A0A077ZCU0_TRITR Loading...

Vacuolar protein sorting-associated protein 29

Component of the commander complex that is essential for endosomal recycling of transmembrane cargos; the commander complex is composed of the Csubcomplex and the retriever subcomplex. Component of the retriever complex, which is a heterotrimeric complex related to retromer cargo-selective complex (CSC) and essential for retromer-independent retrieval and recycling of numerous cargos. Component of the retromer cargo-selective complex (CSC). The CSC is believed to be the core functional component of retromer or respective retromer complex variants acting to prevent missorting of selected transmembrane cargo proteins into the lysosomal degradation pathway. In the endosomes, retriever complex drives the retrieval and recycling of NxxY-motif-containing cargo proteins by coupling to snx17, a cargo essential for the homeostatic maintenance of numerous cell surface proteins associated with processes that include cell migration, cell adhesion, nutrient supply and cell signaling. The recruitment of the retriever complex to the endosomal membrane involves Cand WASH complexes.

AlphaFold DB , UniProt , Accession A0A077ZCU0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 158 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50.9	Low	79.3	Confident	214 Å²	214	96.6 Å²	96.6	100%	1.054	48%	0.484	S	S	*	.				0	126.1	0	-136.2	176.6	126.7	0	0	108.2	L3	M1-L3 HydrophobicContact CB-CD2 4.46Å; M1-L3 HydrophobicContact CE-CD2 4.18Å; M1-L3 PolarHBondContact O-N 2.96Å
2	L	64.4	Low	80.9	Confident	53 Å²	53	90.3 Å²	90.3	28%	0.277	46%	0.455	S	S	.	.			trans	-72.1	110.3	172.1	-64.2	165.7	0	0	0	106.9	I7 L28 I111 F126	L2-I7 HydrophobicContact CD2-CD1 3.7Å; L2-L28 HydrophobicContact CB-CD1 4.39Å; L2-L28 HydrophobicContact CB-CD2 4.5Å; L2-L28 HydrophobicContact CD1-CD1 4.3Å; L2-I111 HydrophobicContact CD1-CD1 4.42Å; L2-F126 HydrophobicContact CD2-CE2 4.05Å; L2-F126 HydrophobicContact CD2-CZ 4.3Å
3	L	69.2	Low	82.2	Confident	73 Å²	73	84.6 Å²	84.6	38%	0.382	43%	0.428	S	S	.	.			trans	-102.5	140.5	-178.9	-66.2	173.3	0	0	0	109.2	M1	M1-L3 HydrophobicContact CB-CD2 4.46Å; M1-L3 HydrophobicContact CE-CD2 4.18Å; M1-L3 PolarHBondContact O-N 2.96Å
4	P	64.6	Low	83.3	Confident	70 Å²	70	79.3 Å²	79.3	46%	0.455	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	149.9	172.1	-26	34.3	0	0	0	112	K6	P4-K6 VanDerWaalsContact C-N 3.3Å; P4-K6 PolarHBondContact O-N 3.36Å
5	N	68.5	Low	84.3	Confident	163 Å²	163	76.7 Å²	76.7	87%	0.872	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	10.7	176.5	-52.8	-38.7	0	0	0	116.9
6	K	83.5	Confident	85	Confident	158 Å²	158	73.6 Å²	73.6	69%	0.687	38%	0.376	S	S	*	.	S	Bend	trans	-104.1	-9.9	170.7	-64.2	-165	177.3	-173.4	0	114	P4	P4-K6 VanDerWaalsContact C-N 3.3Å; P4-K6 PolarHBondContact O-N 3.36Å
7	I	89.5	Confident	85.6	Confident	41 Å²	41	71.9 Å²	71.9	21%	0.21	37%	0.372	C	S	.	.			trans	-118.4	121.6	-174.2	-56.2	175	0	0	0	108	L2 H9 I10 A29	L2-I7 HydrophobicContact CD2-CD1 3.7Å; I7-H9 VanDerWaalsContact CG2-O 3.29Å; I7-H9 WeakPolarHBondContact CG2-O 3.46Å; I7-I10 HydrophobicContact CG2-CG1 3.81Å; I7-A29 HydrophobicContact CB-CB 4.4Å; I7-A29 HydrophobicContact CG2-CB 4.25Å; I7-A29 WeakPolarHBondContact O-CB 3.46Å
8	H	91.9	Very high	86	Confident	150 Å²	150	70.6 Å²	70.6	69%	0.694	37%	0.368	S	S	*	.	S	Bend	trans	-82.5	-43.5	179	-61.5	98	0	0	0	111.7	D31	H8-D31 WeakPolarHBondContact O-CB 3.39Å
9	H	94.8	Very high	86.3	Confident	79 Å²	79	73.5 Å²	73.5	37%	0.366	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137.3	-176.8	-51.5	-77.4	0	0	0	110.1	I7 D31	I7-H9 VanDerWaalsContact CG2-O 3.29Å; I7-H9 WeakPolarHBondContact CG2-O 3.46Å; H9-D31 WeakPolarHBondContact CA-O 3.49Å; H9-D31 IonicContact CE1-OD2 3.01Å; H9-D31 PolarHBondContact CE1-OD2 3.12Å; H9-D31 VanDerWaalsContact CE1-OD2 3.27Å; H9-D31 IonicContact CG-OD2 3.96Å; H9-D31 IonicContact ND1-OD2 3.95Å; H9-D31 PolarHBondContact ND1-OD2 3.43Å
10	I	97	Very high	86.7	Confident	23 Å²	23	77 Å²	77	12%	0.118	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.3	168.3	-67	175	0	0	0	108.8	I7 L25 L28 A29 D31 V32 H33	I7-I10 HydrophobicContact CG2-CG1 3.81Å; I10-L25 HydrophobicContact CD1-CB 4.37Å; I10-L25 HydrophobicContact CD1-CD2 4.39Å; I10-L25 WeakPolarHBondContact CD1-O 3.33Å; I10-L25 HydrophobicContact CG2-CD1 4.19Å; I10-L25 HydrophobicContact CG2-CD2 4.32Å; I10-L28 HydrophobicContact CD1-CB 3.88Å; I10-A29 HydrophobicContact CD1-CB 3.68Å; I10-A29 HydrophobicContact CG1-CB 3.79Å; I10-D31 PolarHBondContact N-O 3.21Å; I10-V32 HydrophobicContact CB-CG1 4.33Å; I10-V32 HydrophobicContact CB-CG2 4.3Å; I10-V32 HydrophobicContact CD1-CG2 4.37Å; I10-V32 HydrophobicContact CG2-CG1 4.27Å; I10-H33 PolarHBondContact O-N 3.38Å
11	L	98	Very high	87.1	Confident	39 Å²	39	77.3 Å²	77.3	20%	0.204	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	101.1	175.9	-53	-171.9	0	0	0	108.7	H33 I51 I58 L60 I88	L11-H33 HydrophobicContact CD2-CB 3.92Å; L11-I51 HydrophobicContact CD2-CD1 3.31Å; L11-I58 HydrophobicContact CD1-CD1 4.04Å; L11-I58 HydrophobicContact CD1-CG2 3.85Å; L11-L60 HydrophobicContact CB-CD1 4.47Å; L11-L60 HydrophobicContact CB-CD2 4.2Å; L11-I88 HydrophobicContact CB-CD1 4.39Å; L11-I88 HydrophobicContact CD1-CD1 3.69Å
12	C	98.1	Very high	89.2	Confident	20 Å²	20	70 Å²	70	14%	0.135	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.3	-176.7	-178.9	0	0	0	0	110.6	G14 L25 H33 V34 V35 L60	C12-G14 PolarHBondContact O-N 3.12Å; C12-G14 PolarHBondContact SG-N 3.06Å; C12-G14 VanDerWaalsContact SG-N 3.44Å; C12-L25 HydrophobicContact CB-CD1 4.09Å; C12-H33 PolarHBondContact N-O 3.49Å; C12-V34 HydrophobicContact CB-CB 4.43Å; C12-V34 HydrophobicContact CB-CG1 4.32Å; C12-V34 HydrophobicContact CB-CG2 4.02Å; C12-V35 PolarHBondContact O-N 3.07Å; C12-L60 WeakPolarHBondContact O-CD2 3.35Å
13	T	98.4	Very high	90.6	Very high	17 Å²	17	71 Å²	71	10%	0.104	36%	0.359	C	S	.	.			trans	-72.9	0.1	178.4	47.8	0	0	0	0	113.9	V35 L60 H62 I88 P108	T13-V35 WeakPolarHBondContact O-CG2 3.43Å; T13-L60 HydrophobicContact CG2-CD1 3.85Å; T13-H62 WeakPolarHBondContact O-CA 3.37Å; T13-H62 WeakPolarHBondContact O-CB 3.31Å; T13-H62 PolarHBondContact O-CD2 2.82Å; T13-I88 HydrophobicContact CG2-CG2 3.87Å; T13-P108 HydrophobicContact CG2-CG 4.26Å
14	G	97.8	Very high	91.8	Very high	10 Å²	10	73.1 Å²	73.1	10%	0.103	36%	0.362	C	S	.	.	S	Bend	trans	96.3	-166.8	-178.1	0	0	0	0	0	113	C12 L16 V35 D40	C12-G14 PolarHBondContact O-N 3.12Å; C12-G14 PolarHBondContact SG-N 3.06Å; C12-G14 VanDerWaalsContact SG-N 3.44Å; G14-L16 VanDerWaalsContact C-N 3.26Å; G14-L16 PolarHBondContact O-N 2.88Å; G14-V35 WeakPolarHBondContact CA-O 3.4Å; G14-V35 PolarHBondContact N-O 3.32Å; G14-D40 WeakPolarHBondContact CA-OD2 3.34Å
15	N	97.8	Very high	93.2	Very high	41 Å²	41	71 Å²	71	22%	0.219	35%	0.347	C	S	.	.			trans	55	43.6	-170	-73.1	-10.9	0	0	0	112.1	C17 G37 D38 F39 D40 H62	N15-C17 VanDerWaalsContact C-N 3.28Å; N15-G37 VanDerWaalsContact OD1-C 3.25Å; N15-G37 WeakPolarHBondContact OD1-CA 3.15Å; N15-D38 PolarHBondContact ND2-OD1 2.55Å; N15-D38 PolarHBondContact OD1-N 3.16Å; N15-D38 VanDerWaalsContact OD1-N 3.13Å; N15-D38 PolarHBondContact OD1-OD1 3.4Å; N15-F39 PolarHBondContact OD1-N 3.18Å; N15-D40 VanDerWaalsContact CA-OD1 3.26Å; N15-D40 WeakPolarHBondContact CA-OD1 3.35Å; N15-D40 VanDerWaalsContact N-CG 3.31Å; N15-D40 PolarHBondContact N-OD1 3.47Å; N15-D40 PolarHBondContact N-OD2 3.13Å; N15-H62 PolarHBondContact ND2-CE1 3.03Å; N15-H62 PolarHBondContact ND2-NE2 2.91Å
16	L	96.4	Very high	94.4	Very high	27 Å²	27	67 Å²	67	14%	0.141	32%	0.322	C	S	.	.			trans	-72.7	-30.4	161.5	-65.1	-177.7	0	0	0	110.5	G14 T18 Q21 Y22 L25 V34 D40	G14-L16 VanDerWaalsContact C-N 3.26Å; G14-L16 PolarHBondContact O-N 2.88Å; L16-T18 PolarHBondContact O-N 3.17Å; L16-Q21 HydrophobicContact CB-CB 4.01Å; L16-Q21 HydrophobicContact CD2-CB 4.09Å; L16-Q21 WeakPolarHBondContact O-CG 3.42Å; L16-Y22 HydrophobicContact CD1-CD2 4.39Å; L16-L25 HydrophobicContact CD1-CD1 3.93Å; L16-L25 HydrophobicContact CD2-CD1 3.92Å; L16-V34 HydrophobicContact CD1-CG1 3.94Å; L16-V34 HydrophobicContact CD1-CG2 3.91Å; L16-V34 HydrophobicContact CG-CG1 4.45Å; L16-D40 PolarHBondContact N-OD1 3.11Å
17	C	94.5	Very high	94.8	Very high	45 Å²	45	63 Å²	63	30%	0.304	31%	0.314	S	S	.	.			trans	66.1	-26.2	178.8	-54	0	0	0	0	115	N15 D40 E41	N15-C17 VanDerWaalsContact C-N 3.28Å; C17-D40 PolarHBondContact N-OD1 3.2Å; C17-E41 VanDerWaalsContact O-CG 3.25Å; C17-E41 WeakPolarHBondContact O-CG 3.33Å
18	T	92.9	Very high	95	Very high	48 Å²	48	61.6 Å²	61.6	29%	0.294	31%	0.307	S	S	.	.	S	Bend	trans	-143.5	154.1	-178.1	72.1	0	0	0	0	113	L16 E20 Q21 Y22	L16-T18 PolarHBondContact O-N 3.17Å; T18-E20 PolarHBondContact O-N 2.84Å; T18-Q21 PolarHBondContact O-N 3.48Å; T18-Y22 PolarHBondContact O-N 2.71Å
