A0A3Q0KRK1_SCHMA Loading...

Single-strand binding protein

AlphaFold DB , UniProt , Accession A0A3Q0KRK1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 171 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	42.5	Very low	42.2	Very low	222 Å²	222	138.6 Å²	138.6	100%	1.094	76%	0.755	S	S	*	*				0	105	0	-85.8	175.4	168	0	0	107.8
2	I	37.3	Very low	42.8	Very low	161 Å²	161	136.5 Å²	136.5	83%	0.826	74%	0.743	S	S	*	*			trans	-98.1	113.5	177.8	-60.3	171.7	0	0	0	106.4	N4	I2-N4 PolarHBondContact O-N 2.81Å
3	W	38.3	Very low	43.5	Very low	215 Å²	215	132.2 Å²	132.2	81%	0.814	72%	0.717	S	S	*	*			trans	-81.1	107	178.7	-81.6	60.1	0	0	0	109.2	N5	W3-N5 PolarHBondContact O-N 3.3Å; W3-N5 VanDerWaalsContact O-N 3.17Å
4	N	41.5	Very low	43.6	Very low	140 Å²	140	127.9 Å²	127.9	75%	0.749	70%	0.702	S	S	*	*			trans	-77.4	94.8	168.5	-76.5	-15.6	0	0	0	108.8	I2 T6	I2-N4 PolarHBondContact O-N 2.81Å; N4-T6 VanDerWaalsContact C-N 3.29Å; N4-T6 PolarHBondContact O-N 3.05Å
5	N	41.1	Very low	43.5	Very low	136 Å²	136	132 Å²	132	73%	0.727	70%	0.703	S	S	*	*			trans	-75.3	86.9	164.2	-88.8	-13.9	0	0	0	108.8	W3 I7	W3-N5 PolarHBondContact O-N 3.3Å; W3-N5 VanDerWaalsContact O-N 3.17Å; N5-I7 VanDerWaalsContact C-N 3.26Å; N5-I7 PolarHBondContact O-N 3.37Å
6	T	40.2	Very low	43.5	Very low	130 Å²	130	130.8 Å²	130.8	80%	0.798	70%	0.696	S	S	*	*			trans	-69.2	91	162.2	-48.3	0	0	0	0	107.3	N4 G8	N4-T6 VanDerWaalsContact C-N 3.29Å; N4-T6 PolarHBondContact O-N 3.05Å; T6-G8 PolarHBondContact O-N 2.93Å
7	I	46.7	Very low	43.5	Very low	142 Å²	142	131.5 Å²	131.5	73%	0.728	69%	0.692	S	S	*	*			trans	-62.3	103.5	169.5	-68.8	165.2	0	0	0	106.3	N5 I9	N5-I7 VanDerWaalsContact C-N 3.26Å; N5-I7 PolarHBondContact O-N 3.37Å; I7-I9 VanDerWaalsContact C-N 3.35Å; I7-I9 PolarHBondContact O-N 3.02Å
8	G	38.8	Very low	43.3	Very low	69 Å²	69	134.3 Å²	134.3	71%	0.711	70%	0.697	S	S	*	*			trans	-63.8	94.3	174.6	0	0	0	0	0	109.4	T6 S10	T6-G8 PolarHBondContact O-N 2.93Å; G8-S10 PolarHBondContact O-N 3.21Å
9	I	42.3	Very low	43.5	Very low	136 Å²	136	134.6 Å²	134.6	70%	0.697	70%	0.698	S	S	*	*			trans	-67.9	104.1	170.1	-60.3	173.5	0	0	0	106.5	I7 I13	I7-I9 VanDerWaalsContact C-N 3.35Å; I7-I9 PolarHBondContact O-N 3.02Å; I9-I13 HydrophobicContact CG2-CD1 3.63Å
10	S	43.9	Very low	43.4	Very low	67 Å²	67	135.5 Å²	135.5	47%	0.469	70%	0.697	S	S	.	*			trans	-51.5	131.5	177.2	171.1	0	0	0	0	110.6	G8 N12 I13	G8-S10 PolarHBondContact O-N 3.21Å; S10-N12 PolarHBondContact O-N 2.96Å; S10-I13 PolarHBondContact O-N 3.16Å
11	P	51.1	Low	43.2	Very low	107 Å²	107	131.6 Å²	131.6	70%	0.695	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-64.4	-4.6	-176.4	23.8	-32.5	0	0	0	114.3	I13 S14	P11-I13 VanDerWaalsContact C-N 3.27Å; P11-I13 PolarHBondContact O-N 3.21Å; P11-S14 PolarHBondContact O-N 3.07Å; P11-S14 PolarHBondContact O-OG 3.06Å
12	N	49.9	Very low	43	Very low	113 Å²	113	130.7 Å²	130.7	60%	0.604	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-69.1	-17.5	178.1	-90	-20.7	0	0	0	114.8	S10 S14 R15	S10-N12 PolarHBondContact O-N 2.96Å; N12-S14 VanDerWaalsContact C-N 3.26Å; N12-S14 PolarHBondContact O-N 3.26Å; N12-R15 PolarHBondContact O-N 2.99Å
13	I	51.5	Low	43.1	Very low	80 Å²	80	130.2 Å²	130.2	41%	0.41	68%	0.678	S	S	.	*	G	3₁₀ helix	trans	-71.9	-24.7	177.6	-40.5	178	0	0	0	111.2	I9 S10 P11 R15 L16 F17	I9-I13 HydrophobicContact CG2-CD1 3.63Å; S10-I13 PolarHBondContact O-N 3.16Å; P11-I13 VanDerWaalsContact C-N 3.27Å; P11-I13 PolarHBondContact O-N 3.21Å; I13-R15 PolarHBondContact O-N 3.37Å; I13-R15 VanDerWaalsContact O-N 3.15Å; I13-L16 PolarHBondContact O-N 2.96Å; I13-L16 VanDerWaalsContact O-N 3.1Å; I13-F17 HydrophobicContact CG2-CD2 4.43Å; I13-F17 HydrophobicContact CG2-CE2 3.78Å; I13-F17 VanDerWaalsContact O-CD2 3.28Å; I13-F17 WeakPolarHBondContact O-CD2 3.43Å
14	S	45.2	Very low	43	Very low	72 Å²	72	124.5 Å²	124.5	50%	0.503	67%	0.671	S	S	.	*	H	α-helix	trans	-62.7	-22.6	177.9	68	0	0	0	0	113.7	P11 N12	P11-S14 PolarHBondContact O-N 3.07Å; P11-S14 PolarHBondContact O-OG 3.06Å; N12-S14 VanDerWaalsContact C-N 3.26Å; N12-S14 PolarHBondContact O-N 3.26Å
15	R	41.7	Very low	42.9	Very low	190 Å²	190	127.4 Å²	127.4	72%	0.717	67%	0.673	S	S	*	*	H	α-helix	trans	-76.8	-26.6	176.5	-70.8	-173.3	177.8	-175.2	0.4	113	N12 I13 K18	N12-R15 PolarHBondContact O-N 2.99Å; I13-R15 PolarHBondContact O-N 3.37Å; I13-R15 VanDerWaalsContact O-N 3.15Å; R15-K18 PolarHBondContact O-N 2.62Å
16	L	44.1	Very low	43	Very low	112 Å²	112	131.5 Å²	131.5	59%	0.586	68%	0.678	S	S	*	*	H	α-helix	trans	-73	-30.7	175.7	-75.6	164.4	0	0	0	111.9	I13 K18 I19	I13-L16 PolarHBondContact O-N 2.96Å; I13-L16 VanDerWaalsContact O-N 3.1Å; L16-K18 VanDerWaalsContact C-N 3.3Å; L16-K18 PolarHBondContact O-N 3.02Å; L16-I19 PolarHBondContact O-N 3.07Å
17	F	43.5	Very low	42.9	Very low	144 Å²	144	132 Å²	132	63%	0.632	67%	0.672	S	S	*	*	H	α-helix	trans	-72.6	-19.1	177.1	-69.2	-72.7	0	0	0	114.2	I13	I13-F17 HydrophobicContact CG2-CD2 4.43Å; I13-F17 HydrophobicContact CG2-CE2 3.78Å; I13-F17 VanDerWaalsContact O-CD2 3.28Å; I13-F17 WeakPolarHBondContact O-CD2 3.43Å
18	K	40.6	Very low	43.1	Very low	181 Å²	181	128.9 Å²	128.9	79%	0.787	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-16.6	176	-73.8	-173.1	178.2	-177.8	0	113.8	R15 L16	R15-K18 PolarHBondContact O-N 2.62Å; L16-K18 VanDerWaalsContact C-N 3.3Å; L16-K18 PolarHBondContact O-N 3.02Å
19	I	45.6	Very low	43.5	Very low	141 Å²	141	132 Å²	132	72%	0.723	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-13.7	178.1	-57.5	173.8	0	0	0	111.5	L16 G21	L16-I19 PolarHBondContact O-N 3.07Å; I19-G21 PolarHBondContact O-N 2.85Å
20	F	41.6	Very low	44	Very low	152 Å²	152	127.9 Å²	127.9	67%	0.667	64%	0.641	S	S	*	*			trans	-74.3	39.5	160.9	-66.7	-79.4	0	0	0	111.4	K22	F20-K22 PolarHBondContact O-N 2.81Å
21	G	40.2	Very low	44.3	Very low	54 Å²	54	132.2 Å²	132.2	56%	0.557	66%	0.658	S	S	*	*			trans	-50.7	115.5	162.1	0	0	0	0	0	106.6	I19 L23	I19-G21 PolarHBondContact O-N 2.85Å; G21-L23 PolarHBondContact O-N 2.8Å
22	K	39	Very low	44.4	Very low	202 Å²	202	132.7 Å²	132.7	88%	0.878	66%	0.664	S	S	*	*			trans	-2.8	90.5	175.4	-68.8	175.8	177.1	178.5	0	110.6	F20 S24	F20-K22 PolarHBondContact O-N 2.81Å; K22-S24 PolarHBondContact O-N 2.95Å
23	L	37.5	Very low	45	Very low	151 Å²	151	129.7 Å²	129.7	79%	0.791	65%	0.651	S	S	*	*			trans	-53.8	102.4	158.2	-85.4	159.8	0	0	0	102.9	G21 Y25	G21-L23 PolarHBondContact O-N 2.8Å; L23-Y25 PolarHBondContact O-N 2.9Å
24	S	36.4	Very low	46.4	Very low	95 Å²	95	132.7 Å²	132.7	66%	0.664	67%	0.674	S	S	*	*			trans	-46.8	115.7	168.6	166.2	0	0	0	0	102.8	K22 R26	K22-S24 PolarHBondContact O-N 2.95Å; S24-R26 PolarHBondContact O-N 2.84Å
25	Y	40.2	Very low	48.3	Very low	202 Å²	202	132 Å²	132	79%	0.792	66%	0.664	S	S	*	*			trans	-52.8	99.6	164.5	-176.8	-96.3	0	0	0	102.4	L23 Q27	L23-Y25 PolarHBondContact O-N 2.9Å; Y25-Q27 HydrophobicContact CD1-CB 4.13Å; Y25-Q27 HydrophobicContact CE1-CB 4.3Å; Y25-Q27 PolarHBondContact O-N 2.95Å
26	R	42.1	Very low	50.5	Low	222 Å²	222	130.3 Å²	130.3	84%	0.838	67%	0.668	S	S	*	*			trans	-63.5	94.3	164.5	-91.9	-169.5	171.4	-169.9	-1.6	100.3	S24 V28	S24-R26 PolarHBondContact O-N 2.84Å; R26-V28 PolarHBondContact O-N 2.9Å
27	Q	39.7	Very low	52.7	Low	140 Å²	140	128.5 Å²	128.5	65%	0.654	66%	0.659	S	S	*	*			trans	-49.9	100.1	157.3	-175.5	172.6	5.8	0	0	101.9	Y25 N29	Y25-Q27 HydrophobicContact CD1-CB 4.13Å; Y25-Q27 HydrophobicContact CE1-CB 4.3Å; Y25-Q27 PolarHBondContact O-N 2.95Å; Q27-N29 VanDerWaalsContact C-N 3.27Å; Q27-N29 PolarHBondContact O-N 2.87Å
28	V	50.2	Low	55.1	Low	76 Å²	76	124.6 Å²	124.6	46%	0.461	64%	0.642	S	S	.	*			trans	-54.2	115.2	163	-172.1	0	0	0	0	100.5	R26 T30 I109	R26-V28 PolarHBondContact O-N 2.9Å; V28-T30 HydrophobicContact CB-CG2 4.21Å; V28-T30 HydrophobicContact CG1-CG2 3.78Å; V28-T30 PolarHBondContact O-N 2.74Å; V28-T30 PolarHBondContact O-OG1 2.73Å; V28-I109 HydrophobicContact CG1-CD1 3.86Å
29	N	47	Very low	57.7	Low	134 Å²	134	117.6 Å²	117.6	72%	0.717	62%	0.615	S	S	*	*			trans	-67.9	58.7	170.2	-77.7	-22.4	0	0	0	106.7	Q27 L31	Q27-N29 VanDerWaalsContact C-N 3.27Å; Q27-N29 PolarHBondContact O-N 2.87Å; N29-L31 PolarHBondContact O-N 2.67Å
