A0A077ZQ74_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZQ74, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 115 aa.

						>A0A077ZQ74_TRITR|A0A077ZQ74
MKKFFSIIAVLAIAISALTTSACALNTPVENARYCATNSIHYGMNTVRLVRATVTATHDDGCVTLKDMRDGNLYAIDDDGLVKGEDVLIAIDDNATPGFVYDDMILGFWNGSALE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	37.6	Very low	33.5	Very low	240 Å²	240	163.5 Å²	163.5	100%	1.182	84%	0.835	S	S	*	*				0	132.7	0	-65.5	175.6	-165.3	0	0	108.1
2	K	33.1	Very low	33.1	Very low	183 Å²	183	156.5 Å²	156.5	80%	0.796	82%	0.821	S	S	*	*			trans	64.5	87.8	170.8	-66.4	176.5	176.7	-179.1	0	117.4	F4	K2-F4 HydrophobicContact CB-CD2 3.95Å; K2-F4 HydrophobicContact CB-CE2 3.98Å; K2-F4 HydrophobicContact CD-CE2 4.09Å; K2-F4 HydrophobicContact CG-CE2 4.14Å; K2-F4 PolarHBondContact O-N 3.26Å
3	K	35.1	Very low	33.5	Very low	217 Å²	217	156.2 Å²	156.2	94%	0.943	82%	0.818	S	S	*	*			trans	-71.9	97.4	156.3	-66.3	-178.5	178.8	-178.8	0	108.4
4	F	32.3	Very low	33.1	Very low	155 Å²	155	151.4 Å²	151.4	68%	0.68	81%	0.812	S	S	*	*			trans	-98.8	155.9	156.4	-79.5	-97.6	0	0	0	106.8	K2	K2-F4 HydrophobicContact CB-CD2 3.95Å; K2-F4 HydrophobicContact CB-CE2 3.98Å; K2-F4 HydrophobicContact CD-CE2 4.09Å; K2-F4 HydrophobicContact CG-CE2 4.14Å; K2-F4 PolarHBondContact O-N 3.26Å
5	F	32.1	Very low	33.1	Very low	208 Å²	208	151.7 Å²	151.7	91%	0.912	81%	0.811	S	S	*	*	S	Bend	trans	83.2	68.4	180	-51.1	-79.9	0	0	0	116.7
6	S	32.6	Very low	33	Very low	108 Å²	108	148.9 Å²	148.9	76%	0.755	81%	0.807	S	S	*	*			trans	-170.1	51.4	139.3	-147.2	0	0	0	0	112.7
7	I	34.8	Very low	32.8	Very low	154 Å²	154	145.1 Å²	145.1	79%	0.79	80%	0.8	S	S	*	*	S	Bend	trans	-117.2	-6	-179.9	-65.7	176.4	0	0	0	112.5
8	I	36.1	Very low	32.9	Very low	161 Å²	161	146.1 Å²	146.1	83%	0.826	80%	0.803	S	S	*	*	G	3₁₀ helix	trans	-88	-4.6	-177.1	-62.4	175.9	0	0	0	112.7
9	A	31	Very low	32.7	Very low	81 Å²	81	145.5 Å²	145.5	67%	0.669	81%	0.805	S	S	*	*	G	3₁₀ helix	trans	-87.6	0	179.1	0	0	0	0	0	115
10	V	32.2	Very low	32.5	Very low	134 Å²	134	144.2 Å²	144.2	81%	0.812	80%	0.801	S	S	*	*	G	3₁₀ helix	trans	-106.8	8.8	-176	-172.4	0	0	0	0	112.5
11	L	31.5	Very low	32.4	Very low	157 Å²	157	143.1 Å²	143.1	82%	0.822	80%	0.804	S	S	*	*	S	Bend	trans	-101	5.2	-175.3	-162.4	57.7	0	0	0	114.8
12	A	29.5	Very low	31.8	Very low	80 Å²	80	136.6 Å²	136.6	66%	0.661	79%	0.788	S	S	*	*	S	Bend	trans	-131.7	7.3	-170	0	0	0	0	0	117.1
13	I	37.1	Very low	31.3	Very low	152 Å²	152	133.1 Å²	133.1	78%	0.779	79%	0.785	S	S	*	*	S	Bend	trans	-126	38.3	-178.4	-41.9	-179.4	0	0	0	112.1
14	A	28.7	Very low	30.7	Very low	89 Å²	89	126.9 Å²	126.9	74%	0.736	77%	0.774	S	S	*	*	S	Bend	trans	-124.1	14.9	168.1	0	0	0	0	0	113
15	I	32.3	Very low	30.3	Very low	156 Å²	156	126.9 Å²	126.9	80%	0.8	78%	0.78	S	S	*	*	S	Bend	trans	-95.3	0.8	-176.4	-64	176	0	0	0	112.7
16	S	32.9	Very low	30	Very low	107 Å²	107	124.3 Å²	124.3	75%	0.748	78%	0.776	S	S	*	*	S	Bend	trans	-132.5	61.5	-177.5	63	0	0	0	0	112.9
17	A	28.7	Very low	29.6	Very low	84 Å²	84	123.4 Å²	123.4	69%	0.694	77%	0.766	S	S	*	*	S	Bend	trans	-164.2	-2.8	165	0	0	0	0	0	115.2
18	L	33.9	Very low	29.1	Very low	163 Å²	163	121.9 Å²	121.9	85%	0.853	77%	0.766	S	S	*	*			trans	-105.4	50.1	-169.2	-121.9	88	0	0	0	113.5
19	T	29.9	Very low	28.6	Very low	136 Å²	136	120.4 Å²	120.4	83%	0.834	76%	0.764	S	S	*	*			trans	-143.6	49.2	167.1	61.2	0	0	0	0	111.8
20	T	29.1	Very low	28.2	Very low	119 Å²	119	123.3 Å²	123.3	73%	0.73	76%	0.764	S	S	*	*	S	Bend	trans	-147.8	86.1	160.5	46.5	0	0	0	0	108.3	A22	T20-A22 PolarHBondContact O-N 3.37Å
21	S	30.4	Very low	27.8	Very low	122 Å²	122	123.2 Å²	123.2	85%	0.853	76%	0.759	S	S	*	*			trans	31.5	82.2	149.1	54.4	0	0	0	0	117.3
22	A	24.3	Very low	27.5	Very low	103 Å²	103	118.4 Å²	118.4	85%	0.851	74%	0.742	S	S	*	*			trans	-87.3	96.7	157.2	0	0	0	0	0	108.9	T20 A24	T20-A22 PolarHBondContact O-N 3.37Å; A22-A24 PolarHBondContact O-N 3.44Å
23	C	23.1	Very low	27.3	Very low	110 Å²	110	124.1 Å²	124.1	74%	0.743	75%	0.746	S	S	*	*			trans	-81.2	99.8	159.2	-178.4	0	0	0	0	107.2
24	A	22.4	Very low	26.9	Very low	86 Å²	86	126 Å²	126	71%	0.711	75%	0.745	S	S	*	*			trans	-157.5	98.8	163.9	0	0	0	0	0	111.5	A22	A22-A24 PolarHBondContact O-N 3.44Å
25	L	24.4	Very low	27	Very low	154 Å²	154	125.4 Å²	125.4	81%	0.806	74%	0.735	S	S	*	*				54.8	97.9	128.3	-149.4	76	0	0	0	118
26	N	25.4	Very low	26.8	Very low	154 Å²	154	120.2 Å²	120.2	82%	0.824	72%	0.715	S	S	*	*			trans	167.8	67.7	132.4	-82.6	-26.6	0	0	0	112.4
27	T	24.8	Very low	26.6	Very low	90 Å²	90	121.1 Å²	121.1	55%	0.552	72%	0.716	S	S	*	*	S	Bend	trans	-141.3	145.4	153.5	45.9	0	0	0	0	108	V29 E30	T27-V29 PolarHBondContact O-N 3.15Å; T27-E30 PolarHBondContact OG1-OE2 2.95Å
28	P	23.8	Very low	26.8	Very low	121 Å²	121	120.8 Å²	120.8	79%	0.786	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	109.8	-177.3	24.9	-31.9	0	0	0	109.9	E30	P28-E30 PolarHBondContact O-N 3.38Å
29	V	25.7	Very low	26.7	Very low	130 Å²	130	116.8 Å²	116.8	79%	0.788	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.6	52.9	165.6	-157.3	0	0	0	0	114.5	T27	T27-V29 PolarHBondContact O-N 3.15Å
