A0A5K4FD49_SCHMA Loading...

Small ribosomal subunit protein uS12m

AlphaFold DB , UniProt , Accession A0A5K4FD49, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 118 aa.

						>A0A5K4FD49_SCHMA|A0A5K4FD49
MSPTVNLATLAQMAICGPFQKKRPPNKAMNSKPFIKGIVLKTFIRKPKKPNSANRKCVRVRLSDGREITAHIPGEGHNLQEHNIILVRGGRTQDLIGVKHKVVRGVYDCAPVQKPSSK
					

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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	46.1	Very low	64.4	Low	247 Å²	247	122.5 Å²	122.5	100%	1.217	72%	0.722	S	S	*	*				0	107.7	0	-76.6	167	162.5	0	0	107.4
2	S	45	Very low	66.3	Low	104 Å²	104	121 Å²	121	73%	0.727	70%	0.702	S	S	*	*			trans	-64.8	142.8	178.9	39.4	0	0	0	0	110	T4	S2-T4 PolarHBondContact O-N 3.1Å
3	P	50.8	Low	67.9	Low	118 Å²	118	119.5 Å²	119.5	77%	0.766	69%	0.686	S	S	*	*			trans	-66.8	114.1	174.8	28.7	-30.4	0	0	0	107.3	V5	P3-V5 VanDerWaalsContact C-N 3.33Å; P3-V5 PolarHBondContact O-N 3.39Å
4	T	51.1	Low	69.3	Low	125 Å²	125	116.9 Å²	116.9	77%	0.767	69%	0.686	S	S	*	*			trans	-63.6	97.1	167.8	28.7	0	0	0	0	107.8	S2 N6	S2-T4 PolarHBondContact O-N 3.1Å; T4-N6 PolarHBondContact O-N 3.49Å
5	V	56	Low	70.6	Confident	116 Å²	116	118.9 Å²	118.9	70%	0.703	69%	0.691	S	S	*	*			trans	-60.9	107.3	164.1	-101.6	0	0	0	0	106.9	P3 L7	P3-V5 VanDerWaalsContact C-N 3.33Å; P3-V5 PolarHBondContact O-N 3.39Å; V5-L7 HydrophobicContact CB-CD1 4.34Å; V5-L7 HydrophobicContact CB-CG 4.47Å; V5-L7 HydrophobicContact CG2-CD1 4.07Å; V5-L7 PolarHBondContact O-N 2.92Å
6	N	58.8	Low	71.7	Confident	161 Å²	161	118.4 Å²	118.4	86%	0.861	70%	0.695	S	S	*	*			trans	-62.2	82.8	169	-79.5	-24.4	0	0	0	108.8	T4	T4-N6 PolarHBondContact O-N 3.49Å
7	L	65.3	Low	72.5	Confident	135 Å²	135	113.6 Å²	113.6	71%	0.707	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-76	126.4	172.2	-79.4	142.4	0	0	0	108.1	V5 T9	V5-L7 HydrophobicContact CB-CD1 4.34Å; V5-L7 HydrophobicContact CB-CG 4.47Å; V5-L7 HydrophobicContact CG2-CD1 4.07Å; V5-L7 PolarHBondContact O-N 2.92Å; L7-T9 PolarHBondContact O-N 2.81Å
8	A	76.1	Confident	73.4	Confident	47 Å²	47	113.6 Å²	113.6	39%	0.388	68%	0.68	S	S	.	*	P	Polyproline II helix	trans	-55.6	138.5	169.6	0	0	0	0	0	109.4	Q12 M13	A8-Q12 HydrophobicContact CB-CB 4.29Å; A8-M13 HydrophobicContact CB-CE 4.22Å; A8-M13 HydrophobicContact CB-CG 4.22Å
9	T	85.8	Confident	74.2	Confident	76 Å²	76	116.8 Å²	116.8	47%	0.466	68%	0.684	S	S	.	*	P	Polyproline II helix	trans	-62.2	152.7	-179	54.6	0	0	0	0	110.8	L7 A11 Q12 M13	L7-T9 PolarHBondContact O-N 2.81Å; T9-A11 PolarHBondContact O-N 2.7Å; T9-Q12 VanDerWaalsContact N-OE1 3.13Å; T9-Q12 WeakPolarHBondContact O-CA 3.28Å; T9-Q12 WeakPolarHBondContact O-CB 3.42Å; T9-Q12 PolarHBondContact O-N 3.3Å; T9-Q12 WeakPolarHBondContact OG1-CB 3.37Å; T9-Q12 VanDerWaalsContact OG1-CD 3.24Å; T9-Q12 WeakPolarHBondContact OG1-CG 3.45Å; T9-Q12 PolarHBondContact OG1-N 2.84Å; T9-Q12 PolarHBondContact OG1-OE1 2.83Å; T9-M13 PolarHBondContact O-N 3.13Å
10	L	84.2	Confident	74.9	Confident	156 Å²	156	119.5 Å²	119.5	82%	0.817	69%	0.69	S	S	*	*	H	α-helix	trans	-53.2	-37.7	175.5	-76.1	171	0	0	0	112	M13 A14	L10-M13 PolarHBondContact O-N 3.44Å; L10-A14 WeakPolarHBondContact O-CB 3.47Å; L10-A14 PolarHBondContact O-N 2.88Å
11	A	88.8	Confident	75.5	Confident	63 Å²	63	122 Å²	122	52%	0.521	69%	0.693	S	S	.	*	H	α-helix	trans	-62.5	-44.6	174	0	0	0	0	0	112.3	T9 M13 A14 I15	T9-A11 PolarHBondContact O-N 2.7Å; A11-M13 PolarHBondContact O-N 3.17Å; A11-A14 PolarHBondContact O-N 3.2Å; A11-I15 WeakPolarHBondContact O-CD1 3.4Å; A11-I15 VanDerWaalsContact O-CG1 3.24Å; A11-I15 WeakPolarHBondContact O-CG1 3.4Å; A11-I15 PolarHBondContact O-N 2.98Å
12	Q	87.4	Confident	77.4	Confident	104 Å²	104	120.1 Å²	120.1	49%	0.486	68%	0.678	S	S	.	*	H	α-helix	trans	-63.3	-40	175.1	-76	167.1	-2.2	0	0	112.1	A8 T9 I15 C16	A8-Q12 HydrophobicContact CB-CB 4.29Å; T9-Q12 VanDerWaalsContact N-OE1 3.13Å; T9-Q12 WeakPolarHBondContact O-CA 3.28Å; T9-Q12 WeakPolarHBondContact O-CB 3.42Å; T9-Q12 PolarHBondContact O-N 3.3Å; T9-Q12 WeakPolarHBondContact OG1-CB 3.37Å; T9-Q12 VanDerWaalsContact OG1-CD 3.24Å; T9-Q12 WeakPolarHBondContact OG1-CG 3.45Å; T9-Q12 PolarHBondContact OG1-N 2.84Å; T9-Q12 PolarHBondContact OG1-OE1 2.83Å; Q12-I15 PolarHBondContact O-N 3.09Å; Q12-C16 VanDerWaalsContact O-CB 3.31Å; Q12-C16 WeakPolarHBondContact O-CB 3.49Å; Q12-C16 PolarHBondContact O-N 2.96Å
13	M	87.7	Confident	79.2	Confident	101 Å²	101	126 Å²	126	50%	0.498	68%	0.684	S	S	.	*	H	α-helix	trans	-66.6	-39.5	176.6	-70.4	-166.5	171.1	0	0	112.2	A8 T9 L10 A11 G17	A8-M13 HydrophobicContact CB-CE 4.22Å; A8-M13 HydrophobicContact CB-CG 4.22Å; T9-M13 PolarHBondContact O-N 3.13Å; L10-M13 PolarHBondContact O-N 3.44Å; A11-M13 PolarHBondContact O-N 3.17Å; M13-G17 PolarHBondContact O-N 3.18Å
14	A	87.8	Confident	80.5	Confident	83 Å²	83	126.1 Å²	126.1	69%	0.686	68%	0.684	S	S	*	*	H	α-helix	trans	-65.1	-38.5	175.6	0	0	0	0	0	112.3	L10 A11	L10-A14 WeakPolarHBondContact O-CB 3.47Å; L10-A14 PolarHBondContact O-N 2.88Å; A11-A14 PolarHBondContact O-N 3.2Å
15	I	88.6	Confident	81.6	Confident	148 Å²	148	124.7 Å²	124.7	76%	0.759	68%	0.677	S	S	*	*	H	α-helix	trans	-73.2	-47.4	177.9	-65.6	164.8	0	0	0	111.7	A11 Q12 G17	A11-I15 WeakPolarHBondContact O-CD1 3.4Å; A11-I15 VanDerWaalsContact O-CG1 3.24Å; A11-I15 WeakPolarHBondContact O-CG1 3.4Å; A11-I15 PolarHBondContact O-N 2.98Å; Q12-I15 PolarHBondContact O-N 3.09Å; I15-G17 VanDerWaalsContact C-N 3.3Å; I15-G17 PolarHBondContact O-N 2.67Å
16	C	87.2	Confident	82.5	Confident	111 Å²	111	123 Å²	123	75%	0.75	66%	0.664	S	S	*	*	H	α-helix	trans	-70.1	-28	-179	-86	0	0	0	0	112.9	Q12	Q12-C16 VanDerWaalsContact O-CB 3.31Å; Q12-C16 WeakPolarHBondContact O-CB 3.49Å; Q12-C16 PolarHBondContact O-N 2.96Å
17	G	86.5	Confident	83.6	Confident	37 Å²	37	123.7 Å²	123.7	38%	0.381	66%	0.66	S	S	.	*			trans	66.1	-169.9	-174.1	0	0	0	0	0	113.3	M13 I15	M13-G17 PolarHBondContact O-N 3.18Å; I15-G17 VanDerWaalsContact C-N 3.3Å; I15-G17 PolarHBondContact O-N 2.67Å
18	P	88.2	Confident	84.4	Confident	113 Å²	113	118.5 Å²	118.5	73%	0.734	64%	0.636	S	S	*	*	S	Bend	trans	-68.3	143.4	-178.4	27.3	-33.4	0	0	0	112	Q20	P18-Q20 PolarHBondContact O-N 2.85Å; P18-Q20 VanDerWaalsContact O-N 3.08Å
19	F	88.3	Confident	84.9	Confident	175 Å²	175	116.4 Å²	116.4	77%	0.768	62%	0.618	S	S	*	*			trans	-59.8	112.9	180	175.3	-113	0	0	0	112.6	K21	F19-K21 HydrophobicContact CD1-CG 3.76Å; F19-K21 HydrophobicContact CE1-CB 4.44Å; F19-K21 HydrophobicContact CE1-CD 4.43Å; F19-K21 HydrophobicContact CE1-CG 3.41Å; F19-K21 VanDerWaalsContact CE1-CG 3.41Å; F19-K21 HydrophobicContact CZ-CG 4.39Å; F19-K21 PolarHBondContact O-N 3.43Å