30	T	52.7	Low	60	Low	50 Å²	50	114.7 Å²	114.7	31%	0.307	60%	0.603	S	S	.	*			trans	-61.4	97.7	150.1	50.8	0	0	0	0	102.2	V28 S32 I109	V28-T30 HydrophobicContact CB-CG2 4.21Å; V28-T30 HydrophobicContact CG1-CG2 3.78Å; V28-T30 PolarHBondContact O-N 2.74Å; V28-T30 PolarHBondContact O-OG1 2.73Å; T30-S32 PolarHBondContact O-N 2.91Å; T30-I109 HydrophobicContact CG2-CD1 4.24Å; T30-I109 HydrophobicContact CG2-CG2 4.33Å
31	L	50.1	Low	62.5	Low	159 Å²	159	108.5 Å²	108.5	83%	0.832	58%	0.577	S	S	*	*			trans	-36.5	118.2	164.1	-77.3	101.4	0	0	0	106.4	N29 S33	N29-L31 PolarHBondContact O-N 2.67Å; L31-S33 WeakPolarHBondContact O-CA 3.48Å; L31-S33 PolarHBondContact O-N 2.68Å
32	S	53.3	Low	65.1	Low	117 Å²	117	111.3 Å²	111.3	82%	0.818	57%	0.574	S	S	*	*			trans	-28.4	81.7	-178.7	-172.9	0	0	0	0	112.2	T30 T34	T30-S32 PolarHBondContact O-N 2.91Å; S32-T34 PolarHBondContact O-N 2.96Å; S32-T34 VanDerWaalsContact O-N 3.14Å
33	S	63.3	Low	67.8	Low	49 Å²	49	102 Å²	102	34%	0.343	54%	0.536	S	S	.	.			trans	-79.3	112.6	-173.1	-177.7	0	0	0	0	104.8	L31 D35 Q38	L31-S33 WeakPolarHBondContact O-CA 3.48Å; L31-S33 PolarHBondContact O-N 2.68Å; S33-D35 PolarHBondContact O-N 3.33Å; S33-D35 WeakPolarHBondContact OG-CB 3.45Å; S33-D35 PolarHBondContact OG-N 2.71Å; S33-Q38 VanDerWaalsContact CB-CD 3.42Å
34	T	80	Confident	70.6	Confident	143 Å²	143	99 Å²	99	88%	0.877	51%	0.514	S	S	*	.			trans	-69.4	-5.9	170.5	54	0	0	0	0	111.6	S32 I36	S32-T34 PolarHBondContact O-N 2.96Å; S32-T34 VanDerWaalsContact O-N 3.14Å; T34-I36 PolarHBondContact O-N 2.61Å
35	D	84.8	Confident	73.4	Confident	57 Å²	57	94.6 Å²	94.6	31%	0.305	48%	0.483	S	S	.	.			trans	-75.1	112.8	178.7	-167.4	-11.5	0	0	0	110.9	S33 N37 Q38 R111	S33-D35 PolarHBondContact O-N 3.33Å; S33-D35 WeakPolarHBondContact OG-CB 3.45Å; S33-D35 PolarHBondContact OG-N 2.71Å; D35-N37 PolarHBondContact O-N 3.02Å; D35-N37 WeakPolarHBondContact OD1-CB 3.46Å; D35-N37 PolarHBondContact OD1-N 3.29Å; D35-N37 PolarHBondContact OD1-ND2 2.96Å; D35-Q38 WeakPolarHBondContact O-CB 3.34Å; D35-Q38 PolarHBondContact O-N 3.07Å; D35-Q38 VanDerWaalsContact O-N 3.16Å; D35-R111 VanDerWaalsContact OD2-CD 3.26Å; D35-R111 WeakPolarHBondContact OD2-CD 3.38Å
36	I	88.4	Confident	76.1	Confident	156 Å²	156	86.8 Å²	86.8	80%	0.8	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.9	176.5	-166.4	168	0	0	0	112.9	T34 Q38	T34-I36 PolarHBondContact O-N 2.61Å; I36-Q38 VanDerWaalsContact C-N 3.33Å
37	N	91.5	Very high	78.6	Confident	74 Å²	74	79.4 Å²	79.4	40%	0.396	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-0.1	-179.3	-60.3	-51.3	0	0	0	113	D35 V39 R111 L112	D35-N37 PolarHBondContact O-N 3.02Å; D35-N37 WeakPolarHBondContact OD1-CB 3.46Å; D35-N37 PolarHBondContact OD1-N 3.29Å; D35-N37 PolarHBondContact OD1-ND2 2.96Å; N37-V39 PolarHBondContact O-N 2.72Å; N37-R111 CarbonylContact O-C 3.57Å; N37-R111 VanDerWaalsContact O-CA 3.31Å; N37-R111 WeakPolarHBondContact O-CA 3.13Å; N37-L112 HydrophobicContact CB-CB 4.5Å; N37-L112 PolarHBondContact O-N 3.48Å
38	Q	93.4	Very high	81.2	Confident	61 Å²	61	75 Å²	75	29%	0.285	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	130.2	177.4	-175.2	173.1	69.8	0	0	110.9	S33 D35 I36 I109 G110	S33-Q38 VanDerWaalsContact CB-CD 3.42Å; D35-Q38 WeakPolarHBondContact O-CB 3.34Å; D35-Q38 PolarHBondContact O-N 3.07Å; D35-Q38 VanDerWaalsContact O-N 3.16Å; I36-Q38 VanDerWaalsContact C-N 3.33Å; Q38-I109 HydrophobicContact CG-CG2 4.5Å; Q38-G110 CarbonylContact C-O 3.57Å; Q38-G110 WeakPolarHBondContact CA-O 3.4Å
39	V	93.6	Very high	83.3	Confident	35 Å²	35	77 Å²	77	21%	0.212	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	148.2	178.4	-64.4	0	0	0	0	111	N37 L41 I109 G110 L112 V126	N37-V39 PolarHBondContact O-N 2.72Å; V39-L41 HydrophobicContact CG2-CG 4.47Å; V39-I109 WeakPolarHBondContact O-CA 3.47Å; V39-G110 PolarHBondContact N-O 2.9Å; V39-G110 PolarHBondContact O-N 2.89Å; V39-L112 HydrophobicContact CG1-CB 4.21Å; V39-V126 HydrophobicContact CG2-CG1 3.72Å; V39-V126 HydrophobicContact CG2-CG2 4.05Å
40	V	94.1	Very high	85.5	Confident	79 Å²	79	75 Å²	75	48%	0.479	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	114.7	168.6	-176.2	0	0	0	0	107.7	V108 I109	V40-V108 CarbonylContact C-O 3.54Å; V40-V108 WeakPolarHBondContact CA-O 3.31Å; V40-I109 HydrophobicContact CG1-CG1 4.28Å; V40-I109 HydrophobicContact CG2-CG1 4.18Å; V40-I109 HydrophobicContact CG2-CG2 4.35Å
41	L	94.9	Very high	87.3	Confident	23 Å²	23	73 Å²	73	12%	0.12	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.9	179.9	-59.2	-178.7	0	0	0	110.1	V39 L65 T67 H84 V86 C107 V108 V126	V39-L41 HydrophobicContact CG2-CG 4.47Å; L41-L65 HydrophobicContact CB-CD2 3.66Å; L41-L65 HydrophobicContact CD1-CD2 4.14Å; L41-T67 HydrophobicContact CB-CG2 4.33Å; L41-T67 HydrophobicContact CD2-CG2 4.45Å; L41-H84 HydrophobicContact CD1-CB 3.95Å; L41-V86 HydrophobicContact CD1-CG2 4.44Å; L41-C107 CarbonylContact O-C 3.48Å; L41-C107 WeakPolarHBondContact O-CA 3.34Å; L41-V108 HydrophobicContact CB-CB 4.38Å; L41-V108 PolarHBondContact N-O 2.98Å; L41-V108 PolarHBondContact O-N 3.33Å; L41-V126 HydrophobicContact CD1-CB 4.49Å; L41-V126 HydrophobicContact CD1-CG2 3.85Å
42	F	95	Very high	89.1	Confident	113 Å²	113	72.2 Å²	72.2	50%	0.496	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.5	170.8	-176.3	-81.9	0	0	0	108.4	T67 C107 L134	F42-T67 WeakPolarHBondContact O-CG2 3.44Å; F42-C107 HydrophobicContact CD2-CB 4.48Å; F42-L134 HydrophobicContact CD2-CD1 3.59Å; F42-L134 HydrophobicContact CE2-CD1 2.99Å; F42-L134 HydrophobicContact CE2-CG 4.33Å; F42-L134 HydrophobicContact CZ-CD1 3.58Å
43	G	95.2	Very high	90.3	Very high	6 Å²	6	68.8 Å²	68.8	6%	0.062	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	-174.2	-172.8	0	0	0	0	0	114.2	V66 R105 L106	G43-V66 CarbonylContact C-O 3.56Å; G43-V66 WeakPolarHBondContact CA-O 3.18Å; G43-R105 WeakPolarHBondContact O-CA 3.28Å; G43-L106 PolarHBondContact N-O 3.48Å; G43-L106 PolarHBondContact O-N 3.21Å
44	R	95.7	Very high	91	Very high	88 Å²	88	76.6 Å²	76.6	33%	0.332	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	139.9	171.5	-66.3	-177.3	-176.3	164.4	0.3	109.7	S46 V66 D104 R105 D144	R44-S46 PolarHBondContact O-N 3.18Å; R44-V66 PolarHBondContact N-O 2.83Å; R44-V66 PolarHBondContact O-N 2.88Å; R44-D104 CarbonylContact C-O 3.58Å; R44-D104 VanDerWaalsContact CA-O 3.29Å; R44-D104 WeakPolarHBondContact CA-O 3.44Å; R44-R105 HydrophobicContact CG-CG 4.46Å; R44-D144 IonicContact NH1-OD2 2.96Å; R44-D144 PolarHBondContact NH1-OD2 2.81Å
45	V	96.1	Very high	90.8	Very high	3 Å²	3	76 Å²	76	2%	0.018	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	122.6	173	176.4	0	0	0	0	109	L48 I63 G64 L100 K102 G103 D104 L106	V45-L48 HydrophobicContact CG1-CD1 4.05Å; V45-L48 HydrophobicContact CG1-CD2 4.16Å; V45-L48 HydrophobicContact CG1-CG 3.73Å; V45-I63 HydrophobicContact CG1-CG2 4.23Å; V45-I63 HydrophobicContact CG2-CG2 4.17Å; V45-G64 CarbonylContact C-O 3.57Å; V45-L100 HydrophobicContact CG2-CB 4.49Å; V45-L100 HydrophobicContact CG2-CD1 4.09Å; V45-K102 CarbonylContact O-C 3.46Å; V45-K102 WeakPolarHBondContact O-CA 3.3Å; V45-G103 PolarHBondContact O-N 3.16Å; V45-D104 PolarHBondContact N-O 2.9Å; V45-L106 HydrophobicContact CG2-CB 4.22Å; V45-L106 HydrophobicContact CG2-CD2 4.21Å
46	S	96.2	Very high	90.4	Very high	38 Å²	38	75.5 Å²	75.5	27%	0.266	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-36.4	169.7	57.9	0	0	0	0	112.4	R44 G64	R44-S46 PolarHBondContact O-N 3.18Å; S46-G64 PolarHBondContact N-O 2.85Å; S46-G64 WeakPolarHBondContact OG-CA 3Å; S46-G64 PolarHBondContact OG-O 3.5Å
47	S	95.2	Very high	89.9	Confident	67 Å²	67	76.8 Å²	76.8	47%	0.469	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	153	-176.7	54	0	0	0	0	111	I63 G64	S47-I63 WeakPolarHBondContact O-CA 3.45Å; S47-G64 PolarHBondContact O-N 2.83Å; S47-G64 WeakPolarHBondContact OG-CA 3.05Å; S47-G64 PolarHBondContact OG-N 2.86Å
48	L	94.8	Very high	89.4	Confident	47 Å²	47	78.2 Å²	78.2	25%	0.246	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	128.7	172.5	-70.3	165.2	0	0	0	108.5	V45 V61 S62 I63 L100	V45-L48 HydrophobicContact CG1-CD1 4.05Å; V45-L48 HydrophobicContact CG1-CD2 4.16Å; V45-L48 HydrophobicContact CG1-CG 3.73Å; L48-V61 HydrophobicContact CD2-CG1 3.93Å; L48-S62 CarbonylContact C-O 3.6Å; L48-S62 WeakPolarHBondContact CA-O 3.49Å; L48-I63 HydrophobicContact CD2-CB 4.06Å; L48-I63 HydrophobicContact CD2-CD1 4.36Å; L48-I63 HydrophobicContact CD2-CG1 3.7Å; L48-I63 HydrophobicContact CD2-CG2 3.79Å; L48-L100 HydrophobicContact CD1-CB 3.68Å; L48-L100 WeakPolarHBondContact CD1-O 3.06Å