19	K	92.5	Very high	95	Very high	126 Å²	126	54.8 Å²	54.8	55%	0.548	28%	0.276	S	S	.	.	H	α-helix	trans	-55.5	-31.5	171.8	-176.6	173.8	-179.1	-62.3	0	114.3	Q21 Y22 D23 E42	K19-Q21 VanDerWaalsContact C-N 3.3Å; K19-Q21 PolarHBondContact O-N 3.3Å; K19-Y22 WeakPolarHBondContact O-CB 3.45Å; K19-Y22 PolarHBondContact O-N 3.38Å; K19-D23 IonicContact NZ-OD1 3.88Å; K19-D23 PolarHBondContact NZ-OD1 3.29Å; K19-D23 IonicContact NZ-OD2 3.43Å; K19-D23 PolarHBondContact NZ-OD2 2.87Å; K19-D23 PolarHBondContact O-N 2.96Å; K19-E42 PolarHBondContact N-OE1 2.68Å
20	E	94.3	Very high	94.8	Very high	143 Å²	143	56 Å²	56	67%	0.668	29%	0.293	S	S	*	.	H	α-helix	trans	-59.4	-42.7	178.6	-175.5	-176.6	175.5	0	0	111.6	T18 D23 Y24	T18-E20 PolarHBondContact O-N 2.84Å; E20-D23 PolarHBondContact O-N 2.88Å; E20-Y24 PolarHBondContact O-N 2.8Å
21	Q	94.2	Very high	94.7	Very high	83 Å²	83	57.7 Å²	57.7	39%	0.388	30%	0.303	S	S	.	.	H	α-helix	trans	-69.5	-35.6	178.4	-61.8	-53.7	-37.9	0	0	111.8	L16 T18 K19 Y24 L25	L16-Q21 HydrophobicContact CB-CB 4.01Å; L16-Q21 HydrophobicContact CD2-CB 4.09Å; L16-Q21 WeakPolarHBondContact O-CG 3.42Å; T18-Q21 PolarHBondContact O-N 3.48Å; K19-Q21 VanDerWaalsContact C-N 3.3Å; K19-Q21 PolarHBondContact O-N 3.3Å; Q21-Y24 PolarHBondContact O-N 2.97Å; Q21-L25 WeakPolarHBondContact O-CG 3.37Å; Q21-L25 PolarHBondContact O-N 3.4Å
22	Y	94.6	Very high	94.6	Very high	60 Å²	60	56.3 Å²	56.3	24%	0.235	30%	0.296	C	S	.	.	H	α-helix	trans	-62.2	-47.1	172	-179.4	-91.7	0	0	0	112.1	L16 T18 K19 Y24 L25 K26 V32 V34	L16-Y22 HydrophobicContact CD1-CD2 4.39Å; T18-Y22 PolarHBondContact O-N 2.71Å; K19-Y22 WeakPolarHBondContact O-CB 3.45Å; K19-Y22 PolarHBondContact O-N 3.38Å; Y22-Y24 VanDerWaalsContact C-N 3.27Å; Y22-Y24 PolarHBondContact O-N 3.02Å; Y22-L25 PolarHBondContact O-N 3.22Å; Y22-L25 VanDerWaalsContact O-N 3.13Å; Y22-K26 HydrophobicContact CD1-CG 4.11Å; Y22-K26 HydrophobicContact CE1-CD 4.4Å; Y22-K26 HydrophobicContact CE1-CG 3.6Å; Y22-K26 PolarHBondContact O-N 3.43Å; Y22-K26 WeakPolarHBondContact OH-CE 3.43Å; Y22-V32 HydrophobicContact CE2-CG1 4.33Å; Y22-V34 HydrophobicContact CD2-CG2 3.89Å; Y22-V34 HydrophobicContact CE2-CG2 3.96Å
23	D	94.6	Very high	94.6	Very high	75 Å²	75	56.2 Å²	56.2	40%	0.401	29%	0.293	S	S	.	.	H	α-helix	trans	-62.1	-37	178.5	-70.5	-21.4	0	0	0	110.8	K19 E20 K26 S27	K19-D23 IonicContact NZ-OD1 3.88Å; K19-D23 PolarHBondContact NZ-OD1 3.29Å; K19-D23 IonicContact NZ-OD2 3.43Å; K19-D23 PolarHBondContact NZ-OD2 2.87Å; K19-D23 PolarHBondContact O-N 2.96Å; E20-D23 PolarHBondContact O-N 2.88Å; D23-K26 PolarHBondContact O-N 2.77Å; D23-S27 PolarHBondContact O-N 3.14Å
24	Y	93.7	Very high	94.6	Very high	118 Å²	118	55.9 Å²	55.9	46%	0.463	29%	0.291	S	S	.	.	H	α-helix	trans	-60.4	-48	171	174.1	-106.4	0	0	0	112.3	E20 Q21 Y22 K26 S27 L28	E20-Y24 PolarHBondContact O-N 2.8Å; Q21-Y24 PolarHBondContact O-N 2.97Å; Y22-Y24 VanDerWaalsContact C-N 3.27Å; Y22-Y24 PolarHBondContact O-N 3.02Å; Y24-K26 VanDerWaalsContact C-N 3.28Å; Y24-K26 PolarHBondContact O-N 2.86Å; Y24-S27 WeakPolarHBondContact O-CB 3.45Å; Y24-S27 PolarHBondContact O-N 3.24Å; Y24-S27 PolarHBondContact O-OG 2.69Å; Y24-L28 HydrophobicContact CD1-CD1 4.42Å; Y24-L28 HydrophobicContact CE1-CD1 3.79Å; Y24-L28 PolarHBondContact O-N 3.06Å
25	L	94.1	Very high	94.6	Very high	25 Å²	25	55.4 Å²	55.4	13%	0.131	29%	0.286	C	S	.	.	H	α-helix	trans	-60.3	-39.2	176.1	-66.8	-176.2	0	0	0	112.1	I10 C12 L16 Q21 Y22 S27 L28 A29 V32	I10-L25 HydrophobicContact CD1-CB 4.37Å; I10-L25 HydrophobicContact CD1-CD2 4.39Å; I10-L25 WeakPolarHBondContact CD1-O 3.33Å; I10-L25 HydrophobicContact CG2-CD1 4.19Å; I10-L25 HydrophobicContact CG2-CD2 4.32Å; C12-L25 HydrophobicContact CB-CD1 4.09Å; L16-L25 HydrophobicContact CD1-CD1 3.93Å; L16-L25 HydrophobicContact CD2-CD1 3.92Å; Q21-L25 WeakPolarHBondContact O-CG 3.37Å; Q21-L25 PolarHBondContact O-N 3.4Å; Y22-L25 PolarHBondContact O-N 3.22Å; Y22-L25 VanDerWaalsContact O-N 3.13Å; L25-S27 PolarHBondContact O-N 2.98Å; L25-L28 WeakPolarHBondContact O-CB 3.36Å; L25-L28 PolarHBondContact O-N 2.82Å; L25-A29 PolarHBondContact O-N 3.48Å; L25-A29 VanDerWaalsContact O-N 3.16Å; L25-V32 HydrophobicContact CB-CG1 3.96Å; L25-V32 HydrophobicContact CB-CG2 4.34Å; L25-V32 HydrophobicContact CD1-CG1 4.14Å
26	K	93.8	Very high	94.6	Very high	80 Å²	80	56.9 Å²	56.9	35%	0.348	29%	0.289	S	S	.	.	H	α-helix	trans	-64.2	-25.3	175.1	-80.7	-71.5	-175.7	180	0	113.6	Y22 D23 Y24 L28 A29 S30 V32	Y22-K26 HydrophobicContact CD1-CG 4.11Å; Y22-K26 HydrophobicContact CE1-CD 4.4Å; Y22-K26 HydrophobicContact CE1-CG 3.6Å; Y22-K26 PolarHBondContact O-N 3.43Å; Y22-K26 WeakPolarHBondContact OH-CE 3.43Å; D23-K26 PolarHBondContact O-N 2.77Å; Y24-K26 VanDerWaalsContact C-N 3.28Å; Y24-K26 PolarHBondContact O-N 2.86Å; K26-L28 VanDerWaalsContact C-N 3.29Å; K26-A29 CarbonylContact C-O 3.58Å; K26-A29 WeakPolarHBondContact CA-O 3.43Å; K26-S30 PolarHBondContact NZ-O 3.06Å; K26-V32 HydrophobicContact CD-CB 4.21Å; K26-V32 HydrophobicContact CD-CG2 3.79Å; K26-V32 HydrophobicContact CG-CG2 4.16Å
27	S	93	Very high	94.7	Very high	73 Å²	73	55.7 Å²	55.7	51%	0.51	28%	0.283	S	S	.	.	H	α-helix	trans	-73.4	-21.8	172.5	83.2	0	0	0	0	113.3	D23 Y24 L25	D23-S27 PolarHBondContact O-N 3.14Å; Y24-S27 WeakPolarHBondContact O-CB 3.45Å; Y24-S27 PolarHBondContact O-N 3.24Å; Y24-S27 PolarHBondContact O-OG 2.69Å; L25-S27 PolarHBondContact O-N 2.98Å
28	L	92.2	Very high	94.8	Very high	12 Å²	12	56.8 Å²	56.8	6%	0.063	29%	0.286	C	S	.	.	H	α-helix	trans	-89.8	-38.3	-179.5	-61.8	178.3	0	0	0	112.7	L2 I10 Y24 L25 K26	L2-L28 HydrophobicContact CB-CD1 4.39Å; L2-L28 HydrophobicContact CB-CD2 4.5Å; L2-L28 HydrophobicContact CD1-CD1 4.3Å; I10-L28 HydrophobicContact CD1-CB 3.88Å; Y24-L28 HydrophobicContact CD1-CD1 4.42Å; Y24-L28 HydrophobicContact CE1-CD1 3.79Å; Y24-L28 PolarHBondContact O-N 3.06Å; L25-L28 WeakPolarHBondContact O-CB 3.36Å; L25-L28 PolarHBondContact O-N 2.82Å; K26-L28 VanDerWaalsContact C-N 3.29Å
29	A	93.1	Very high	95	Very high	6 Å²	6	61.4 Å²	61.4	5%	0.05	30%	0.302	C	S	.	.			trans	-145.8	144.8	177.4	0	0	0	0	0	111.1	I7 I10 L25 K26 V32	I7-A29 HydrophobicContact CB-CB 4.4Å; I7-A29 HydrophobicContact CG2-CB 4.25Å; I7-A29 WeakPolarHBondContact O-CB 3.46Å; I10-A29 HydrophobicContact CD1-CB 3.68Å; I10-A29 HydrophobicContact CG1-CB 3.79Å; L25-A29 PolarHBondContact O-N 3.48Å; L25-A29 VanDerWaalsContact O-N 3.16Å; K26-A29 CarbonylContact C-O 3.58Å; K26-A29 WeakPolarHBondContact CA-O 3.43Å; A29-V32 VanDerWaalsContact O-CG2 3.27Å; A29-V32 WeakPolarHBondContact O-CG2 3.48Å
30	S	90.4	Very high	95.2	Very high	104 Å²	104	55.8 Å²	55.8	73%	0.727	28%	0.278	S	S	*	.	S	Bend	trans	-69.8	-35.1	175.9	52.6	0	0	0	0	112.2	K26	K26-S30 PolarHBondContact NZ-O 3.06Å
31	D	95	Very high	95	Very high	59 Å²	59	55.7 Å²	55.7	32%	0.316	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	104.3	-179.7	-161	21.7	0	0	0	111.4	H8 H9 I10 H33	H8-D31 WeakPolarHBondContact O-CB 3.39Å; H9-D31 WeakPolarHBondContact CA-O 3.49Å; H9-D31 IonicContact CE1-OD2 3.01Å; H9-D31 PolarHBondContact CE1-OD2 3.12Å; H9-D31 VanDerWaalsContact CE1-OD2 3.27Å; H9-D31 IonicContact CG-OD2 3.96Å; H9-D31 IonicContact ND1-OD2 3.95Å; H9-D31 PolarHBondContact ND1-OD2 3.43Å; I10-D31 PolarHBondContact N-O 3.21Å; D31-H33 VanDerWaalsContact CG-NE2 3.32Å; D31-H33 IonicContact OD1-CD2 3.4Å; D31-H33 IonicContact OD1-CE1 3.2Å; D31-H33 IonicContact OD1-NE2 2.71Å; D31-H33 PolarHBondContact OD1-NE2 2.91Å; D31-H33 IonicContact OD2-CE1 3.13Å; D31-H33 IonicContact OD2-NE2 3.99Å; D31-H33 PolarHBondContact OD2-NE2 2.69Å; D31-H33 VanDerWaalsContact OD2-NE2 3.13Å
32	V	96.4	Very high	94.8	Very high	10 Å²	10	54 Å²	54	6%	0.061	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.7	-174.6	-177.4	0	0	0	0	108.6	I10 Y22 L25 K26 A29 V34	I10-V32 HydrophobicContact CB-CG1 4.33Å; I10-V32 HydrophobicContact CB-CG2 4.3Å; I10-V32 HydrophobicContact CD1-CG2 4.37Å; I10-V32 HydrophobicContact CG2-CG1 4.27Å; Y22-V32 HydrophobicContact CE2-CG1 4.33Å; L25-V32 HydrophobicContact CB-CG1 3.96Å; L25-V32 HydrophobicContact CB-CG2 4.34Å; L25-V32 HydrophobicContact CD1-CG1 4.14Å; K26-V32 HydrophobicContact CD-CB 4.21Å; K26-V32 HydrophobicContact CD-CG2 3.79Å; K26-V32 HydrophobicContact CG-CG2 4.16Å; A29-V32 VanDerWaalsContact O-CG2 3.27Å; A29-V32 WeakPolarHBondContact O-CG2 3.48Å; V32-V34 HydrophobicContact CG1-CG2 3.99Å
33	H	97.5	Very high	94.3	Very high	19 Å²	19	57 Å²	57	9%	0.088	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.8	178.8	-57.2	-102.9	0	0	0	108.9	I10 L11 C12 D31 K49 I51 L60	I10-H33 PolarHBondContact O-N 3.38Å; L11-H33 HydrophobicContact CD2-CB 3.92Å; C12-H33 PolarHBondContact N-O 3.49Å; D31-H33 VanDerWaalsContact CG-NE2 3.32Å; D31-H33 IonicContact OD1-CD2 3.4Å; D31-H33 IonicContact OD1-CE1 3.2Å; D31-H33 IonicContact OD1-NE2 2.71Å; D31-H33 PolarHBondContact OD1-NE2 2.91Å; D31-H33 IonicContact OD2-CE1 3.13Å; D31-H33 IonicContact OD2-NE2 3.99Å; D31-H33 PolarHBondContact OD2-NE2 2.69Å; D31-H33 VanDerWaalsContact OD2-NE2 3.13Å; H33-K49 HydrophobicContact CB-CD 4.13Å; H33-K49 VanDerWaalsContact ND1-CE 3.33Å; H33-K49 WeakPolarHBondContact ND1-CE 3.18Å; H33-K49 PolarHBondContact ND1-NZ 3.18Å; H33-K49 VanDerWaalsContact ND1-NZ 3.11Å; H33-I51 HydrophobicContact CB-CD1 3.49Å; H33-I51 VanDerWaalsContact CB-CD1 3.49Å; H33-I51 VanDerWaalsContact ND1-CD1 3.3Å; H33-I51 WeakPolarHBondContact ND1-CD1 3.4Å; H33-L60 HydrophobicContact CB-CD2 4.47Å