20	Q	88.1	Confident	85.1	Confident	170 Å²	170	115.9 Å²	115.9	79%	0.794	61%	0.613	S	S	*	*			trans	-82.3	102.7	176.7	-69.2	-103.3	-19.2	0	0	110.9	P18 K22	P18-Q20 PolarHBondContact O-N 2.85Å; P18-Q20 VanDerWaalsContact O-N 3.08Å; Q20-K22 PolarHBondContact O-N 2.92Å
21	K	87.7	Confident	85.2	Confident	172 Å²	172	113 Å²	113	75%	0.748	61%	0.605	S	S	*	*			trans	-67.9	114.8	175.6	-74.9	179	-176.7	178.9	0	111.2	F19 R23	F19-K21 HydrophobicContact CD1-CG 3.76Å; F19-K21 HydrophobicContact CE1-CB 4.44Å; F19-K21 HydrophobicContact CE1-CD 4.43Å; F19-K21 HydrophobicContact CE1-CG 3.41Å; F19-K21 VanDerWaalsContact CE1-CG 3.41Å; F19-K21 HydrophobicContact CZ-CG 4.39Å; F19-K21 PolarHBondContact O-N 3.43Å; K21-R23 PolarHBondContact O-N 2.85Å
22	K	86.7	Confident	85.3	Confident	208 Å²	208	114 Å²	114	90%	0.904	60%	0.598	S	S	*	*			trans	-68.8	112.2	172.5	-62.7	-174.3	-178.6	179.7	0	110.2	Q20	Q20-K22 PolarHBondContact O-N 2.92Å
23	R	81.7	Confident	85.6	Confident	228 Å²	228	113.7 Å²	113.7	86%	0.86	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-80.5	136.6	173.4	-65.5	-179.3	-177.7	158	0.9	109.9	K21	K21-R23 PolarHBondContact O-N 2.85Å
24	P	79.3	Confident	85.9	Confident	119 Å²	119	113.8 Å²	113.8	77%	0.773	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-68.1	128.5	176.8	26.3	-31.9	0	0	0	110.1
25	P	73.7	Confident	86.3	Confident	95 Å²	95	110.1 Å²	110.1	62%	0.617	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-68.1	153.4	175.6	27.3	-33.2	0	0	0	110.6	K27	P25-K27 PolarHBondContact O-N 2.86Å
26	N	74.5	Confident	86.7	Confident	80 Å²	80	107.7 Å²	107.7	43%	0.428	56%	0.556	S	S	.	*			trans	-69.9	77.5	172.6	-174.3	3.2	0	0	0	110.5	A28 M29 N30 S31	N26-A28 PolarHBondContact O-N 2.88Å; N26-M29 PolarHBondContact O-N 3.09Å; N26-N30 PolarHBondContact O-N 2.89Å; N26-S31 PolarHBondContact O-N 2.62Å
27	K	81.2	Confident	87.2	Confident	177 Å²	177	102.5 Å²	102.5	77%	0.77	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-23.3	-172.3	-158.7	169.6	-172.4	176.4	0	112.7	P25 M29	P25-K27 PolarHBondContact O-N 2.86Å; K27-M29 VanDerWaalsContact C-N 3.28Å; K27-M29 PolarHBondContact O-N 2.87Å
28	A	83.1	Confident	87.8	Confident	26 Å²	26	104.7 Å²	104.7	22%	0.215	52%	0.523	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-25.6	179.5	0	0	0	0	0	113	N26 K99 H100	N26-A28 PolarHBondContact O-N 2.88Å; A28-K99 HydrophobicContact CB-CB 4.11Å; A28-K99 HydrophobicContact CB-CD 4.39Å; A28-H100 PolarHBondContact O-NE2 2.89Å
29	M	87.3	Confident	88.2	Confident	2 Å²	2	99.3 Å²	99.3	1%	0.01	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	13.7	-175	-70.1	-154.2	62.1	0	0	114.3	N26 K27 S31 K32 P33 F34 I35 G89	N26-M29 PolarHBondContact O-N 3.09Å; K27-M29 VanDerWaalsContact C-N 3.28Å; K27-M29 PolarHBondContact O-N 2.87Å; M29-S31 PolarHBondContact O-N 2.91Å; M29-K32 WeakPolarHBondContact CB-O 3.18Å; M29-K32 HydrophobicContact CE-CB 4.43Å; M29-K32 WeakPolarHBondContact CE-O 3.38Å; M29-K32 WeakPolarHBondContact O-CB 3.12Å; M29-K32 PolarHBondContact O-N 3.15Å; M29-P33 VanDerWaalsContact CE-C 3.49Å; M29-P33 WeakPolarHBondContact CE-O 3.42Å; M29-P33 VanDerWaalsContact SD-O 3.37Å; M29-F34 VanDerWaalsContact CE-C 3.45Å; M29-F34 VanDerWaalsContact CE-CA 3.45Å; M29-I35 HydrophobicContact CB-CD1 4.38Å; M29-I35 HydrophobicContact CE-CB 4.05Å; M29-I35 HydrophobicContact CE-CD1 3.72Å; M29-I35 HydrophobicContact CE-CG1 3.49Å; M29-I35 VanDerWaalsContact CE-CG1 3.49Å; M29-G89 VanDerWaalsContact SD-CA 3.54Å; M29-G89 PolarHBondContact SD-N 2.88Å
30	N	88.4	Confident	88.7	Confident	65 Å²	65	93.7 Å²	93.7	35%	0.348	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	44.1	-176	-65.2	-17.9	0	0	0	112.4	N26 K32 D64 R66	N26-N30 PolarHBondContact O-N 2.89Å; N30-K32 PolarHBondContact O-N 2.92Å; N30-K32 VanDerWaalsContact O-N 3.07Å; N30-D64 PolarHBondContact ND2-OD2 2.74Å; N30-R66 VanDerWaalsContact CG-NH1 3.34Å; N30-R66 VanDerWaalsContact ND2-CZ 3.27Å; N30-R66 PolarHBondContact ND2-NH1 2.85Å; N30-R66 PolarHBondContact ND2-NH2 3Å; N30-R66 PolarHBondContact OD1-NH1 2.94Å; N30-R66 PolarHBondContact OD1-NH2 3.37Å; N30-R66 VanDerWaalsContact OD1-NH2 3.11Å
31	S	86.5	Confident	89.1	Confident	95 Å²	95	90 Å²	90	66%	0.664	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	6.7	-177.4	-52	0	0	0	0	116.3	N26 M29	N26-S31 PolarHBondContact O-N 2.62Å; M29-S31 PolarHBondContact O-N 2.91Å
32	K	91	Very high	89.6	Confident	85 Å²	85	84.8 Å²	84.8	37%	0.37	43%	0.43	S	S	.	.			trans	-83	146.5	172.5	-59	174.3	-177.4	174	0	110.6	M29 N30 I35 D64	M29-K32 WeakPolarHBondContact CB-O 3.18Å; M29-K32 HydrophobicContact CE-CB 4.43Å; M29-K32 WeakPolarHBondContact CE-O 3.38Å; M29-K32 WeakPolarHBondContact O-CB 3.12Å; M29-K32 PolarHBondContact O-N 3.15Å; N30-K32 PolarHBondContact O-N 2.92Å; N30-K32 VanDerWaalsContact O-N 3.07Å; K32-I35 HydrophobicContact CB-CD1 4.32Å; K32-I35 HydrophobicContact CB-CG1 4.02Å; K32-I35 HydrophobicContact CD-CD1 4.03Å; K32-I35 HydrophobicContact CD-CG1 3.82Å; K32-D64 VanDerWaalsContact NZ-CG 3.29Å; K32-D64 IonicContact NZ-OD1 2.74Å; K32-D64 PolarHBondContact NZ-OD1 3.11Å; K32-D64 IonicContact NZ-OD2 3.05Å; K32-D64 PolarHBondContact NZ-OD2 3.11Å
33	P	93.4	Very high	90.1	Very high	97 Å²	97	77.1 Å²	77.1	63%	0.63	40%	0.397	S	S	*	.	S	Bend	trans	-76.9	-40	175.4	28.7	-33.1	0	0	0	112.5	M29	M29-P33 VanDerWaalsContact CE-C 3.49Å; M29-P33 WeakPolarHBondContact CE-O 3.42Å; M29-P33 VanDerWaalsContact SD-O 3.37Å
34	F	95.3	Very high	90.8	Very high	103 Å²	103	71.2 Å²	71.2	45%	0.452	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	148.2	-179.6	-57.3	-80.7	0	0	0	110.3	M29 L86 V87 R88 V103	M29-F34 VanDerWaalsContact CE-C 3.45Å; M29-F34 VanDerWaalsContact CE-CA 3.45Å; F34-L86 HydrophobicContact CB-CD1 3.83Å; F34-L86 HydrophobicContact CB-CD2 4.06Å; F34-L86 HydrophobicContact CB-CG 4Å; F34-L86 HydrophobicContact CD1-CD2 3.93Å; F34-L86 HydrophobicContact CD1-CG 4.25Å; F34-L86 HydrophobicContact CG-CD2 4.06Å; F34-L86 HydrophobicContact CG-CG 4.42Å; F34-V87 WeakPolarHBondContact CA-O 3.24Å; F34-R88 HydrophobicContact CD1-CB 3.59Å; F34-R88 HydrophobicContact CE1-CB 3.6Å; F34-R88 HydrophobicContact CE1-CG 4.47Å; F34-V103 HydrophobicContact CD1-CG2 3.87Å; F34-V103 HydrophobicContact CE1-CG2 3.85Å