30	E	22.6	Very low	26.9	Very low	142 Å²	142	113.8 Å²	113.8	66%	0.664	67%	0.667	S	S	*	*			trans	-105.4	14	171.9	-77.9	-175	147.7	0	0	114.3	T27 P28	T27-E30 PolarHBondContact OG1-OE2 2.95Å; P28-E30 PolarHBondContact O-N 3.38Å
31	N	24	Very low	27.1	Very low	132 Å²	132	113.8 Å²	113.8	71%	0.706	66%	0.658	S	S	*	*			trans	-114.3	25.8	168	-75.9	-10	0	0	0	112.9	R33	N31-R33 PolarHBondContact O-N 3.42Å
32	A	23.8	Very low	27.2	Very low	56 Å²	56	110.4 Å²	110.4	46%	0.463	63%	0.627	S	S	.	*			trans	-72.9	77.5	147.7	0	0	0	0	0	106	Y34	A32-Y34 PolarHBondContact O-N 3.02Å
33	R	26.7	Very low	27.3	Very low	200 Å²	200	107.1 Å²	107.1	76%	0.755	60%	0.603	S	S	*	*			trans	-60.2	98.8	161.8	-155.1	178.1	-161.1	-144.4	-0.8	103.8	N31 C35 D60	N31-R33 PolarHBondContact O-N 3.42Å; R33-C35 PolarHBondContact O-N 2.96Å; R33-C35 VanDerWaalsContact O-N 3.13Å; R33-D60 PolarHBondContact NH1-O 3.2Å
34	Y	27.5	Very low	27.4	Very low	193 Å²	193	110.4 Å²	110.4	76%	0.757	61%	0.609	S	S	*	*			trans	-55	118.4	-174.9	-106.3	-85.2	0	0	0	107.8	A32 A36	A32-Y34 PolarHBondContact O-N 3.02Å; Y34-A36 HydrophobicContact CD1-CB 3.2Å; Y34-A36 HydrophobicContact CE1-CB 3.82Å; Y34-A36 HydrophobicContact CG-CB 4.03Å; Y34-A36 PolarHBondContact O-N 2.99Å; Y34-A36 VanDerWaalsContact O-N 3.08Å
35	C	31.1	Very low	27.5	Very low	75 Å²	75	112.3 Å²	112.3	51%	0.507	61%	0.608	S	S	.	*			trans	-70	24.4	151.3	-58.2	0	0	0	0	110.9	R33	R33-C35 PolarHBondContact O-N 2.96Å; R33-C35 VanDerWaalsContact O-N 3.13Å
36	A	28.6	Very low	27.4	Very low	48 Å²	48	110.1 Å²	110.1	40%	0.397	60%	0.601	S	S	.	*			trans	-95.1	124	161.2	0	0	0	0	0	105.7	Y34	Y34-A36 HydrophobicContact CD1-CB 3.2Å; Y34-A36 HydrophobicContact CE1-CB 3.82Å; Y34-A36 HydrophobicContact CG-CB 4.03Å; Y34-A36 PolarHBondContact O-N 2.99Å; Y34-A36 VanDerWaalsContact O-N 3.08Å
37	T	29.2	Very low	27.7	Very low	125 Å²	125	107.6 Å²	107.6	77%	0.767	59%	0.591	S	S	*	*	S	Bend		-149.2	13.6	63.1	39.3	0	0	0	0	114.4	S39	T37-S39 PolarHBondContact O-N 3.22Å
38	N	32.4	Very low	27.9	Very low	77 Å²	77	114 Å²	114	41%	0.412	61%	0.605	S	S	.	*			trans	-101.9	97.4	178.3	-63.1	-11.8	0	0	0	106.9	I40 D102	N38-I40 PolarHBondContact O-N 2.8Å; N38-D102 HydrophobicContact CB-CB 4.21Å; N38-D102 WeakPolarHBondContact ND2-CB 3.39Å; N38-D102 PolarHBondContact ND2-OD1 3.33Å; N38-D102 PolarHBondContact ND2-OD2 3.39Å
39	S	32.4	Very low	28.4	Very low	80 Å²	80	108.8 Å²	108.8	56%	0.559	57%	0.57	S	S	*	*			trans	-45.2	113	162.4	38.9	0	0	0	0	107.3	T37 H41	T37-S39 PolarHBondContact O-N 3.22Å; S39-H41 VanDerWaalsContact C-N 3.35Å; S39-H41 VanDerWaalsContact CB-CD2 3.43Å; S39-H41 WeakPolarHBondContact CB-CD2 3.36Å; S39-H41 WeakPolarHBondContact CB-NE2 3.28Å; S39-H41 PolarHBondContact O-CD2 3.28Å; S39-H41 PolarHBondContact O-N 2.81Å; S39-H41 PolarHBondContact OG-CD2 3Å; S39-H41 VanDerWaalsContact OG-CD2 3.25Å; S39-H41 PolarHBondContact OG-NE2 3.08Å
40	I	33.2	Very low	28.7	Very low	73 Å²	73	108.2 Å²	108.2	37%	0.374	57%	0.567	S	S	.	*			trans	-66.7	105.7	172	-46.8	174	0	0	0	105	N38 Y42	N38-I40 PolarHBondContact O-N 2.8Å; I40-Y42 HydrophobicContact CB-CD2 4.45Å; I40-Y42 HydrophobicContact CB-CE1 4.45Å; I40-Y42 HydrophobicContact CB-CE2 3.73Å; I40-Y42 WeakPolarHBondContact CD1-OH 3.42Å; I40-Y42 HydrophobicContact CG2-CD1 4.06Å; I40-Y42 HydrophobicContact CG2-CD2 4.16Å; I40-Y42 HydrophobicContact CG2-CE1 3.38Å; I40-Y42 HydrophobicContact CG2-CE2 3.55Å; I40-Y42 HydrophobicContact CG2-CG 4.43Å; I40-Y42 VanDerWaalsContact CG2-OH 3.31Å; I40-Y42 WeakPolarHBondContact CG2-OH 3.42Å
41	H	32.2	Very low	29.1	Very low	119 Å²	119	109.9 Å²	109.9	55%	0.551	57%	0.567	S	S	*	*			trans	-85.4	117.8	177.1	-80	-152.4	0	0	0	106.6	S39	S39-H41 VanDerWaalsContact C-N 3.35Å; S39-H41 VanDerWaalsContact CB-CD2 3.43Å; S39-H41 WeakPolarHBondContact CB-CD2 3.36Å; S39-H41 WeakPolarHBondContact CB-NE2 3.28Å; S39-H41 PolarHBondContact O-CD2 3.28Å; S39-H41 PolarHBondContact O-N 2.81Å; S39-H41 PolarHBondContact OG-CD2 3Å; S39-H41 VanDerWaalsContact OG-CD2 3.25Å; S39-H41 PolarHBondContact OG-NE2 3.08Å
42	Y	33.6	Very low	29.7	Very low	51 Å²	51	104.3 Å²	104.3	20%	0.2	54%	0.539	C	S	.	.			trans	-110.9	125.6	170.8	-52.3	-80.7	0	0	0	108.8	I40 M44 L73 D86 M104	I40-Y42 HydrophobicContact CB-CD2 4.45Å; I40-Y42 HydrophobicContact CB-CE1 4.45Å; I40-Y42 HydrophobicContact CB-CE2 3.73Å; I40-Y42 WeakPolarHBondContact CD1-OH 3.42Å; I40-Y42 HydrophobicContact CG2-CD1 4.06Å; I40-Y42 HydrophobicContact CG2-CD2 4.16Å; I40-Y42 HydrophobicContact CG2-CE1 3.38Å; I40-Y42 HydrophobicContact CG2-CE2 3.55Å; I40-Y42 HydrophobicContact CG2-CG 4.43Å; I40-Y42 VanDerWaalsContact CG2-OH 3.31Å; I40-Y42 WeakPolarHBondContact CG2-OH 3.42Å; Y42-M44 PolarHBondContact O-N 3.13Å; Y42-L73 HydrophobicContact CE1-CD2 3.86Å; Y42-L73 WeakPolarHBondContact OH-CD2 2.92Å; Y42-D86 HydrophobicContact CD2-CB 4.15Å; Y42-D86 WeakPolarHBondContact CD2-OD2 3.38Å; Y42-D86 HydrophobicContact CE2-CB 3.73Å; Y42-D86 WeakPolarHBondContact CE2-OD2 3.3Å; Y42-M104 HydrophobicContact CD1-CE 4.39Å; Y42-M104 HydrophobicContact CE1-CE 3.58Å
43	G	26.7	Very low	30.5	Very low	33 Å²	33	107.1 Å²	107.1	34%	0.34	55%	0.551	S	S	.	*			trans	-66.1	120.3	165.1	0	0	0	0	0	111.5	L114 E115	G43-L114 WeakPolarHBondContact O-CD2 2.93Å; G43-E115 PolarHBondContact N-O 2.98Å
