å²	93.8	73%	0.733	52%	0.518	S	S	*	.			trans	54.4	35.5	177.3	-145.8	53.3	0	0	0	112.8	L149 E150	L149-N154 PolarHBondContact O-N 2.91Å; E150-N154 VanDerWaalsContact O-CA 3.31Å; E150-N154 WeakPolarHBondContact O-CA 3.11Å; E150-N154 PolarHBondContact O-N 3.28Å
155	L	91.5	Very high	75.5	Confident	21 Å²	21	97.3 Å²	97.3	11%	0.11	53%	0.528	C	S	.	.			trans	-90	146.1	176.2	-60.8	174	0	0	0	110.3	L125 S131 Y133 L149 E150 Y153	L125-L155 HydrophobicContact CD2-CD1 4.03Å; S131-L155 CarbonylContact O-C 3.57Å; S131-L155 VanDerWaalsContact O-CA 3.28Å; S131-L155 WeakPolarHBondContact O-CA 3.28Å; Y133-L155 HydrophobicContact CD1-CB 3.91Å; L149-L155 HydrophobicContact CD2-CD1 3.87Å; L149-L155 PolarHBondContact O-N 3.13Å; L149-L155 VanDerWaalsContact O-N 3.11Å; E150-L155 VanDerWaalsContact CG-O 3.26Å; E150-L155 WeakPolarHBondContact CG-O 3.31Å; Y153-L155 PolarHBondContact O-N 3.49Å
156	S	91.3	Very high	72.8	Confident	66 Å²	66	107.2 Å²	107.2	46%	0.462	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.7	146.5	178.3	-11.3	0	0	0	0	111.6	S131 V132 Y133 S158	S131-S156 PolarHBondContact O-N 3.42Å; S131-S156 PolarHBondContact O-OG 3.24Å; V132-S156 CarbonylContact C-O 3.53Å; V132-S156 WeakPolarHBondContact CA-O 3.13Å; V132-S156 WeakPolarHBondContact CB-O 3.4Å; Y133-S156 WeakPolarHBondContact CD1-O 3.28Å; Y133-S156 PolarHBondContact N-O 2.77Å; S156-S158 PolarHBondContact O-N 3.22Å
157	L	90.8	Very high	71.8	Confident	71 Å²	71	111.6 Å²	111.6	37%	0.372	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-64.3	131.9	173.1	-174.4	67.8	0	0	0	110.2	Y133 V135 D159	Y133-L157 HydrophobicContact CD2-CD1 3.96Å; Y133-L157 HydrophobicContact CE1-CB 4.22Å; Y133-L157 HydrophobicContact CE2-CB 4.45Å; Y133-L157 HydrophobicContact CE2-CD1 3.45Å; Y133-L157 VanDerWaalsContact CE2-CD1 3.45Å; Y133-L157 CarbonylContact O-C 3.39Å; V135-L157 HydrophobicContact CG2-CD1 3.56Å; L157-D159 PolarHBondContact O-N 2.87Å
158	S	86.1	Confident	70.7	Confident	23 Å²	23	114.1 Å²	114.1	16%	0.161	61%	0.607	C	S	.	*			trans	-76.5	117.9	175.5	74.1	0	0	0	0	110	Y133 S134 S156 N160	Y133-S158 PolarHBondContact O-N 2.72Å; Y133-S158 PolarHBondContact O-OG 2.86Å; S134-S158 WeakPolarHBondContact CB-OG 3.18Å; S156-S158 PolarHBondContact O-N 3.22Å; S158-N160 VanDerWaalsContact C-N 3.26Å; S158-N160 PolarHBondContact O-N 3.42Å
159	D	68.5	Low	69.4	Low	144 Å²	144	115.3 Å²	115.3	77%	0.77	61%	0.614	S	S	*	*			trans	-71.1	78.6	172.3	-69.3	-34.7	0	0	0	110.8	L157	L157-D159 PolarHBondContact O-N 2.87Å
160	N	57.6	Low	68	Low	127 Å²	127	121.4 Å²	121.4	68%	0.679	65%	0.646	S	S	*	*			trans	-99.3	12.3	169.7	-74.7	-28.3	0	0	0	112.8	S158 S162	S158-N160 VanDerWaalsContact C-N 3.26Å; S158-N160 PolarHBondContact O-N 3.42Å; N160-S162 VanDerWaalsContact C-N 3.34Å; N160-S162 PolarHBondContact O-N 3.34Å
161	F	46.4	Very low	66.4	Low	221 Å²	221	123.6 Å²	123.6	97%	0.969	66%	0.662	S	S	*	*			trans	-92.4	67.8	165.5	-84.3	-83.1	0	0	0	110.4
162	S	35	Very low	64.6	Low	95 Å²	95	127.3 Å²	127.3	66%	0.664	66%	0.659	S	S	*	*			trans	-131.4	106.8	163.5	57.5	0	0	0	0	110.4	N160	N160-S162 VanDerWaalsContact C-N 3.34Å; N160-S162 PolarHBondContact O-N 3.34Å
163	N	32.6	Very low	62.6	Low	139 Å²	139	122.3 Å²	122.3	74%	0.743	65%	0.653	S	S	*	*			trans	65.2	95.1	155.7	-74.9	-16.6	0	0	0	120.1
164	T	31.5	Very low	60.6	Low	145 Å²	145	120.6 Å²	120.6	89%	0.89	66%	0.66	S	S	*	*				-111	71.4	129.6	54.9	0	0	0	0	109
165	N	29.7	Very low	58	Low	134 Å²	134	119.3 Å²	119.3	72%	0.717	65%	0.654	S	S	*	*			trans	-127.4	92.8	156.1	-81	-27.4	0	0	0	105.4
166	N	35.1	Very low	55	Low	245 Å²	245	128.2 Å²	128.2	100%	1.31	70%	0.703	S	S	*	*			trans	-168.3	0	155.1	-91.7	-13.7	0	0	0	108.2

Retrieved 166 of 166 residues in 37 ms (Link to these results)

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