35	I	95.9	Very high	91.7	Very high	7 Å²	7	70.3 Å²	70.3	4%	0.036	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	134.2	175.1	-63.3	169	0	0	0	108.7	M29 K32 L62 S63 V87	M29-I35 HydrophobicContact CB-CD1 4.38Å; M29-I35 HydrophobicContact CE-CB 4.05Å; M29-I35 HydrophobicContact CE-CD1 3.72Å; M29-I35 HydrophobicContact CE-CG1 3.49Å; M29-I35 VanDerWaalsContact CE-CG1 3.49Å; K32-I35 HydrophobicContact CB-CD1 4.32Å; K32-I35 HydrophobicContact CB-CG1 4.02Å; K32-I35 HydrophobicContact CD-CD1 4.03Å; K32-I35 HydrophobicContact CD-CG1 3.82Å; I35-L62 HydrophobicContact CB-CD2 4.26Å; I35-L62 HydrophobicContact CD1-CD1 4.37Å; I35-L62 HydrophobicContact CG2-CB 3.93Å; I35-L62 HydrophobicContact CG2-CD1 4.4Å; I35-L62 HydrophobicContact CG2-CD2 3.85Å; I35-L62 HydrophobicContact CG2-CG 4.27Å; I35-S63 WeakPolarHBondContact CG2-OG 3.41Å; I35-V87 PolarHBondContact N-O 3.43Å; I35-V87 PolarHBondContact O-N 3.18Å
36	K	97.1	Very high	92.8	Very high	96 Å²	96	72.9 Å²	72.9	42%	0.417	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	143.8	173.4	-172.6	-178.8	-177.3	-175.8	0	109.9	S63 I84 Y107	K36-S63 PolarHBondContact O-N 3.35Å; K36-I84 HydrophobicContact CD-CG2 4.2Å; K36-I84 HydrophobicContact CG-CG2 3.99Å; K36-Y107 HydrophobicContact CD-CE2 4.49Å; K36-Y107 HydrophobicContact CG-CE2 4.08Å
37	G	97.3	Very high	93.9	Very high	3 Å²	3	70 Å²	70	3%	0.031	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	166.1	175.5	0	0	0	0	0	113.2	R61 I84 I85	G37-R61 CarbonylContact C-O 3.59Å; G37-R61 WeakPolarHBondContact CA-O 3.24Å; G37-I84 WeakPolarHBondContact O-CA 3.4Å; G37-I85 PolarHBondContact N-O 3.39Å; G37-I85 PolarHBondContact O-N 2.93Å
38	I	98.2	Very high	94.5	Very high	82 Å²	82	66.3 Å²	66.3	42%	0.421	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.4	177.3	-63	168.7	0	0	0	108.3	V60 R61 N83	I38-V60 CarbonylContact O-C 3.48Å; I38-V60 WeakPolarHBondContact O-CA 3.41Å; I38-V60 WeakPolarHBondContact O-CG1 3.34Å; I38-R61 PolarHBondContact N-O 3.33Å; I38-R61 PolarHBondContact O-N 2.88Å; I38-N83 WeakPolarHBondContact CA-O 3.44Å
39	V	98.2	Very high	95	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	125.3	175.7	178.2	0	0	0	0	109.6	T42 V58 Q80 H82 N83 I85	V39-T42 HydrophobicContact CG1-CG2 4.28Å; V39-V58 HydrophobicContact CG1-CB 4.35Å; V39-V58 HydrophobicContact CG1-CG1 3.81Å; V39-V58 HydrophobicContact CG2-CG1 4.4Å; V39-Q80 WeakPolarHBondContact CB-O 3.42Å; V39-Q80 WeakPolarHBondContact CG1-O 3.43Å; V39-H82 PolarHBondContact O-N 3.16Å; V39-N83 HydrophobicContact CG2-CB 4.48Å; V39-N83 PolarHBondContact N-O 2.93Å; V39-I85 HydrophobicContact CG2-CD1 3.75Å; V39-I85 HydrophobicContact CG2-CG1 4.02Å; V39-I85 HydrophobicContact CG2-CG2 4.06Å
40	L	98	Very high	95.4	Very high	58 Å²	58	80.3 Å²	80.3	30%	0.304	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-44.4	174.1	-63	175.9	0	0	0	111.5	R59 R61 E67 E81	L40-R59 HydrophobicContact CB-CB 4.16Å; L40-R59 HydrophobicContact CB-CG 4.3Å; L40-R59 HydrophobicContact CD1-CG 4.04Å; L40-R59 PolarHBondContact N-O 2.83Å; L40-R61 HydrophobicContact CD1-CB 4.19Å; L40-R61 HydrophobicContact CD2-CB 4.22Å; L40-R61 HydrophobicContact CG-CB 4.19Å; L40-E67 HydrophobicContact CD1-CG 3.94Å; L40-E81 WeakPolarHBondContact O-CG 3.36Å
41	K	97.4	Very high	95.7	Very high	92 Å²	92	80.9 Å²	80.9	40%	0.4	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	145.9	175.9	62.2	175.1	-177.9	-174.8	0	112.2	F43 V58 R59	K41-F43 HydrophobicContact CD-CD1 4.45Å; K41-F43 HydrophobicContact CG-CD1 4.06Å; K41-V58 WeakPolarHBondContact O-CA 3.43Å; K41-R59 HydrophobicContact CG-CB 3.62Å; K41-R59 PolarHBondContact O-N 3.35Å
42	T	97.3	Very high	96.1	Very high	62 Å²	62	81.9 Å²	81.9	38%	0.38	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	138.3	168.3	64.2	0	0	0	0	109.2	V39 V58 L79	V39-T42 HydrophobicContact CG1-CG2 4.28Å; T42-V58 HydrophobicContact CG2-CG1 3.68Å; T42-L79 HydrophobicContact CG2-CB 4.36Å; T42-L79 VanDerWaalsContact CG2-O 3.28Å; T42-L79 WeakPolarHBondContact CG2-O 3.35Å
43	F	97.2	Very high	96.3	Very high	48 Å²	48	79.4 Å²	79.4	21%	0.211	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	162.2	177.1	63	-85.2	0	0	0	111.7	K41 R45 C57 R59 T69	K41-F43 HydrophobicContact CD-CD1 4.45Å; K41-F43 HydrophobicContact CG-CD1 4.06Å; F43-R45 HydrophobicContact CD2-CG 4.2Å; F43-R45 HydrophobicContact CE2-CG 3.83Å; F43-C57 HydrophobicContact CD2-CB 4.32Å; F43-C57 HydrophobicContact CE2-CB 4.01Å; F43-C57 HydrophobicContact CZ-CB 4.2Å; F43-C57 PolarHBondContact N-O 3.08Å; F43-C57 CarbonylContact O-C 3.44Å; F43-C57 WeakPolarHBondContact O-CA 3.17Å; F43-C57 PolarHBondContact O-N 2.98Å; F43-R59 HydrophobicContact CE1-CB 3.89Å; F43-T69 HydrophobicContact CE1-CG2 4.4Å; F43-T69 HydrophobicContact CE2-CG2 4.24Å; F43-T69 HydrophobicContact CZ-CG2 3.56Å
44	I	97.3	Very high	96.5	Very high	104 Å²	104	79.4 Å²	79.4	53%	0.533	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	134.8	179.3	-59.8	173.7	0	0	0	108.9	N54 R55	I44-N54 HydrophobicContact CG2-CB 3.6Å; I44-R55 WeakPolarHBondContact CA-O 3.36Å
45	R	96.6	Very high	96.5	Very high	100 Å²	100	78.7 Å²	78.7	38%	0.377	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.7	168.8	-95.6	-179	178.6	-154.7	0.9	110.8	F43 R55 L95 I96	F43-R45 HydrophobicContact CD2-CG 4.2Å; F43-R45 HydrophobicContact CE2-CG 3.83Å; R45-R55 PolarHBondContact N-O 3.14Å; R45-R55 WeakPolarHBondContact O-CB 3.47Å; R45-R55 PolarHBondContact O-N 2.93Å; R45-L95 HydrophobicContact CB-CD2 3.81Å; R45-I96 PolarHBondContact NH1-O 3.18Å; R45-I96 VanDerWaalsContact NH1-O 3.08Å
46	K	96.7	Very high	96.6	Very high	148 Å²	148	82.2 Å²	82.2	64%	0.643	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-77.7	141	168.2	-62.2	-66.6	-167.5	167.7	0	109.7	A53 N54	K46-A53 WeakPolarHBondContact CD-O 3.09Å; K46-N54 WeakPolarHBondContact CD-OD1 3.44Å; K46-N54 WeakPolarHBondContact CE-OD1 3.5Å; K46-N54 PolarHBondContact NZ-OD1 2.74Å
47	P	97.6	Very high	96.6	Very high	19 Å²	19	77.7 Å²	77.7	12%	0.123	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-70.7	167.7	174.8	31.7	-36.8	0	0	0	112.4	N51 A53 D94	P47-N51 HydrophobicContact CB-CB 4.3Å; P47-N51 HydrophobicContact CG-CB 4.25Å; P47-N51 WeakPolarHBondContact CG-O 3.21Å; P47-A53 WeakPolarHBondContact CD-O 3.33Å; P47-A53 HydrophobicContact CG-CB 4.25Å; P47-D94 WeakPolarHBondContact CA-O 3.42Å; P47-D94 HydrophobicContact CB-CB 3.7Å