34	V	97.8	Very high	94.2	Very high	10 Å²	10	62.4 Å²	62.4	6%	0.061	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	138.1	176.7	-170.4	0	0	0	0	108	C12 L16 Y22 V32 Y45	C12-V34 HydrophobicContact CB-CB 4.43Å; C12-V34 HydrophobicContact CB-CG1 4.32Å; C12-V34 HydrophobicContact CB-CG2 4.02Å; L16-V34 HydrophobicContact CD1-CG1 3.94Å; L16-V34 HydrophobicContact CD1-CG2 3.91Å; L16-V34 HydrophobicContact CG-CG1 4.45Å; Y22-V34 HydrophobicContact CD2-CG2 3.89Å; Y22-V34 HydrophobicContact CE2-CG2 3.96Å; V32-V34 HydrophobicContact CG1-CG2 3.99Å; V34-Y45 HydrophobicContact CB-CD1 4.39Å; V34-Y45 HydrophobicContact CB-CE1 4.32Å; V34-Y45 HydrophobicContact CB-CE2 4.5Å; V34-Y45 HydrophobicContact CG1-CD2 3.92Å; V34-Y45 HydrophobicContact CG1-CE2 3.89Å; V34-Y45 HydrophobicContact CG1-CG 4.32Å
35	V	98.3	Very high	94.2	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-107.2	157.6	164.6	-67.4	0	0	0	0	109.4	C12 T13 G14 G37 Q46 K49 L60	C12-V35 PolarHBondContact O-N 3.07Å; T13-V35 WeakPolarHBondContact O-CG2 3.43Å; G14-V35 WeakPolarHBondContact CA-O 3.4Å; G14-V35 PolarHBondContact N-O 3.32Å; V35-G37 PolarHBondContact O-N 2.81Å; V35-Q46 CarbonylContact C-O 3.59Å; V35-Q46 WeakPolarHBondContact CA-O 3.3Å; V35-Q46 VanDerWaalsContact CB-O 3.31Å; V35-Q46 WeakPolarHBondContact CB-O 3.23Å; V35-K49 HydrophobicContact CG1-CB 3.81Å; V35-L60 HydrophobicContact CB-CG 4.38Å; V35-L60 HydrophobicContact CG1-CB 4.02Å; V35-L60 HydrophobicContact CG1-CD2 3.9Å; V35-L60 HydrophobicContact CG1-CG 3.7Å; V35-L60 HydrophobicContact CG2-CD1 4.49Å; V35-L60 HydrophobicContact CG2-CD2 4.33Å; V35-L60 HydrophobicContact CG2-CG 3.8Å
36	R	97.9	Very high	94.4	Very high	72 Å²	72	63.1 Å²	63.1	27%	0.272	32%	0.317	S	S	.	.			trans	-73.7	122.1	-174.7	-168.5	167.7	172.2	-141.8	-3.4	112.1	D40 Q46 E47 H62	R36-D40 HydrophobicContact CG-CB 4.46Å; R36-Q46 PolarHBondContact N-O 3.06Å; R36-E47 IonicContact NH1-OE1 3.27Å; R36-E47 PolarHBondContact NH1-OE1 2.83Å; R36-H62 VanDerWaalsContact O-CB 3.25Å; R36-H62 WeakPolarHBondContact O-CB 3.48Å
37	G	97.9	Very high	94.5	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.01	32%	0.317	C	S	.	.			trans	-85	166.1	164.2	0	0	0	0	0	112.7	N15 V35 F39 D40	N15-G37 VanDerWaalsContact OD1-C 3.25Å; N15-G37 WeakPolarHBondContact OD1-CA 3.15Å; V35-G37 PolarHBondContact O-N 2.81Å; G37-F39 PolarHBondContact O-N 2.9Å; G37-D40 WeakPolarHBondContact CA-OD2 3.29Å; G37-D40 PolarHBondContact N-OD2 3.19Å; G37-D40 PolarHBondContact O-N 2.91Å
38	D	96.7	Very high	94.8	Very high	69 Å²	69	61.5 Å²	61.5	37%	0.369	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-17.7	-179.5	47.9	-18.4	0	0	0	113.5	N15 H62 H64 H91	N15-D38 PolarHBondContact ND2-OD1 2.55Å; N15-D38 PolarHBondContact OD1-N 3.16Å; N15-D38 VanDerWaalsContact OD1-N 3.13Å; N15-D38 PolarHBondContact OD1-OD1 3.4Å; D38-H62 IonicContact OD1-CE1 3.97Å; D38-H62 PolarHBondContact OD1-CE1 2.81Å; D38-H62 IonicContact OD1-ND1 3.69Å; D38-H62 PolarHBondContact OD1-ND1 3.22Å; D38-H64 HydrophobicContact CB-CB 4.27Å; D38-H91 IonicContact OD2-CE1 2.72Å; D38-H91 IonicContact OD2-ND1 2.7Å
39	F	96.7	Very high	95.1	Very high	145 Å²	145	63.6 Å²	63.6	64%	0.636	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	2.1	177.6	-64	-84.8	0	0	0	113.9	N15 G37 E41	N15-F39 PolarHBondContact OD1-N 3.18Å; G37-F39 PolarHBondContact O-N 2.9Å; F39-E41 PolarHBondContact O-N 3.43Å
40	D	96.3	Very high	95.3	Very high	8 Å²	8	65.9 Å²	65.9	4%	0.043	33%	0.328	C	S	.	.			trans	-70.5	128	177.7	-75.3	-42.3	0	0	0	111.9	G14 N15 L16 C17 R36 G37 E42 Y45	G14-D40 WeakPolarHBondContact CA-OD2 3.34Å; N15-D40 VanDerWaalsContact CA-OD1 3.26Å; N15-D40 WeakPolarHBondContact CA-OD1 3.35Å; N15-D40 VanDerWaalsContact N-CG 3.31Å; N15-D40 PolarHBondContact N-OD1 3.47Å; N15-D40 PolarHBondContact N-OD2 3.13Å; L16-D40 PolarHBondContact N-OD1 3.11Å; C17-D40 PolarHBondContact N-OD1 3.2Å; R36-D40 HydrophobicContact CG-CB 4.46Å; G37-D40 WeakPolarHBondContact CA-OD2 3.29Å; G37-D40 PolarHBondContact N-OD2 3.19Å; G37-D40 PolarHBondContact O-N 2.91Å; D40-E42 VanDerWaalsContact C-N 3.33Å; D40-Y45 HydrophobicContact CB-CD2 4.31Å
41	E	91.7	Very high	95.7	Very high	140 Å²	140	61.7 Å²	61.7	65%	0.654	30%	0.297	S	S	*	.	S	Bend	trans	-69.5	-31.6	173.6	-70.5	-178.9	-175.8	0	0	112	C17 F39 L43	C17-E41 VanDerWaalsContact O-CG 3.25Å; C17-E41 WeakPolarHBondContact O-CG 3.33Å; F39-E41 PolarHBondContact O-N 3.43Å; E41-L43 PolarHBondContact O-N 3.34Å
42	E	88.4	Confident	95.7	Very high	47 Å²	47	63 Å²	63	22%	0.22	31%	0.308	C	S	.	.			trans	-73.3	97.6	179.1	-74.9	83.9	-133	0	0	112.2	K19 D40 E44 Y45	K19-E42 PolarHBondContact N-OE1 2.68Å; D40-E42 VanDerWaalsContact C-N 3.33Å; E42-E44 PolarHBondContact O-N 2.9Å; E42-Y45 HydrophobicContact CB-CD1 4.43Å; E42-Y45 HydrophobicContact CB-CD2 3.8Å; E42-Y45 HydrophobicContact CB-CE1 4.16Å; E42-Y45 HydrophobicContact CB-CE2 3.47Å; E42-Y45 VanDerWaalsContact CB-CE2 3.47Å; E42-Y45 HydrophobicContact CB-CG 4.25Å; E42-Y45 HydrophobicContact CG-CE2 4.11Å; E42-Y45 PolarHBondContact O-N 3.47Å; E42-Y45 PolarHBondContact OE2-OH 2.93Å; E42-Y45 VanDerWaalsContact OE2-OH 3.11Å
43	L	85.2	Confident	95.7	Very high	124 Å²	124	63.3 Å²	63.3	65%	0.649	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-13.7	178.9	-55	-178.5	0	0	0	114.2	E41	E41-L43 PolarHBondContact O-N 3.34Å
44	E	92	Very high	95.3	Very high	189 Å²	189	65.4 Å²	65.4	88%	0.883	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-14.5	-178.6	-63.3	-174.6	174.3	0	0	113.3	E42 Q46	E42-E44 PolarHBondContact O-N 2.9Å; E44-Q46 PolarHBondContact O-N 2.96Å
45	Y	94.7	Very high	95.1	Very high	41 Å²	41	70.8 Å²	70.8	16%	0.161	36%	0.36	C	S	.	.	S	Bend	trans	-62.8	138.2	175.8	-65.6	-27.7	0	0	0	110.9	V34 D40 E42	V34-Y45 HydrophobicContact CB-CD1 4.39Å; V34-Y45 HydrophobicContact CB-CE1 4.32Å; V34-Y45 HydrophobicContact CB-CE2 4.5Å; V34-Y45 HydrophobicContact CG1-CD2 3.92Å; V34-Y45 HydrophobicContact CG1-CE2 3.89Å; V34-Y45 HydrophobicContact CG1-CG 4.32Å; D40-Y45 HydrophobicContact CB-CD2 4.31Å; E42-Y45 HydrophobicContact CB-CD1 4.43Å; E42-Y45 HydrophobicContact CB-CD2 3.8Å; E42-Y45 HydrophobicContact CB-CE1 4.16Å; E42-Y45 HydrophobicContact CB-CE2 3.47Å; E42-Y45 VanDerWaalsContact CB-CE2 3.47Å; E42-Y45 HydrophobicContact CB-CG 4.25Å; E42-Y45 HydrophobicContact CG-CE2 4.11Å; E42-Y45 PolarHBondContact O-N 3.47Å; E42-Y45 PolarHBondContact OE2-OH 2.93Å; E42-Y45 VanDerWaalsContact OE2-OH 3.11Å
46	Q	96.8	Very high	95	Very high	116 Å²	116	70.8 Å²	70.8	54%	0.542	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-72.9	140.8	177.2	-61.6	-178.9	-47.7	0	0	110	V35 R36 E44 T48	V35-Q46 CarbonylContact C-O 3.59Å; V35-Q46 WeakPolarHBondContact CA-O 3.3Å; V35-Q46 VanDerWaalsContact CB-O 3.31Å; V35-Q46 WeakPolarHBondContact CB-O 3.23Å; R36-Q46 PolarHBondContact N-O 3.06Å; E44-Q46 PolarHBondContact O-N 2.96Å; Q46-T48 PolarHBondContact O-N 2.83Å
47	E	97.1	Very high	94.9	Very high	72 Å²	72	72 Å²	72	34%	0.336	37%	0.365	S	S	.	.	S	Bend	trans	-61.1	-35.1	175	-63.1	-64	148.1	0	0	112.3	R36 Q65	R36-E47 IonicContact NH1-OE1 3.27Å; R36-E47 PolarHBondContact NH1-OE1 2.83Å; E47-Q65 PolarHBondContact OE2-NE2 2.78Å
48	T	98.3	Very high	94.9	Very high	47 Å²	47	72 Å²	72	29%	0.288	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	150.2	177.2	63.1	0	0	0	0	110.8	Q46 L60 C61 M78	Q46-T48 PolarHBondContact O-N 2.83Å; T48-L60 CarbonylContact C-O 3.52Å; T48-L60 VanDerWaalsContact CA-O 3.23Å; T48-L60 WeakPolarHBondContact CA-O 3.31Å; T48-C61 HydrophobicContact CG2-CB 4.12Å; T48-M78 HydrophobicContact CG2-CE 4.35Å; T48-M78 HydrophobicContact CG2-SD 4.26Å
49	K	98.2	Very high	95	Very high	57 Å²	57	68.7 Å²	68.7	25%	0.248	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	146.9	175	-158.2	168.1	-173.6	176.8	0	110.8	H33 V35 I51 G59 L60	H33-K49 HydrophobicContact CB-CD 4.13Å; H33-K49 VanDerWaalsContact ND1-CE 3.33Å; H33-K49 WeakPolarHBondContact ND1-CE 3.18Å; H33-K49 PolarHBondContact ND1-NZ 3.18Å; H33-K49 VanDerWaalsContact ND1-NZ 3.11Å; V35-K49 HydrophobicContact CG1-CB 3.81Å; K49-I51 HydrophobicContact CD-CD1 4.23Å; K49-I51 HydrophobicContact CD-CG1 4.38Å; K49-I51 HydrophobicContact CG-CD1 4.33Å; K49-I51 HydrophobicContact CG-CG1 4.13Å; K49-G59 CarbonylContact O-C 3.59Å; K49-G59 WeakPolarHBondContact O-CA 3.37Å; K49-L60 HydrophobicContact CB-CB 4.42Å; K49-L60 PolarHBondContact N-O 3.43Å; K49-L60 PolarHBondContact O-N 2.86Å
50	V	98.5	Very high	95.1	Very high	54 Å²	54	61.8 Å²	61.8	33%	0.327	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	128.8	170.4	178.4	0	0	0	0	108.7	I58 L82 V84	V50-I58 CarbonylContact C-O 3.57Å; V50-I58 WeakPolarHBondContact CA-O 3.48Å; V50-L82 HydrophobicContact CG2-CB 3.97Å; V50-L82 HydrophobicContact CG2-CD1 4.39Å; V50-L82 HydrophobicContact CG2-CD2 4.17Å; V50-L82 HydrophobicContact CG2-CG 4.4Å; V50-V84 HydrophobicContact CB-CG1 4.49Å; V50-V84 HydrophobicContact CG1-CG1 3.81Å; V50-V84 HydrophobicContact CG2-CG1 3.93Å