44	M	24	Very low	31.3	Very low	179 Å²	179	98.3 Å²	98.3	88%	0.882	52%	0.519	S	S	*	.			trans	-78.7	125	-179.3	-68.9	-176.4	-70.3	0	0	112.6	Y42	Y42-M44 PolarHBondContact O-N 3.13Å
45	N	24.3	Very low	32.2	Very low	126 Å²	126	93.4 Å²	93.4	67%	0.674	51%	0.51	S	S	*	.			trans	-143.3	143.4	151.8	-84.6	-47.5	0	0	0	109.1
46	T	23.4	Very low	33	Very low	108 Å²	108	90.5 Å²	90.5	66%	0.663	49%	0.491	S	S	*	.			trans	-95.7	106.1	-166	54	0	0	0	0	115.3	I89	T46-I89 VanDerWaalsContact CA-CG2 3.42Å; T46-I89 HydrophobicContact CG2-CD1 3.89Å; T46-I89 HydrophobicContact CG2-CG2 4.18Å
47	V	31.5	Very low	33.9	Very low	102 Å²	102	92.6 Å²	92.6	62%	0.618	50%	0.499	S	S	*	.			trans	-137.3	176.8	159.3	177	0	0	0	0	113.6	I89 A90	V47-I89 VanDerWaalsContact N-CG2 3.25Å; V47-I89 PolarHBondContact N-O 3.3Å; V47-I89 CarbonylContact O-C 2.69Å; V47-I89 WeakPolarHBondContact O-CA 3.38Å; V47-I89 WeakPolarHBondContact O-CB 3Å; V47-I89 WeakPolarHBondContact O-CG2 3.46Å; V47-A90 HydrophobicContact CB-CB 3.15Å; V47-A90 HydrophobicContact CG1-CB 3.42Å; V47-A90 VanDerWaalsContact CG1-CB 3.42Å; V47-A90 WeakPolarHBondContact O-CA 3.37Å; V47-A90 WeakPolarHBondContact O-CB 3.4Å; V47-A90 PolarHBondContact O-N 2.88Å
48	R	29.6	Very low	34.8	Very low	223 Å²	223	88.6 Å²	88.6	84%	0.842	47%	0.472	S	S	*	.			trans	-113.3	141.4	-174.6	178	-179.1	172.1	-176.3	-0.8	115.2	A90	R48-A90 VanDerWaalsContact N-CB 3.29Å
49	L	34.2	Very low	35.6	Very low	12 Å²	12	93.1 Å²	93.1	6%	0.063	50%	0.496	C	S	.	.			trans	-105.1	159.7	170.6	-108.8	88.7	0	0	0	116.1	A52 M68 A90 I91	L49-A52 HydrophobicContact CD2-CB 4.01Å; L49-M68 HydrophobicContact CD2-CB 4.37Å; L49-M68 HydrophobicContact CD2-SD 3.76Å; L49-A90 VanDerWaalsContact CD1-CA 3.41Å; L49-A90 HydrophobicContact CD1-CB 4.16Å; L49-I91 VanDerWaalsContact CD1-CA 3.46Å; L49-I91 HydrophobicContact CD1-CB 3.53Å; L49-I91 HydrophobicContact CD1-CG1 3.75Å; L49-I91 WeakPolarHBondContact CD1-O 3.26Å; L49-I91 HydrophobicContact CD2-CB 4.26Å; L49-I91 HydrophobicContact CG-CB 4.43Å; L49-I91 VanDerWaalsContact CG-O 3.24Å; L49-I91 WeakPolarHBondContact CG-O 3.38Å
50	V	30.6	Very low	36.3	Very low	118 Å²	118	93 Å²	93	72%	0.715	49%	0.489	S	S	*	.	S	Bend	trans	-117.2	-26.2	176.8	-176.2	0	0	0	0	115
51	R	32.9	Very low	36.9	Very low	177 Å²	177	91 Å²	91	67%	0.668	49%	0.486	S	S	*	.			trans	177.1	130.1	163.8	-111	169.9	-168.1	-156.9	2.7	112.7
52	A	36.5	Very low	37.4	Very low	15 Å²	15	87 Å²	87	12%	0.124	47%	0.471	C	S	.	.	B	Isolated β-bridge	trans	-143.6	137.2	165.2	0	0	0	0	0	111.9	L49 V54 M68	L49-A52 HydrophobicContact CD2-CB 4.01Å; A52-V54 HydrophobicContact CB-CG2 4.12Å; A52-M68 HydrophobicContact CB-SD 4.29Å; A52-M68 PolarHBondContact O-N 2.94Å
53	T	39.2	Very low	37.8	Very low	115 Å²	115	86.7 Å²	86.7	71%	0.706	47%	0.474	S	S	*	.			trans	-105	116.9	166.7	-44.8	0	0	0	0	107.4
54	V	43.6	Very low	38.7	Very low	15 Å²	15	85.9 Å²	85.9	9%	0.091	46%	0.463	C	S	.	.			trans	-132.2	137.8	-173.5	170.1	0	0	0	0	106.2	A52 L65 M68 P97	A52-V54 HydrophobicContact CB-CG2 4.12Å; V54-L65 HydrophobicContact CB-CB 4.09Å; V54-L65 HydrophobicContact CB-CD1 4.05Å; V54-L65 HydrophobicContact CG1-CB 4.04Å; V54-L65 HydrophobicContact CG1-CD1 3.53Å; V54-L65 HydrophobicContact CG1-CG 4.4Å; V54-L65 CarbonylContact O-C 3.02Å; V54-L65 WeakPolarHBondContact O-CA 3.46Å; V54-L65 WeakPolarHBondContact O-CB 3.45Å; V54-M68 HydrophobicContact CG2-CE 4.36Å; V54-P97 HydrophobicContact CB-CG 4.43Å; V54-P97 HydrophobicContact CG1-CG 3.09Å
55	T	47	Very low	39.9	Very low	91 Å²	91	77.6 Å²	77.6	56%	0.558	42%	0.422	S	S	*	.			trans	-136.5	114.3	178.5	-46.9	0	0	0	0	108.3	V63	T55-V63 HydrophobicContact CG2-CG1 4.07Å
56	A	47.2	Very low	40.8	Very low	13 Å²	13	77.7 Å²	77.7	11%	0.107	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	138.6	170.9	0	0	0	0	0	108.1	T64 F99	A56-T64 PolarHBondContact N-O 2.9Å; A56-T64 CarbonylContact O-C 3.43Å; A56-T64 PolarHBondContact O-N 2.99Å; A56-T64 VanDerWaalsContact O-O 3.06Å; A56-F99 HydrophobicContact CB-CD2 3.95Å; A56-F99 HydrophobicContact CB-CE2 3.27Å; A56-F99 HydrophobicContact CB-CZ 4.1Å
57	T	49.1	Very low	41.7	Very low	92 Å²	92	74.7 Å²	74.7	56%	0.564	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.9	-177	-49.2	0	0	0	0	107.2	V63	T57-V63 HydrophobicContact CG2-CG2 4.15Å
58	H	47.2	Very low	42.5	Very low	42 Å²	42	70.3 Å²	70.3	19%	0.194	37%	0.369	C	S	.	.			trans	-87.7	152.6	174.2	-163.3	-72.8	0	0	0	109.6	D60 G61 C62 F99 Y101	H58-D60 VanDerWaalsContact CB-OD1 3.28Å; H58-D60 WeakPolarHBondContact CB-OD1 3.32Å; H58-D60 IonicContact CG-OD1 3.57Å; H58-D60 IonicContact ND1-OD1 3.28Å; H58-D60 PolarHBondContact ND1-OD1 3.17Å; H58-D60 IonicContact ND1-OD2 3.85Å; H58-D60 PolarHBondContact O-N 3.12Å; H58-D60 VanDerWaalsContact O-N 3.15Å; H58-G61 PolarHBondContact O-N 3.49Å; H58-C62 PolarHBondContact N-O 3.22Å; H58-F99 HydrophobicContact CB-CE2 4.47Å; H58-F99 AromaticContact CD2-CD1 3.93Å; H58-F99 AromaticContact CD2-CG 3.96Å; H58-Y101 PolarHBondContact NE2-O 3.06Å
59	D	49.2	Very low	43.2	Very low	172 Å²	172	65.9 Å²	65.9	92%	0.92	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.7	-172.5	-81.1	-16.2	0	0	0	113.1	G61	D59-G61 PolarHBondContact O-N 2.91Å