49	H	94.4	Very high	89.1	Confident	117 Å²	117	77.8 Å²	77.8	54%	0.542	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	124	176.7	-178.1	68	0	0	0	109.7	V61 S62	H49-V61 CarbonylContact O-C 3.54Å; H49-V61 WeakPolarHBondContact O-CA 3.38Å; H49-S62 PolarHBondContact N-O 2.82Å; H49-S62 PolarHBondContact O-N 2.8Å
50	F	92.5	Very high	89.1	Confident	94 Å²	94	79.2 Å²	79.2	41%	0.412	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	120.2	175.8	-61.4	-96.8	0	0	0	108.2	V59 V61 K98	F50-V59 HydrophobicContact CB-CG1 4.34Å; F50-V59 HydrophobicContact CD1-CG1 4.21Å; F50-V61 HydrophobicContact CD1-CG2 3.48Å; F50-V61 VanDerWaalsContact CD1-CG2 3.48Å; F50-V61 HydrophobicContact CE1-CG2 3.51Å; F50-V61 HydrophobicContact CG-CG2 4.34Å; F50-V61 HydrophobicContact CZ-CG2 4.41Å; F50-K98 HydrophobicContact CE1-CB 3.86Å; F50-K98 HydrophobicContact CZ-CB 3.93Å
51	G	90	Very high	89.1	Confident	6 Å²	6	75.5 Å²	75.5	6%	0.062	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	154.5	174.5	0	0	0	0	0	110.8	V59 Y60	G51-V59 CarbonylContact O-C 3.56Å; G51-V59 WeakPolarHBondContact O-CA 3.38Å; G51-Y60 PolarHBondContact N-O 2.82Å; G51-Y60 WeakPolarHBondContact O-CD1 3.39Å; G51-Y60 PolarHBondContact O-N 2.99Å
52	E	87.9	Confident	89.1	Confident	144 Å²	144	75.4 Å²	75.4	67%	0.673	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	139.9	170.7	-66.7	-179.4	-173.5	0	0	109.7
53	S	79.3	Confident	89.2	Confident	45 Å²	45	70 Å²	70	32%	0.315	36%	0.361	S	S	.	.			trans	-62.1	156.3	169.6	-177.5	0	0	0	0	110.3	N55 G56 N58	S53-N55 PolarHBondContact O-N 2.97Å; S53-G56 WeakPolarHBondContact O-CA 3.34Å; S53-G56 PolarHBondContact O-N 2.78Å; S53-N58 VanDerWaalsContact CB-O 3.28Å; S53-N58 WeakPolarHBondContact CB-O 3.32Å; S53-N58 PolarHBondContact N-O 3.43Å
54	K	78.2	Confident	89.2	Confident	212 Å²	212	70.2 Å²	70.2	92%	0.922	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-27.3	177.1	-68.3	-173.5	177.9	-177.2	0	113.8	G56	K54-G56 VanDerWaalsContact C-N 3.31Å
55	N	76.7	Confident	89.3	Confident	130 Å²	130	66.1 Å²	66.1	70%	0.695	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-0.1	179.8	-62.3	-2.9	0	0	0	113.3	S53 K57	S53-N55 PolarHBondContact O-N 2.97Å; N55-K57 PolarHBondContact O-N 3.14Å
56	G	76	Confident	89.3	Confident	48 Å²	48	67.5 Å²	67.5	50%	0.495	36%	0.356	S	S	.	.	S	Bend	trans	65.7	-4.9	-177.6	0	0	0	0	0	115.6	S53 K54	S53-G56 WeakPolarHBondContact O-CA 3.34Å; S53-G56 PolarHBondContact O-N 2.78Å; K54-G56 VanDerWaalsContact C-N 3.31Å
57	K	77.5	Confident	89.2	Confident	183 Å²	183	66.2 Å²	66.2	80%	0.796	35%	0.347	S	S	*	.	S	Bend	trans	-89.9	-30	-172	-71.4	-179.1	-178.4	-176.4	0	114.4	N55	N55-K57 PolarHBondContact O-N 3.14Å
58	N	80.3	Confident	89.1	Confident	104 Å²	104	69.8 Å²	69.8	56%	0.556	35%	0.354	S	S	*	.			trans	-116.2	127.8	-173.3	-62.5	-19.7	0	0	0	109.3	S53	S53-N58 VanDerWaalsContact CB-O 3.28Å; S53-N58 WeakPolarHBondContact CB-O 3.32Å; S53-N58 PolarHBondContact N-O 3.43Å
59	V	88.6	Confident	88.8	Confident	52 Å²	52	71 Å²	71	32%	0.315	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	134.2	171.1	-178.6	0	0	0	0	107.8	F50 G51	F50-V59 HydrophobicContact CB-CG1 4.34Å; F50-V59 HydrophobicContact CD1-CG1 4.21Å; G51-V59 CarbonylContact O-C 3.56Å; G51-V59 WeakPolarHBondContact O-CA 3.38Å
60	Y	92	Very high	88.4	Confident	65 Å²	65	69.8 Å²	69.8	26%	0.255	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	156.2	168.6	73.6	-87.3	0	0	0	109.5	G51 Y87 V88 F89	G51-Y60 PolarHBondContact N-O 2.82Å; G51-Y60 WeakPolarHBondContact O-CD1 3.39Å; G51-Y60 PolarHBondContact O-N 2.99Å; Y60-Y87 HydrophobicContact CD2-CD1 4.16Å; Y60-Y87 HydrophobicContact CE2-CD1 4.14Å; Y60-Y87 HydrophobicContact CE2-CE1 4.22Å; Y60-V88 WeakPolarHBondContact CA-O 3.5Å; Y60-V88 WeakPolarHBondContact CB-O 3.35Å; Y60-F89 HydrophobicContact CD2-CE1 4.34Å; Y60-F89 HydrophobicContact CG-CD1 4.31Å; Y60-F89 HydrophobicContact CG-CE1 4.1Å
61	V	94.5	Very high	88.2	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129	176.8	-178.8	0	0	0	0	109.3	L48 H49 F50 I63 Y87 V88 V94 I97	L48-V61 HydrophobicContact CD2-CG1 3.93Å; H49-V61 CarbonylContact O-C 3.54Å; H49-V61 WeakPolarHBondContact O-CA 3.38Å; F50-V61 HydrophobicContact CD1-CG2 3.48Å; F50-V61 VanDerWaalsContact CD1-CG2 3.48Å; F50-V61 HydrophobicContact CE1-CG2 3.51Å; F50-V61 HydrophobicContact CG-CG2 4.34Å; F50-V61 HydrophobicContact CZ-CG2 4.41Å; V61-I63 HydrophobicContact CG1-CG1 3.94Å; V61-Y87 CarbonylContact O-C 3.6Å; V61-Y87 WeakPolarHBondContact O-CA 3.28Å; V61-V88 HydrophobicContact CB-CB 4.4Å; V61-V88 PolarHBondContact N-O 2.9Å; V61-V88 PolarHBondContact O-N 2.85Å; V61-V94 HydrophobicContact CG2-CB 4.23Å; V61-V94 HydrophobicContact CG2-CG1 3.67Å; V61-V94 HydrophobicContact CG2-CG2 3.93Å; V61-I97 HydrophobicContact CB-CD1 3.94Å; V61-I97 HydrophobicContact CG1-CD1 3.82Å; V61-I97 HydrophobicContact CG2-CD1 4.31Å
62	S	94.8	Very high	88.2	Confident	21 Å²	21	76.1 Å²	76.1	15%	0.147	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	124.4	164.6	-177	0	0	0	0	109	L48 H49 V86	L48-S62 CarbonylContact C-O 3.6Å; L48-S62 WeakPolarHBondContact CA-O 3.49Å; H49-S62 PolarHBondContact N-O 2.82Å; H49-S62 PolarHBondContact O-N 2.8Å; S62-V86 CarbonylContact C-O 3.52Å; S62-V86 WeakPolarHBondContact CA-O 3.33Å
63	I	96.5	Very high	88.3	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.4	179.8	-42.8	177.9	0	0	0	107.6	V45 S47 L48 V61 L65 V86 V88 I97 L106	V45-I63 HydrophobicContact CG1-CG2 4.23Å; V45-I63 HydrophobicContact CG2-CG2 4.17Å; S47-I63 WeakPolarHBondContact O-CA 3.45Å; L48-I63 HydrophobicContact CD2-CB 4.06Å; L48-I63 HydrophobicContact CD2-CD1 4.36Å; L48-I63 HydrophobicContact CD2-CG1 3.7Å; L48-I63 HydrophobicContact CD2-CG2 3.79Å; V61-I63 HydrophobicContact CG1-CG1 3.94Å; I63-L65 PolarHBondContact O-N 2.97Å; I63-V86 HydrophobicContact CB-CB 4.18Å; I63-V86 PolarHBondContact N-O 2.82Å; I63-V86 PolarHBondContact O-N 2.86Å; I63-V88 HydrophobicContact CD1-CG2 3.77Å; I63-V88 HydrophobicContact CG1-CG2 4.27Å; I63-I97 HydrophobicContact CD1-CD1 3.56Å; I63-I97 HydrophobicContact CG1-CD1 4.14Å; I63-L106 HydrophobicContact CD1-CD2 3.61Å; I63-L106 HydrophobicContact CG2-CD2 4.18Å
64	G	96.7	Very high	89	Confident	11 Å²	11	76.4 Å²	76.4	11%	0.113	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	116.6	159	0	0	0	0	0	108.4	V45 S46 S47	V45-G64 CarbonylContact C-O 3.57Å; S46-G64 PolarHBondContact N-O 2.85Å; S46-G64 WeakPolarHBondContact OG-CA 3Å; S46-G64 PolarHBondContact OG-O 3.5Å; S47-G64 PolarHBondContact O-N 2.83Å; S47-G64 WeakPolarHBondContact OG-CA 3.05Å; S47-G64 PolarHBondContact OG-N 2.86Å
65	L	96.9	Very high	89.6	Confident	1 Å²	1	73.7 Å²	73.7	1%	0.005	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	124.1	179.7	-172.2	71.5	0	0	0	109.8	L41 I63 T67 H84 V86 L106 V108	L41-L65 HydrophobicContact CB-CD2 3.66Å; L41-L65 HydrophobicContact CD1-CD2 4.14Å; I63-L65 PolarHBondContact O-N 2.97Å; L65-T67 HydrophobicContact CD2-CG2 4.48Å; L65-H84 HydrophobicContact CB-CB 4.46Å; L65-H84 PolarHBondContact N-O 2.96Å; L65-H84 PolarHBondContact O-N 3.43Å; L65-V86 HydrophobicContact CB-CG2 3.92Å; L65-V86 HydrophobicContact CD2-CG2 4.19Å; L65-L106 HydrophobicContact CD1-CB 3.89Å; L65-L106 HydrophobicContact CD1-CD2 4.28Å; L65-V108 HydrophobicContact CD2-CG2 4.03Å
66	V	96.4	Very high	90.3	Very high	33 Å²	33	69 Å²	69	20%	0.2	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	118.9	177.7	-176.1	0	0	0	0	109.1	G43 R44 V81 A82 F83	G43-V66 CarbonylContact C-O 3.56Å; G43-V66 WeakPolarHBondContact CA-O 3.18Å; R44-V66 PolarHBondContact N-O 2.83Å; R44-V66 PolarHBondContact O-N 2.88Å; V66-V81 HydrophobicContact CG1-CB 4.1Å; V66-V81 HydrophobicContact CG1-CG1 4.29Å; V66-A82 WeakPolarHBondContact CA-O 3.38Å; V66-F83 HydrophobicContact CG1-CE1 4.44Å; V66-F83 HydrophobicContact CG2-CD1 3.58Å; V66-F83 HydrophobicContact CG2-CE1 3.48Å; V66-F83 VanDerWaalsContact CG2-CE1 3.48Å; V66-F83 HydrophobicContact CG2-CZ 4.44Å
67	T	94.8	Very high	91	Very high	10 Å²	10	75.7 Å²	75.7	6%	0.061	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	147.1	173.3	66.2	0	0	0	0	110.1	L41 F42 L65 V81 A82 H84	L41-T67 HydrophobicContact CB-CG2 4.33Å; L41-T67 HydrophobicContact CD2-CG2 4.45Å; F42-T67 WeakPolarHBondContact O-CG2 3.44Å; L65-T67 HydrophobicContact CD2-CG2 4.48Å; T67-V81 WeakPolarHBondContact O-CA 3.36Å; T67-A82 PolarHBondContact N-O 3.18Å; T67-A82 PolarHBondContact O-N 2.7Å; T67-H84 PolarHBondContact OG1-NE2 3.01Å