48	K	95.2	Very high	96.6	Very high	100 Å²	100	77.5 Å²	77.5	44%	0.435	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-68.6	148.7	166.8	69.1	176.4	-177.2	156.6	0	110.6	N51 Q93 D94 I96	K48-N51 PolarHBondContact O-N 2.93Å; K48-Q93 WeakPolarHBondContact CE-O 3.17Å; K48-D94 WeakPolarHBondContact CG-O 3.02Å; K48-D94 PolarHBondContact N-O 2.94Å; K48-I96 HydrophobicContact CB-CD1 4.29Å; K48-I96 HydrophobicContact CB-CG1 4.4Å
49	K	92.5	Very high	96.6	Very high	202 Å²	202	77.6 Å²	77.6	88%	0.878	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	139.5	164.2	-62.3	-176	179.5	-176.6	0	108.5
50	P	96.1	Very high	96.6	Very high	120 Å²	120	77.6 Å²	77.6	78%	0.779	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.9	-6.5	15.8	34.5	-37.7	0	0	0	115.5
51	N	95.8	Very high	96.6	Very high	78 Å²	78	81.6 Å²	81.6	42%	0.417	40%	0.396	S	S	.	.			trans	-84.1	150	-173.4	-63.4	-19.6	0	0	0	110.9	P47 K48 D94	P47-N51 HydrophobicContact CB-CB 4.3Å; P47-N51 HydrophobicContact CG-CB 4.25Å; P47-N51 WeakPolarHBondContact CG-O 3.21Å; K48-N51 PolarHBondContact O-N 2.93Å; N51-D94 PolarHBondContact ND2-OD1 3.34Å
52	S	94.3	Very high	96.5	Very high	116 Å²	116	77.7 Å²	77.7	81%	0.811	38%	0.379	S	S	*	.			trans	-131.8	122.6	173.1	58.2	0	0	0	0	110
53	A	95.4	Very high	96.4	Very high	33 Å²	33	78.8 Å²	78.8	27%	0.273	39%	0.39	S	S	.	.			trans	-167.6	172.1	178.8	0	0	0	0	0	111	K46 P47	K46-A53 WeakPolarHBondContact CD-O 3.09Å; P47-A53 WeakPolarHBondContact CD-O 3.33Å; P47-A53 HydrophobicContact CG-CB 4.25Å
54	N	96.1	Very high	96.2	Very high	97 Å²	97	79 Å²	79	52%	0.519	39%	0.393	S	S	.	.			trans	-105.6	99.9	167.4	-74	-14.3	0	0	0	109.1	I44 K46	I44-N54 HydrophobicContact CG2-CB 3.6Å; K46-N54 WeakPolarHBondContact CD-OD1 3.44Å; K46-N54 WeakPolarHBondContact CE-OD1 3.5Å; K46-N54 PolarHBondContact NZ-OD1 2.74Å
55	R	96.6	Very high	96.1	Very high	88 Å²	88	76.1 Å²	76.1	33%	0.332	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	123.3	179.2	-59.8	-63.2	-168.3	-171.5	0.7	110.4	I44 R45 C57 D94 L95	I44-R55 WeakPolarHBondContact CA-O 3.36Å; R45-R55 PolarHBondContact N-O 3.14Å; R45-R55 WeakPolarHBondContact O-CB 3.47Å; R45-R55 PolarHBondContact O-N 2.93Å; R55-C57 PolarHBondContact O-N 2.86Å; R55-D94 IonicContact CZ-OD2 3.52Å; R55-D94 IonicContact NE-OD2 3.55Å; R55-D94 IonicContact NH2-OD2 2.74Å; R55-D94 PolarHBondContact NH2-OD2 3.3Å; R55-L95 HydrophobicContact CB-CD1 3.85Å; R55-L95 HydrophobicContact CB-CD2 4.06Å; R55-L95 HydrophobicContact CB-CG 4.31Å; R55-L95 HydrophobicContact CG-CD1 4.23Å; R55-L95 HydrophobicContact CG-CD2 4.05Å; R55-L95 HydrophobicContact CG-CG 4.22Å
56	K	97	Very high	96	Very high	80 Å²	80	77.2 Å²	77.2	35%	0.348	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	120.2	177.2	-61.7	176.4	-175.4	-180	0	109.6	I72	K56-I72 HydrophobicContact CB-CB 4.46Å; K56-I72 HydrophobicContact CB-CD1 4.43Å; K56-I72 PolarHBondContact O-N 2.85Å; K56-I72 VanDerWaalsContact O-N 3.09Å
57	C	97.2	Very high	96	Very high	1 Å²	1	75.6 Å²	75.6	1%	0.007	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	161.9	-177.8	-59.5	0	0	0	0	110.3	F43 R55 T69 A70 L95	F43-C57 HydrophobicContact CD2-CB 4.32Å; F43-C57 HydrophobicContact CE2-CB 4.01Å; F43-C57 HydrophobicContact CZ-CB 4.2Å; F43-C57 PolarHBondContact N-O 3.08Å; F43-C57 CarbonylContact O-C 3.44Å; F43-C57 WeakPolarHBondContact O-CA 3.17Å; F43-C57 PolarHBondContact O-N 2.98Å; R55-C57 PolarHBondContact O-N 2.86Å; C57-T69 HydrophobicContact CB-CG2 4.1Å; C57-A70 CarbonylContact C-O 3.16Å; C57-A70 WeakPolarHBondContact CA-O 3.42Å; C57-L95 VanDerWaalsContact SG-CD1 3.53Å
58	V	97.8	Very high	95.9	Very high	0 Å²	0	75.8 Å²	75.8	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	140.9	175.5	-90.7	0	0	0	0	110.1	V39 K41 T42 V60 T69 A70 I72 L79 I85 V102	V39-V58 HydrophobicContact CG1-CB 4.35Å; V39-V58 HydrophobicContact CG1-CG1 3.81Å; V39-V58 HydrophobicContact CG2-CG1 4.4Å; K41-V58 WeakPolarHBondContact O-CA 3.43Å; T42-V58 HydrophobicContact CG2-CG1 3.68Å; V58-V60 HydrophobicContact CB-CG2 4Å; V58-V60 HydrophobicContact CG2-CG2 3.83Å; V58-T69 CarbonylContact O-C 3.56Å; V58-T69 WeakPolarHBondContact O-CA 3.29Å; V58-A70 HydrophobicContact CG2-CB 4.17Å; V58-A70 WeakPolarHBondContact CG2-O 3.32Å; V58-A70 PolarHBondContact N-O 2.95Å; V58-A70 PolarHBondContact O-N 2.88Å; V58-I72 HydrophobicContact CG1-CD1 3.9Å; V58-I72 HydrophobicContact CG2-CD1 4.2Å; V58-I72 HydrophobicContact CG2-CG1 3.89Å; V58-L79 HydrophobicContact CG1-CD1 4.24Å; V58-I85 HydrophobicContact CG2-CD1 4.43Å; V58-V102 HydrophobicContact CG2-CG2 3.72Å
59	R	98	Very high	96	Very high	84 Å²	84	72.1 Å²	72.1	32%	0.317	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	126.9	163.7	-162.1	80.9	73.8	107	-2.2	106.3	L40 K41 F43 I68	L40-R59 HydrophobicContact CB-CB 4.16Å; L40-R59 HydrophobicContact CB-CG 4.3Å; L40-R59 HydrophobicContact CD1-CG 4.04Å; L40-R59 PolarHBondContact N-O 2.83Å; K41-R59 HydrophobicContact CG-CB 3.62Å; K41-R59 PolarHBondContact O-N 3.35Å; F43-R59 HydrophobicContact CE1-CB 3.89Å; R59-I68 WeakPolarHBondContact CA-O 3.38Å
60	V	97.9	Very high	96.2	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.9	-172.5	-170.8	0	0	0	0	108.7	I38 V58 L62 E67 I68 A70 I85 V87	I38-V60 CarbonylContact O-C 3.48Å; I38-V60 WeakPolarHBondContact O-CA 3.41Å; I38-V60 WeakPolarHBondContact O-CG1 3.34Å; V58-V60 HydrophobicContact CB-CG2 4Å; V58-V60 HydrophobicContact CG2-CG2 3.83Å; V60-L62 HydrophobicContact CG1-CD2 4.39Å; V60-E67 WeakPolarHBondContact O-CA 3.24Å; V60-I68 HydrophobicContact CB-CG1 4.1Å; V60-I68 PolarHBondContact N-O 2.87Å; V60-I68 PolarHBondContact O-N 3.19Å; V60-A70 HydrophobicContact CG2-CB 4.1Å; V60-I85 HydrophobicContact CB-CD1 4.46Å; V60-I85 HydrophobicContact CG1-CD1 3.91Å; V60-I85 HydrophobicContact CG1-CG1 4.15Å; V60-I85 HydrophobicContact CG2-CD1 3.65Å; V60-V87 HydrophobicContact CG1-CG2 4.2Å
61	R	97.7	Very high	96.3	Very high	141 Å²	141	58 Å²	58	53%	0.532	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	113.9	166.5	-170.4	172.2	-177	-178.1	-0.5	108.3	G37 I38 L40	G37-R61 CarbonylContact C-O 3.59Å; G37-R61 WeakPolarHBondContact CA-O 3.24Å; I38-R61 PolarHBondContact N-O 3.33Å; I38-R61 PolarHBondContact O-N 2.88Å; L40-R61 HydrophobicContact CD1-CB 4.19Å; L40-R61 HydrophobicContact CD2-CB 4.22Å; L40-R61 HydrophobicContact CG-CB 4.19Å