60	D	48.1	Very low	44.2	Very low	78 Å²	78	72.6 Å²	72.6	42%	0.417	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-6	173.9	62.4	-1.6	0	0	0	113.7	R33 H58 C62	R33-D60 PolarHBondContact NH1-O 3.2Å; H58-D60 VanDerWaalsContact CB-OD1 3.28Å; H58-D60 WeakPolarHBondContact CB-OD1 3.32Å; H58-D60 IonicContact CG-OD1 3.57Å; H58-D60 IonicContact ND1-OD1 3.28Å; H58-D60 PolarHBondContact ND1-OD1 3.17Å; H58-D60 IonicContact ND1-OD2 3.85Å; H58-D60 PolarHBondContact O-N 3.12Å; H58-D60 VanDerWaalsContact O-N 3.15Å; D60-C62 WeakPolarHBondContact OD1-CB 3.41Å; D60-C62 PolarHBondContact OD1-N 2.96Å
61	G	45.6	Very low	45.1	Very low	29 Å²	29	67.7 Å²	67.7	30%	0.299	36%	0.361	S	S	.	.	S	Bend	trans	91.1	3.9	-178.2	0	0	0	0	0	113	H58 D59 V63 D78	H58-G61 PolarHBondContact O-N 3.49Å; D59-G61 PolarHBondContact O-N 2.91Å; G61-V63 PolarHBondContact O-N 2.89Å; G61-D78 VanDerWaalsContact O-OD1 3.13Å
62	C	41.6	Very low	46.1	Very low	37 Å²	37	60.7 Å²	60.7	25%	0.25	34%	0.337	C	S	.	.			trans	-74.5	110.5	171.7	-68.8	0	0	0	0	109.3	H58 D60	H58-C62 PolarHBondContact N-O 3.22Å; D60-C62 WeakPolarHBondContact OD1-CB 3.41Å; D60-C62 PolarHBondContact OD1-N 2.96Å
63	V	42.3	Very low	47.1	Very low	43 Å²	43	60 Å²	60	26%	0.261	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	126	162.4	-176.9	0	0	0	0	107.2	T55 T57 G61	T55-V63 HydrophobicContact CG2-CG1 4.07Å; T57-V63 HydrophobicContact CG2-CG2 4.15Å; G61-V63 PolarHBondContact O-N 2.89Å
64	T	46.7	Very low	47.9	Very low	16 Å²	16	56.9 Å²	56.9	10%	0.098	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	95.6	165.5	-65.1	0	0	0	0	106.4	A56 A75	A56-T64 PolarHBondContact N-O 2.9Å; A56-T64 CarbonylContact O-C 3.43Å; A56-T64 PolarHBondContact O-N 2.99Å; A56-T64 VanDerWaalsContact O-O 3.06Å; T64-A75 HydrophobicContact CG2-CB 3.84Å
65	L	47.2	Very low	48.7	Very low	5 Å²	5	56.7 Å²	56.7	3%	0.026	31%	0.307	C	S	.	.				-176	140.3	104.7	-81.6	175.6	0	0	0	106.2	V54 M68 L73 P97 M104	V54-L65 HydrophobicContact CB-CB 4.09Å; V54-L65 HydrophobicContact CB-CD1 4.05Å; V54-L65 HydrophobicContact CG1-CB 4.04Å; V54-L65 HydrophobicContact CG1-CD1 3.53Å; V54-L65 HydrophobicContact CG1-CG 4.4Å; V54-L65 CarbonylContact O-C 3.02Å; V54-L65 WeakPolarHBondContact O-CA 3.46Å; V54-L65 WeakPolarHBondContact O-CB 3.45Å; L65-M68 HydrophobicContact CD1-CE 4.15Å; L65-L73 HydrophobicContact CD1-CD1 3.87Å; L65-L73 HydrophobicContact CD2-CD1 3.11Å; L65-L73 HydrophobicContact CD2-CD2 3.72Å; L65-L73 HydrophobicContact CD2-CG 3.29Å; L65-L73 HydrophobicContact CG-CD1 4.11Å; L65-P97 HydrophobicContact CD1-CB 4.4Å; L65-P97 HydrophobicContact CD1-CG 3.43Å; L65-P97 VanDerWaalsContact CD1-CG 3.43Å; L65-M104 HydrophobicContact CD1-CE 4.32Å; L65-M104 HydrophobicContact CD1-SD 3.91Å; L65-M104 HydrophobicContact CG-SD 4.35Å
66	K	44.2	Very low	49.2	Very low	128 Å²	128	53.5 Å²	53.5	56%	0.557	29%	0.287	S	S	*	.			trans	-148.2	116.4	167.2	-129.5	179.7	-179.3	174.9	0	107.2	I76	K66-I76 HydrophobicContact CB-CD1 3.44Å; K66-I76 VanDerWaalsContact CB-CD1 3.44Å; K66-I76 WeakPolarHBondContact O-CD1 3.49Å
67	D	43	Very low	49.7	Very low	45 Å²	45	54 Å²	54	24%	0.241	29%	0.288	C	S	.	.			trans	71.9	94.9	168.8	-140.5	-15.2	0	0	0	113.9	R69 Y74	D67-R69 PolarHBondContact O-N 3.25Å; D67-R69 WeakPolarHBondContact OD1-CG 3.43Å; D67-R69 IonicContact OD1-NE 3.07Å; D67-R69 PolarHBondContact OD1-NE 2.91Å; D67-R69 IonicContact OD2-CZ 2.78Å; D67-R69 IonicContact OD2-NE 3.33Å; D67-R69 PolarHBondContact OD2-NE 2.65Å; D67-R69 IonicContact OD2-NH2 2.82Å; D67-R69 PolarHBondContact OD2-NH2 2.93Å; D67-Y74 WeakPolarHBondContact O-CD2 3.22Å
68	M	48	Very low	50.1	Low	10 Å²	10	55.3 Å²	55.3	5%	0.049	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-77.4	75.6	157	-65	-176.4	-158	0	0	108.5	L49 A52 V54 L65 N72 L73 I91	L49-M68 HydrophobicContact CD2-CB 4.37Å; L49-M68 HydrophobicContact CD2-SD 3.76Å; A52-M68 HydrophobicContact CB-SD 4.29Å; A52-M68 PolarHBondContact O-N 2.94Å; V54-M68 HydrophobicContact CG2-CE 4.36Å; L65-M68 HydrophobicContact CD1-CE 4.15Å; M68-N72 WeakPolarHBondContact CA-O 3.31Å; M68-L73 HydrophobicContact CE-CD1 3.31Å; M68-L73 HydrophobicContact CG-CD1 4.11Å; M68-L73 HydrophobicContact SD-CD1 4.19Å; M68-I91 HydrophobicContact CE-CD1 3.16Å; M68-I91 HydrophobicContact SD-CD1 3.37Å; M68-I91 WeakPolarHBondContact SD-CD1 3.35Å; M68-I91 HydrophobicContact SD-CG1 4.29Å
69	R	43.3	Very low	50.6	Low	131 Å²	131	60.1 Å²	60.1	49%	0.494	32%	0.318	S	S	.	.			trans	-86.7	141.8	165.3	-103.8	177.9	-131.9	-175.8	11.1	108.9	D67 G71 N72	D67-R69 PolarHBondContact O-N 3.25Å; D67-R69 WeakPolarHBondContact OD1-CG 3.43Å; D67-R69 IonicContact OD1-NE 3.07Å; D67-R69 PolarHBondContact OD1-NE 2.91Å; D67-R69 IonicContact OD2-CZ 2.78Å; D67-R69 IonicContact OD2-NE 3.33Å; D67-R69 PolarHBondContact OD2-NE 2.65Å; D67-R69 IonicContact OD2-NH2 2.82Å; D67-R69 PolarHBondContact OD2-NH2 2.93Å; R69-G71 PolarHBondContact O-N 3.31Å; R69-N72 PolarHBondContact O-N 2.78Å
70	D	54.9	Low	51.1	Low	153 Å²	153	54.2 Å²	54.2	82%	0.818	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	14.1	171.9	-49.9	-35.3	0	0	0	115.7
71	G	49.9	Very low	51.6	Low	14 Å²	14	55.4 Å²	55.4	14%	0.144	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	12.6	177.4	0	0	0	0	0	114.9	R69	R69-G71 PolarHBondContact O-N 3.31Å