68	K	92.1	Very high	91.5	Very high	143 Å²	143	70.9 Å²	70.9	62%	0.622	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	120.6	172.7	-172.6	169.8	-175.1	165.5	0	108.4	S79	K68-S79 WeakPolarHBondContact CE-OG 3.47Å; K68-S79 WeakPolarHBondContact CG-OG 3.31Å
69	N	87.7	Confident	91.9	Very high	73 Å²	73	67.5 Å²	67.5	39%	0.39	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	139.4	173.3	-64.1	-6.6	0	0	0	108.1	S79 T80	N69-S79 CarbonylContact O-C 3.54Å; N69-S79 WeakPolarHBondContact O-CA 3.44Å; N69-S79 PolarHBondContact O-OG 2.86Å; N69-T80 PolarHBondContact N-O 2.94Å; N69-T80 PolarHBondContact O-N 2.85Å
70	S	87.7	Confident	92	Very high	91 Å²	91	67.4 Å²	67.4	64%	0.636	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	123.2	173.2	-61.2	0	0	0	0	108.1	L78	S70-L78 WeakPolarHBondContact CA-O 3.29Å
71	L	86.9	Confident	92	Very high	69 Å²	69	68.7 Å²	68.7	36%	0.361	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.5	-177.6	66.7	96.1	0	0	0	109.5	T73 Y77 L78 T80	L71-T73 HydrophobicContact CD1-CG2 3.31Å; L71-Y77 WeakPolarHBondContact O-CA 3.4Å; L71-L78 HydrophobicContact CD1-CB 3.87Å; L71-L78 HydrophobicContact CD1-CD2 4.17Å; L71-L78 HydrophobicContact CD2-CD2 4.25Å; L71-L78 HydrophobicContact CG-CB 3.97Å; L71-L78 HydrophobicContact CG-CD2 4.42Å; L71-L78 HydrophobicContact CG-CG 4.46Å; L71-L78 PolarHBondContact N-O 3.43Å; L71-L78 PolarHBondContact O-N 2.81Å; L71-T80 HydrophobicContact CD2-CG2 4.05Å
72	K	90.6	Very high	91.9	Very high	163 Å²	163	69.6 Å²	69.6	71%	0.709	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	120	177.6	-174.1	179.4	178.4	-176.9	0	108.8	Y77	K72-Y77 HydrophobicContact CB-CD1 4.18Å; K72-Y77 HydrophobicContact CB-CE1 3.96Å; K72-Y77 HydrophobicContact CD-CE1 4.39Å; K72-Y77 HydrophobicContact CG-CE1 4.14Å
73	T	89.8	Confident	91.9	Very high	55 Å²	55	75.7 Å²	75.7	34%	0.337	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	176.4	172.3	69.3	0	0	0	0	110.4	L71 N75 G76 L78	L71-T73 HydrophobicContact CD1-CG2 3.31Å; T73-N75 PolarHBondContact O-N 2.88Å; T73-N75 PolarHBondContact OG1-N 3Å; T73-G76 PolarHBondContact N-O 3.24Å; T73-G76 PolarHBondContact O-N 2.88Å; T73-G76 PolarHBondContact OG1-N 3.31Å; T73-G76 PolarHBondContact OG1-O 3.14Å; T73-L78 HydrophobicContact CG2-CB 4.18Å
74	T	93.4	Very high	91.9	Very high	141 Å²	141	78 Å²	78	87%	0.865	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.9	170	52.9	0	0	0	0	112.6
75	N	91.5	Very high	91.8	Very high	155 Å²	155	79.7 Å²	79.7	83%	0.829	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	2.1	-174.9	-62.7	-9.5	0	0	0	113.2	T73	T73-N75 PolarHBondContact O-N 2.88Å; T73-N75 PolarHBondContact OG1-N 3Å
76	G	91.5	Very high	91.8	Very high	31 Å²	31	79.6 Å²	79.6	32%	0.32	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	134.5	-147.1	178.2	0	0	0	0	0	113.3	T73	T73-G76 PolarHBondContact N-O 3.24Å; T73-G76 PolarHBondContact O-N 2.88Å; T73-G76 PolarHBondContact OG1-N 3.31Å; T73-G76 PolarHBondContact OG1-O 3.14Å
77	Y	90.3	Very high	91.7	Very high	189 Å²	189	80.2 Å²	80.2	74%	0.741	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	124.9	174.1	-69.5	-81.7	0	0	0	109.6	L71 K72	L71-Y77 WeakPolarHBondContact O-CA 3.4Å; K72-Y77 HydrophobicContact CB-CD1 4.18Å; K72-Y77 HydrophobicContact CB-CE1 3.96Å; K72-Y77 HydrophobicContact CD-CE1 4.39Å; K72-Y77 HydrophobicContact CG-CE1 4.14Å
78	L	88.5	Confident	91.8	Very high	82 Å²	82	79.8 Å²	79.8	43%	0.429	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	146.2	168.1	179.6	65.4	0	0	0	108.4	S70 L71 T73 T80	S70-L78 WeakPolarHBondContact CA-O 3.29Å; L71-L78 HydrophobicContact CD1-CB 3.87Å; L71-L78 HydrophobicContact CD1-CD2 4.17Å; L71-L78 HydrophobicContact CD2-CD2 4.25Å; L71-L78 HydrophobicContact CG-CB 3.97Å; L71-L78 HydrophobicContact CG-CD2 4.42Å; L71-L78 HydrophobicContact CG-CG 4.46Å; L71-L78 PolarHBondContact N-O 3.43Å; L71-L78 PolarHBondContact O-N 2.81Å; T73-L78 HydrophobicContact CG2-CB 4.18Å; L78-T80 HydrophobicContact CD2-CG2 4.17Å; L78-T80 HydrophobicContact CG-CG2 4.27Å
79	S	87.9	Confident	91.8	Very high	32 Å²	32	78.5 Å²	78.5	22%	0.224	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.2	169.7	-156.3	0	0	0	0	110.3	K68 N69 M147	K68-S79 WeakPolarHBondContact CE-OG 3.47Å; K68-S79 WeakPolarHBondContact CG-OG 3.31Å; N69-S79 CarbonylContact O-C 3.54Å; N69-S79 WeakPolarHBondContact O-CA 3.44Å; N69-S79 PolarHBondContact O-OG 2.86Å; S79-M147 WeakPolarHBondContact O-CE 3.48Å
80	T	91.9	Very high	91.9	Very high	50 Å²	50	79.9 Å²	79.9	31%	0.307	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	164.6	174.4	61	0	0	0	0	109.2	N69 L71 L78	N69-T80 PolarHBondContact N-O 2.94Å; N69-T80 PolarHBondContact O-N 2.85Å; L71-T80 HydrophobicContact CD2-CG2 4.05Å; L78-T80 HydrophobicContact CD2-CG2 4.17Å; L78-T80 HydrophobicContact CG-CG2 4.27Å
81	V	92.6	Very high	92.1	Very high	92 Å²	92	79.5 Å²	79.5	56%	0.558	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	145.1	173.3	-67.1	0	0	0	0	109.4	V66 T67 F83	V66-V81 HydrophobicContact CG1-CB 4.1Å; V66-V81 HydrophobicContact CG1-CG1 4.29Å; T67-V81 WeakPolarHBondContact O-CA 3.36Å; V81-F83 HydrophobicContact CG2-CE2 3.93Å; V81-F83 HydrophobicContact CG2-CZ 4.39Å
82	A	92.5	Very high	92.3	Very high	20 Å²	20	78.6 Å²	78.6	17%	0.165	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	134.8	172.1	0	0	0	0	0	109.4	V66 T67 H84	V66-A82 WeakPolarHBondContact CA-O 3.38Å; T67-A82 PolarHBondContact N-O 3.18Å; T67-A82 PolarHBondContact O-N 2.7Å; A82-H84 PolarHBondContact O-CD2 2.78Å
83	F	94.7	Very high	92.5	Very high	148 Å²	148	71.9 Å²	71.9	65%	0.649	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.9	178.8	-66.2	-90.5	0	0	0	109.3	V66 V81	V66-F83 HydrophobicContact CG1-CE1 4.44Å; V66-F83 HydrophobicContact CG2-CD1 3.58Å; V66-F83 HydrophobicContact CG2-CE1 3.48Å; V66-F83 VanDerWaalsContact CG2-CE1 3.48Å; V66-F83 HydrophobicContact CG2-CZ 4.44Å; V81-F83 HydrophobicContact CG2-CE2 3.93Å; V81-F83 HydrophobicContact CG2-CZ 4.39Å
84	H	95.1	Very high	92.6	Very high	48 Å²	48	69.4 Å²	69.4	22%	0.222	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	133.4	179.5	-53.3	-87.8	0	0	0	109.2	L41 L65 T67 A82 V86	L41-H84 HydrophobicContact CD1-CB 3.95Å; L65-H84 HydrophobicContact CB-CB 4.46Å; L65-H84 PolarHBondContact N-O 2.96Å; L65-H84 PolarHBondContact O-N 3.43Å; T67-H84 PolarHBondContact OG1-NE2 3.01Å; A82-H84 PolarHBondContact O-CD2 2.78Å; H84-V86 HydrophobicContact CB-CG2 4.41Å
85	T	95.7	Very high	92.4	Very high	47 Å²	47	66 Å²	66	29%	0.288	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	116.5	168.4	-58.1	0	0	0	0	108.2	Y87 S125 V126	T85-Y87 HydrophobicContact CG2-CD2 4.47Å; T85-Y87 HydrophobicContact CG2-CE1 4.4Å; T85-Y87 HydrophobicContact CG2-CE2 3.81Å; T85-S125 CarbonylContact O-C 3.52Å; T85-S125 VanDerWaalsContact O-CA 3.3Å; T85-S125 WeakPolarHBondContact O-CA 3.48Å; T85-S125 WeakPolarHBondContact O-CB 3.41Å; T85-V126 PolarHBondContact O-N 3.35Å
86	V	96.6	Very high	92.3	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123	-177.8	-175.7	0	0	0	0	109.8	L41 S62 I63 L65 H84 V108 V126 A128	L41-V86 HydrophobicContact CD1-CG2 4.44Å; S62-V86 CarbonylContact C-O 3.52Å; S62-V86 WeakPolarHBondContact CA-O 3.33Å; I63-V86 HydrophobicContact CB-CB 4.18Å; I63-V86 PolarHBondContact N-O 2.82Å; I63-V86 PolarHBondContact O-N 2.86Å; L65-V86 HydrophobicContact CB-CG2 3.92Å; L65-V86 HydrophobicContact CD2-CG2 4.19Å; H84-V86 HydrophobicContact CB-CG2 4.41Å; V86-V108 HydrophobicContact CG1-CG1 3.78Å; V86-V108 HydrophobicContact CG1-CG2 4.29Å; V86-V126 CarbonylContact C-O 3.56Å; V86-V126 VanDerWaalsContact CA-O 3.26Å; V86-V126 WeakPolarHBondContact CA-O 3.33Å; V86-V126 HydrophobicContact CG1-CB 4.48Å; V86-V126 HydrophobicContact CG1-CG1 4.48Å; V86-V126 HydrophobicContact CG2-CB 4.25Å; V86-A128 HydrophobicContact CG1-CB 3.84Å
87	Y	95.3	Very high	92.4	Very high	46 Å²	46	62.8 Å²	62.8	18%	0.18	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	131.4	175.3	-65.6	-75.6	0	0	0	111.4	Y60 V61 T85 F89 Y115 V126 A128	Y60-Y87 HydrophobicContact CD2-CD1 4.16Å; Y60-Y87 HydrophobicContact CE2-CD1 4.14Å; Y60-Y87 HydrophobicContact CE2-CE1 4.22Å; V61-Y87 CarbonylContact O-C 3.6Å; V61-Y87 WeakPolarHBondContact O-CA 3.28Å; T85-Y87 HydrophobicContact CG2-CD2 4.47Å; T85-Y87 HydrophobicContact CG2-CE1 4.4Å; T85-Y87 HydrophobicContact CG2-CE2 3.81Å; Y87-F89 HydrophobicContact CG-CZ 4.34Å; Y87-Y115 HydrophobicContact CE2-CE1 4.18Å; Y87-Y115 PolarHBondContact OH-OH 2.89Å; Y87-V126 PolarHBondContact N-O 2.89Å; Y87-A128 PolarHBondContact O-N 2.76Å