51	I	97.6	Very high	95.2	Very high	15 Å²	15	61.4 Å²	61.4	8%	0.077	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.8	-175.9	-58.2	156.5	0	0	0	107.5	L11 H33 K49 V53 I58	L11-I51 HydrophobicContact CD2-CD1 3.31Å; H33-I51 HydrophobicContact CB-CD1 3.49Å; H33-I51 VanDerWaalsContact CB-CD1 3.49Å; H33-I51 VanDerWaalsContact ND1-CD1 3.3Å; H33-I51 WeakPolarHBondContact ND1-CD1 3.4Å; K49-I51 HydrophobicContact CD-CD1 4.23Å; K49-I51 HydrophobicContact CD-CG1 4.38Å; K49-I51 HydrophobicContact CG-CD1 4.33Å; K49-I51 HydrophobicContact CG-CG1 4.13Å; I51-V53 HydrophobicContact CG2-CG2 4.16Å; I51-I58 PolarHBondContact N-O 2.97Å; I51-I58 PolarHBondContact O-N 3.4Å
52	T	96.7	Very high	95.5	Very high	87 Å²	87	55 Å²	55	53%	0.534	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	123.2	176.1	-57.8	0	0	0	0	109	F56	T52-F56 WeakPolarHBondContact CA-O 3.45Å
53	V	94.6	Very high	96	Very high	17 Å²	17	53 Å²	53	10%	0.103	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	113	174.7	-175.9	0	0	0	0	107.9	I51 H55 F56 I58 F131	I51-V53 HydrophobicContact CG2-CG2 4.16Å; V53-H55 PolarHBondContact O-N 2.85Å; V53-F56 PolarHBondContact N-O 3.48Å; V53-F56 PolarHBondContact O-N 2.78Å; V53-I58 HydrophobicContact CB-CD1 4.09Å; V53-I58 HydrophobicContact CG2-CD1 3.83Å; V53-F131 HydrophobicContact CB-CD2 4.36Å; V53-F131 HydrophobicContact CB-CE2 4.25Å; V53-F131 HydrophobicContact CB-CZ 4.36Å; V53-F131 HydrophobicContact CG1-CB 4.32Å; V53-F131 HydrophobicContact CG1-CD1 4.36Å; V53-F131 HydrophobicContact CG1-CD2 3.56Å; V53-F131 HydrophobicContact CG1-CE2 3.87Å; V53-F131 HydrophobicContact CG1-CG 3.83Å; V53-F131 HydrophobicContact CG1-CZ 4.42Å
54	G	90.8	Very high	96.6	Very high	63 Å²	63	49.2 Å²	49.2	65%	0.649	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	-122.4	-171	0	0	0	0	0	111.4
55	H	92.3	Very high	96.8	Very high	122 Å²	122	43.2 Å²	43.2	57%	0.565	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.5	1.7	178.6	-62.6	-71.5	0	0	0	114.1	V53 Q133 K157	V53-H55 PolarHBondContact O-N 2.85Å; H55-Q133 PolarHBondContact CD2-O 2.82Å; H55-K157 PolarHBondContact O-NZ 2.88Å
56	F	95.8	Very high	96.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	130.3	-174	-62.5	-92.2	0	0	0	111.3	T52 V53 I58 D85 I86 F131 S134 V136 Y155 K157	T52-F56 WeakPolarHBondContact CA-O 3.45Å; V53-F56 PolarHBondContact N-O 3.48Å; V53-F56 PolarHBondContact O-N 2.78Å; F56-I58 HydrophobicContact CB-CG1 4.47Å; F56-D85 HydrophobicContact CD1-CB 4.24Å; F56-I86 HydrophobicContact CB-CD1 4.35Å; F56-I86 HydrophobicContact CD1-CD1 4.03Å; F56-I86 HydrophobicContact CD1-CG1 4.33Å; F56-I86 HydrophobicContact CG-CD1 4.35Å; F56-F131 HydrophobicContact CB-CD1 4.46Å; F56-F131 HydrophobicContact CB-CE1 4.01Å; F56-F131 AromaticContact CD2-CD1 3.5Å; F56-F131 HydrophobicContact CD2-CD1 3.5Å; F56-F131 AromaticContact CD2-CE1 3.81Å; F56-F131 HydrophobicContact CD2-CE1 3.81Å; F56-F131 AromaticContact CE2-CD1 3.93Å; F56-F131 HydrophobicContact CE2-CD1 3.93Å; F56-F131 HydrophobicContact CE2-CE1 4.46Å; F56-F131 HydrophobicContact CG-CD1 4.14Å; F56-F131 AromaticContact CG-CE1 3.96Å; F56-F131 HydrophobicContact CG-CE1 3.96Å; F56-S134 VanDerWaalsContact CZ-C 3.5Å; F56-S134 WeakPolarHBondContact CZ-O 3.46Å; F56-V136 HydrophobicContact CE1-CG1 4.2Å; F56-V136 HydrophobicContact CE2-CB 4.39Å; F56-V136 HydrophobicContact CZ-CB 4.22Å; F56-V136 HydrophobicContact CZ-CG1 4.16Å; F56-Y155 HydrophobicContact CD1-CD1 4.47Å; F56-Y155 HydrophobicContact CD1-CE1 4.19Å; F56-Y155 AromaticContact CE1-CD1 3.71Å; F56-Y155 HydrophobicContact CE1-CD1 3.71Å; F56-Y155 AromaticContact CE1-CE1 3.61Å; F56-Y155 HydrophobicContact CE1-CE1 3.61Å; F56-K157 HydrophobicContact CD1-CD 4.34Å; F56-K157 HydrophobicContact CE1-CB 3.76Å; F56-K157 HydrophobicContact CE1-CD 4.36Å; F56-K157 HydrophobicContact CZ-CB 4.03Å
57	R	97.2	Very high	96.8	Very high	99 Å²	99	42.2 Å²	42.2	37%	0.374	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	126.1	164.2	-69.4	172.9	61.3	100.4	-2.3	108.6	D83 V84 D85 I86	R57-D83 PolarHBondContact NE-O 3.23Å; R57-V84 HydrophobicContact CB-CB 4.31Å; R57-V84 HydrophobicContact CB-CG1 4.23Å; R57-V84 WeakPolarHBondContact O-CB 3.34Å; R57-D85 PolarHBondContact N-OD2 2.88Å; R57-D85 PolarHBondContact O-N 3.21Å; R57-I86 PolarHBondContact O-N 2.98Å; R57-I86 VanDerWaalsContact O-N 3.14Å
58	I	98.2	Very high	96.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	121.2	-175.7	-51.3	174.5	0	0	0	108.1	L11 V50 I51 V53 F56 I86 I88 F131	L11-I58 HydrophobicContact CD1-CD1 4.04Å; L11-I58 HydrophobicContact CD1-CG2 3.85Å; V50-I58 CarbonylContact C-O 3.57Å; V50-I58 WeakPolarHBondContact CA-O 3.48Å; I51-I58 PolarHBondContact N-O 2.97Å; I51-I58 PolarHBondContact O-N 3.4Å; V53-I58 HydrophobicContact CB-CD1 4.09Å; V53-I58 HydrophobicContact CG2-CD1 3.83Å; F56-I58 HydrophobicContact CB-CG1 4.47Å; I58-I86 CarbonylContact C-O 3.23Å; I58-I86 WeakPolarHBondContact CA-O 3.36Å; I58-I86 HydrophobicContact CG1-CB 4.32Å; I58-I86 HydrophobicContact CG1-CD1 4.42Å; I58-I86 HydrophobicContact CG2-CB 4.33Å; I58-I86 HydrophobicContact CG2-CG2 4.4Å; I58-I88 HydrophobicContact CG2-CD1 3.54Å; I58-I88 HydrophobicContact CG2-CG1 3.81Å; I58-F131 HydrophobicContact CD1-CE1 4.13Å; I58-F131 HydrophobicContact CD1-CE2 4.25Å; I58-F131 HydrophobicContact CD1-CZ 3.48Å; I58-F131 VanDerWaalsContact CD1-CZ 3.48Å
59	G	98.6	Very high	96.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	140.9	170.5	0	0	0	0	0	110.1	K49 I86 I88	K49-G59 CarbonylContact O-C 3.59Å; K49-G59 WeakPolarHBondContact O-CA 3.37Å; G59-I86 PolarHBondContact N-O 3.26Å; G59-I88 PolarHBondContact O-N 2.85Å
60	L	98.7	Very high	96.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	133.3	179	-173.2	61.9	0	0	0	108.6	L11 C12 T13 H33 V35 T48 K49 I88	L11-L60 HydrophobicContact CB-CD1 4.47Å; L11-L60 HydrophobicContact CB-CD2 4.2Å; C12-L60 WeakPolarHBondContact O-CD2 3.35Å; T13-L60 HydrophobicContact CG2-CD1 3.85Å; H33-L60 HydrophobicContact CB-CD2 4.47Å; V35-L60 HydrophobicContact CB-CG 4.38Å; V35-L60 HydrophobicContact CG1-CB 4.02Å; V35-L60 HydrophobicContact CG1-CD2 3.9Å; V35-L60 HydrophobicContact CG1-CG 3.7Å; V35-L60 HydrophobicContact CG2-CD1 4.49Å; V35-L60 HydrophobicContact CG2-CD2 4.33Å; V35-L60 HydrophobicContact CG2-CG 3.8Å; T48-L60 CarbonylContact C-O 3.52Å; T48-L60 VanDerWaalsContact CA-O 3.23Å; T48-L60 WeakPolarHBondContact CA-O 3.31Å; K49-L60 HydrophobicContact CB-CB 4.42Å; K49-L60 PolarHBondContact N-O 3.43Å; K49-L60 PolarHBondContact O-N 2.86Å; L60-I88 WeakPolarHBondContact CA-O 3.3Å; L60-I88 HydrophobicContact CD1-CB 3.79Å; L60-I88 HydrophobicContact CD1-CG2 3.73Å
61	C	98.3	Very high	96	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	145.8	178.8	177.8	0	0	0	0	108.6	T48 Q65 M87 I88 T89	T48-C61 HydrophobicContact CG2-CB 4.12Å; C61-Q65 PolarHBondContact SG-OE1 2.74Å; C61-M87 HydrophobicContact CB-CE 3.54Å; C61-I88 PolarHBondContact N-O 3.27Å; C61-T89 HydrophobicContact CB-CG2 4.37Å; C61-T89 VanDerWaalsContact O-CA 3.29Å; C61-T89 WeakPolarHBondContact O-CA 3.34Å
62	H	98.4	Very high	95.9	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.019	27%	0.265	C	S	.	.			trans	-65.6	-43.5	176.3	-179.2	-129.3	0	0	0	111.6	T13 N15 R36 D38 H64 G90 H91	T13-H62 WeakPolarHBondContact O-CA 3.37Å; T13-H62 WeakPolarHBondContact O-CB 3.31Å; T13-H62 PolarHBondContact O-CD2 2.82Å; N15-H62 PolarHBondContact ND2-CE1 3.03Å; N15-H62 PolarHBondContact ND2-NE2 2.91Å; R36-H62 VanDerWaalsContact O-CB 3.25Å; R36-H62 WeakPolarHBondContact O-CB 3.48Å; D38-H62 IonicContact OD1-CE1 3.97Å; D38-H62 PolarHBondContact OD1-CE1 2.81Å; D38-H62 IonicContact OD1-ND1 3.69Å; D38-H62 PolarHBondContact OD1-ND1 3.22Å; H62-H64 AromaticContact CG-ND1 3.69Å; H62-H64 AromaticContact ND1-CG 3.68Å; H62-H64 AromaticContact ND1-ND1 3.01Å; H62-H64 PolarHBondContact ND1-ND1 3.27Å; H62-G90 CarbonylContact O-C 3.57Å; H62-G90 WeakPolarHBondContact O-CA 3.25Å; H62-G90 PolarHBondContact O-N 3.26Å; H62-H91 AromaticContact CE1-ND1 3.74Å; H62-H91 PolarHBondContact NE2-N 2.68Å; H62-H91 WeakPolarHBondContact O-CB 3.46Å; H62-H91 PolarHBondContact O-N 3.43Å
63	G	97.8	Very high	95.9	Very high	6 Å²	6	52.5 Å²	52.5	6%	0.062	27%	0.273	C	S	.	.	S	Bend	trans	107.2	-14.9	175	0	0	0	0	0	114.4	Q65 L66	G63-Q65 PolarHBondContact O-N 3.47Å; G63-L66 WeakPolarHBondContact O-CB 3.35Å; G63-L66 PolarHBondContact O-N 3.38Å
64	H	97.5	Very high	96	Very high	45 Å²	45	53.9 Å²	53.9	21%	0.208	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-26.5	174.2	72.8	-88.1	0	0	0	112.6	D38 H62 L66 W69	D38-H64 HydrophobicContact CB-CB 4.27Å; H62-H64 AromaticContact CG-ND1 3.69Å; H62-H64 AromaticContact ND1-CG 3.68Å; H62-H64 AromaticContact ND1-ND1 3.01Å; H62-H64 PolarHBondContact ND1-ND1 3.27Å; H64-L66 VanDerWaalsContact C-N 3.29Å; H64-L66 PolarHBondContact O-N 3.47Å; H64-W69 PolarHBondContact O-NE1 3.2Å; H64-W69 VanDerWaalsContact O-NE1 3.07Å
65	Q	96	Very high	96.4	Very high	62 Å²	62	51.7 Å²	51.7	29%	0.29	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-12.5	176.9	-46.3	89.6	-24.9	0	0	113.2	E47 C61 G63 I67	E47-Q65 PolarHBondContact OE2-NE2 2.78Å; C61-Q65 PolarHBondContact SG-OE1 2.74Å; G63-Q65 PolarHBondContact O-N 3.47Å; Q65-I67 PolarHBondContact O-N 3.39Å