72	N	55.4	Low	52.4	Low	31 Å²	31	58 Å²	58	17%	0.166	31%	0.313	C	S	.	.			trans	-108.3	157	178.1	-66.4	-15	0	0	0	112	M68 R69 Y74 E85	M68-N72 WeakPolarHBondContact CA-O 3.31Å; R69-N72 PolarHBondContact O-N 2.78Å; N72-Y74 HydrophobicContact CB-CE2 3.74Å; N72-Y74 PolarHBondContact ND2-OH 3Å; N72-E85 HydrophobicContact CB-CG 4.44Å; N72-E85 PolarHBondContact ND2-OE1 2.94Å
73	L	57.2	Low	53.2	Low	1 Å²	1	61.1 Å²	61.1	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	128.6	173.7	-163	77.2	0	0	0	109.9	Y42 L65 M68 E85 D86 L88 M104	Y42-L73 HydrophobicContact CE1-CD2 3.86Å; Y42-L73 WeakPolarHBondContact OH-CD2 2.92Å; L65-L73 HydrophobicContact CD1-CD1 3.87Å; L65-L73 HydrophobicContact CD2-CD1 3.11Å; L65-L73 HydrophobicContact CD2-CD2 3.72Å; L65-L73 HydrophobicContact CD2-CG 3.29Å; L65-L73 HydrophobicContact CG-CD1 4.11Å; M68-L73 HydrophobicContact CE-CD1 3.31Å; M68-L73 HydrophobicContact CG-CD1 4.11Å; M68-L73 HydrophobicContact SD-CD1 4.19Å; L73-E85 WeakPolarHBondContact O-CA 3.32Å; L73-D86 WeakPolarHBondContact CB-O 3.45Å; L73-D86 PolarHBondContact N-O 3.01Å; L73-D86 PolarHBondContact O-N 3.35Å; L73-L88 HydrophobicContact CB-CB 4.15Å; L73-L88 HydrophobicContact CB-CD1 3.68Å; L73-L88 HydrophobicContact CB-CG 4.24Å; L73-L88 HydrophobicContact CD1-CD1 3.51Å; L73-L88 HydrophobicContact CD2-CD1 3.34Å; L73-L88 HydrophobicContact CD2-CG 4.46Å; L73-L88 HydrophobicContact CG-CD1 3.66Å; L73-M104 HydrophobicContact CD2-CE 3.55Å
74	Y	55.8	Low	53.8	Low	48 Å²	48	60.7 Å²	60.7	19%	0.188	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	121.8	178.2	-60.7	-79.9	0	0	0	110.8	D67 N72 V82 E85	D67-Y74 WeakPolarHBondContact O-CD2 3.22Å; N72-Y74 HydrophobicContact CB-CE2 3.74Å; N72-Y74 PolarHBondContact ND2-OH 3Å; Y74-V82 HydrophobicContact CD1-CG1 3.85Å; Y74-V82 HydrophobicContact CD1-CG2 4.05Å; Y74-E85 HydrophobicContact CD1-CB 4.11Å; Y74-E85 HydrophobicContact CD1-CG 4.03Å; Y74-E85 HydrophobicContact CE1-CB 4.08Å; Y74-E85 HydrophobicContact CE1-CG 3.6Å; Y74-E85 VanDerWaalsContact CE1-OE1 3.26Å; Y74-E85 WeakPolarHBondContact CE1-OE1 3.39Å; Y74-E85 PolarHBondContact OH-OE1 2.78Å
75	A	59.5	Low	54.2	Low	12 Å²	12	65.1 Å²	65.1	10%	0.099	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	117.8	162	0	0	0	0	0	108	T64 V82 K83 G84	T64-A75 HydrophobicContact CG2-CB 3.84Å; A75-V82 CarbonylContact O-C 3.55Å; A75-V82 WeakPolarHBondContact O-CA 3.19Å; A75-K83 PolarHBondContact O-N 3.28Å; A75-G84 PolarHBondContact N-O 2.82Å; A75-G84 PolarHBondContact O-N 2.99Å
76	I	56.8	Low	54.4	Low	23 Å²	23	68.2 Å²	68.2	12%	0.118	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124.6	-171.7	-67.7	163	0	0	0	108.2	K66 G80 L81 V82	K66-I76 HydrophobicContact CB-CD1 3.44Å; K66-I76 VanDerWaalsContact CB-CD1 3.44Å; K66-I76 WeakPolarHBondContact O-CD1 3.49Å; I76-G80 VanDerWaalsContact CG2-C 3.44Å; I76-G80 VanDerWaalsContact CG2-CA 3.49Å; I76-L81 VanDerWaalsContact CA-O 3.32Å; I76-L81 WeakPolarHBondContact CA-O 2.95Å; I76-V82 HydrophobicContact CG1-CG2 4.01Å
77	D	58.2	Low	54.4	Low	24 Å²	24	66 Å²	66	13%	0.128	36%	0.36	C	S	.	.			trans	-71.1	175.6	178.1	69.6	14.1	0	0	0	113.1	D79 G80 L81 K83	D77-D79 PolarHBondContact O-N 2.92Å; D77-D79 VanDerWaalsContact O-N 3.17Å; D77-D79 WeakPolarHBondContact OD1-CA 3.03Å; D77-D79 WeakPolarHBondContact OD1-CB 3.16Å; D77-D79 PolarHBondContact OD1-N 2.78Å; D77-G80 PolarHBondContact O-N 3.25Å; D77-G80 PolarHBondContact OD1-N 3.16Å; D77-L81 PolarHBondContact N-O 2.91Å; D77-L81 WeakPolarHBondContact OD1-CB 3.39Å; D77-L81 PolarHBondContact OD1-N 2.99Å; D77-K83 HydrophobicContact CB-CG 3.97Å; D77-K83 WeakPolarHBondContact OD2-CE 3.45Å; D77-K83 IonicContact OD2-NZ 2.65Å; D77-K83 PolarHBondContact OD2-NZ 2.79Å
78	D	57.4	Low	54.4	Low	120 Å²	120	64.8 Å²	64.8	64%	0.642	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-26.6	-179.4	-40.1	-3.6	0	0	0	112.3	G61 G80	G61-D78 VanDerWaalsContact O-OD1 3.13Å; D78-G80 VanDerWaalsContact C-N 3.32Å
79	D	59.3	Low	54	Low	143 Å²	143	67.9 Å²	67.9	77%	0.765	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-4.9	177.8	-65.6	-42	0	0	0	112.5	D77	D77-D79 PolarHBondContact O-N 2.92Å; D77-D79 VanDerWaalsContact O-N 3.17Å; D77-D79 WeakPolarHBondContact OD1-CA 3.03Å; D77-D79 WeakPolarHBondContact OD1-CB 3.16Å; D77-D79 PolarHBondContact OD1-N 2.78Å
80	G	58.6	Low	53.7	Low	48 Å²	48	62.1 Å²	62.1	50%	0.495	35%	0.35	S	S	.	.	S	Bend	trans	84.7	14	-179.4	0	0	0	0	0	114.6	I76 D77 D78	I76-G80 VanDerWaalsContact CG2-C 3.44Å; I76-G80 VanDerWaalsContact CG2-CA 3.49Å; D77-G80 PolarHBondContact O-N 3.25Å; D77-G80 PolarHBondContact OD1-N 3.16Å; D78-G80 VanDerWaalsContact C-N 3.32Å
81	L	57.9	Low	53.3	Low	102 Å²	102	55.3 Å²	55.3	53%	0.534	31%	0.314	S	S	.	.			trans	-90.8	135.3	177.6	-61.6	169.4	0	0	0	111.3	I76 D77 K83	I76-L81 VanDerWaalsContact CA-O 3.32Å; I76-L81 WeakPolarHBondContact CA-O 2.95Å; D77-L81 PolarHBondContact N-O 2.91Å; D77-L81 WeakPolarHBondContact OD1-CB 3.39Å; D77-L81 PolarHBondContact OD1-N 2.99Å; L81-K83 PolarHBondContact O-N 3.49Å