88	V	95.2	Very high	92.4	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	114.3	176.3	-170.6	0	0	0	0	108.4	Y60 V61 I63 F93 V94 I97 A128 V131	Y60-V88 WeakPolarHBondContact CA-O 3.5Å; Y60-V88 WeakPolarHBondContact CB-O 3.35Å; V61-V88 HydrophobicContact CB-CB 4.4Å; V61-V88 PolarHBondContact N-O 2.9Å; V61-V88 PolarHBondContact O-N 2.85Å; I63-V88 HydrophobicContact CD1-CG2 3.77Å; I63-V88 HydrophobicContact CG1-CG2 4.27Å; V88-F93 HydrophobicContact CG1-CB 3.61Å; V88-V94 HydrophobicContact CB-CG2 4.45Å; V88-V94 HydrophobicContact CG1-CG2 4.06Å; V88-I97 HydrophobicContact CB-CD1 4.16Å; V88-I97 HydrophobicContact CG1-CD1 4.33Å; V88-I97 HydrophobicContact CG2-CD1 3.77Å; V88-A128 HydrophobicContact CG2-CB 3.99Å; V88-V131 HydrophobicContact CG1-CG2 4.29Å; V88-V131 HydrophobicContact CG2-CG2 3.83Å
89	F	92.2	Very high	92.4	Very high	117 Å²	117	61.1 Å²	61.1	51%	0.513	30%	0.304	S	S	.	.			trans	-104.1	-23.9	-179.3	-63.2	-73.7	0	0	0	113.2	Y60 Y87 Q91 T127	Y60-F89 HydrophobicContact CD2-CE1 4.34Å; Y60-F89 HydrophobicContact CG-CD1 4.31Å; Y60-F89 HydrophobicContact CG-CE1 4.1Å; Y87-F89 HydrophobicContact CG-CZ 4.34Å; F89-Q91 PolarHBondContact O-N 3.47Å; F89-T127 HydrophobicContact CD2-CG2 3.85Å; F89-T127 HydrophobicContact CE2-CG2 3.96Å
90	E	91.4	Very high	92.6	Very high	102 Å²	102	60.8 Å²	60.8	48%	0.477	30%	0.3	S	S	.	.			trans	-77.6	120.1	-179.8	-173.7	-177.4	155.6	0	0	110.5	S92 F93 V94	E90-S92 VanDerWaalsContact CD-OG 3.32Å; E90-S92 PolarHBondContact O-N 2.76Å; E90-S92 VanDerWaalsContact O-N 3.16Å; E90-S92 PolarHBondContact OE1-OG 2.83Å; E90-F93 HydrophobicContact CB-CD2 3.89Å; E90-F93 HydrophobicContact CG-CD2 4.16Å; E90-F93 PolarHBondContact O-N 3.26Å; E90-F93 WeakPolarHBondContact OE2-CE2 3.38Å; E90-V94 PolarHBondContact O-N 2.84Å
91	Q	91	Very high	92.6	Very high	82 Å²	82	62.4 Å²	62.4	38%	0.383	31%	0.31	S	S	.	.	H	α-helix	trans	-56.6	-35.3	-175.6	-171.4	58.3	42.2	0	0	112.8	F89 F93 V94 D95	F89-Q91 PolarHBondContact O-N 3.47Å; Q91-F93 PolarHBondContact O-N 2.88Å; Q91-V94 WeakPolarHBondContact O-CB 3.08Å; Q91-V94 PolarHBondContact O-N 2.81Å; Q91-D95 PolarHBondContact NE2-OD2 3.41Å; Q91-D95 VanDerWaalsContact NE2-OD2 3.07Å; Q91-D95 PolarHBondContact O-N 3.33Å
92	S	91.8	Very high	92.7	Very high	51 Å²	51	66.5 Å²	66.5	36%	0.357	32%	0.32	S	S	.	.	H	α-helix	trans	-61.1	-31.9	178.7	86.2	0	0	0	0	112.7	E90 K96	E90-S92 VanDerWaalsContact CD-OG 3.32Å; E90-S92 PolarHBondContact O-N 2.76Å; E90-S92 VanDerWaalsContact O-N 3.16Å; E90-S92 PolarHBondContact OE1-OG 2.83Å; S92-K96 WeakPolarHBondContact O-CD 3.33Å; S92-K96 WeakPolarHBondContact O-CG 3.26Å
93	F	93	Very high	92.8	Very high	21 Å²	21	67 Å²	67	9%	0.092	33%	0.328	C	S	.	.	H	α-helix	trans	-86.4	-36.6	175.4	-66.8	-58.7	0	0	0	111.8	V88 E90 Q91 D95 K96 I97 D129 I130 V131	V88-F93 HydrophobicContact CG1-CB 3.61Å; E90-F93 HydrophobicContact CB-CD2 3.89Å; E90-F93 HydrophobicContact CG-CD2 4.16Å; E90-F93 PolarHBondContact O-N 3.26Å; E90-F93 WeakPolarHBondContact OE2-CE2 3.38Å; Q91-F93 PolarHBondContact O-N 2.88Å; F93-D95 VanDerWaalsContact C-N 3.27Å; F93-D95 PolarHBondContact O-N 3.43Å; F93-K96 HydrophobicContact CD1-CD 4.02Å; F93-K96 WeakPolarHBondContact O-CB 3.45Å; F93-K96 PolarHBondContact O-N 2.92Å; F93-I97 WeakPolarHBondContact O-CG1 3.36Å; F93-I97 PolarHBondContact O-N 3.15Å; F93-D129 WeakPolarHBondContact CE2-O 3.33Å; F93-I130 HydrophobicContact CE1-CG2 4.19Å; F93-I130 HydrophobicContact CZ-CB 4.32Å; F93-I130 HydrophobicContact CZ-CG1 4.31Å; F93-I130 HydrophobicContact CZ-CG2 4.27Å; F93-V131 HydrophobicContact CB-CB 4.39Å; F93-V131 HydrophobicContact CB-CG2 4.42Å; F93-V131 HydrophobicContact CD1-CB 4.36Å
94	V	92.3	Very high	92.7	Very high	4 Å²	4	62.7 Å²	62.7	2%	0.024	31%	0.311	C	S	.	.	H	α-helix	trans	-53.1	-47.8	171.9	171.1	0	0	0	0	110.7	V61 V88 E90 Q91 K96 I97 K98	V61-V94 HydrophobicContact CG2-CB 4.23Å; V61-V94 HydrophobicContact CG2-CG1 3.67Å; V61-V94 HydrophobicContact CG2-CG2 3.93Å; V88-V94 HydrophobicContact CB-CG2 4.45Å; V88-V94 HydrophobicContact CG1-CG2 4.06Å; E90-V94 PolarHBondContact O-N 2.84Å; Q91-V94 WeakPolarHBondContact O-CB 3.08Å; Q91-V94 PolarHBondContact O-N 2.81Å; V94-K96 VanDerWaalsContact C-N 3.26Å; V94-K96 PolarHBondContact O-N 3.1Å; V94-I97 WeakPolarHBondContact O-CG1 3.34Å; V94-I97 PolarHBondContact O-N 2.82Å; V94-K98 WeakPolarHBondContact O-CB 3.48Å; V94-K98 PolarHBondContact O-N 3.44Å
95	D	90.1	Very high	92.7	Very high	69 Å²	69	62.3 Å²	62.3	37%	0.369	31%	0.308	S	S	.	.	H	α-helix	trans	-64.7	-27.8	178.7	-80.7	-51.6	0	0	0	113.9	Q91 F93 K98	Q91-D95 PolarHBondContact NE2-OD2 3.41Å; Q91-D95 VanDerWaalsContact NE2-OD2 3.07Å; Q91-D95 PolarHBondContact O-N 3.33Å; F93-D95 VanDerWaalsContact C-N 3.27Å; F93-D95 PolarHBondContact O-N 3.43Å; D95-K98 WeakPolarHBondContact O-CE 3.35Å; D95-K98 IonicContact OD1-NZ 2.81Å; D95-K98 PolarHBondContact OD1-NZ 3.39Å
96	K	90.1	Very high	92.6	Very high	118 Å²	118	60 Å²	60	51%	0.513	29%	0.294	S	S	.	.	H	α-helix	trans	-75.8	-33.8	175.7	-72	169.7	-174.1	167.8	0	112.7	S92 F93 V94	S92-K96 WeakPolarHBondContact O-CD 3.33Å; S92-K96 WeakPolarHBondContact O-CG 3.26Å; F93-K96 HydrophobicContact CD1-CD 4.02Å; F93-K96 WeakPolarHBondContact O-CB 3.45Å; F93-K96 PolarHBondContact O-N 2.92Å; V94-K96 VanDerWaalsContact C-N 3.26Å; V94-K96 PolarHBondContact O-N 3.1Å
97	I	92	Very high	92.5	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-98.6	-8.4	-173.5	66.9	177.5	0	0	0	114.3	V61 I63 V88 F93 V94 H99 L100 L106 V131 P133	V61-I97 HydrophobicContact CB-CD1 3.94Å; V61-I97 HydrophobicContact CG1-CD1 3.82Å; V61-I97 HydrophobicContact CG2-CD1 4.31Å; I63-I97 HydrophobicContact CD1-CD1 3.56Å; I63-I97 HydrophobicContact CG1-CD1 4.14Å; V88-I97 HydrophobicContact CB-CD1 4.16Å; V88-I97 HydrophobicContact CG1-CD1 4.33Å; V88-I97 HydrophobicContact CG2-CD1 3.77Å; F93-I97 WeakPolarHBondContact O-CG1 3.36Å; F93-I97 PolarHBondContact O-N 3.15Å; V94-I97 WeakPolarHBondContact O-CG1 3.34Å; V94-I97 PolarHBondContact O-N 2.82Å; I97-H99 PolarHBondContact O-N 3.4Å; I97-L100 HydrophobicContact CB-CD1 3.69Å; I97-L100 HydrophobicContact CB-CG 4.17Å; I97-L100 HydrophobicContact CG2-CD1 3.82Å; I97-L100 VanDerWaalsContact O-CB 3.32Å; I97-L100 WeakPolarHBondContact O-CB 3.43Å; I97-L100 WeakPolarHBondContact O-CG 3.26Å; I97-L100 PolarHBondContact O-N 2.81Å; I97-L106 HydrophobicContact CG2-CD1 4.38Å; I97-V131 HydrophobicContact CG2-CB 4.17Å; I97-V131 HydrophobicContact CG2-CG1 3.47Å; I97-V131 VanDerWaalsContact CG2-CG1 3.47Å; I97-P133 HydrophobicContact CG2-CG 4.31Å
98	K	90.3	Very high	92.5	Very high	90 Å²	90	59.2 Å²	59.2	39%	0.391	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.9	-173.4	68.4	-174.6	169.7	-166.6	0	115.1	F50 V94 D95	F50-K98 HydrophobicContact CE1-CB 3.86Å; F50-K98 HydrophobicContact CZ-CB 3.93Å; V94-K98 WeakPolarHBondContact O-CB 3.48Å; V94-K98 PolarHBondContact O-N 3.44Å; D95-K98 WeakPolarHBondContact O-CE 3.35Å; D95-K98 IonicContact OD1-NZ 2.81Å; D95-K98 PolarHBondContact OD1-NZ 3.39Å
99	H	89.3	Confident	92.5	Very high	146 Å²	146	60.2 Å²	60.2	68%	0.676	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	0.6	178.9	-58	-59.2	0	0	0	113.6	I97	I97-H99 PolarHBondContact O-N 3.4Å
100	L	92.3	Very high	92.7	Very high	25 Å²	25	54.6 Å²	54.6	13%	0.131	28%	0.275	C	S	.	.			trans	-65.9	148.8	177.1	-65.9	-179.1	0	0	0	110.5	V45 L48 I97 D104 L106 P133	V45-L100 HydrophobicContact CG2-CB 4.49Å; V45-L100 HydrophobicContact CG2-CD1 4.09Å; L48-L100 HydrophobicContact CD1-CB 3.68Å; L48-L100 WeakPolarHBondContact CD1-O 3.06Å; I97-L100 HydrophobicContact CB-CD1 3.69Å; I97-L100 HydrophobicContact CB-CG 4.17Å; I97-L100 HydrophobicContact CG2-CD1 3.82Å; I97-L100 VanDerWaalsContact O-CB 3.32Å; I97-L100 WeakPolarHBondContact O-CB 3.43Å; I97-L100 WeakPolarHBondContact O-CG 3.26Å; I97-L100 PolarHBondContact O-N 2.81Å; L100-D104 WeakPolarHBondContact CA-OD2 3.33Å; L100-D104 HydrophobicContact CD2-CB 3.97Å; L100-L106 HydrophobicContact CD1-CD1 3.59Å; L100-L106 HydrophobicContact CD1-CD2 4.35Å; L100-P133 HydrophobicContact CD1-CG 4.38Å; L100-P133 HydrophobicContact CD2-CB 4Å; L100-P133 HydrophobicContact CD2-CG 4.15Å