62	L	96.6	Very high	96.3	Very high	10 Å²	10	54.5 Å²	54.5	5%	0.052	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	160.6	178.2	-63.6	178.4	0	0	0	110.9	I35 V60 D64 G65 R66 I68 V87	I35-L62 HydrophobicContact CB-CD2 4.26Å; I35-L62 HydrophobicContact CD1-CD1 4.37Å; I35-L62 HydrophobicContact CG2-CB 3.93Å; I35-L62 HydrophobicContact CG2-CD1 4.4Å; I35-L62 HydrophobicContact CG2-CD2 3.85Å; I35-L62 HydrophobicContact CG2-CG 4.27Å; V60-L62 HydrophobicContact CG1-CD2 4.39Å; L62-D64 PolarHBondContact O-N 3.32Å; L62-D64 VanDerWaalsContact O-N 3.15Å; L62-G65 PolarHBondContact O-N 3.06Å; L62-R66 PolarHBondContact N-O 3.44Å; L62-I68 HydrophobicContact CD1-CD1 3.91Å; L62-I68 HydrophobicContact CD1-CG1 4.11Å; L62-I68 HydrophobicContact CD1-CG2 3.97Å; L62-I68 HydrophobicContact CD2-CD1 3.75Å; L62-I68 HydrophobicContact CD2-CG1 4.14Å; L62-I68 HydrophobicContact CG-CD1 3.95Å; L62-I68 HydrophobicContact CG-CG1 3.93Å; L62-V87 HydrophobicContact CD2-CB 4.3Å; L62-V87 HydrophobicContact CD2-CG2 4.27Å
63	S	95.7	Very high	96.4	Very high	85 Å²	85	50.4 Å²	50.4	59%	0.594	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-29.5	170.8	59.7	0	0	0	0	113.1	I35 K36 G65	I35-S63 WeakPolarHBondContact CG2-OG 3.41Å; K36-S63 PolarHBondContact O-N 3.35Å; S63-G65 PolarHBondContact O-N 2.75Å
64	D	92.7	Very high	96.3	Very high	52 Å²	52	51.6 Å²	51.6	28%	0.278	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	9.6	177.5	-63.3	4	0	0	0	112.6	N30 K32 L62 R66	N30-D64 PolarHBondContact ND2-OD2 2.74Å; K32-D64 VanDerWaalsContact NZ-CG 3.29Å; K32-D64 IonicContact NZ-OD1 2.74Å; K32-D64 PolarHBondContact NZ-OD1 3.11Å; K32-D64 IonicContact NZ-OD2 3.05Å; K32-D64 PolarHBondContact NZ-OD2 3.11Å; L62-D64 PolarHBondContact O-N 3.32Å; L62-D64 VanDerWaalsContact O-N 3.15Å; D64-R66 PolarHBondContact O-N 3.26Å; D64-R66 VanDerWaalsContact O-N 3.14Å
65	G	93.8	Very high	96.2	Very high	44 Å²	44	55 Å²	55	45%	0.454	28%	0.281	S	S	.	.	S	Bend	trans	79.7	-15.5	178.3	0	0	0	0	0	115.3	L62 S63	L62-G65 PolarHBondContact O-N 3.06Å; S63-G65 PolarHBondContact O-N 2.75Å
66	R	94.8	Very high	95.9	Very high	123 Å²	123	52.5 Å²	52.5	46%	0.464	28%	0.283	S	S	.	.			trans	-72.1	136.5	-179.1	-60.6	179.6	-172.8	169.5	4.3	111.8	N30 L62 D64	N30-R66 VanDerWaalsContact CG-NH1 3.34Å; N30-R66 VanDerWaalsContact ND2-CZ 3.27Å; N30-R66 PolarHBondContact ND2-NH1 2.85Å; N30-R66 PolarHBondContact ND2-NH2 3Å; N30-R66 PolarHBondContact OD1-NH1 2.94Å; N30-R66 PolarHBondContact OD1-NH2 3.37Å; N30-R66 VanDerWaalsContact OD1-NH2 3.11Å; L62-R66 PolarHBondContact N-O 3.44Å; D64-R66 PolarHBondContact O-N 3.26Å; D64-R66 VanDerWaalsContact O-N 3.14Å
67	E	96.5	Very high	95.8	Very high	115 Å²	115	51.8 Å²	51.8	54%	0.537	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	129.4	167.1	-65.8	-171.9	-173.7	0	0	110.9	L40 V60	L40-E67 HydrophobicContact CD1-CG 3.94Å; V60-E67 WeakPolarHBondContact O-CA 3.24Å
68	I	96	Very high	95.7	Very high	23 Å²	23	56.5 Å²	56.5	12%	0.118	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	166.1	179.8	62	155.7	0	0	0	110.8	R59 V60 L62 V87 H100	R59-I68 WeakPolarHBondContact CA-O 3.38Å; V60-I68 HydrophobicContact CB-CG1 4.1Å; V60-I68 PolarHBondContact N-O 2.87Å; V60-I68 PolarHBondContact O-N 3.19Å; L62-I68 HydrophobicContact CD1-CD1 3.91Å; L62-I68 HydrophobicContact CD1-CG1 4.11Å; L62-I68 HydrophobicContact CD1-CG2 3.97Å; L62-I68 HydrophobicContact CD2-CD1 3.75Å; L62-I68 HydrophobicContact CD2-CG1 4.14Å; L62-I68 HydrophobicContact CG-CD1 3.95Å; L62-I68 HydrophobicContact CG-CG1 3.93Å; I68-V87 HydrophobicContact CD1-CG1 3.97Å; I68-H100 HydrophobicContact CD1-CB 3.75Å; I68-H100 VanDerWaalsContact CD1-CD2 3.47Å; I68-H100 WeakPolarHBondContact CD1-CD2 3.35Å; I68-H100 VanDerWaalsContact CD1-CG 3.44Å
69	T	97.2	Very high	95.6	Very high	23 Å²	23	57 Å²	57	14%	0.141	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	125.5	165.1	-57.9	0	0	0	0	108.9	F43 C57 V58 V98	F43-T69 HydrophobicContact CE1-CG2 4.4Å; F43-T69 HydrophobicContact CE2-CG2 4.24Å; F43-T69 HydrophobicContact CZ-CG2 3.56Å; C57-T69 HydrophobicContact CB-CG2 4.1Å; V58-T69 CarbonylContact O-C 3.56Å; V58-T69 WeakPolarHBondContact O-CA 3.29Å; T69-V98 HydrophobicContact CG2-CG2 3.85Å
70	A	97.5	Very high	95.5	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	143.5	175.1	0	0	0	0	0	111.1	C57 V58 V60 V87 H100 V102	C57-A70 CarbonylContact C-O 3.16Å; C57-A70 WeakPolarHBondContact CA-O 3.42Å; V58-A70 HydrophobicContact CG2-CB 4.17Å; V58-A70 WeakPolarHBondContact CG2-O 3.32Å; V58-A70 PolarHBondContact N-O 2.95Å; V58-A70 PolarHBondContact O-N 2.88Å; V60-A70 HydrophobicContact CG2-CB 4.1Å; A70-V87 HydrophobicContact CB-CG1 4.31Å; A70-H100 WeakPolarHBondContact CA-O 3.48Å; A70-H100 HydrophobicContact CB-CB 3.98Å; A70-V102 HydrophobicContact CB-CG2 3.95Å
71	H	97.4	Very high	95.4	Very high	25 Å²	25	64.4 Å²	64.4	12%	0.116	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	138.6	173.9	176	-92	0	0	0	110.6	P73 T92 V98 H100 K101 V102	H71-P73 WeakPolarHBondContact O-CD 3.2Å; H71-T92 VanDerWaalsContact CB-OG1 3.29Å; H71-T92 WeakPolarHBondContact CB-OG1 3.42Å; H71-V98 HydrophobicContact CB-CG1 3.91Å; H71-H100 PolarHBondContact N-O 3.42Å; H71-K101 HydrophobicContact CB-CG 4.4Å; H71-K101 WeakPolarHBondContact O-CA 3.4Å; H71-V102 PolarHBondContact O-N 3.42Å
72	I	96.8	Very high	95.4	Very high	4 Å²	4	64.7 Å²	64.7	2%	0.021	35%	0.354	C	S	.	.			trans	-94	113.4	176.3	-52	175.7	0	0	0	108.5	K56 V58 H77 L79 V102	K56-I72 HydrophobicContact CB-CB 4.46Å; K56-I72 HydrophobicContact CB-CD1 4.43Å; K56-I72 PolarHBondContact O-N 2.85Å; K56-I72 VanDerWaalsContact O-N 3.09Å; V58-I72 HydrophobicContact CG1-CD1 3.9Å; V58-I72 HydrophobicContact CG2-CD1 4.2Å; V58-I72 HydrophobicContact CG2-CG1 3.89Å; I72-H77 HydrophobicContact CD1-CB 4.39Å; I72-H77 WeakPolarHBondContact CD1-CD2 3.47Å; I72-H77 HydrophobicContact CG2-CB 3.95Å; I72-L79 HydrophobicContact CD1-CD1 3.87Å; I72-L79 HydrophobicContact CG1-CD1 4.3Å; I72-V102 HydrophobicContact CG1-CG2 4.16Å
73	P	96.3	Very high	95.5	Very high	31 Å²	31	65.7 Å²	65.7	20%	0.201	36%	0.359	C	S	.	.			trans	-78.1	155.7	179.6	32.6	-34	0	0	0	112.1	H71 V102 R104	H71-P73 WeakPolarHBondContact O-CD 3.2Å; P73-V102 VanDerWaalsContact CD-O 3.24Å; P73-V102 WeakPolarHBondContact CD-O 3.47Å; P73-V102 VanDerWaalsContact CG-O 3.24Å; P73-V102 WeakPolarHBondContact CG-O 3.32Å; P73-R104 HydrophobicContact CG-CG 4.04Å; P73-R104 PolarHBondContact O-NE 3.05Å; P73-R104 PolarHBondContact O-NH2 2.76Å
74	G	94	Very high	95.6	Very high	58 Å²	58	64.3 Å²	64.3	60%	0.598	34%	0.344	S	S	*	.	S	Bend	trans	81	-170.9	179.7	0	0	0	0	0	113.9