82	V	63.7	Low	52.9	Low	83 Å²	83	59.1 Å²	59.1	50%	0.503	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	119.9	172.6	179.3	0	0	0	0	109.5	Y74 A75 I76 G84	Y74-V82 HydrophobicContact CD1-CG1 3.85Å; Y74-V82 HydrophobicContact CD1-CG2 4.05Å; A75-V82 CarbonylContact O-C 3.55Å; A75-V82 WeakPolarHBondContact O-CA 3.19Å; I76-V82 HydrophobicContact CG1-CG2 4.01Å; V82-G84 WeakPolarHBondContact CG1-O 3.4Å
83	K	58.7	Low	52.4	Low	104 Å²	104	61.8 Å²	61.8	45%	0.452	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	-22.3	176.3	-66.4	-60.4	-159.7	-141.7	0	113.2	A75 D77 L81	A75-K83 PolarHBondContact O-N 3.28Å; D77-K83 HydrophobicContact CB-CG 3.97Å; D77-K83 WeakPolarHBondContact OD2-CE 3.45Å; D77-K83 IonicContact OD2-NZ 2.65Å; D77-K83 PolarHBondContact OD2-NZ 2.79Å; L81-K83 PolarHBondContact O-N 3.49Å
84	G	55	Low	52	Low	34 Å²	34	67.4 Å²	67.4	35%	0.351	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	145.1	177.9	0	0	0	0	0	109.9	A75 V82	A75-G84 PolarHBondContact N-O 2.82Å; A75-G84 PolarHBondContact O-N 2.99Å; V82-G84 WeakPolarHBondContact CG1-O 3.4Å
85	E	54.4	Low	51.7	Low	109 Å²	109	65.4 Å²	65.4	51%	0.509	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130.4	172.9	176.8	174	-158.7	0	0	107	N72 L73 Y74	N72-E85 HydrophobicContact CB-CG 4.44Å; N72-E85 PolarHBondContact ND2-OE1 2.94Å; L73-E85 WeakPolarHBondContact O-CA 3.32Å; Y74-E85 HydrophobicContact CD1-CB 4.11Å; Y74-E85 HydrophobicContact CD1-CG 4.03Å; Y74-E85 HydrophobicContact CE1-CB 4.08Å; Y74-E85 HydrophobicContact CE1-CG 3.6Å; Y74-E85 VanDerWaalsContact CE1-OE1 3.26Å; Y74-E85 WeakPolarHBondContact CE1-OE1 3.39Å; Y74-E85 PolarHBondContact OH-OE1 2.78Å
86	D	50.4	Low	51.4	Low	69 Å²	69	70.4 Å²	70.4	37%	0.369	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.8	166.3	-147.3	-28.4	0	0	0	109.7	Y42 L73 L88	Y42-D86 HydrophobicContact CD2-CB 4.15Å; Y42-D86 WeakPolarHBondContact CD2-OD2 3.38Å; Y42-D86 HydrophobicContact CE2-CB 3.73Å; Y42-D86 WeakPolarHBondContact CE2-OD2 3.3Å; L73-D86 WeakPolarHBondContact CB-O 3.45Å; L73-D86 PolarHBondContact N-O 3.01Å; L73-D86 PolarHBondContact O-N 3.35Å; D86-L88 PolarHBondContact O-N 2.89Å
87	V	44.5	Very low	51.5	Low	82 Å²	82	69.7 Å²	69.7	50%	0.497	40%	0.395	S	S	.	.			trans	-85.5	94.9	179.3	-176.6	0	0	0	0	106.9	I89	V87-I89 HydrophobicContact CG1-CD1 4.22Å; V87-I89 HydrophobicContact CG1-CG1 3.72Å; V87-I89 PolarHBondContact O-N 2.93Å; V87-I89 VanDerWaalsContact O-N 3.15Å
88	L	44.1	Very low	51.1	Low	19 Å²	19	70.2 Å²	70.2	10%	0.099	41%	0.406	C	S	.	.			trans	-80.8	99.6	172.1	-100	163.2	0	0	0	109.9	L73 D86 A90 I91 L106	L73-L88 HydrophobicContact CB-CB 4.15Å; L73-L88 HydrophobicContact CB-CD1 3.68Å; L73-L88 HydrophobicContact CB-CG 4.24Å; L73-L88 HydrophobicContact CD1-CD1 3.51Å; L73-L88 HydrophobicContact CD2-CD1 3.34Å; L73-L88 HydrophobicContact CD2-CG 4.46Å; L73-L88 HydrophobicContact CG-CD1 3.66Å; D86-L88 PolarHBondContact O-N 2.89Å; L88-A90 PolarHBondContact O-N 2.98Å; L88-I91 HydrophobicContact CD1-CD1 4.2Å; L88-L106 HydrophobicContact CD1-CD1 3.48Å; L88-L106 VanDerWaalsContact CD1-CD1 3.48Å; L88-L106 HydrophobicContact CD2-CD1 3.84Å; L88-L106 HydrophobicContact CG-CD1 4.37Å
89	I	38	Very low	51.1	Low	76 Å²	76	67.8 Å²	67.8	39%	0.39	39%	0.39	S	S	.	.			trans	-78.7	79.9	174.4	-41.7	174.1	0	0	0	104.8	T46 V47 V87	T46-I89 VanDerWaalsContact CA-CG2 3.42Å; T46-I89 HydrophobicContact CG2-CD1 3.89Å; T46-I89 HydrophobicContact CG2-CG2 4.18Å; V47-I89 VanDerWaalsContact N-CG2 3.25Å; V47-I89 PolarHBondContact N-O 3.3Å; V47-I89 CarbonylContact O-C 2.69Å; V47-I89 WeakPolarHBondContact O-CA 3.38Å; V47-I89 WeakPolarHBondContact O-CB 3Å; V47-I89 WeakPolarHBondContact O-CG2 3.46Å; V87-I89 HydrophobicContact CG1-CD1 4.22Å; V87-I89 HydrophobicContact CG1-CG1 3.72Å; V87-I89 PolarHBondContact O-N 2.93Å; V87-I89 VanDerWaalsContact O-N 3.15Å
90	A	38.8	Very low	50.9	Low	10 Å²	10	64.6 Å²	64.6	8%	0.083	38%	0.376	C	S	.	.			trans	82	147.5	164.9	0	0	0	0	0	123.1	V47 R48 L49 L88 F108	V47-A90 HydrophobicContact CB-CB 3.15Å; V47-A90 HydrophobicContact CG1-CB 3.42Å; V47-A90 VanDerWaalsContact CG1-CB 3.42Å; V47-A90 WeakPolarHBondContact O-CA 3.37Å; V47-A90 WeakPolarHBondContact O-CB 3.4Å; V47-A90 PolarHBondContact O-N 2.88Å; R48-A90 VanDerWaalsContact N-CB 3.29Å; L49-A90 VanDerWaalsContact CD1-CA 3.41Å; L49-A90 HydrophobicContact CD1-CB 4.16Å; L88-A90 PolarHBondContact O-N 2.98Å; A90-F108 WeakPolarHBondContact O-CE1 3.2Å; A90-F108 WeakPolarHBondContact O-CZ 3.42Å
91	I	46.3	Very low	51.2	Low	10 Å²	10	71.9 Å²	71.9	5%	0.051	39%	0.39	C	S	.	.			trans	-158.2	132.3	-175.3	-35.7	-176.1	0	0	0	104.4	L49 M68 L88 A95 L106 F108	L49-I91 VanDerWaalsContact CD1-CA 3.46Å; L49-I91 HydrophobicContact CD1-CB 3.53Å; L49-I91 HydrophobicContact CD1-CG1 3.75Å; L49-I91 WeakPolarHBondContact CD1-O 3.26Å; L49-I91 HydrophobicContact CD2-CB 4.26Å; L49-I91 HydrophobicContact CG-CB 4.43Å; L49-I91 VanDerWaalsContact CG-O 3.24Å; L49-I91 WeakPolarHBondContact CG-O 3.38Å; M68-I91 HydrophobicContact CE-CD1 3.16Å; M68-I91 HydrophobicContact SD-CD1 3.37Å; M68-I91 WeakPolarHBondContact SD-CD1 3.35Å; M68-I91 HydrophobicContact SD-CG1 4.29Å; L88-I91 HydrophobicContact CD1-CD1 4.2Å; I91-A95 HydrophobicContact CG2-CB 3.16Å; I91-L106 HydrophobicContact CD1-CD1 3.85Å; I91-L106 HydrophobicContact CD1-CD2 4.09Å; I91-F108 HydrophobicContact CB-CE1 4.37Å; I91-F108 HydrophobicContact CG2-CE1 4.3Å