101	T	92.2	Very high	92.8	Very high	85 Å²	85	54.8 Å²	54.8	52%	0.521	27%	0.272	S	S	.	.			trans	-125.2	164.6	179.8	61.3	0	0	0	0	110.1	G103 D104	T101-G103 PolarHBondContact O-N 2.84Å; T101-D104 PolarHBondContact N-OD2 3.39Å; T101-D104 VanDerWaalsContact O-CB 3.31Å; T101-D104 WeakPolarHBondContact O-CB 3.48Å; T101-D104 PolarHBondContact O-N 2.71Å; T101-D104 VanDerWaalsContact O-N 3.07Å; T101-D104 PolarHBondContact OG1-OD2 3.35Å
102	K	93.9	Very high	93	Very high	177 Å²	177	54.5 Å²	54.5	77%	0.77	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	130.2	177.2	-177.7	178.7	177.9	-178.8	0	110	V45	V45-K102 CarbonylContact O-C 3.46Å; V45-K102 WeakPolarHBondContact O-CA 3.3Å
103	G	93.7	Very high	93	Very high	32 Å²	32	55.3 Å²	55.3	33%	0.33	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.9	-15.5	-178.1	0	0	0	0	0	114.2	V45 T101	V45-G103 PolarHBondContact O-N 3.16Å; T101-G103 PolarHBondContact O-N 2.84Å
104	D	93.9	Very high	92.9	Very high	56 Å²	56	57.8 Å²	57.8	30%	0.299	29%	0.293	S	S	.	.			trans	-61.9	140.9	176.3	-75.2	-24.1	0	0	0	111.1	R44 V45 L100 T101	R44-D104 CarbonylContact C-O 3.58Å; R44-D104 VanDerWaalsContact CA-O 3.29Å; R44-D104 WeakPolarHBondContact CA-O 3.44Å; V45-D104 PolarHBondContact N-O 2.9Å; L100-D104 WeakPolarHBondContact CA-OD2 3.33Å; L100-D104 HydrophobicContact CD2-CB 3.97Å; T101-D104 PolarHBondContact N-OD2 3.39Å; T101-D104 VanDerWaalsContact O-CB 3.31Å; T101-D104 WeakPolarHBondContact O-CB 3.48Å; T101-D104 PolarHBondContact O-N 2.71Å; T101-D104 VanDerWaalsContact O-N 3.07Å; T101-D104 PolarHBondContact OG1-OD2 3.35Å
105	R	94	Very high	92.8	Very high	40 Å²	40	61.3 Å²	61.3	15%	0.151	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	133.7	-178.4	-68.2	178.8	-178.1	176.2	1.9	110.2	G43 R44 L134 M137 P138 T139	G43-R105 WeakPolarHBondContact O-CA 3.28Å; R44-R105 HydrophobicContact CG-CG 4.46Å; R105-L134 HydrophobicContact CB-CB 3.8Å; R105-L134 HydrophobicContact CB-CD1 4.03Å; R105-L134 PolarHBondContact O-N 2.87Å; R105-M137 PolarHBondContact NH1-O 2.94Å; R105-P138 VanDerWaalsContact CZ-O 3.3Å; R105-P138 PolarHBondContact NH1-O 2.96Å; R105-P138 VanDerWaalsContact NH1-O 3.14Å; R105-P138 PolarHBondContact NH2-O 3.26Å; R105-T139 VanDerWaalsContact NH2-CA 3.32Å
106	L	94.5	Very high	92.8	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	133.2	-176.4	-162.9	64.9	0	0	0	110.1	G43 V45 I63 L65 I97 L100 V108 V131 P133	G43-L106 PolarHBondContact N-O 3.48Å; G43-L106 PolarHBondContact O-N 3.21Å; V45-L106 HydrophobicContact CG2-CB 4.22Å; V45-L106 HydrophobicContact CG2-CD2 4.21Å; I63-L106 HydrophobicContact CD1-CD2 3.61Å; I63-L106 HydrophobicContact CG2-CD2 4.18Å; L65-L106 HydrophobicContact CD1-CB 3.89Å; L65-L106 HydrophobicContact CD1-CD2 4.28Å; I97-L106 HydrophobicContact CG2-CD1 4.38Å; L100-L106 HydrophobicContact CD1-CD1 3.59Å; L100-L106 HydrophobicContact CD1-CD2 4.35Å; L106-V108 HydrophobicContact CD2-CG2 3.79Å; L106-V108 HydrophobicContact CG-CG2 3.96Å; L106-V131 HydrophobicContact CD1-CG1 3.4Å; L106-V131 HydrophobicContact CD2-CG1 3.8Å; L106-V131 HydrophobicContact CG-CG1 3.78Å; L106-P133 HydrophobicContact CD1-CG 4.19Å
107	C	95	Very high	92.7	Very high	29 Å²	29	57.4 Å²	57.4	20%	0.196	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.9	164.3	-176.8	0	0	0	0	108.7	L41 F42 S132 L134	L41-C107 CarbonylContact O-C 3.48Å; L41-C107 WeakPolarHBondContact O-CA 3.34Å; F42-C107 HydrophobicContact CD2-CB 4.48Å; C107-S132 PolarHBondContact N-O 2.87Å; C107-S132 PolarHBondContact O-N 2.92Å; C107-L134 HydrophobicContact CB-CD1 4.21Å
108	V	95.3	Very high	92.6	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	128.6	179.3	177.5	0	0	0	0	108.2	V40 L41 L65 V86 L106 V126 A128 I130 V131	V40-V108 CarbonylContact C-O 3.54Å; V40-V108 WeakPolarHBondContact CA-O 3.31Å; L41-V108 HydrophobicContact CB-CB 4.38Å; L41-V108 PolarHBondContact N-O 2.98Å; L41-V108 PolarHBondContact O-N 3.33Å; L65-V108 HydrophobicContact CD2-CG2 4.03Å; V86-V108 HydrophobicContact CG1-CG1 3.78Å; V86-V108 HydrophobicContact CG1-CG2 4.29Å; L106-V108 HydrophobicContact CD2-CG2 3.79Å; L106-V108 HydrophobicContact CG-CG2 3.96Å; V108-V126 HydrophobicContact CG1-CG1 4.42Å; V108-A128 HydrophobicContact CG1-CB 3.74Å; V108-I130 WeakPolarHBondContact CA-O 3.44Å; V108-V131 HydrophobicContact CG2-CG1 4.36Å
109	I	95.2	Very high	92.7	Very high	20 Å²	20	64.6 Å²	64.6	10%	0.103	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.3	164.2	-53.1	174.5	0	0	0	105.9	V28 T30 Q38 V39 V40 D129 I130	V28-I109 HydrophobicContact CG1-CD1 3.86Å; T30-I109 HydrophobicContact CG2-CD1 4.24Å; T30-I109 HydrophobicContact CG2-CG2 4.33Å; Q38-I109 HydrophobicContact CG-CG2 4.5Å; V39-I109 WeakPolarHBondContact O-CA 3.47Å; V40-I109 HydrophobicContact CG1-CG1 4.28Å; V40-I109 HydrophobicContact CG2-CG1 4.18Å; V40-I109 HydrophobicContact CG2-CG2 4.35Å; I109-D129 PolarHBondContact O-N 2.88Å; I109-I130 HydrophobicContact CB-CB 4.14Å; I109-I130 HydrophobicContact CD1-CD1 4.3Å; I109-I130 PolarHBondContact N-O 2.78Å; I109-I130 PolarHBondContact O-N 2.91Å
110	G	94.9	Very high	92.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	-163	-175.7	0	0	0	0	0	112.5	Q38 V39 T127	Q38-G110 CarbonylContact C-O 3.57Å; Q38-G110 WeakPolarHBondContact CA-O 3.4Å; V39-G110 PolarHBondContact N-O 2.9Å; V39-G110 PolarHBondContact O-N 2.89Å; G110-T127 CarbonylContact C-O 3.59Å; G110-T127 WeakPolarHBondContact CA-O 3.44Å
111	R	94.8	Very high	92.8	Very high	105 Å²	105	63.5 Å²	63.5	40%	0.396	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.8	-178.5	-73	171.1	-87.2	159.8	-6.4	110.8	D35 N37 V126 T127 D129	D35-R111 VanDerWaalsContact OD2-CD 3.26Å; D35-R111 WeakPolarHBondContact OD2-CD 3.38Å; N37-R111 CarbonylContact O-C 3.57Å; N37-R111 VanDerWaalsContact O-CA 3.31Å; N37-R111 WeakPolarHBondContact O-CA 3.13Å; R111-V126 CarbonylContact O-C 3.55Å; R111-V126 WeakPolarHBondContact O-CA 2.81Å; R111-T127 PolarHBondContact N-O 2.78Å; R111-T127 PolarHBondContact O-N 3.43Å; R111-D129 IonicContact CZ-OD1 2.78Å; R111-D129 IonicContact CZ-OD2 2.7Å; R111-D129 IonicContact NE-OD1 2.74Å; R111-D129 PolarHBondContact NE-OD1 2.95Å; R111-D129 IonicContact NE-OD2 3.48Å; R111-D129 PolarHBondContact NE-OD2 2.92Å; R111-D129 IonicContact NH2-OD1 3.99Å; R111-D129 PolarHBondContact NH2-OD1 2.8Å; R111-D129 IonicContact NH2-OD2 3.18Å
112	L	94.4	Very high	92.7	Very high	77 Å²	77	68 Å²	68	40%	0.403	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	129.1	172.7	-174.6	71	0	0	0	109.3	N37 V39 V126	N37-L112 HydrophobicContact CB-CB 4.5Å; N37-L112 PolarHBondContact O-N 3.48Å; V39-L112 HydrophobicContact CG1-CB 4.21Å; L112-V126 HydrophobicContact CD1-CG2 4.35Å
113	N	92.7	Very high	92.6	Very high	67 Å²	67	65.3 Å²	65.3	36%	0.358	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	154.5	178.6	-67.8	-43.5	0	0	0	109.5	S124 S125 T127	N113-S124 CarbonylContact O-C 3.56Å; N113-S124 WeakPolarHBondContact O-CA 2.99Å; N113-S125 PolarHBondContact N-O 2.78Å; N113-S125 PolarHBondContact O-N 2.74Å; N113-S125 PolarHBondContact O-OG 3.17Å; N113-T127 VanDerWaalsContact ND2-CB 3.34Å; N113-T127 WeakPolarHBondContact ND2-CB 3.2Å; N113-T127 PolarHBondContact ND2-OG1 2.87Å
114	S	91.2	Very high	92.5	Very high	74 Å²	74	68 Å²	68	52%	0.517	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148.1	169.1	62.6	0	0	0	0	110.2	R123	S114-R123 CarbonylContact C-O 3.45Å; S114-R123 VanDerWaalsContact CA-O 3.22Å; S114-R123 WeakPolarHBondContact CA-O 3.22Å
115	Y	88.9	Confident	92.5	Very high	78 Å²	78	65.7 Å²	65.7	31%	0.306	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	146.4	173.9	65.2	-85.7	0	0	0	110.3	Y87 K117 R123	Y87-Y115 HydrophobicContact CE2-CE1 4.18Å; Y87-Y115 PolarHBondContact OH-OH 2.89Å; Y115-K117 HydrophobicContact CE2-CG 4.1Å; Y115-R123 HydrophobicContact CE1-CB 4.08Å; Y115-R123 HydrophobicContact CE2-CB 4.37Å; Y115-R123 PolarHBondContact N-O 3.49Å; Y115-R123 PolarHBondContact O-N 3.37Å
116	S	90.2	Very high	92.6	Very high	63 Å²	63	63.9 Å²	63.9	44%	0.441	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	129.8	172.8	-175.8	0	0	0	0	109.2