66	L	96.9	Very high	96.6	Very high	11 Å²	11	46 Å²	46	6%	0.058	23%	0.228	C	C	.	.	S	Bend	trans	-95.2	92.2	-173	-58.4	-175.9	0	0	0	110.2	G63 H64 P68 W69 I74 V75 M78 T89	G63-L66 WeakPolarHBondContact O-CB 3.35Å; G63-L66 PolarHBondContact O-N 3.38Å; H64-L66 VanDerWaalsContact C-N 3.29Å; H64-L66 PolarHBondContact O-N 3.47Å; L66-P68 CarbonylContact O-C 3.59Å; L66-P68 VanDerWaalsContact O-O 3.1Å; L66-W69 WeakPolarHBondContact O-CA 3.37Å; L66-W69 PolarHBondContact O-N 3.22Å; L66-I74 HydrophobicContact CB-CG2 3.76Å; L66-I74 HydrophobicContact CD2-CG2 4.1Å; L66-I74 HydrophobicContact CG-CG2 4.44Å; L66-V75 HydrophobicContact CD1-CG2 3.87Å; L66-M78 HydrophobicContact CD2-CB 4.09Å; L66-M78 HydrophobicContact CD2-CE 3.55Å; L66-M78 HydrophobicContact CD2-CG 4.31Å; L66-T89 HydrophobicContact CD1-CG2 3.8Å
67	I	96.2	Very high	96.7	Very high	125 Å²	125	50.5 Å²	50.5	64%	0.641	25%	0.251	S	S	*	.	S	Bend	trans	-105	132.8	-174.8	-57.3	176.7	0	0	0	110.4	Q65	Q65-I67 PolarHBondContact O-N 3.39Å
68	P	95.9	Very high	96.7	Very high	82 Å²	82	47.2 Å²	47.2	53%	0.532	24%	0.24	S	C	.	.	S	Bend	cis	-68	144.9	-4.8	27.5	-34.4	0	0	0	112.5	L66 S71	L66-P68 CarbonylContact O-C 3.59Å; L66-P68 VanDerWaalsContact O-O 3.1Å; P68-S71 VanDerWaalsContact O-CB 3.31Å; P68-S71 WeakPolarHBondContact O-CB 3.48Å; P68-S71 PolarHBondContact O-N 2.8Å
69	W	94.1	Very high	96.7	Very high	119 Å²	119	48.2 Å²	48.2	45%	0.451	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	148.5	177.1	-57.7	-28.7	0	0	0	110.7	H64 L66 S71 H91 V118	H64-W69 PolarHBondContact O-NE1 3.2Å; H64-W69 VanDerWaalsContact O-NE1 3.07Å; L66-W69 WeakPolarHBondContact O-CA 3.37Å; L66-W69 PolarHBondContact O-N 3.22Å; W69-S71 PolarHBondContact O-N 3.4Å; W69-H91 AromaticContact CD1-CD2 3.92Å; W69-H91 AromaticContact CD1-NE2 3.73Å; W69-H91 AromaticContact CD2-CD2 3.95Å; W69-H91 AromaticContact CD2-NE2 3.2Å; W69-H91 AromaticContact CE2-CE1 3.95Å; W69-H91 AromaticContact CE2-NE2 3.12Å; W69-H91 AromaticContact CE3-NE2 3.62Å; W69-H91 AromaticContact CG-CD2 3.88Å; W69-H91 AromaticContact CG-NE2 3.62Å; W69-H91 AromaticContact CH2-NE2 3.87Å; W69-H91 AromaticContact CZ2-CE1 3.91Å; W69-H91 AromaticContact CZ2-NE2 3.5Å; W69-H91 WeakPolarHBondContact CZ2-NE2 3.42Å; W69-H91 AromaticContact CZ3-NE2 3.93Å; W69-H91 AromaticContact NE1-NE2 3.47Å; W69-H91 PolarHBondContact NE1-NE2 3.01Å; W69-V118 HydrophobicContact CE3-CG1 3.79Å; W69-V118 HydrophobicContact CZ3-CG1 4.08Å
70	N	88.7	Confident	96.6	Very high	103 Å²	103	53.6 Å²	53.6	55%	0.551	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	23	-178.8	-158.3	31.9	0	0	0	115.3	T92 E96	N70-T92 HydrophobicContact CB-CG2 4.12Å; N70-E96 PolarHBondContact OD1-OE2 2.85Å
71	S	95.4	Very high	96.6	Very high	24 Å²	24	61.6 Å²	61.6	17%	0.168	30%	0.299	C	S	.	.			trans	-91.6	111.9	173.5	175.1	0	0	0	0	111.8	P68 W69 E73 I74 V75	P68-S71 VanDerWaalsContact O-CB 3.31Å; P68-S71 WeakPolarHBondContact O-CB 3.48Å; P68-S71 PolarHBondContact O-N 2.8Å; W69-S71 PolarHBondContact O-N 3.4Å; S71-E73 PolarHBondContact O-N 3.02Å; S71-E73 PolarHBondContact OG-N 3.47Å; S71-I74 PolarHBondContact O-N 3.09Å; S71-I74 VanDerWaalsContact O-N 3.12Å; S71-I74 PolarHBondContact OG-N 2.8Å; S71-V75 WeakPolarHBondContact O-CG2 3.48Å; S71-V75 PolarHBondContact O-N 3.07Å
72	L	95.7	Very high	96.6	Very high	70 Å²	70	62.9 Å²	62.9	37%	0.366	31%	0.306	S	S	.	.	H	α-helix	trans	-57.1	-32.2	173.6	-179.6	61	0	0	0	111.9	S76 H100 Y105	L72-S76 WeakPolarHBondContact O-CB 3.25Å; L72-S76 PolarHBondContact O-N 3.25Å; L72-S76 PolarHBondContact O-OG 2.89Å; L72-H100 HydrophobicContact CD2-CB 4.14Å; L72-Y105 HydrophobicContact CD1-CD1 4.16Å; L72-Y105 HydrophobicContact CD1-CD2 4.14Å; L72-Y105 HydrophobicContact CD1-CE1 4.33Å; L72-Y105 HydrophobicContact CD1-CE2 4.34Å; L72-Y105 HydrophobicContact CD1-CG 4.06Å
73	E	96.7	Very high	96.5	Very high	151 Å²	151	67.7 Å²	67.7	71%	0.706	33%	0.332	S	S	*	.	H	α-helix	trans	-64.2	-45.9	176.8	-63.8	-179.9	174.8	0	0	111.5	S71 S76 L77	S71-E73 PolarHBondContact O-N 3.02Å; S71-E73 PolarHBondContact OG-N 3.47Å; E73-S76 WeakPolarHBondContact O-CB 3.06Å; E73-S76 PolarHBondContact O-N 2.91Å; E73-L77 WeakPolarHBondContact O-CG 3.15Å; E73-L77 PolarHBondContact O-N 3.01Å
74	I	97.6	Very high	96.5	Very high	45 Å²	45	67.4 Å²	67.4	23%	0.231	33%	0.329	C	S	.	.	H	α-helix	trans	-67.5	-43	178.1	-58.8	-62.4	0	0	0	110.9	L66 S71 S76 L77 M78	L66-I74 HydrophobicContact CB-CG2 3.76Å; L66-I74 HydrophobicContact CD2-CG2 4.1Å; L66-I74 HydrophobicContact CG-CG2 4.44Å; S71-I74 PolarHBondContact O-N 3.09Å; S71-I74 VanDerWaalsContact O-N 3.12Å; S71-I74 PolarHBondContact OG-N 2.8Å; I74-S76 VanDerWaalsContact C-N 3.29Å; I74-S76 PolarHBondContact O-N 2.77Å; I74-L77 HydrophobicContact CD1-CD1 4.26Å; I74-L77 WeakPolarHBondContact O-CB 3.49Å; I74-L77 PolarHBondContact O-N 3.39Å; I74-M78 PolarHBondContact O-N 2.91Å
75	V	97.7	Very high	96.4	Very high	17 Å²	17	65.7 Å²	65.7	10%	0.103	32%	0.322	C	S	.	.	H	α-helix	trans	-63.2	-39	175.3	-177.2	0	0	0	0	110.5	L66 S71 L77 M78 R79 M87 T89 Y105	L66-V75 HydrophobicContact CD1-CG2 3.87Å; S71-V75 WeakPolarHBondContact O-CG2 3.48Å; S71-V75 PolarHBondContact O-N 3.07Å; V75-L77 PolarHBondContact O-N 2.74Å; V75-M78 PolarHBondContact O-N 2.68Å; V75-R79 WeakPolarHBondContact O-CB 3.2Å; V75-R79 PolarHBondContact O-N 2.89Å; V75-M87 HydrophobicContact CG1-CB 4.39Å; V75-M87 HydrophobicContact CG1-CG 3.76Å; V75-T89 HydrophobicContact CG1-CG2 4.04Å; V75-Y105 HydrophobicContact CG1-CD1 3.65Å; V75-Y105 HydrophobicContact CG1-CE1 4.03Å
76	S	97.5	Very high	96.5	Very high	4 Å²	4	62.8 Å²	62.8	3%	0.028	31%	0.308	C	S	.	.	H	α-helix	trans	-64.9	-36.8	175.2	-64.1	0	0	0	0	112.4	L72 E73 I74 R79 R80 Y105	L72-S76 WeakPolarHBondContact O-CB 3.25Å; L72-S76 PolarHBondContact O-N 3.25Å; L72-S76 PolarHBondContact O-OG 2.89Å; E73-S76 WeakPolarHBondContact O-CB 3.06Å; E73-S76 PolarHBondContact O-N 2.91Å; I74-S76 VanDerWaalsContact C-N 3.29Å; I74-S76 PolarHBondContact O-N 2.77Å; S76-R79 PolarHBondContact O-N 3.39Å; S76-R80 WeakPolarHBondContact O-CG 3.45Å; S76-R80 PolarHBondContact O-N 3.11Å; S76-Y105 PolarHBondContact OG-OH 2.84Å; S76-Y105 VanDerWaalsContact OG-OH 3.07Å
77	L	97.4	Very high	96.5	Very high	94 Å²	94	62.2 Å²	62.2	49%	0.492	31%	0.305	S	S	.	.	H	α-helix	trans	-63.3	-44.8	171.8	-74.1	168.2	0	0	0	111.3	E73 I74 V75 R80 K81	E73-L77 WeakPolarHBondContact O-CG 3.15Å; E73-L77 PolarHBondContact O-N 3.01Å; I74-L77 HydrophobicContact CD1-CD1 4.26Å; I74-L77 WeakPolarHBondContact O-CB 3.49Å; I74-L77 PolarHBondContact O-N 3.39Å; V75-L77 PolarHBondContact O-N 2.74Å; L77-R80 PolarHBondContact O-N 3.46Å; L77-K81 WeakPolarHBondContact O-CB 3.5Å; L77-K81 PolarHBondContact O-N 2.95Å
78	M	97.6	Very high	96.6	Very high	29 Å²	29	56.7 Å²	56.7	14%	0.143	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-45.5	175.4	-176.7	59.6	78.2	0	0	111.6	T48 L66 I74 V75 R80 K81 L82 M87	T48-M78 HydrophobicContact CG2-CE 4.35Å; T48-M78 HydrophobicContact CG2-SD 4.26Å; L66-M78 HydrophobicContact CD2-CB 4.09Å; L66-M78 HydrophobicContact CD2-CE 3.55Å; L66-M78 HydrophobicContact CD2-CG 4.31Å; I74-M78 PolarHBondContact O-N 2.91Å; V75-M78 PolarHBondContact O-N 2.68Å; M78-R80 VanDerWaalsContact C-N 3.32Å; M78-R80 PolarHBondContact O-N 3.47Å; M78-K81 WeakPolarHBondContact O-CB 3.44Å; M78-K81 PolarHBondContact O-N 2.83Å; M78-K81 HydrophobicContact SD-CD 4.28Å; M78-L82 HydrophobicContact CG-CD1 4.11Å; M78-L82 HydrophobicContact CG-CG 4.5Å; M78-L82 WeakPolarHBondContact O-CG 3.33Å; M78-L82 PolarHBondContact O-N 3.19Å; M78-L82 HydrophobicContact SD-CD1 4.04Å; M78-L82 HydrophobicContact SD-CG 4.06Å; M78-M87 HydrophobicContact CB-CE 4.4Å; M78-M87 HydrophobicContact CG-CE 3.56Å; M78-M87 HydrophobicContact CG-SD 4.24Å
79	R	97.8	Very high	96.8	Very high	22 Å²	22	53.5 Å²	53.5	8%	0.083	26%	0.256	C	S	.	.	H	α-helix	trans	-57.4	-44	175.4	-173.2	-147.4	60.5	73.2	-4	111.9	V75 S76 D83 V84 M87 Y105	V75-R79 WeakPolarHBondContact O-CB 3.2Å; V75-R79 PolarHBondContact O-N 2.89Å; S76-R79 PolarHBondContact O-N 3.39Å; R79-D83 PolarHBondContact O-N 2.78Å; R79-V84 HydrophobicContact CB-CG2 4.27Å; R79-V84 WeakPolarHBondContact CD-O 3.48Å; R79-V84 HydrophobicContact CG-CG2 3.5Å; R79-V84 WeakPolarHBondContact CG-O 3.29Å; R79-V84 PolarHBondContact NH1-O 2.77Å; R79-V84 PolarHBondContact O-N 3.42Å; R79-M87 HydrophobicContact CB-CB 3.97Å; R79-M87 HydrophobicContact CB-CG 4.22Å; R79-M87 HydrophobicContact CB-SD 4.39Å; R79-M87 HydrophobicContact CG-CB 3.99Å; R79-Y105 HydrophobicContact CB-CE1 4.03Å; R79-Y105 WeakPolarHBondContact CD-OH 3.18Å; R79-Y105 HydrophobicContact CG-CE1 4.36Å; R79-Y105 PolarHBondContact NE-OH 3.2Å
80	R	97.5	Very high	97	Very high	112 Å²	112	48 Å²	48	42%	0.423	24%	0.236	S	C	.	.	H	α-helix	trans	-63.1	-46	175	-79.1	-173.7	-68.9	-94.8	-0.1	111.6	S76 L77 M78 L82 D83 E101	S76-R80 WeakPolarHBondContact O-CG 3.45Å; S76-R80 PolarHBondContact O-N 3.11Å; L77-R80 PolarHBondContact O-N 3.46Å; M78-R80 VanDerWaalsContact C-N 3.32Å; M78-R80 PolarHBondContact O-N 3.47Å; R80-L82 VanDerWaalsContact C-N 3.28Å; R80-L82 PolarHBondContact O-N 2.81Å; R80-D83 PolarHBondContact O-N 3.44Å; R80-D83 VanDerWaalsContact O-N 3.12Å; R80-E101 IonicContact NH1-OE2 3.48Å