92	D	41.1	Very low	51.1	Low	93 Å²	93	71 Å²	71	50%	0.497	39%	0.385	S	S	.	.			trans	-61.2	145.8	167.1	-152	-26.3	0	0	0	108	N94 A95 W109	D92-N94 PolarHBondContact O-N 3.08Å; D92-A95 PolarHBondContact O-N 2.79Å; D92-W109 HydrophobicContact CB-CB 4.44Å
93	D	45.3	Very low	50.6	Low	88 Å²	88	70.1 Å²	70.1	47%	0.471	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	15.6	-160.9	-96.7	-12.9	0	0	0	115.8
94	N	48	Very low	50.5	Low	118 Å²	118	65.4 Å²	65.4	63%	0.631	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-155.2	22.3	-178.1	-111.7	-0.6	0	0	0	115.4	D92 T96 W109	D92-N94 PolarHBondContact O-N 3.08Å; N94-T96 PolarHBondContact O-N 3.17Å; N94-W109 HydrophobicContact CB-CZ2 4.45Å
95	A	50	Low	50.6	Low	6 Å²	6	65.3 Å²	65.3	5%	0.05	35%	0.349	C	S	.	.			trans	-65.9	126.5	172.5	0	0	0	0	0	110.5	I91 D92 G107	I91-A95 HydrophobicContact CG2-CB 3.16Å; D92-A95 PolarHBondContact O-N 2.79Å; A95-G107 WeakPolarHBondContact CB-O 3.14Å
96	T	53.1	Low	50.6	Low	117 Å²	117	60.4 Å²	60.4	72%	0.718	33%	0.326	S	S	*	.			trans	-91.6	114	165.5	-46.5	0	0	0	0	106.6	N94	N94-T96 PolarHBondContact O-N 3.17Å
97	P	57.6	Low	50.5	Low	8 Å²	8	58.8 Å²	58.8	5%	0.052	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	138	171	4.9	2.4	0	0	0	108.9	V54 L65 M104 I105 L106	V54-P97 HydrophobicContact CB-CG 4.43Å; V54-P97 HydrophobicContact CG1-CG 3.09Å; L65-P97 HydrophobicContact CD1-CB 4.4Å; L65-P97 HydrophobicContact CD1-CG 3.43Å; L65-P97 VanDerWaalsContact CD1-CG 3.43Å; P97-M104 HydrophobicContact CB-CG 3.76Å; P97-M104 HydrophobicContact CB-SD 3.79Å; P97-M104 HydrophobicContact CG-SD 4.28Å; P97-I105 CarbonylContact C-O 3.56Å; P97-I105 WeakPolarHBondContact CA-O 3.13Å; P97-L106 HydrophobicContact CB-CD2 3.6Å; P97-L106 HydrophobicContact CG-CD2 3.78Å
98	G	51.3	Low	50.7	Low	36 Å²	36	56.6 Å²	56.6	37%	0.371	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	166.2	161.3	0	0	0	0	0	109.5	M104 I105	G98-M104 CarbonylContact O-C 3.6Å; G98-I105 PolarHBondContact N-O 3.24Å; G98-I105 PolarHBondContact O-N 3.23Å
99	F	57.5	Low	50.8	Low	68 Å²	68	64.7 Å²	64.7	30%	0.298	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	139.7	166	-70.5	-79.8	0	0	0	109.1	A56 H58 D103 M104	A56-F99 HydrophobicContact CB-CD2 3.95Å; A56-F99 HydrophobicContact CB-CE2 3.27Å; A56-F99 HydrophobicContact CB-CZ 4.1Å; H58-F99 HydrophobicContact CB-CE2 4.47Å; H58-F99 AromaticContact CD2-CD1 3.93Å; H58-F99 AromaticContact CD2-CG 3.96Å; F99-D103 WeakPolarHBondContact CA-O 3.2Å; F99-M104 HydrophobicContact CD1-CB 3.94Å; F99-M104 HydrophobicContact CD1-CG 4.28Å; F99-M104 HydrophobicContact CE1-CB 3.7Å; F99-M104 HydrophobicContact CE1-CG 3.93Å; F99-M104 HydrophobicContact CE1-SD 4.43Å; F99-M104 HydrophobicContact CZ-CG 4.36Å; F99-M104 HydrophobicContact CZ-SD 4.44Å
100	V	55.1	Low	51.6	Low	77 Å²	77	66.8 Å²	66.8	47%	0.467	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	106.3	168.8	177.9	0	0	0	0	106.7	D102 D103 I105	V100-D102 PolarHBondContact O-N 2.65Å; V100-D103 PolarHBondContact N-O 2.72Å; V100-D103 PolarHBondContact O-N 2.98Å; V100-D103 VanDerWaalsContact O-N 3.12Å; V100-I105 HydrophobicContact CB-CG1 4Å; V100-I105 HydrophobicContact CG2-CD1 4.42Å; V100-I105 HydrophobicContact CG2-CG1 3.58Å
101	Y	64.1	Low	51.9	Low	201 Å²	201	69.9 Å²	69.9	79%	0.788	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	-116.1	-167.2	-52.8	-74.5	0	0	0	111.6	H58	H58-Y101 PolarHBondContact NE2-O 3.06Å
102	D	56.2	Low	51.8	Low	82 Å²	82	72.3 Å²	72.3	44%	0.439	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-5.1	-177.3	-62.4	-31.2	0	0	0	112.4	N38 V100	N38-D102 HydrophobicContact CB-CB 4.21Å; N38-D102 WeakPolarHBondContact ND2-CB 3.39Å; N38-D102 PolarHBondContact ND2-OD1 3.33Å; N38-D102 PolarHBondContact ND2-OD2 3.39Å; V100-D102 PolarHBondContact O-N 2.65Å
103	D	52.1	Low	51.9	Low	65 Å²	65	71.1 Å²	71.1	35%	0.348	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	138.9	-177	-60.8	-43.3	0	0	0	110.9	F99 V100	F99-D103 WeakPolarHBondContact CA-O 3.2Å; V100-D103 PolarHBondContact N-O 2.72Å; V100-D103 PolarHBondContact O-N 2.98Å; V100-D103 VanDerWaalsContact O-N 3.12Å
104	M	57.4	Low	51.8	Low	5 Å²	5	69 Å²	69	3%	0.025	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	117	173.8	-173.3	178.1	71.7	0	0	109.7	Y42 L65 L73 P97 G98 F99 L106	Y42-M104 HydrophobicContact CD1-CE 4.39Å; Y42-M104 HydrophobicContact CE1-CE 3.58Å; L65-M104 HydrophobicContact CD1-CE 4.32Å; L65-M104 HydrophobicContact CD1-SD 3.91Å; L65-M104 HydrophobicContact CG-SD 4.35Å; L73-M104 HydrophobicContact CD2-CE 3.55Å; P97-M104 HydrophobicContact CB-CG 3.76Å; P97-M104 HydrophobicContact CB-SD 3.79Å; P97-M104 HydrophobicContact CG-SD 4.28Å; G98-M104 CarbonylContact O-C 3.6Å; F99-M104 HydrophobicContact CD1-CB 3.94Å; F99-M104 HydrophobicContact CD1-CG 4.28Å; F99-M104 HydrophobicContact CE1-CB 3.7Å; F99-M104 HydrophobicContact CE1-CG 3.93Å; F99-M104 HydrophobicContact CE1-SD 4.43Å; F99-M104 HydrophobicContact CZ-CG 4.36Å; F99-M104 HydrophobicContact CZ-SD 4.44Å; M104-L106 HydrophobicContact CE-CD1 4.02Å; M104-L106 HydrophobicContact CE-CD2 4.27Å; M104-L106 HydrophobicContact CE-CG 4.09Å