75	E	92.5	Very high	95.8	Very high	167 Å²	167	61.8 Å²	61.8	78%	0.78	33%	0.331	S	S	*	.	S	Bend	trans	-103.7	148.8	-178.3	-61.5	-178.4	177.3	0	0	111	R104	E75-R104 PolarHBondContact O-NH2 3.31Å
76	G	91.6	Very high	96	Very high	37 Å²	37	61 Å²	61	38%	0.381	32%	0.316	S	S	.	.			trans	60.4	162.9	-171.9	0	0	0	0	0	113.8	R104	G76-R104 PolarHBondContact O-NH2 3.48Å
77	H	94.3	Very high	96.1	Very high	64 Å²	64	55.2 Å²	55.2	30%	0.296	29%	0.294	S	S	.	.			trans	-165	153.5	163.9	68.7	-52.3	0	0	0	109.6	I72	I72-H77 HydrophobicContact CD1-CB 4.39Å; I72-H77 WeakPolarHBondContact CD1-CD2 3.47Å; I72-H77 HydrophobicContact CG2-CB 3.95Å
78	N	93.9	Very high	96	Very high	101 Å²	101	55.4 Å²	55.4	54%	0.54	29%	0.29	S	S	.	.			trans	-109.9	20.5	180	-168.3	38.4	0	0	0	112.7
79	L	96	Very high	95.9	Very high	9 Å²	9	55.7 Å²	55.7	5%	0.047	30%	0.299	C	S	.	.			trans	-79.2	131	-176.4	-58.5	177	0	0	0	110.5	T42 V58 I72 N83 I85 V102 C109	T42-L79 HydrophobicContact CG2-CB 4.36Å; T42-L79 VanDerWaalsContact CG2-O 3.28Å; T42-L79 WeakPolarHBondContact CG2-O 3.35Å; V58-L79 HydrophobicContact CG1-CD1 4.24Å; I72-L79 HydrophobicContact CD1-CD1 3.87Å; I72-L79 HydrophobicContact CG1-CD1 4.3Å; L79-N83 HydrophobicContact CD2-CB 4.48Å; L79-I85 HydrophobicContact CD1-CG2 4.03Å; L79-I85 HydrophobicContact CD2-CG2 3.43Å; L79-I85 VanDerWaalsContact CD2-CG2 3.43Å; L79-I85 HydrophobicContact CG-CG2 4.39Å; L79-V102 HydrophobicContact CD1-CG1 4.41Å; L79-C109 HydrophobicContact CD2-CB 3.96Å
80	Q	96.4	Very high	95.7	Very high	124 Å²	124	55.7 Å²	55.7	58%	0.579	30%	0.303	S	S	*	.			trans	-117.4	175.6	172.5	-63.3	179.1	-11	0	0	109.5	V39 N83	V39-Q80 WeakPolarHBondContact CB-O 3.42Å; V39-Q80 WeakPolarHBondContact CG1-O 3.43Å; Q80-N83 PolarHBondContact N-ND2 2.92Å; Q80-N83 WeakPolarHBondContact O-CB 3.44Å; Q80-N83 PolarHBondContact O-N 3.19Å
81	E	97	Very high	95.6	Very high	116 Å²	116	62.9 Å²	62.9	54%	0.542	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	147.6	171.7	-59.2	-174.3	167.7	0	0	110.1	L40 N83	L40-E81 WeakPolarHBondContact O-CG 3.36Å; E81-N83 PolarHBondContact O-N 2.92Å; E81-N83 VanDerWaalsContact O-N 3.1Å
82	H	97.1	Very high	95.5	Very high	148 Å²	148	62.2 Å²	62.2	69%	0.685	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	-5.3	-176.1	-49.6	131.4	0	0	0	117.1	V39	V39-H82 PolarHBondContact O-N 3.16Å
83	N	97.4	Very high	95.3	Very high	30 Å²	30	69 Å²	69	16%	0.16	36%	0.36	C	S	.	.			trans	-61.5	142.6	172.8	-75.7	22.7	0	0	0	111.6	I38 V39 L79 Q80 E81 D108	I38-N83 WeakPolarHBondContact CA-O 3.44Å; V39-N83 HydrophobicContact CG2-CB 4.48Å; V39-N83 PolarHBondContact N-O 2.93Å; L79-N83 HydrophobicContact CD2-CB 4.48Å; Q80-N83 PolarHBondContact N-ND2 2.92Å; Q80-N83 WeakPolarHBondContact O-CB 3.44Å; Q80-N83 PolarHBondContact O-N 3.19Å; E81-N83 PolarHBondContact O-N 2.92Å; E81-N83 VanDerWaalsContact O-N 3.1Å; N83-D108 WeakPolarHBondContact CA-OD2 3.41Å; N83-D108 HydrophobicContact CB-CB 3.9Å
84	I	97.8	Very high	95.3	Very high	56 Å²	56	68.7 Å²	68.7	29%	0.287	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	130.7	175.7	-60.3	176.1	0	0	0	108.8	K36 G37 Y107 D108	K36-I84 HydrophobicContact CD-CG2 4.2Å; K36-I84 HydrophobicContact CG-CG2 3.99Å; G37-I84 WeakPolarHBondContact O-CA 3.4Å; I84-Y107 HydrophobicContact CG2-CD1 4.19Å; I84-Y107 HydrophobicContact CG2-CD2 4.01Å; I84-Y107 HydrophobicContact CG2-CE2 4.45Å; I84-Y107 HydrophobicContact CG2-CG 3.86Å; I84-Y107 WeakPolarHBondContact O-CB 3.48Å; I84-D108 PolarHBondContact N-OD2 2.94Å; I84-D108 PolarHBondContact O-N 2.83Å
85	I	97.7	Very high	95.3	Very high	0 Å²	0	66 Å²	66	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	157.6	179.3	58	167.2	0	0	0	112	G37 V39 V58 V60 L79 V87 V102 C109	G37-I85 PolarHBondContact N-O 3.39Å; G37-I85 PolarHBondContact O-N 2.93Å; V39-I85 HydrophobicContact CG2-CD1 3.75Å; V39-I85 HydrophobicContact CG2-CG1 4.02Å; V39-I85 HydrophobicContact CG2-CG2 4.06Å; V58-I85 HydrophobicContact CG2-CD1 4.43Å; V60-I85 HydrophobicContact CB-CD1 4.46Å; V60-I85 HydrophobicContact CG1-CD1 3.91Å; V60-I85 HydrophobicContact CG1-CG1 4.15Å; V60-I85 HydrophobicContact CG2-CD1 3.65Å; L79-I85 HydrophobicContact CD1-CG2 4.03Å; L79-I85 HydrophobicContact CD2-CG2 3.43Å; L79-I85 VanDerWaalsContact CD2-CG2 3.43Å; L79-I85 HydrophobicContact CG-CG2 4.39Å; I85-V87 HydrophobicContact CD1-CG2 3.97Å; I85-V87 HydrophobicContact CG1-CG2 4.26Å; I85-V102 HydrophobicContact CB-CG1 4.21Å; I85-V102 HydrophobicContact CD1-CG1 4.19Å; I85-V102 HydrophobicContact CD1-CG2 3.94Å; I85-V102 HydrophobicContact CG2-CG1 4.38Å; I85-C109 HydrophobicContact CG2-CB 4.22Å
86	L	97.6	Very high	95.4	Very high	28 Å²	28	64.2 Å²	64.2	15%	0.147	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.7	170.1	-167	70.8	0	0	0	109	F34 V103 V106 Y107	F34-L86 HydrophobicContact CB-CD1 3.83Å; F34-L86 HydrophobicContact CB-CD2 4.06Å; F34-L86 HydrophobicContact CB-CG 4Å; F34-L86 HydrophobicContact CD1-CD2 3.93Å; F34-L86 HydrophobicContact CD1-CG 4.25Å; F34-L86 HydrophobicContact CG-CD2 4.06Å; F34-L86 HydrophobicContact CG-CG 4.42Å; L86-V103 HydrophobicContact CB-CB 4.23Å; L86-V103 HydrophobicContact CB-CG2 4.34Å; L86-V103 HydrophobicContact CD2-CB 4.4Å; L86-V103 HydrophobicContact CD2-CG2 4.17Å; L86-V103 HydrophobicContact CG-CG2 4.23Å; L86-V103 PolarHBondContact O-N 2.97Å; L86-V106 HydrophobicContact CB-CB 4.31Å; L86-V106 HydrophobicContact CB-CG1 3.94Å; L86-V106 HydrophobicContact CD2-CG1 4.03Å; L86-Y107 HydrophobicContact CB-CD2 3.9Å; L86-Y107 HydrophobicContact CB-CE2 3.79Å; L86-Y107 HydrophobicContact CD1-CE2 3.95Å; L86-Y107 HydrophobicContact CG-CE2 4.42Å
87	V	96.9	Very high	95.5	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.5	-179.7	-178	0	0	0	0	109.7	F34 I35 V60 L62 I68 A70 I85 H100	F34-V87 WeakPolarHBondContact CA-O 3.24Å; I35-V87 PolarHBondContact N-O 3.43Å; I35-V87 PolarHBondContact O-N 3.18Å; V60-V87 HydrophobicContact CG1-CG2 4.2Å; L62-V87 HydrophobicContact CD2-CB 4.3Å; L62-V87 HydrophobicContact CD2-CG2 4.27Å; I68-V87 HydrophobicContact CD1-CG1 3.97Å; A70-V87 HydrophobicContact CB-CG1 4.31Å; I85-V87 HydrophobicContact CD1-CG2 3.97Å; I85-V87 HydrophobicContact CG1-CG2 4.26Å; V87-H100 HydrophobicContact CG1-CB 3.66Å
88	R	95.6	Very high	95.6	Very high	119 Å²	119	62.1 Å²	62.1	45%	0.449	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	164.6	172.8	71.8	172.1	177.6	172.5	-0.9	112.4	F34 H100 K101 V103	F34-R88 HydrophobicContact CD1-CB 3.59Å; F34-R88 HydrophobicContact CE1-CB 3.6Å; F34-R88 HydrophobicContact CE1-CG 4.47Å; R88-H100 WeakPolarHBondContact O-CA 3.45Å; R88-K101 HydrophobicContact CG-CB 4.26Å; R88-K101 PolarHBondContact N-O 3.01Å; R88-K101 PolarHBondContact O-N 3.46Å; R88-V103 HydrophobicContact CB-CG2 4Å; R88-V103 HydrophobicContact CG-CG2 4.01Å