117	K	88.7	Confident	92.6	Very high	41 Å²	41	65.4 Å²	65.4	18%	0.178	35%	0.349	C	S	.	.			trans	-78.2	164.2	169.6	-71.1	161.9	101.3	-142.6	0	110.1	Y115 D119 G120 E121 R123	Y115-K117 HydrophobicContact CE2-CG 4.1Å; K117-D119 WeakPolarHBondContact CB-OD1 3.44Å; K117-D119 IonicContact NZ-OD1 3.43Å; K117-D119 IonicContact NZ-OD2 3.7Å; K117-D119 PolarHBondContact NZ-OD2 2.9Å; K117-D119 PolarHBondContact O-N 2.76Å; K117-G120 PolarHBondContact O-N 2.85Å; K117-E121 HydrophobicContact CD-CB 4.08Å; K117-E121 PolarHBondContact N-O 3.02Å; K117-E121 IonicContact NZ-OE2 3.77Å; K117-E121 PolarHBondContact NZ-OE2 3.44Å; K117-R123 HydrophobicContact CD-CG 3.84Å
118	P	89.8	Confident	92.7	Very high	146 Å²	146	64.4 Å²	64.4	95%	0.948	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-24	176.7	-24.4	34.9	0	0	0	114.9	G120	P118-G120 PolarHBondContact O-N 2.8Å
119	D	92.6	Very high	92.6	Very high	95 Å²	95	66.7 Å²	66.7	51%	0.508	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-3.7	174.9	55.6	20	0	0	0	113.1	K117 E121	K117-D119 WeakPolarHBondContact CB-OD1 3.44Å; K117-D119 IonicContact NZ-OD1 3.43Å; K117-D119 IonicContact NZ-OD2 3.7Å; K117-D119 PolarHBondContact NZ-OD2 2.9Å; K117-D119 PolarHBondContact O-N 2.76Å; D119-E121 VanDerWaalsContact C-N 3.32Å; D119-E121 WeakPolarHBondContact OD1-CB 3.47Å; D119-E121 PolarHBondContact OD1-N 2.94Å
120	G	90.9	Very high	92.5	Very high	46 Å²	46	69.2 Å²	69.2	47%	0.474	37%	0.368	S	S	.	.	S	Bend	trans	88.1	-10.5	-176.9	0	0	0	0	0	114.1	K117 P118	K117-G120 PolarHBondContact O-N 2.85Å; P118-G120 PolarHBondContact O-N 2.8Å
121	E	92	Very high	92.4	Very high	103 Å²	103	69.4 Å²	69.4	48%	0.481	37%	0.368	S	S	.	.			trans	-70	136.3	178.6	-61.7	179.5	164.6	0	0	111.1	K117 D119	K117-E121 HydrophobicContact CD-CB 4.08Å; K117-E121 PolarHBondContact N-O 3.02Å; K117-E121 IonicContact NZ-OE2 3.77Å; K117-E121 PolarHBondContact NZ-OE2 3.44Å; D119-E121 VanDerWaalsContact C-N 3.32Å; D119-E121 WeakPolarHBondContact OD1-CB 3.47Å; D119-E121 PolarHBondContact OD1-N 2.94Å
122	W	90.5	Very high	92.4	Very high	179 Å²	179	67 Å²	67	68%	0.678	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	132.3	172	-75.9	83.2	0	0	0	110.5
123	R	91.1	Very high	92.3	Very high	121 Å²	121	65.2 Å²	65.2	46%	0.457	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	136.2	170.9	-78	-170.7	180	-167.5	2.5	111.6	S114 Y115 K117	S114-R123 CarbonylContact C-O 3.45Å; S114-R123 VanDerWaalsContact CA-O 3.22Å; S114-R123 WeakPolarHBondContact CA-O 3.22Å; Y115-R123 HydrophobicContact CE1-CB 4.08Å; Y115-R123 HydrophobicContact CE2-CB 4.37Å; Y115-R123 PolarHBondContact N-O 3.49Å; Y115-R123 PolarHBondContact O-N 3.37Å; K117-R123 HydrophobicContact CD-CG 3.84Å
124	S	91.9	Very high	92.1	Very high	88 Å²	88	64.6 Å²	64.6	62%	0.615	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	141.9	169.8	-58.1	0	0	0	0	110.1	N113	N113-S124 CarbonylContact O-C 3.56Å; N113-S124 WeakPolarHBondContact O-CA 2.99Å
125	S	94.5	Very high	91.5	Very high	7 Å²	7	67.7 Å²	67.7	5%	0.049	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	167.8	178	61.7	0	0	0	0	110.1	T85 N113	T85-S125 CarbonylContact O-C 3.52Å; T85-S125 VanDerWaalsContact O-CA 3.3Å; T85-S125 WeakPolarHBondContact O-CA 3.48Å; T85-S125 WeakPolarHBondContact O-CB 3.41Å; N113-S125 PolarHBondContact N-O 2.78Å; N113-S125 PolarHBondContact O-N 2.74Å; N113-S125 PolarHBondContact O-OG 3.17Å
126	V	96	Very high	90.2	Very high	3 Å²	3	67.6 Å²	67.6	2%	0.018	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	128.3	175.6	177.5	0	0	0	0	108.5	V39 L41 T85 V86 Y87 V108 R111 L112	V39-V126 HydrophobicContact CG2-CG1 3.72Å; V39-V126 HydrophobicContact CG2-CG2 4.05Å; L41-V126 HydrophobicContact CD1-CB 4.49Å; L41-V126 HydrophobicContact CD1-CG2 3.85Å; T85-V126 PolarHBondContact O-N 3.35Å; V86-V126 CarbonylContact C-O 3.56Å; V86-V126 VanDerWaalsContact CA-O 3.26Å; V86-V126 WeakPolarHBondContact CA-O 3.33Å; V86-V126 HydrophobicContact CG1-CB 4.48Å; V86-V126 HydrophobicContact CG1-CG1 4.48Å; V86-V126 HydrophobicContact CG2-CB 4.25Å; Y87-V126 PolarHBondContact N-O 2.89Å; V108-V126 HydrophobicContact CG1-CG1 4.42Å; R111-V126 CarbonylContact O-C 3.55Å; R111-V126 WeakPolarHBondContact O-CA 2.81Å; L112-V126 HydrophobicContact CD1-CG2 4.35Å
127	T	95.2	Very high	88.5	Confident	32 Å²	32	69.7 Å²	69.7	20%	0.196	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	118.2	165.5	-62.2	0	0	0	0	108.4	F89 G110 R111 N113	F89-T127 HydrophobicContact CD2-CG2 3.85Å; F89-T127 HydrophobicContact CE2-CG2 3.96Å; G110-T127 CarbonylContact C-O 3.59Å; G110-T127 WeakPolarHBondContact CA-O 3.44Å; R111-T127 PolarHBondContact N-O 2.78Å; R111-T127 PolarHBondContact O-N 3.43Å; N113-T127 VanDerWaalsContact ND2-CB 3.34Å; N113-T127 WeakPolarHBondContact ND2-CB 3.2Å; N113-T127 PolarHBondContact ND2-OG1 2.87Å
128	A	95.6	Very high	86.5	Confident	7 Å²	7	72.7 Å²	72.7	6%	0.058	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	129.8	-179.5	0	0	0	0	0	111.1	V86 Y87 V88 V108 V131	V86-A128 HydrophobicContact CG1-CB 3.84Å; Y87-A128 PolarHBondContact O-N 2.76Å; V88-A128 HydrophobicContact CG2-CB 3.99Å; V108-A128 HydrophobicContact CG1-CB 3.74Å; A128-V131 HydrophobicContact CB-CG2 3.5Å
129	D	93.1	Very high	84.6	Confident	48 Å²	48	70.5 Å²	70.5	26%	0.257	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-31.9	168.9	-65.7	-49.5	0	0	0	110.9	F93 I109 R111	F93-D129 WeakPolarHBondContact CE2-O 3.33Å; I109-D129 PolarHBondContact O-N 2.88Å; R111-D129 IonicContact CZ-OD1 2.78Å; R111-D129 IonicContact CZ-OD2 2.7Å; R111-D129 IonicContact NE-OD1 2.74Å; R111-D129 PolarHBondContact NE-OD1 2.95Å; R111-D129 IonicContact NE-OD2 3.48Å; R111-D129 PolarHBondContact NE-OD2 2.92Å; R111-D129 IonicContact NH2-OD1 3.99Å; R111-D129 PolarHBondContact NH2-OD1 2.8Å; R111-D129 IonicContact NH2-OD2 3.18Å
130	I	93.4	Very high	82.3	Confident	74 Å²	74	73.4 Å²	73.4	38%	0.379	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	132.9	175.3	-57	175.7	0	0	0	108.8	F93 V108 I109	F93-I130 HydrophobicContact CE1-CG2 4.19Å; F93-I130 HydrophobicContact CZ-CB 4.32Å; F93-I130 HydrophobicContact CZ-CG1 4.31Å; F93-I130 HydrophobicContact CZ-CG2 4.27Å; V108-I130 WeakPolarHBondContact CA-O 3.44Å; I109-I130 HydrophobicContact CB-CB 4.14Å; I109-I130 HydrophobicContact CD1-CD1 4.3Å; I109-I130 PolarHBondContact N-O 2.78Å; I109-I130 PolarHBondContact O-N 2.91Å
131	V	93.6	Very high	79.9	Confident	3 Å²	3	76.7 Å²	76.7	2%	0.018	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.7	173.1	-170.7	0	0	0	0	110.2	V88 F93 I97 L106 V108 A128	V88-V131 HydrophobicContact CG1-CG2 4.29Å; V88-V131 HydrophobicContact CG2-CG2 3.83Å; F93-V131 HydrophobicContact CB-CB 4.39Å; F93-V131 HydrophobicContact CB-CG2 4.42Å; F93-V131 HydrophobicContact CD1-CB 4.36Å; I97-V131 HydrophobicContact CG2-CB 4.17Å; I97-V131 HydrophobicContact CG2-CG1 3.47Å; I97-V131 VanDerWaalsContact CG2-CG1 3.47Å; L106-V131 HydrophobicContact CD1-CG1 3.4Å; L106-V131 HydrophobicContact CD2-CG1 3.8Å; L106-V131 HydrophobicContact CG-CG1 3.78Å; V108-V131 HydrophobicContact CG2-CG1 4.36Å; A128-V131 HydrophobicContact CB-CG2 3.5Å
132	S	93.7	Very high	77.4	Confident	54 Å²	54	74.1 Å²	74.1	38%	0.378	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	101.2	-176.6	-65.6	0	0	0	0	110.8	C107	C107-S132 PolarHBondContact N-O 2.87Å; C107-S132 PolarHBondContact O-N 2.92Å
133	P	92.7	Very high	74.9	Confident	41 Å²	41	72.4 Å²	72.4	27%	0.266	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	136.8	165.9	-28.3	37.8	0	0	0	111.6	I97 L100 L106 V135	I97-P133 HydrophobicContact CG2-CG 4.31Å; L100-P133 HydrophobicContact CD1-CG 4.38Å; L100-P133 HydrophobicContact CD2-CB 4Å; L100-P133 HydrophobicContact CD2-CG 4.15Å; L106-P133 HydrophobicContact CD1-CG 4.19Å; P133-V135 HydrophobicContact CB-CG2 4.49Å
134	L	88.3	Confident	72.4	Confident	53 Å²	53	72.2 Å²	72.2	28%	0.277	45%	0.449	S	S	.	.			trans	-105.4	83.8	178.4	-65.4	159.6	0	0	0	109.1	F42 R105 C107	F42-L134 HydrophobicContact CD2-CD1 3.59Å; F42-L134 HydrophobicContact CE2-CD1 2.99Å; F42-L134 HydrophobicContact CE2-CG 4.33Å; F42-L134 HydrophobicContact CZ-CD1 3.58Å; R105-L134 HydrophobicContact CB-CB 3.8Å; R105-L134 HydrophobicContact CB-CD1 4.03Å; R105-L134 PolarHBondContact O-N 2.87Å; C107-L134 HydrophobicContact CB-CD1 4.21Å
135	V	78.6	Confident	69.7	Low	139 Å²	139	72.4 Å²	72.4	84%	0.842	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	135.5	176.8	-173.1	0	0	0	0	109.5	P133	P133-V135 HydrophobicContact CB-CG2 4.49Å