81	K	97.7	Very high	97.4	Very high	168 Å²	168	44.1 Å²	44.1	73%	0.73	21%	0.214	S	C	*	.	H	α-helix	trans	-57.6	-40.4	178.2	179.6	-176.9	175.7	-174.9	0	112.1	L77 M78	L77-K81 WeakPolarHBondContact O-CB 3.5Å; L77-K81 PolarHBondContact O-N 2.95Å; M78-K81 WeakPolarHBondContact O-CB 3.44Å; M78-K81 PolarHBondContact O-N 2.83Å; M78-K81 HydrophobicContact SD-CD 4.28Å
82	L	97.9	Very high	97.5	Very high	27 Å²	27	43.4 Å²	43.4	14%	0.141	21%	0.209	C	C	.	.	H	α-helix	trans	-84.7	-9.5	179.9	-63.7	179.8	0	0	0	113.8	V50 M78 R80 V84 M87	V50-L82 HydrophobicContact CG2-CB 3.97Å; V50-L82 HydrophobicContact CG2-CD1 4.39Å; V50-L82 HydrophobicContact CG2-CD2 4.17Å; V50-L82 HydrophobicContact CG2-CG 4.4Å; M78-L82 HydrophobicContact CG-CD1 4.11Å; M78-L82 HydrophobicContact CG-CG 4.5Å; M78-L82 WeakPolarHBondContact O-CG 3.33Å; M78-L82 PolarHBondContact O-N 3.19Å; M78-L82 HydrophobicContact SD-CD1 4.04Å; M78-L82 HydrophobicContact SD-CG 4.06Å; R80-L82 VanDerWaalsContact C-N 3.28Å; R80-L82 PolarHBondContact O-N 2.81Å; L82-V84 HydrophobicContact CB-CG1 3.9Å; L82-V84 HydrophobicContact CB-CG2 4.34Å; L82-V84 WeakPolarHBondContact O-CG1 3.19Å; L82-M87 HydrophobicContact CD1-CE 4.21Å; L82-M87 HydrophobicContact CD1-SD 4.17Å
83	D	97.4	Very high	97.7	Very high	105 Å²	105	41.7 Å²	41.7	56%	0.561	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	49	64.4	-173.7	-173.1	36.1	0	0	0	112.7	R57 R79 R80	R57-D83 PolarHBondContact NE-O 3.23Å; R79-D83 PolarHBondContact O-N 2.78Å; R80-D83 PolarHBondContact O-N 3.44Å; R80-D83 VanDerWaalsContact O-N 3.12Å
84	V	97.7	Very high	97.7	Very high	1 Å²	1	39 Å²	39	1%	0.006	19%	0.185	C	C	.	.			trans	-123.2	152.9	-176.5	-59.9	0	0	0	0	112.7	V50 R57 R79 L82 I86 M87	V50-V84 HydrophobicContact CB-CG1 4.49Å; V50-V84 HydrophobicContact CG1-CG1 3.81Å; V50-V84 HydrophobicContact CG2-CG1 3.93Å; R57-V84 HydrophobicContact CB-CB 4.31Å; R57-V84 HydrophobicContact CB-CG1 4.23Å; R57-V84 WeakPolarHBondContact O-CB 3.34Å; R79-V84 HydrophobicContact CB-CG2 4.27Å; R79-V84 WeakPolarHBondContact CD-O 3.48Å; R79-V84 HydrophobicContact CG-CG2 3.5Å; R79-V84 WeakPolarHBondContact CG-O 3.29Å; R79-V84 PolarHBondContact NH1-O 2.77Å; R79-V84 PolarHBondContact O-N 3.42Å; L82-V84 HydrophobicContact CB-CG1 3.9Å; L82-V84 HydrophobicContact CB-CG2 4.34Å; L82-V84 WeakPolarHBondContact O-CG1 3.19Å; V84-I86 WeakPolarHBondContact CG2-O 3.17Å; V84-M87 HydrophobicContact CG2-SD 4.19Å
85	D	96	Very high	97.7	Very high	9 Å²	9	38.1 Å²	38.1	5%	0.048	18%	0.181	C	C	.	.	S	Bend	trans	-81.6	-38.8	177.4	-61.1	-55.1	0	0	0	112.2	F56 R57 K103 F104 K157	F56-D85 HydrophobicContact CD1-CB 4.24Å; R57-D85 PolarHBondContact N-OD2 2.88Å; R57-D85 PolarHBondContact O-N 3.21Å; D85-K103 IonicContact OD1-NZ 2.68Å; D85-K103 PolarHBondContact OD1-NZ 3.06Å; D85-F104 PolarHBondContact O-N 3.01Å; D85-K157 IonicContact OD1-NZ 3.91Å; D85-K157 PolarHBondContact OD1-NZ 3.24Å; D85-K157 IonicContact OD2-NZ 2.84Å; D85-K157 PolarHBondContact OD2-NZ 2.98Å
86	I	97.1	Very high	97.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.2	179.3	-53.8	178.3	0	0	0	107.6	F56 R57 I58 G59 V84 I88 F104 I106 F131 V136	F56-I86 HydrophobicContact CB-CD1 4.35Å; F56-I86 HydrophobicContact CD1-CD1 4.03Å; F56-I86 HydrophobicContact CD1-CG1 4.33Å; F56-I86 HydrophobicContact CG-CD1 4.35Å; R57-I86 PolarHBondContact O-N 2.98Å; R57-I86 VanDerWaalsContact O-N 3.14Å; I58-I86 CarbonylContact C-O 3.23Å; I58-I86 WeakPolarHBondContact CA-O 3.36Å; I58-I86 HydrophobicContact CG1-CB 4.32Å; I58-I86 HydrophobicContact CG1-CD1 4.42Å; I58-I86 HydrophobicContact CG2-CB 4.33Å; I58-I86 HydrophobicContact CG2-CG2 4.4Å; G59-I86 PolarHBondContact N-O 3.26Å; V84-I86 WeakPolarHBondContact CG2-O 3.17Å; I86-I88 HydrophobicContact CG2-CG1 4.17Å; I86-F104 CarbonylContact C-O 3.57Å; I86-F104 VanDerWaalsContact CA-O 3.3Å; I86-F104 WeakPolarHBondContact CA-O 3.28Å; I86-F104 HydrophobicContact CG1-CB 4.2Å; I86-F104 HydrophobicContact CG2-CB 4.5Å; I86-I106 HydrophobicContact CG2-CD1 3.72Å; I86-I106 HydrophobicContact CG2-CG1 4.14Å; I86-F131 HydrophobicContact CD1-CE1 4Å; I86-F131 HydrophobicContact CD1-CZ 4.34Å; I86-V136 HydrophobicContact CD1-CG1 4.15Å
87	M	98	Very high	97.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	125.7	170.6	-170.5	66.1	-159.3	0	0	109.6	C61 V75 M78 R79 L82 V84 T89 F104 Y105 I106	C61-M87 HydrophobicContact CB-CE 3.54Å; V75-M87 HydrophobicContact CG1-CB 4.39Å; V75-M87 HydrophobicContact CG1-CG 3.76Å; M78-M87 HydrophobicContact CB-CE 4.4Å; M78-M87 HydrophobicContact CG-CE 3.56Å; M78-M87 HydrophobicContact CG-SD 4.24Å; R79-M87 HydrophobicContact CB-CB 3.97Å; R79-M87 HydrophobicContact CB-CG 4.22Å; R79-M87 HydrophobicContact CB-SD 4.39Å; R79-M87 HydrophobicContact CG-CB 3.99Å; L82-M87 HydrophobicContact CD1-CE 4.21Å; L82-M87 HydrophobicContact CD1-SD 4.17Å; V84-M87 HydrophobicContact CG2-SD 4.19Å; M87-T89 HydrophobicContact CE-CG2 3.82Å; M87-T89 HydrophobicContact CG-CG2 4.24Å; M87-F104 PolarHBondContact N-O 2.83Å; M87-Y105 HydrophobicContact CB-CD1 3.86Å; M87-Y105 HydrophobicContact CB-CE1 4.18Å; M87-Y105 CarbonylContact O-C 3.55Å; M87-Y105 WeakPolarHBondContact O-CA 3.43Å; M87-I106 PolarHBondContact O-N 3.13Å
88	I	98.5	Very high	97.5	Very high	9 Å²	9	39.8 Å²	39.8	5%	0.046	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.6	175.7	-51.5	-176.6	0	0	0	108.8	L11 T13 I58 G59 L60 C61 I86 I106 L129	L11-I88 HydrophobicContact CB-CD1 4.39Å; L11-I88 HydrophobicContact CD1-CD1 3.69Å; T13-I88 HydrophobicContact CG2-CG2 3.87Å; I58-I88 HydrophobicContact CG2-CD1 3.54Å; I58-I88 HydrophobicContact CG2-CG1 3.81Å; G59-I88 PolarHBondContact O-N 2.85Å; L60-I88 WeakPolarHBondContact CA-O 3.3Å; L60-I88 HydrophobicContact CD1-CB 3.79Å; L60-I88 HydrophobicContact CD1-CG2 3.73Å; C61-I88 PolarHBondContact N-O 3.27Å; I86-I88 HydrophobicContact CG2-CG1 4.17Å; I88-I106 CarbonylContact C-O 3.56Å; I88-I106 VanDerWaalsContact CA-O 3.28Å; I88-I106 WeakPolarHBondContact CA-O 3.46Å; I88-I106 HydrophobicContact CG1-CB 4.2Å; I88-L129 HydrophobicContact CD1-CD1 4.38Å
89	T	98.5	Very high	97.3	Very high	15 Å²	15	44.3 Å²	44.3	9%	0.092	21%	0.212	C	C	.	.			trans	-129.7	157.7	175.5	53.3	0	0	0	0	111	C61 L66 V75 M87 I106 N107 P108	C61-T89 HydrophobicContact CB-CG2 4.37Å; C61-T89 VanDerWaalsContact O-CA 3.29Å; C61-T89 WeakPolarHBondContact O-CA 3.34Å; L66-T89 HydrophobicContact CD1-CG2 3.8Å; V75-T89 HydrophobicContact CG1-CG2 4.04Å; M87-T89 HydrophobicContact CE-CG2 3.82Å; M87-T89 HydrophobicContact CG-CG2 4.24Å; T89-I106 PolarHBondContact N-O 3.39Å; T89-N107 WeakPolarHBondContact O-CA 3.47Å; T89-N107 WeakPolarHBondContact O-CB 3.45Å; T89-N107 VanDerWaalsContact O-CG 3.28Å; T89-N107 PolarHBondContact O-OD1 3.19Å; T89-P108 WeakPolarHBondContact O-CD 3.26Å
90	G	98.2	Very high	97.1	Very high	4 Å²	4	46.6 Å²	46.6	4%	0.041	22%	0.223	C	C	.	.			trans	-121.8	-125.1	175.7	0	0	0	0	0	111.5	H62 T92 N107	H62-G90 CarbonylContact O-C 3.57Å; H62-G90 WeakPolarHBondContact O-CA 3.25Å; H62-G90 PolarHBondContact O-N 3.26Å; G90-T92 PolarHBondContact O-N 3.3Å; G90-N107 PolarHBondContact O-ND2 3Å; G90-N107 VanDerWaalsContact O-ND2 3.09Å
91	H	98.3	Very high	96.6	Very high	20 Å²	20	47.9 Å²	47.9	9%	0.093	23%	0.234	C	C	.	.	S	Bend	trans	65.6	-44.8	174	-177.4	65	0	0	0	117	D38 H62 W69 H93	D38-H91 IonicContact OD2-CE1 2.72Å; D38-H91 IonicContact OD2-ND1 2.7Å; H62-H91 AromaticContact CE1-ND1 3.74Å; H62-H91 PolarHBondContact NE2-N 2.68Å; H62-H91 WeakPolarHBondContact O-CB 3.46Å; H62-H91 PolarHBondContact O-N 3.43Å; W69-H91 AromaticContact CD1-CD2 3.92Å; W69-H91 AromaticContact CD1-NE2 3.73Å; W69-H91 AromaticContact CD2-CD2 3.95Å; W69-H91 AromaticContact CD2-NE2 3.2Å; W69-H91 AromaticContact CE2-CE1 3.95Å; W69-H91 AromaticContact CE2-NE2 3.12Å; W69-H91 AromaticContact CE3-NE2 3.62Å; W69-H91 AromaticContact CG-CD2 3.88Å; W69-H91 AromaticContact CG-NE2 3.62Å; W69-H91 AromaticContact CH2-NE2 3.87Å; W69-H91 AromaticContact CZ2-CE1 3.91Å; W69-H91 AromaticContact CZ2-NE2 3.5Å; W69-H91 WeakPolarHBondContact CZ2-NE2 3.42Å; W69-H91 AromaticContact CZ3-NE2 3.93Å; W69-H91 AromaticContact NE1-NE2 3.47Å; W69-H91 PolarHBondContact NE1-NE2 3.01Å; H91-H93 PolarHBondContact O-CD2 3.27Å; H91-H93 PolarHBondContact O-N 3.27Å
92	T	97.8	Very high	96.2	Very high	9 Å²	9	41.6 Å²	41.6	6%	0.055	22%	0.217	C	C	.	.	S	Bend	trans	-71.6	-19.1	-177.5	68	0	0	0	0	113.2	N70 G90 K94 N107 S116 T119	N70-T92 HydrophobicContact CB-CG2 4.12Å; G90-T92 PolarHBondContact O-N 3.3Å; T92-K94 PolarHBondContact O-N 3.49Å; T92-K94 PolarHBondContact OG1-N 2.7Å; T92-N107 PolarHBondContact OG1-ND2 3.48Å; T92-S116 PolarHBondContact O-OG 2.92Å; T92-S116 VanDerWaalsContact O-OG 3.07Å; T92-T119 WeakPolarHBondContact O-CB 3.38Å; T92-T119 PolarHBondContact O-OG1 2.89Å
93	H	98.4	Very high	96	Very high	35 Å²	35	42.7 Å²	42.7	16%	0.162	22%	0.221	C	C	.	.			trans	61.1	19.2	-170.4	-58.4	-168.6	0	0	0	113.7	H91 A114 F115 V122	H91-H93 PolarHBondContact O-CD2 3.27Å; H91-H93 PolarHBondContact O-N 3.27Å; H93-A114 PolarHBondContact ND1-O 3.07Å; H93-F115 PolarHBondContact CE1-O 3.03Å; H93-F115 PolarHBondContact ND1-O 2.96Å; H93-F115 VanDerWaalsContact ND1-O 3.15Å; H93-V122 HydrophobicContact CB-CG1 3.75Å; H93-V122 HydrophobicContact CB-CG2 4.05Å; H93-V122 WeakPolarHBondContact O-CG1 3.36Å