89	G	93.4	Very high	95.6	Very high	29 Å²	29	63.1 Å²	63.1	30%	0.299	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	138.7	174.1	0	0	0	0	0	109.4	M29	M29-G89 VanDerWaalsContact SD-CA 3.54Å; M29-G89 PolarHBondContact SD-N 2.88Å
90	G	93.5	Very high	95.6	Very high	23 Å²	23	63.4 Å²	63.4	24%	0.237	32%	0.319	C	S	.	.			trans	166.1	103.9	178.1	0	0	0	0	0	110.8	T92 K99 K101	G90-T92 PolarHBondContact O-N 3.21Å; G90-K99 CarbonylContact C-O 3.6Å; G90-K99 PolarHBondContact N-O 2.88Å; G90-K99 CarbonylContact O-C 3.28Å; G90-K99 VanDerWaalsContact O-C 3.28Å; G90-K101 WeakPolarHBondContact O-CG 3.31Å
91	R	94.3	Very high	95.6	Very high	150 Å²	150	60.4 Å²	60.4	57%	0.566	30%	0.304	S	S	*	.			trans	-63.9	131.2	175.6	-174.2	177.2	126.1	99.7	-2.2	110.1
92	T	95.4	Very high	95.6	Very high	11 Å²	11	54.9 Å²	54.9	7%	0.067	28%	0.279	C	S	.	.			trans	-89.7	108	166.9	-57.5	0	0	0	0	106.9	H71 G90 D94 L95 V98	H71-T92 VanDerWaalsContact CB-OG1 3.29Å; H71-T92 WeakPolarHBondContact CB-OG1 3.42Å; G90-T92 PolarHBondContact O-N 3.21Å; T92-D94 PolarHBondContact O-N 3.07Å; T92-L95 HydrophobicContact CG2-CB 4.15Å; T92-L95 HydrophobicContact CG2-CD1 3.88Å; T92-L95 HydrophobicContact CG2-CG 3.94Å; T92-L95 PolarHBondContact O-N 3.2Å; T92-L95 VanDerWaalsContact O-N 3.11Å; T92-V98 PolarHBondContact N-O 3.08Å
93	Q	93.6	Very high	95.6	Very high	147 Å²	147	49.1 Å²	49.1	69%	0.687	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.4	-168.4	-66.9	175.5	-13.8	0	0	113.1	K48	K48-Q93 WeakPolarHBondContact CE-O 3.17Å
94	D	94.8	Very high	95.5	Very high	24 Å²	24	50.1 Å²	50.1	13%	0.128	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-26.4	-179.3	-61.4	-26.7	0	0	0	113.9	P47 K48 N51 R55 T92	P47-D94 WeakPolarHBondContact CA-O 3.42Å; P47-D94 HydrophobicContact CB-CB 3.7Å; K48-D94 WeakPolarHBondContact CG-O 3.02Å; K48-D94 PolarHBondContact N-O 2.94Å; N51-D94 PolarHBondContact ND2-OD1 3.34Å; R55-D94 IonicContact CZ-OD2 3.52Å; R55-D94 IonicContact NE-OD2 3.55Å; R55-D94 IonicContact NH2-OD2 2.74Å; R55-D94 PolarHBondContact NH2-OD2 3.3Å; T92-D94 PolarHBondContact O-N 3.07Å
95	L	95.7	Very high	95.4	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.01	26%	0.264	C	S	.	.	S	Bend	trans	-102.9	121.1	-171.6	-67.6	177.3	0	0	0	110.6	R45 R55 C57 T92 G97 V98	R45-L95 HydrophobicContact CB-CD2 3.81Å; R55-L95 HydrophobicContact CB-CD1 3.85Å; R55-L95 HydrophobicContact CB-CD2 4.06Å; R55-L95 HydrophobicContact CB-CG 4.31Å; R55-L95 HydrophobicContact CG-CD1 4.23Å; R55-L95 HydrophobicContact CG-CD2 4.05Å; R55-L95 HydrophobicContact CG-CG 4.22Å; C57-L95 VanDerWaalsContact SG-CD1 3.53Å; T92-L95 HydrophobicContact CG2-CB 4.15Å; T92-L95 HydrophobicContact CG2-CD1 3.88Å; T92-L95 HydrophobicContact CG2-CG 3.94Å; T92-L95 PolarHBondContact O-N 3.2Å; T92-L95 VanDerWaalsContact O-N 3.11Å; L95-G97 PolarHBondContact O-N 2.73Å; L95-V98 HydrophobicContact CB-CB 3.75Å; L95-V98 HydrophobicContact CB-CG2 3.65Å; L95-V98 HydrophobicContact CD1-CB 4.25Å; L95-V98 HydrophobicContact CD1-CG1 4.34Å; L95-V98 HydrophobicContact CD1-CG2 4.03Å; L95-V98 HydrophobicContact CG-CG2 4.47Å; L95-V98 PolarHBondContact O-N 3.24Å
96	I	94.6	Very high	95.3	Very high	129 Å²	129	51.9 Å²	51.9	66%	0.662	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	127.2	177.9	-56.6	165.1	0	0	0	108.8	R45 K48 V98	R45-I96 PolarHBondContact NH1-O 3.18Å; R45-I96 VanDerWaalsContact NH1-O 3.08Å; K48-I96 HydrophobicContact CB-CD1 4.29Å; K48-I96 HydrophobicContact CB-CG1 4.4Å; I96-V98 VanDerWaalsContact C-N 3.29Å; I96-V98 PolarHBondContact O-N 3.35Å
97	G	93	Very high	95.2	Very high	57 Å²	57	56.5 Å²	56.5	59%	0.588	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	-5.2	177.6	0	0	0	0	0	116.1	L95 K99	L95-G97 PolarHBondContact O-N 2.73Å; G97-K99 PolarHBondContact O-N 3.22Å
98	V	95.7	Very high	95.2	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.006	31%	0.312	C	S	.	.			trans	-91.4	96.8	-178.3	-174.6	0	0	0	0	110.2	T69 H71 T92 L95 I96	T69-V98 HydrophobicContact CG2-CG2 3.85Å; H71-V98 HydrophobicContact CB-CG1 3.91Å; T92-V98 PolarHBondContact N-O 3.08Å; L95-V98 HydrophobicContact CB-CB 3.75Å; L95-V98 HydrophobicContact CB-CG2 3.65Å; L95-V98 HydrophobicContact CD1-CB 4.25Å; L95-V98 HydrophobicContact CD1-CG1 4.34Å; L95-V98 HydrophobicContact CD1-CG2 4.03Å; L95-V98 HydrophobicContact CG-CG2 4.47Å; L95-V98 PolarHBondContact O-N 3.24Å; I96-V98 VanDerWaalsContact C-N 3.29Å; I96-V98 PolarHBondContact O-N 3.35Å
99	K	94.7	Very high	95.2	Very high	121 Å²	121	54.2 Å²	54.2	53%	0.526	29%	0.291	S	S	.	.			trans	-100	-2.4	-175.8	-62.6	-179.2	-176.2	176.7	0	113.8	A28 G90 G97	A28-K99 HydrophobicContact CB-CB 4.11Å; A28-K99 HydrophobicContact CB-CD 4.39Å; G90-K99 CarbonylContact C-O 3.6Å; G90-K99 PolarHBondContact N-O 2.88Å; G90-K99 CarbonylContact O-C 3.28Å; G90-K99 VanDerWaalsContact O-C 3.28Å; G97-K99 PolarHBondContact O-N 3.22Å
100	H	95.9	Very high	95.2	Very high	16 Å²	16	54.8 Å²	54.8	7%	0.074	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	146.8	-169.9	-55.6	80.1	0	0	0	110.7	A28 I68 A70 H71 V87 R88	A28-H100 PolarHBondContact O-NE2 2.89Å; I68-H100 HydrophobicContact CD1-CB 3.75Å; I68-H100 VanDerWaalsContact CD1-CD2 3.47Å; I68-H100 WeakPolarHBondContact CD1-CD2 3.35Å; I68-H100 VanDerWaalsContact CD1-CG 3.44Å; A70-H100 WeakPolarHBondContact CA-O 3.48Å; A70-H100 HydrophobicContact CB-CB 3.98Å; H71-H100 PolarHBondContact N-O 3.42Å; V87-H100 HydrophobicContact CG1-CB 3.66Å; R88-H100 WeakPolarHBondContact O-CA 3.45Å
101	K	96.5	Very high	95.3	Very high	60 Å²	60	58.1 Å²	58.1	26%	0.261	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	141.1	175.5	-73.4	175	-174.7	-178.1	0	109.7	H71 R88 G90	H71-K101 HydrophobicContact CB-CG 4.4Å; H71-K101 WeakPolarHBondContact O-CA 3.4Å; R88-K101 HydrophobicContact CG-CB 4.26Å; R88-K101 PolarHBondContact N-O 3.01Å; R88-K101 PolarHBondContact O-N 3.46Å; G90-K101 WeakPolarHBondContact O-CG 3.31Å