136	G	62.8	Low	67	Low	76 Å²	76	77.9 Å²	77.9	78%	0.784	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	4.8	166.9	0	0	0	0	0	117.1
137	M	53.5	Low	64.2	Low	107 Å²	107	85 Å²	85	53%	0.527	52%	0.518	S	S	.	.			trans	-82.7	120.9	165.8	-63.6	-164.5	106.2	0	0	108.8	R105 T139	R105-M137 PolarHBondContact NH1-O 2.94Å; M137-T139 PolarHBondContact O-N 2.79Å
138	P	46.3	Very low	61.3	Low	105 Å²	105	91.9 Å²	91.9	68%	0.682	55%	0.548	S	S	*	.			trans	-54	128.9	-178.8	18.8	-29.5	0	0	0	109.7	R105 M140	R105-P138 VanDerWaalsContact CZ-O 3.3Å; R105-P138 PolarHBondContact NH1-O 2.96Å; R105-P138 VanDerWaalsContact NH1-O 3.14Å; R105-P138 PolarHBondContact NH2-O 3.26Å; P138-M140 VanDerWaalsContact C-N 3.32Å; P138-M140 PolarHBondContact O-N 3.32Å
139	T	49.3	Very low	58.3	Low	99 Å²	99	99 Å²	99	61%	0.607	59%	0.585	S	S	*	*			trans	-53.8	103.7	158	35.8	0	0	0	0	105.9	R105 M137 S141	R105-T139 VanDerWaalsContact NH2-CA 3.32Å; M137-T139 PolarHBondContact O-N 2.79Å; T139-S141 PolarHBondContact O-N 2.78Å
140	M	46.1	Very low	55.7	Low	157 Å²	157	106 Å²	106	77%	0.773	62%	0.616	S	S	*	*			trans	-61.1	95.9	154.8	-72.1	-87.8	-173.2	0	0	103	P138 G142	P138-M140 VanDerWaalsContact C-N 3.32Å; P138-M140 PolarHBondContact O-N 3.32Å; M140-G142 PolarHBondContact O-N 3.42Å
141	S	40.5	Very low	52.7	Low	114 Å²	114	110.9 Å²	110.9	80%	0.797	64%	0.635	S	S	*	*			trans	-66.7	66.6	158.9	55.3	0	0	0	0	106.3	T139	T139-S141 PolarHBondContact O-N 2.78Å
142	G	39.6	Very low	49.9	Very low	49 Å²	49	114.8 Å²	114.8	51%	0.505	67%	0.667	S	S	.	*			trans	-86.5	117.4	160.7	0	0	0	0	0	104.9	M140 D144	M140-G142 PolarHBondContact O-N 3.42Å; G142-D144 PolarHBondContact O-N 2.73Å
143	D	36.6	Very low	46.9	Very low	144 Å²	144	118.6 Å²	118.6	77%	0.77	68%	0.683	S	S	*	*			trans	-28.7	101.7	176.3	-67.3	-44.9	0	0	0	113	S145	D143-S145 PolarHBondContact O-N 3.04Å
144	D	40	Very low	44.2	Very low	117 Å²	117	124.8 Å²	124.8	63%	0.626	71%	0.708	S	S	*	*			trans	-85.6	17.6	161.4	-79.2	-33.3	0	0	0	109.7	R44 G142 V146	R44-D144 IonicContact NH1-OD2 2.96Å; R44-D144 PolarHBondContact NH1-OD2 2.81Å; G142-D144 PolarHBondContact O-N 2.73Å; D144-V146 VanDerWaalsContact C-N 3.33Å; D144-V146 PolarHBondContact O-N 3.17Å
145	S	34.5	Very low	41.7	Very low	91 Å²	91	128.9 Å²	128.9	64%	0.636	73%	0.73	S	S	*	*			trans	-91.3	35.3	179.4	70.8	0	0	0	0	113.6	D143	D143-S145 PolarHBondContact O-N 3.04Å
146	V	38.6	Very low	39.8	Very low	122 Å²	122	130.9 Å²	130.9	74%	0.739	73%	0.731	S	S	*	*			trans	-155.3	76.4	161.7	-167.8	0	0	0	0	109.3	D144	D144-V146 VanDerWaalsContact C-N 3.33Å; D144-V146 PolarHBondContact O-N 3.17Å
147	M	37.1	Very low	38.7	Very low	152 Å²	152	135.3 Å²	135.3	75%	0.749	73%	0.731	S	S	*	*			trans	-141.8	92.1	148.3	-73.8	-71.9	-111.1	0	0	104	S79	S79-M147 WeakPolarHBondContact O-CE 3.48Å
148	E	34	Very low	37.7	Very low	177 Å²	177	136.8 Å²	136.8	83%	0.827	74%	0.74	S	S	*	*			trans	-49	140.7	172.1	-69.1	175.4	147.7	0	0	109.1	E150	E148-E150 VanDerWaalsContact C-N 3.3Å; E148-E150 PolarHBondContact O-N 3.45Å
149	D	32.8	Very low	37.3	Very low	157 Å²	157	139 Å²	139	84%	0.84	75%	0.745	S	S	*	*			trans	-47.6	97.6	164.3	-67.2	-51.1	0	0	0	108.3	K151	D149-K151 PolarHBondContact O-N 3.33Å
150	E	37.8	Very low	36.8	Very low	195 Å²	195	139 Å²	139	91%	0.911	75%	0.745	S	S	*	*			trans	-63.3	92.8	155.7	-82.9	-170.8	169.5	0	0	104.5	E148 A152	E148-E150 VanDerWaalsContact C-N 3.3Å; E148-E150 PolarHBondContact O-N 3.45Å; E150-A152 PolarHBondContact O-N 3.21Å
151	K	30.5	Very low	36.3	Very low	177 Å²	177	139 Å²	139	77%	0.77	75%	0.748	S	S	*	*			trans	-30.6	129.8	168.7	-83.5	177.6	172	177.1	0	109.1	D149 N153	D149-K151 PolarHBondContact O-N 3.33Å; K151-N153 PolarHBondContact O-N 3.34Å
152	A	34	Very low	36.4	Very low	84 Å²	84	142 Å²	142	69%	0.694	75%	0.749	S	S	*	*			trans	-42.7	91.4	149.4	0	0	0	0	0	109.3	E150 E154	E150-A152 PolarHBondContact O-N 3.21Å; A152-E154 PolarHBondContact O-N 2.81Å
153	N	30.6	Very low	36.4	Very low	134 Å²	134	147.1 Å²	147.1	72%	0.717	76%	0.762	S	S	*	*			trans	-83.7	68.4	140.4	-80.7	-5.1	0	0	0	104.7	K151 D155	K151-N153 PolarHBondContact O-N 3.34Å; N153-D155 PolarHBondContact O-N 2.76Å
154	E	37.6	Very low	36.6	Very low	171 Å²	171	147.6 Å²	147.6	80%	0.799	76%	0.76	S	S	*	*			trans	-69.2	99.2	144	-73.1	179.6	-177.6	0	0	102.5	A152 E156	A152-E154 PolarHBondContact O-N 2.81Å; E154-E156 VanDerWaalsContact C-N 3.25Å; E154-E156 PolarHBondContact O-N 3.18Å
155	D	34.9	Very low	36.6	Very low	139 Å²	139	148.4 Å²	148.4	74%	0.743	76%	0.764	S	S	*	*			trans	-50.9	100.1	168.3	-67	-43.4	0	0	0	106.1	N153 E157	N153-D155 PolarHBondContact O-N 2.76Å; D155-E157 PolarHBondContact O-N 3.41Å
156	E	39.2	Very low	37	Very low	182 Å²	182	152.2 Å²	152.2	85%	0.85	77%	0.769	S	S	*	*			trans	-58.9	87.1	157.2	-78.4	-175.6	170.8	0	0	104.7	E154 I158	E154-E156 VanDerWaalsContact C-N 3.25Å; E154-E156 PolarHBondContact O-N 3.18Å; E156-I158 PolarHBondContact O-N 2.82Å
157	E	39	Very low	37	Very low	169 Å²	169	153.2 Å²	153.2	79%	0.79	77%	0.77	S	S	*	*			trans	-62.3	96.7	167.5	-157.1	174.8	-148.7	0	0	104.8	D155 L159	D155-E157 PolarHBondContact O-N 3.41Å; E157-L159 PolarHBondContact O-N 3.18Å
158	I	33.5	Very low	37.2	Very low	138 Å²	138	153.6 Å²	153.6	71%	0.708	78%	0.775	S	S	*	*			trans	-54.3	89.5	168.6	-64	162.1	0	0	0	105.5	E156 T160	E156-I158 PolarHBondContact O-N 2.82Å; I158-T160 HydrophobicContact CG2-CG2 3.88Å; I158-T160 PolarHBondContact O-N 2.93Å
159	L	36.7	Very low	37.5	Very low	152 Å²	152	149.6 Å²	149.6	80%	0.796	77%	0.772	S	S	*	*			trans	-69.2	89.5	156	-82.4	165.4	0	0	0	104.8	E157 D161	E157-L159 PolarHBondContact O-N 3.18Å; L159-D161 PolarHBondContact O-N 2.75Å
160	T	38.3	Very low	38.2	Very low	97 Å²	97	151.2 Å²	151.2	60%	0.595	78%	0.775	S	S	*	*			trans	-46.4	120.5	163.5	43.4	0	0	0	0	108.2	I158 E162	I158-T160 HydrophobicContact CG2-CG2 3.88Å; I158-T160 PolarHBondContact O-N 2.93Å; T160-E162 PolarHBondContact O-N 3.17Å
161	D	36.6	Very low	38.4	Very low	159 Å²	159	155.5 Å²	155.5	85%	0.85	79%	0.79	S	S	*	*			trans	-58.5	74.3	159.3	-71.5	-40	0	0	0	108.9	L159 M163	L159-D161 PolarHBondContact O-N 2.75Å; D161-M163 VanDerWaalsContact C-N 3.27Å; D161-M163 PolarHBondContact O-N 2.75Å; D161-M163 VanDerWaalsContact O-N 3.17Å
162	E	42.7	Very low	38.8	Very low	176 Å²	176	154.4 Å²	154.4	82%	0.822	79%	0.791	S	S	*	*			trans	-82.6	87.6	161.3	-75.8	-162.2	162.9	0	0	107.9	T160 E164	T160-E162 PolarHBondContact O-N 3.17Å; E162-E164 PolarHBondContact O-N 3.3Å
163	M	38.5	Very low	39	Very low	157 Å²	157	158.1 Å²	158.1	77%	0.773	80%	0.796	S	S	*	*			trans	-32.5	114.7	155.2	-58.4	166.8	71.8	0	0	112.2	D161	D161-M163 VanDerWaalsContact C-N 3.27Å; D161-M163 PolarHBondContact O-N 2.75Å; D161-M163 VanDerWaalsContact O-N 3.17Å
164	E	41.5	Very low	39.5	Very low	153 Å²	153	159.4 Å²	159.4	72%	0.715	80%	0.8	S	S	*	*			trans	-128.3	78.5	138.6	-84.4	-155.5	179.8	0	0	108.3	E162 K166	E162-E164 PolarHBondContact O-N 3.3Å; E164-K166 VanDerWaalsContact C-N 3.3Å; E164-K166 PolarHBondContact O-N 2.79Å; E164-K166 IonicContact OE1-NZ 3.9Å; E164-K166 IonicContact OE2-NZ 2.79Å; E164-K166 PolarHBondContact OE2-NZ 3.01Å
165	D	40.6	Very low	39.6	Very low	135 Å²	135	158.8 Å²	158.8	72%	0.722	80%	0.801	S	S	*	*			trans	-54	99.9	146.4	-90.1	-31.5	0	0	0	108
166	K	42.3	Very low	39.9	Very low	171 Å²	171	160 Å²	160	74%	0.743	80%	0.804	S	S	*	*			trans	-107.8	67.8	153.4	-85.7	178.8	-178.5	130.9	0	108.4	E164	E164-K166 VanDerWaalsContact C-N 3.3Å; E164-K166 PolarHBondContact O-N 2.79Å; E164-K166 IonicContact OE1-NZ 3.9Å; E164-K166 IonicContact OE2-NZ 2.79Å; E164-K166 PolarHBondContact OE2-NZ 3.01Å
167	L	39.2	Very low	39.9	Very low	143 Å²	143	158.5 Å²	158.5	75%	0.749	80%	0.801	S	S	*	*			trans	-95.3	136.1	146.4	-78.5	164.1	0	0	0	107.2
168	D	40	Very low	40	Very low	160 Å²	160	157.8 Å²	157.8	86%	0.856	80%	0.802	S	S	*	*			trans	97	78.5	167.5	-53.2	-17.9	0	0	0	118.5
169	A	42.1	Very low	40.5	Very low	93 Å²	93	159.3 Å²	159.3	77%	0.769	81%	0.809	S	S	*	*				-165.2	124	129.8	0	0	0	0	0	105.6
170	E	46.1	Very low	40.8	Very low	191 Å²	191	159.9 Å²	159.9	89%	0.893	81%	0.81	S	S	*	*			cis	-152.7	149.7	40.5	-69.8	175.5	141.2	0	0	109.9
171	K	41.8	Very low	41	Very low	284 Å²	284	165.6 Å²	165.6	100%	1.235	83%	0.83	S	S	*	*			trans	-58.8	0	159.4	-83.7	176.2	171.5	174.2	0	111.7

Retrieved 171 of 171 residues in 285.6 ms (Link to these results)

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