105	I	56.4	Low	51.4	Low	33 Å²	33	71.2 Å²	71.2	17%	0.169	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125.1	175.1	-54.3	-66.6	0	0	0	109.6	P97 G98 V100 A113 E115	P97-I105 CarbonylContact C-O 3.56Å; P97-I105 WeakPolarHBondContact CA-O 3.13Å; G98-I105 PolarHBondContact N-O 3.24Å; G98-I105 PolarHBondContact O-N 3.23Å; V100-I105 HydrophobicContact CB-CG1 4Å; V100-I105 HydrophobicContact CG2-CD1 4.42Å; V100-I105 HydrophobicContact CG2-CG1 3.58Å; I105-A113 HydrophobicContact CG2-CB 4.07Å; I105-E115 HydrophobicContact CD1-CB 4.33Å; I105-E115 HydrophobicContact CD1-CG 3.82Å
106	L	55	Low	51.5	Low	6 Å²	6	74.5 Å²	74.5	3%	0.031	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	113.2	169.7	-70.4	166.3	0	0	0	109.9	L88 I91 P97 M104 F108 L114	L88-L106 HydrophobicContact CD1-CD1 3.48Å; L88-L106 VanDerWaalsContact CD1-CD1 3.48Å; L88-L106 HydrophobicContact CD2-CD1 3.84Å; L88-L106 HydrophobicContact CG-CD1 4.37Å; I91-L106 HydrophobicContact CD1-CD1 3.85Å; I91-L106 HydrophobicContact CD1-CD2 4.09Å; P97-L106 HydrophobicContact CB-CD2 3.6Å; P97-L106 HydrophobicContact CG-CD2 3.78Å; M104-L106 HydrophobicContact CE-CD1 4.02Å; M104-L106 HydrophobicContact CE-CD2 4.27Å; M104-L106 HydrophobicContact CE-CG 4.09Å; L106-F108 HydrophobicContact CB-CE2 4.21Å; L106-F108 VanDerWaalsContact O-CD2 3.3Å; L106-F108 WeakPolarHBondContact O-CD2 3.47Å; L106-F108 WeakPolarHBondContact O-CE2 3.09Å; L106-L114 PolarHBondContact O-N 2.83Å
107	G	47.6	Very low	51.4	Low	34 Å²	34	72.3 Å²	72.3	35%	0.351	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	121.6	177.7	0	0	0	0	0	112.2	A95	A95-G107 WeakPolarHBondContact CB-O 3.14Å
108	F	50.5	Low	51.1	Low	37 Å²	37	75.8 Å²	75.8	16%	0.162	42%	0.42	C	S	.	.			trans	-94.4	145.6	179.4	-63.6	-99.2	0	0	0	111.1	A90 I91 L106 N110 G111 S112 L114	A90-F108 WeakPolarHBondContact O-CE1 3.2Å; A90-F108 WeakPolarHBondContact O-CZ 3.42Å; I91-F108 HydrophobicContact CB-CE1 4.37Å; I91-F108 HydrophobicContact CG2-CE1 4.3Å; L106-F108 HydrophobicContact CB-CE2 4.21Å; L106-F108 VanDerWaalsContact O-CD2 3.3Å; L106-F108 WeakPolarHBondContact O-CD2 3.47Å; L106-F108 WeakPolarHBondContact O-CE2 3.09Å; F108-N110 WeakPolarHBondContact CB-OD1 2.92Å; F108-N110 PolarHBondContact O-N 2.79Å; F108-N110 VanDerWaalsContact O-N 3.08Å; F108-G111 PolarHBondContact O-N 3.15Å; F108-S112 WeakPolarHBondContact CB-O 3.24Å; F108-S112 WeakPolarHBondContact CD2-O 3.4Å; F108-S112 PolarHBondContact N-O 3.39Å; F108-L114 HydrophobicContact CE2-CB 4.05Å; F108-L114 HydrophobicContact CE2-CD1 3.75Å; F108-L114 HydrophobicContact CE2-CG 4.13Å; F108-L114 HydrophobicContact CZ-CD1 3.77Å
109	W	45	Very low	51.1	Low	188 Å²	188	78.2 Å²	78.2	71%	0.712	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.4	178.6	-83.6	60.6	0	0	0	113.6	D92 N94 G111	D92-W109 HydrophobicContact CB-CB 4.44Å; N94-W109 HydrophobicContact CB-CZ2 4.45Å; W109-G111 PolarHBondContact O-N 2.81Å
110	N	54.9	Low	50.7	Low	121 Å²	121	78.8 Å²	78.8	65%	0.647	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	3.7	171.8	71.5	0.1	0	0	0	113.7	F108 S112	F108-N110 WeakPolarHBondContact CB-OD1 2.92Å; F108-N110 PolarHBondContact O-N 2.79Å; F108-N110 VanDerWaalsContact O-N 3.08Å; N110-S112 VanDerWaalsContact C-N 3.3Å; N110-S112 PolarHBondContact ND2-OG 2.77Å; N110-S112 WeakPolarHBondContact OD1-CB 2.85Å; N110-S112 PolarHBondContact OD1-N 2.82Å; N110-S112 PolarHBondContact OD1-OG 3.25Å
111	G	45.3	Very low	50.4	Low	74 Å²	74	78.9 Å²	78.9	76%	0.763	43%	0.429	S	S	*	.	S	Bend	trans	80.5	6	-178.3	0	0	0	0	0	114.4	F108 W109	F108-G111 PolarHBondContact O-N 3.15Å; W109-G111 PolarHBondContact O-N 2.81Å
112	S	44.3	Very low	49.4	Very low	61 Å²	61	70.2 Å²	70.2	43%	0.427	40%	0.403	S	S	.	.			trans	-82.6	143.9	173.6	-43.7	0	0	0	0	109.6	F108 N110	F108-S112 WeakPolarHBondContact CB-O 3.24Å; F108-S112 WeakPolarHBondContact CD2-O 3.4Å; F108-S112 PolarHBondContact N-O 3.39Å; N110-S112 VanDerWaalsContact C-N 3.3Å; N110-S112 PolarHBondContact ND2-OG 2.77Å; N110-S112 WeakPolarHBondContact OD1-CB 2.85Å; N110-S112 PolarHBondContact OD1-N 2.82Å; N110-S112 PolarHBondContact OD1-OG 3.25Å
113	A	43	Very low	48.9	Very low	69 Å²	69	69.3 Å²	69.3	57%	0.57	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	136.6	165.1	0	0	0	0	0	107.5	I105	I105-A113 HydrophobicContact CG2-CB 4.07Å
114	L	43.7	Very low	48.6	Very low	44 Å²	44	69.7 Å²	69.7	23%	0.23	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.3	164.4	-92.7	160.9	0	0	0	107.5	G43 L106 F108	G43-L114 WeakPolarHBondContact O-CD2 2.93Å; L106-L114 PolarHBondContact O-N 2.83Å; F108-L114 HydrophobicContact CE2-CB 4.05Å; F108-L114 HydrophobicContact CE2-CD1 3.75Å; F108-L114 HydrophobicContact CE2-CG 4.13Å; F108-L114 HydrophobicContact CZ-CD1 3.77Å
115	E	40	Very low	47.8	Very low	164 Å²	164	75.5 Å²	75.5	77%	0.766	44%	0.439	S	S	*	.			trans	-83.6	0	165.1	-69.8	-179.3	169.7	0	0	110.2	G43 I105	G43-E115 PolarHBondContact N-O 2.98Å; I105-E115 HydrophobicContact CD1-CB 4.33Å; I105-E115 HydrophobicContact CD1-CG 3.82Å

Retrieved 115 of 115 residues in 172.8 ms (Link to these results)

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