102	V	97.3	Very high	95.2	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	140.4	171.3	-173.9	0	0	0	0	109.3	V58 A70 H71 I72 P73 L79 I85 C109	V58-V102 HydrophobicContact CG2-CG2 3.72Å; A70-V102 HydrophobicContact CB-CG2 3.95Å; H71-V102 PolarHBondContact O-N 3.42Å; I72-V102 HydrophobicContact CG1-CG2 4.16Å; P73-V102 VanDerWaalsContact CD-O 3.24Å; P73-V102 WeakPolarHBondContact CD-O 3.47Å; P73-V102 VanDerWaalsContact CG-O 3.24Å; P73-V102 WeakPolarHBondContact CG-O 3.32Å; L79-V102 HydrophobicContact CD1-CG1 4.41Å; I85-V102 HydrophobicContact CB-CG1 4.21Å; I85-V102 HydrophobicContact CD1-CG1 4.19Å; I85-V102 HydrophobicContact CD1-CG2 3.94Å; I85-V102 HydrophobicContact CG2-CG1 4.38Å; V102-C109 HydrophobicContact CG1-CB 4.26Å; V102-C109 VanDerWaalsContact CG1-SG 3.58Å
103	V	96.8	Very high	95	Very high	26 Å²	26	62.3 Å²	62.3	16%	0.158	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-84.2	132.7	171.1	-174.5	0	0	0	0	108.6	F34 L86 R88 V106	F34-V103 HydrophobicContact CD1-CG2 3.87Å; F34-V103 HydrophobicContact CE1-CG2 3.85Å; L86-V103 HydrophobicContact CB-CB 4.23Å; L86-V103 HydrophobicContact CB-CG2 4.34Å; L86-V103 HydrophobicContact CD2-CB 4.4Å; L86-V103 HydrophobicContact CD2-CG2 4.17Å; L86-V103 HydrophobicContact CG-CG2 4.23Å; L86-V103 PolarHBondContact O-N 2.97Å; R88-V103 HydrophobicContact CB-CG2 4Å; R88-V103 HydrophobicContact CG-CG2 4.01Å; V103-V106 HydrophobicContact CG1-CB 4.5Å; V103-V106 HydrophobicContact CG1-CG2 3.76Å
104	R	95.4	Very high	94.7	Very high	51 Å²	51	64.5 Å²	64.5	19%	0.192	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	146.4	177.1	-72.9	-64.4	-156.1	145.7	13.8	110.8	P73 E75 G76 A110 V112	P73-R104 HydrophobicContact CG-CG 4.04Å; P73-R104 PolarHBondContact O-NE 3.05Å; P73-R104 PolarHBondContact O-NH2 2.76Å; E75-R104 PolarHBondContact O-NH2 3.31Å; G76-R104 PolarHBondContact O-NH2 3.48Å; R104-A110 PolarHBondContact NH1-O 2.92Å; R104-A110 VanDerWaalsContact NH1-O 3.16Å; R104-V112 HydrophobicContact CG-CG2 4.49Å
105	G	94.9	Very high	94.2	Very high	47 Å²	47	69.4 Å²	69.4	49%	0.485	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	22.1	178.6	0	0	0	0	0	113.9	C109	G105-C109 WeakPolarHBondContact CA-O 3.43Å; G105-C109 PolarHBondContact N-O 3.17Å
106	V	95.3	Very high	93.5	Very high	46 Å²	46	74.1 Å²	74.1	28%	0.279	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-135.8	137.1	-179.1	-173.1	0	0	0	0	110	L86 V103 C109	L86-V106 HydrophobicContact CB-CB 4.31Å; L86-V106 HydrophobicContact CB-CG1 3.94Å; L86-V106 HydrophobicContact CD2-CG1 4.03Å; V103-V106 HydrophobicContact CG1-CB 4.5Å; V103-V106 HydrophobicContact CG1-CG2 3.76Å; V106-C109 PolarHBondContact N-O 3.35Å; V106-C109 WeakPolarHBondContact O-CB 3.46Å; V106-C109 PolarHBondContact O-N 3.35Å
107	Y	96.5	Very high	92.3	Very high	125 Å²	125	73.8 Å²	73.8	49%	0.49	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	-131.7	-171.9	-54.6	-60.2	0	0	0	111.2	K36 I84 L86 C109	K36-Y107 HydrophobicContact CD-CE2 4.49Å; K36-Y107 HydrophobicContact CG-CE2 4.08Å; I84-Y107 HydrophobicContact CG2-CD1 4.19Å; I84-Y107 HydrophobicContact CG2-CD2 4.01Å; I84-Y107 HydrophobicContact CG2-CE2 4.45Å; I84-Y107 HydrophobicContact CG2-CG 3.86Å; I84-Y107 WeakPolarHBondContact O-CB 3.48Å; L86-Y107 HydrophobicContact CB-CD2 3.9Å; L86-Y107 HydrophobicContact CB-CE2 3.79Å; L86-Y107 HydrophobicContact CD1-CE2 3.95Å; L86-Y107 HydrophobicContact CG-CE2 4.42Å; Y107-C109 PolarHBondContact O-N 3.49Å
108	D	96.9	Very high	90.8	Very high	70 Å²	70	83.5 Å²	83.5	37%	0.374	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-4	-176.4	-54.8	-33.2	0	0	0	112.7	N83 I84 A110	N83-D108 WeakPolarHBondContact CA-OD2 3.41Å; N83-D108 HydrophobicContact CB-CB 3.9Å; I84-D108 PolarHBondContact N-OD2 2.94Å; I84-D108 PolarHBondContact O-N 2.83Å; D108-A110 PolarHBondContact O-N 3.47Å; D108-A110 VanDerWaalsContact O-N 3.13Å
109	C	94.8	Very high	90.5	Very high	2 Å²	2	87.7 Å²	87.7	1%	0.014	47%	0.471	C	S	.	.	B	Isolated β-bridge	trans	-85.3	88.3	179.7	-154.7	0	0	0	0	110.3	L79 I85 V102 G105 V106 Y107	L79-C109 HydrophobicContact CD2-CB 3.96Å; I85-C109 HydrophobicContact CG2-CB 4.22Å; V102-C109 HydrophobicContact CG1-CB 4.26Å; V102-C109 VanDerWaalsContact CG1-SG 3.58Å; G105-C109 WeakPolarHBondContact CA-O 3.43Å; G105-C109 PolarHBondContact N-O 3.17Å; V106-C109 PolarHBondContact N-O 3.35Å; V106-C109 WeakPolarHBondContact O-CB 3.46Å; V106-C109 PolarHBondContact O-N 3.35Å; Y107-C109 PolarHBondContact O-N 3.49Å
110	A	94.5	Very high	90.3	Very high	42 Å²	42	85.9 Å²	85.9	35%	0.347	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-54.1	147.6	178.9	0	0	0	0	0	113.1	R104 D108	R104-A110 PolarHBondContact NH1-O 2.92Å; R104-A110 VanDerWaalsContact NH1-O 3.16Å; D108-A110 PolarHBondContact O-N 3.47Å; D108-A110 VanDerWaalsContact O-N 3.13Å
111	P	94	Very high	90	Very high	93 Å²	93	89.8 Å²	89.8	60%	0.604	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-62.2	156.7	172.5	27.8	-33.6	0	0	0	111.1	Q113	P111-Q113 PolarHBondContact O-N 2.92Å
112	V	93.8	Very high	89.6	Confident	69 Å²	69	91.5 Å²	91.5	42%	0.418	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-71.3	127.7	178	-179.1	0	0	0	0	108.7	R104	R104-V112 HydrophobicContact CG-CG2 4.49Å
113	Q	90.8	Very high	89.1	Confident	179 Å²	179	97.2 Å²	97.2	84%	0.836	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-69.9	133.2	175.8	-67.4	-178.8	-7.7	0	0	109.5	P111	P111-Q113 PolarHBondContact O-N 2.92Å
114	K	87.4	Confident	88.6	Confident	194 Å²	194	101.9 Å²	101.9	84%	0.843	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-70.2	139.2	169.9	-68	-176.4	-179.6	177.9	0	108.2	S116	K114-S116 PolarHBondContact O-N 3.04Å
115	P	83.7	Confident	88.1	Confident	126 Å²	126	105.6 Å²	105.6	82%	0.818	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-58.3	125.5	166.2	25.6	-31.2	0	0	0	107.4	S117	P115-S117 PolarHBondContact O-N 3.07Å; P115-S117 VanDerWaalsContact O-N 3.09Å
116	S	80.2	Confident	87.6	Confident	101 Å²	101	110.1 Å²	110.1	71%	0.706	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-57.8	117.4	172.8	53.4	0	0	0	0	107.6	K114 K118	K114-S116 PolarHBondContact O-N 3.04Å; S116-K118 PolarHBondContact O-N 2.92Å
117	S	70.2	Confident	87	Confident	123 Å²	123	115.4 Å²	115.4	86%	0.86	62%	0.621	S	S	*	*			trans	-54.3	109.8	168.8	-176.1	0	0	0	0	107.3	P115	P115-S117 PolarHBondContact O-N 3.07Å; P115-S117 VanDerWaalsContact O-N 3.09Å
118	K	60.8	Low	86.1	Confident	261 Å²	261	114.5 Å²	114.5	100%	1.135	63%	0.632	S	S	*	*			trans	-82.2	0	161.6	-77.9	-175.2	178.3	-179	0	108.5	S116	S116-K118 PolarHBondContact O-N 2.92Å

Retrieved 118 of 118 residues in 23.4 ms (Link to these results)

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