94	K	97.8	Very high	95.9	Very high	95 Å²	95	38.3 Å²	38.3	41%	0.413	20%	0.196	S	C	.	.			trans	-111.5	118.9	179.2	-168.8	-175	174.6	-157.2	0	110	T92 E96 N107 T119	T92-K94 PolarHBondContact O-N 3.49Å; T92-K94 PolarHBondContact OG1-N 2.7Å; K94-E96 HydrophobicContact CD-CG 4.11Å; K94-E96 WeakPolarHBondContact CD-OE1 3.49Å; K94-E96 VanDerWaalsContact CE-OE1 3.29Å; K94-E96 WeakPolarHBondContact CE-OE1 2.99Å; K94-E96 HydrophobicContact CG-CG 4.07Å; K94-E96 IonicContact NZ-OE1 3.38Å; K94-E96 PolarHBondContact NZ-OE1 3.31Å; K94-E96 PolarHBondContact O-N 3.07Å; K94-N107 PolarHBondContact O-OD1 3.21Å; K94-T119 HydrophobicContact CB-CG2 4.49Å
95	L	98.1	Very high	95.8	Very high	26 Å²	26	38.7 Å²	38.7	14%	0.136	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	118.2	172.2	176.7	66.2	0	0	0	109.6	N107 V127 D140 Q142	L95-N107 CarbonylContact C-O 3.52Å; L95-N107 VanDerWaalsContact CA-O 3.28Å; L95-N107 WeakPolarHBondContact CA-O 3.39Å; L95-N107 WeakPolarHBondContact CD1-O 3.38Å; L95-V127 HydrophobicContact CD1-CG2 3.41Å; L95-V127 VanDerWaalsContact CD1-CG2 3.41Å; L95-D140 HydrophobicContact CD2-CB 3.99Å; L95-Q142 HydrophobicContact CD2-CG 3.33Å
96	E	96.7	Very high	95.9	Very high	62 Å²	62	38.4 Å²	38.4	29%	0.29	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	119.1	178	-68.2	-175.5	139.7	0	0	109.9	N70 K94 I106 N107	N70-E96 PolarHBondContact OD1-OE2 2.85Å; K94-E96 HydrophobicContact CD-CG 4.11Å; K94-E96 WeakPolarHBondContact CD-OE1 3.49Å; K94-E96 VanDerWaalsContact CE-OE1 3.29Å; K94-E96 WeakPolarHBondContact CE-OE1 2.99Å; K94-E96 HydrophobicContact CG-CG 4.07Å; K94-E96 IonicContact NZ-OE1 3.38Å; K94-E96 PolarHBondContact NZ-OE1 3.31Å; K94-E96 PolarHBondContact O-N 3.07Å; E96-I106 CarbonylContact O-C 3.59Å; E96-I106 WeakPolarHBondContact O-CA 3.43Å; E96-N107 HydrophobicContact CB-CB 4.31Å; E96-N107 PolarHBondContact N-O 2.86Å; E96-N107 PolarHBondContact O-N 2.88Å
97	T	96.4	Very high	96	Very high	38 Å²	38	38.8 Å²	38.8	23%	0.233	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	129	171.7	62.6	0	0	0	0	109.2	Y105 I106 V127 I138 D140	T97-Y105 WeakPolarHBondContact CA-O 3.29Å; T97-I106 HydrophobicContact CG2-CG1 4.41Å; T97-I106 HydrophobicContact CG2-CG2 4.2Å; T97-V127 HydrophobicContact CG2-CG2 4.23Å; T97-I138 HydrophobicContact CG2-CG2 4.07Å; T97-D140 VanDerWaalsContact CG2-OD1 3.25Å; T97-D140 WeakPolarHBondContact CG2-OD1 3.27Å; T97-D140 VanDerWaalsContact CG2-OD2 3.26Å; T97-D140 WeakPolarHBondContact CG2-OD2 3.47Å; T97-D140 PolarHBondContact OG1-OD2 3.22Å
98	S	94.5	Very high	96	Very high	50 Å²	50	39.8 Å²	39.8	35%	0.35	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	155.2	-175.6	67	0	0	0	0	112.9	F104 Y105	S98-F104 WeakPolarHBondContact O-CA 3.41Å; S98-F104 WeakPolarHBondContact O-CD2 3.26Å; S98-Y105 PolarHBondContact N-O 3.38Å; S98-Y105 PolarHBondContact O-N 2.7Å
99	K	93.3	Very high	96	Very high	124 Å²	124	39.9 Å²	39.9	54%	0.539	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	125.3	172.3	-174.9	-179.8	176.7	175.1	0	109.1	K103 F104 Y155	K99-K103 CarbonylContact C-O 3.58Å; K99-K103 WeakPolarHBondContact CA-O 3.37Å; K99-F104 HydrophobicContact CB-CD2 3.87Å; K99-F104 HydrophobicContact CB-CE2 3.96Å; K99-F104 HydrophobicContact CG-CD2 4.37Å; K99-Y155 HydrophobicContact CD-CD2 4.04Å; K99-Y155 HydrophobicContact CD-CE2 4.24Å; K99-Y155 HydrophobicContact CG-CD2 4.45Å; K99-Y155 HydrophobicContact CG-CE2 4.48Å
100	H	92.7	Very high	96	Very high	69 Å²	69	39.9 Å²	39.9	32%	0.319	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	130.6	175.8	-176.8	-91.4	0	0	0	109.8	L72 G102 K103 Y105	L72-H100 HydrophobicContact CD2-CB 4.14Å; H100-G102 PolarHBondContact O-N 3.2Å; H100-K103 PolarHBondContact N-O 2.72Å; H100-K103 PolarHBondContact O-N 2.87Å; H100-K103 VanDerWaalsContact O-O 3.12Å; H100-Y105 HydrophobicContact CB-CD2 4.08Å; H100-Y105 HydrophobicContact CB-CE2 3.7Å
101	E	88.4	Confident	96	Very high	139 Å²	139	44.6 Å²	44.6	65%	0.65	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	40.1	-178.8	-67.4	173.6	167	0	0	113.9	R80 K103	R80-E101 IonicContact NH1-OE2 3.48Å; E101-K103 PolarHBondContact O-N 2.86Å; E101-K103 VanDerWaalsContact O-N 3.16Å
102	G	89	Confident	95.9	Very high	37 Å²	37	48.7 Å²	48.7	38%	0.381	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	5.2	-179.4	0	0	0	0	0	114.6	H100 Y155	H100-G102 PolarHBondContact O-N 3.2Å; G102-Y155 VanDerWaalsContact O-CE2 3.29Å; G102-Y155 WeakPolarHBondContact O-CE2 3.46Å; G102-Y155 VanDerWaalsContact O-CZ 3.28Å; G102-Y155 PolarHBondContact O-OH 2.9Å
103	K	93	Very high	95.9	Very high	50 Å²	50	49.2 Å²	49.2	22%	0.217	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	157.4	175.6	-61	-66.7	-176.9	-174.4	0	110.5	D85 K99 H100 E101 Y105	D85-K103 IonicContact OD1-NZ 2.68Å; D85-K103 PolarHBondContact OD1-NZ 3.06Å; K99-K103 CarbonylContact C-O 3.58Å; K99-K103 WeakPolarHBondContact CA-O 3.37Å; H100-K103 PolarHBondContact N-O 2.72Å; H100-K103 PolarHBondContact O-N 2.87Å; H100-K103 VanDerWaalsContact O-O 3.12Å; E101-K103 PolarHBondContact O-N 2.86Å; E101-K103 VanDerWaalsContact O-N 3.16Å; K103-Y105 HydrophobicContact CB-CE2 4.1Å
104	F	94.7	Very high	95.9	Very high	12 Å²	12	49.5 Å²	49.5	5%	0.053	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	141.8	-174.4	-147.3	-96.8	0	0	0	111.5	D85 I86 M87 S98 K99 I106 I138 Y155	D85-F104 PolarHBondContact O-N 3.01Å; I86-F104 CarbonylContact C-O 3.57Å; I86-F104 VanDerWaalsContact CA-O 3.3Å; I86-F104 WeakPolarHBondContact CA-O 3.28Å; I86-F104 HydrophobicContact CG1-CB 4.2Å; I86-F104 HydrophobicContact CG2-CB 4.5Å; M87-F104 PolarHBondContact N-O 2.83Å; S98-F104 WeakPolarHBondContact O-CA 3.41Å; S98-F104 WeakPolarHBondContact O-CD2 3.26Å; K99-F104 HydrophobicContact CB-CD2 3.87Å; K99-F104 HydrophobicContact CB-CE2 3.96Å; K99-F104 HydrophobicContact CG-CD2 4.37Å; F104-I106 HydrophobicContact CD1-CD1 3.93Å; F104-I106 HydrophobicContact CD1-CG1 3.6Å; F104-I106 HydrophobicContact CE1-CD1 4.16Å; F104-I106 HydrophobicContact CE1-CG1 3.73Å; F104-I138 HydrophobicContact CD1-CD1 3.43Å; F104-I138 VanDerWaalsContact CD1-CD1 3.43Å; F104-I138 HydrophobicContact CD2-CD1 4.47Å; F104-I138 HydrophobicContact CE1-CD1 2.96Å; F104-I138 HydrophobicContact CE1-CG1 4.4Å; F104-I138 HydrophobicContact CE2-CD1 4.08Å; F104-I138 HydrophobicContact CG-CD1 4.19Å; F104-I138 HydrophobicContact CZ-CD1 3.34Å; F104-Y155 HydrophobicContact CB-CD1 4.29Å; F104-Y155 HydrophobicContact CB-CD2 4.5Å; F104-Y155 HydrophobicContact CB-CE1 4.48Å; F104-Y155 HydrophobicContact CB-CG 4.31Å; F104-Y155 AromaticContact CD2-CD2 3.97Å; F104-Y155 HydrophobicContact CD2-CD2 3.97Å; F104-Y155 AromaticContact CD2-CG 3.97Å; F104-Y155 HydrophobicContact CD2-CG 3.97Å; F104-Y155 HydrophobicContact CG-CG 4.32Å
105	Y	97.3	Very high	95.9	Very high	10 Å²	10	53.3 Å²	53.3	4%	0.039	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.5	-177.2	-59.7	-92.9	0	0	0	108.3	L72 V75 S76 R79 M87 T97 S98 H100 K103	L72-Y105 HydrophobicContact CD1-CD1 4.16Å; L72-Y105 HydrophobicContact CD1-CD2 4.14Å; L72-Y105 HydrophobicContact CD1-CE1 4.33Å; L72-Y105 HydrophobicContact CD1-CE2 4.34Å; L72-Y105 HydrophobicContact CD1-CG 4.06Å; V75-Y105 HydrophobicContact CG1-CD1 3.65Å; V75-Y105 HydrophobicContact CG1-CE1 4.03Å; S76-Y105 PolarHBondContact OG-OH 2.84Å; S76-Y105 VanDerWaalsContact OG-OH 3.07Å; R79-Y105 HydrophobicContact CB-CE1 4.03Å; R79-Y105 WeakPolarHBondContact CD-OH 3.18Å; R79-Y105 HydrophobicContact CG-CE1 4.36Å; R79-Y105 PolarHBondContact NE-OH 3.2Å; M87-Y105 HydrophobicContact CB-CD1 3.86Å; M87-Y105 HydrophobicContact CB-CE1 4.18Å; M87-Y105 CarbonylContact O-C 3.55Å; M87-Y105 WeakPolarHBondContact O-CA 3.43Å; T97-Y105 WeakPolarHBondContact CA-O 3.29Å; S98-Y105 PolarHBondContact N-O 3.38Å; S98-Y105 PolarHBondContact O-N 2.7Å; H100-Y105 HydrophobicContact CB-CD2 4.08Å; H100-Y105 HydrophobicContact CB-CE2 3.7Å; K103-Y105 HydrophobicContact CB-CE2 4.1Å
106	I	98	Very high	95.8	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.015	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	130.3	-174.5	-58.8	179.7	0	0	0	108.5	I86 M87 I88 T89 E96 T97 F104 V127 L129 I138	I86-I106 HydrophobicContact CG2-CD1 3.72Å; I86-I106 HydrophobicContact CG2-CG1 4.14Å; M87-I106 PolarHBondContact O-N 3.13Å; I88-I106 CarbonylContact C-O 3.56Å; I88-I106 VanDerWaalsContact CA-O 3.28Å; I88-I106 WeakPolarHBondContact CA-O 3.46Å; I88-I106 HydrophobicContact CG1-CB 4.2Å; T89-I106 PolarHBondContact N-O 3.39Å; E96-I106 CarbonylContact O-C 3.59Å; E96-I106 WeakPolarHBondContact O-CA 3.43Å; T97-I106 HydrophobicContact CG2-CG1 4.41Å; T97-I106 HydrophobicContact CG2-CG2 4.2Å; F104-I106 HydrophobicContact CD1-CD1 3.93Å; F104-I106 HydrophobicContact CD1-CG1 3.6Å; F104-I106 HydrophobicContact CE1-CD1 4.16Å; F104-I106 HydrophobicContact CE1-CG1 3.73Å; I106-V127 HydrophobicContact CG2-CB 4.28Å; I106-V127 HydrophobicContact CG2-CG1 4.22Å; I106-V127 HydrophobicContact CG2-CG2 4.04Å; I106-L129 HydrophobicContact CD1-CD1 4.06Å; I106-L129 HydrophobicContact CD1-CD2 3.73Å; I106-L129 HydrophobicContact CD1-CG 4.49Å; I106-I138 HydrophobicContact CD1-CD1 4.34Å
107	N	98.3	Very high	95.7	Very high	7 Å²	7	54.2 Å²	54.2	4%	0.037	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	114.8	160.4	-171.5	-29.4	0	0	0	108.1	T89 G90 T92 K94 L95 E96 G109	T89-N107 WeakPolarHBondContact O-CA 3.47Å; T89-N107 WeakPolarHBondContact O-CB 3.45Å; T89-N107 VanDerWaalsContact O-CG 3.28Å; T89-N107 PolarHBondContact O-OD1 3.19Å; G90-N107 PolarHBondContact O-ND2 3Å; G90-N107 VanDerWaalsContact O-ND2 3.09Å; T92-N107 PolarHBondContact OG1-ND2 3.48Å; K94-N107 PolarHBondContact O-OD1 3.21Å; L95-N107 CarbonylContact C-O 3.52Å; L95-N107 VanDerWaalsContact CA-O 3.28Å; L95-N107 WeakPolarHBondContact CA-O 3.39Å; L95-N107 WeakPolarHBondContact CD1-O 3.38Å; E96-N107 HydrophobicContact CB-CB 4.31Å; E96-N107 PolarHBondContact N-O 2.86Å; E96-N107 PolarHBondContact O-N 2.88Å; N107-G109 PolarHBondContact O-N 3.38Å; N107-G109 PolarHBondContact OD1-N 3.23Å
108	P	98.5	Very high	95.6	Very high	22 Å²	22	55.9 Å²	55.9	14%	0.143	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	-7	-176.7	31.6	-34.9	0	0	0	113.5	T13 T89 S125 F126 V127	T13-P108 HydrophobicContact CG2-CG 4.26Å; T89-P108 WeakPolarHBondContact O-CD 3.26Å; P108-S125 CarbonylContact O-C 3.54Å; P108-S125 VanDerWaalsContact O-C 3.23Å; P108-S125 WeakPolarHBondContact O-CB 3.43Å; P108-S125 PolarHBondContact O-OG 3.13Å; P108-F126 PolarHBondContact O-N 3.06Å; P108-V127 HydrophobicContact CB-CB 4.37Å; P108-V127 HydrophobicContact CB-CG2 4.1Å
109	G	98.3	Very high	95.7	Very high	11 Å²	11	54.6 Å²	54.6	11%	0.113	30%	0.304	C	S	.	.			trans	73.4	-159.2	-169.9	0	0	0	0	0	112.3	N107	N107-G109 PolarHBondContact O-N 3.38Å; N107-G109 PolarHBondContact OD1-N 3.23Å
110	S	98.4	Very high	95.8	Very high	14 Å²	14	57.7 Å²	57.7	10%	0.098	32%	0.32	C	S	.	.			trans	-102.1	121.8	174.3	175.1	0	0	0	0	109.7	T112 G113 A114 P124 S125	S110-T112 PolarHBondContact O-N 3.32Å; S110-T112 PolarHBondContact OG-OG1 3.35Å; S110-G113 PolarHBondContact O-N 3.4Å; S110-G113 VanDerWaalsContact O-N 3.12Å; S110-G113 PolarHBondContact OG-N 2.96Å; S110-A114 PolarHBondContact OG-N 3.05Å; S110-P124 CarbonylContact O-C 3.1Å; S110-P124 VanDerWaalsContact O-CA 3.28Å; S110-P124 WeakPolarHBondContact O-CA 3.26Å; S110-S125 CarbonylContact C-O 3.59Å; S110-S125 PolarHBondContact O-N 2.63Å
111	I	97.5	Very high	95.9	Very high	103 Å²	103	60.9 Å²	60.9	53%	0.528	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-25.3	178.9	-164.8	170.1	0	0	0	113.3	L2 S125 F126	L2-I111 HydrophobicContact CD1-CD1 4.42Å; I111-S125 WeakPolarHBondContact CA-O 3.25Å; I111-S125 PolarHBondContact N-O 3.48Å; I111-F126 HydrophobicContact CD1-CB 4.3Å; I111-F126 HydrophobicContact CG1-CB 4.32Å; I111-F126 HydrophobicContact CG1-CD1 4.46Å
112	T	97.1	Very high	96.3	Very high	106 Å²	106	55.6 Å²	55.6	65%	0.65	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-7.6	179.1	54.4	0	0	0	0	113.2	S110 A114	S110-T112 PolarHBondContact O-N 3.32Å; S110-T112 PolarHBondContact OG-OG1 3.35Å; T112-A114 VanDerWaalsContact C-N 3.29Å
113	G	97.7	Very high	96.8	Very high	21 Å²	21	57 Å²	57	22%	0.216	32%	0.315	C	S	.	.			trans	67.3	29.8	-170	0	0	0	0	0	113.2	S110	S110-G113 PolarHBondContact O-N 3.4Å; S110-G113 VanDerWaalsContact O-N 3.12Å; S110-G113 PolarHBondContact OG-N 2.96Å
114	A	98	Very high	97	Very high	40 Å²	40	56.3 Å²	56.3	33%	0.331	32%	0.316	S	S	.	.			trans	-57.9	146.8	-178	0	0	0	0	0	112	H93 S110 T112 V122	H93-A114 PolarHBondContact ND1-O 3.07Å; S110-A114 PolarHBondContact OG-N 3.05Å; T112-A114 VanDerWaalsContact C-N 3.29Å; A114-V122 WeakPolarHBondContact O-CG1 3.48Å; A114-V122 WeakPolarHBondContact O-CG2 3.28Å
115	F	97.7	Very high	97.2	Very high	175 Å²	175	55.8 Å²	55.8	77%	0.768	31%	0.314	S	S	*	.			trans	-51.7	143.1	176.5	169.7	-96.4	0	0	0	112.1	H93	H93-F115 PolarHBondContact CE1-O 3.03Å; H93-F115 PolarHBondContact ND1-O 2.96Å; H93-F115 VanDerWaalsContact ND1-O 3.15Å
116	S	96.6	Very high	97.2	Very high	3 Å²	3	58 Å²	58	2%	0.021	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-135.3	136.7	174.7	174.8	0	0	0	0	110.3	T92 V118 T119	T92-S116 PolarHBondContact O-OG 2.92Å; T92-S116 VanDerWaalsContact O-OG 3.07Å; S116-V118 PolarHBondContact O-N 3.44Å; S116-V118 VanDerWaalsContact OG-CG2 3.26Å; S116-V118 WeakPolarHBondContact OG-CG2 3.36Å; S116-V118 PolarHBondContact OG-N 3.33Å; S116-T119 PolarHBondContact OG-N 3.04Å
117	P	94.5	Very high	97.2	Very high	105 Å²	105	59.2 Å²	59.2	68%	0.682	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-12.1	174.8	30.6	-35.2	0	0	0	113.2
118	V	95	Very high	97.2	Very high	73 Å²	73	61.8 Å²	61.8	44%	0.442	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-4.8	-177.4	-63.2	0	0	0	0	114	W69 S116	W69-V118 HydrophobicContact CE3-CG1 3.79Å; W69-V118 HydrophobicContact CZ3-CG1 4.08Å; S116-V118 PolarHBondContact O-N 3.44Å; S116-V118 VanDerWaalsContact OG-CG2 3.26Å; S116-V118 WeakPolarHBondContact OG-CG2 3.36Å; S116-V118 PolarHBondContact OG-N 3.33Å
119	T	96.2	Very high	97.1	Very high	23 Å²	23	62.6 Å²	62.6	14%	0.141	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-133.4	111.9	179.2	-61.4	0	0	0	0	109.5	T92 K94 S116 V122	T92-T119 WeakPolarHBondContact O-CB 3.38Å; T92-T119 PolarHBondContact O-OG1 2.89Å; K94-T119 HydrophobicContact CB-CG2 4.49Å; S116-T119 PolarHBondContact OG-N 3.04Å; T119-V122 HydrophobicContact CG2-CG2 3.9Å; T119-V122 WeakPolarHBondContact O-CG2 3.34Å
120	E	94.5	Very high	96.9	Very high	189 Å²	189	64.7 Å²	64.7	88%	0.883	36%	0.356	S	S	*	.	S	Bend	trans	-64.9	-43.1	-173.5	-64.5	-179.5	170.7	0	0	113.6
121	N	94.7	Very high	96.7	Very high	136 Å²	136	66.5 Å²	66.5	73%	0.727	36%	0.362	S	S	*	.	S	Bend	trans	-122.4	82.3	-175.5	-66.5	-59.4	0	0	0	109.7	I123	N121-I123 PolarHBondContact O-N 3.36Å
122	V	97.8	Very high	96.5	Very high	28 Å²	28	66.3 Å²	66.3	17%	0.17	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-72.4	120.7	-179	-173.6	0	0	0	0	110	H93 A114 T119	H93-V122 HydrophobicContact CB-CG1 3.75Å; H93-V122 HydrophobicContact CB-CG2 4.05Å; H93-V122 WeakPolarHBondContact O-CG1 3.36Å; A114-V122 WeakPolarHBondContact O-CG1 3.48Å; A114-V122 WeakPolarHBondContact O-CG2 3.28Å; T119-V122 HydrophobicContact CG2-CG2 3.9Å; T119-V122 WeakPolarHBondContact O-CG2 3.34Å
123	I	98.2	Very high	96.1	Very high	65 Å²	65	69 Å²	69	33%	0.333	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-98.1	125.7	176.3	-62.8	174	0	0	0	108.5	N121 S125 Q142 L143 V144	N121-I123 PolarHBondContact O-N 3.36Å; I123-S125 PolarHBondContact O-N 3.32Å; I123-S125 PolarHBondContact O-OG 3.08Å; I123-Q142 HydrophobicContact CG2-CB 3.95Å; I123-Q142 HydrophobicContact CG2-CG 4.42Å; I123-L143 WeakPolarHBondContact CG2-O 3.42Å; I123-V144 HydrophobicContact CD1-CG2 4.41Å; I123-V144 HydrophobicContact CG2-CG2 4.04Å
124	P	98.5	Very high	95.9	Very high	36 Å²	36	70 Å²	70	23%	0.234	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-53.5	125.5	174.5	-22.9	30.2	0	0	0	111.2	S110 Q142 L143	S110-P124 CarbonylContact O-C 3.1Å; S110-P124 VanDerWaalsContact O-CA 3.28Å; S110-P124 WeakPolarHBondContact O-CA 3.26Å; P124-Q142 WeakPolarHBondContact O-CA 3.29Å; P124-L143 HydrophobicContact CB-CB 4.01Å; P124-L143 HydrophobicContact CG-CB 4.25Å; P124-L143 HydrophobicContact CG-CD2 4.32Å; P124-L143 PolarHBondContact O-N 3.16Å
125	S	98.6	Very high	95.7	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.014	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	152.1	-170.3	40.2	0	0	0	0	114.2	P108 S110 I111 I123 Y141	P108-S125 CarbonylContact O-C 3.54Å; P108-S125 VanDerWaalsContact O-C 3.23Å; P108-S125 WeakPolarHBondContact O-CB 3.43Å; P108-S125 PolarHBondContact O-OG 3.13Å; S110-S125 CarbonylContact C-O 3.59Å; S110-S125 PolarHBondContact O-N 2.63Å; I111-S125 WeakPolarHBondContact CA-O 3.25Å; I111-S125 PolarHBondContact N-O 3.48Å; I123-S125 PolarHBondContact O-N 3.32Å; I123-S125 PolarHBondContact O-OG 3.08Å; S125-Y141 WeakPolarHBondContact CA-O 3.46Å; S125-Y141 WeakPolarHBondContact CB-O 3.43Å
126	F	98.3	Very high	95.6	Very high	56 Å²	56	61.2 Å²	61.2	25%	0.246	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	165.5	169.3	70.1	-85	0	0	0	110.2	L2 P108 I111 Y141	L2-F126 HydrophobicContact CD2-CE2 4.05Å; L2-F126 HydrophobicContact CD2-CZ 4.3Å; P108-F126 PolarHBondContact O-N 3.06Å; I111-F126 HydrophobicContact CD1-CB 4.3Å; I111-F126 HydrophobicContact CG1-CB 4.32Å; I111-F126 HydrophobicContact CG1-CD1 4.46Å; F126-Y141 HydrophobicContact CD1-CG 4.49Å; F126-Y141 HydrophobicContact CD2-CD2 4.11Å; F126-Y141 HydrophobicContact CD2-CG 4.47Å; F126-Y141 VanDerWaalsContact CE1-CB 3.41Å; F126-Y141 HydrophobicContact CE1-CD1 4.31Å; F126-Y141 HydrophobicContact CE1-CD2 4.33Å; F126-Y141 AromaticContact CE1-CG 3.79Å; F126-Y141 HydrophobicContact CE1-CG 3.79Å; F126-Y141 AromaticContact CE2-CD2 3.44Å; F126-Y141 HydrophobicContact CE2-CD2 3.44Å; F126-Y141 VanDerWaalsContact CE2-CD2 3.44Å; F126-Y141 AromaticContact CE2-CE2 3.99Å; F126-Y141 HydrophobicContact CE2-CE2 3.99Å; F126-Y141 AromaticContact CE2-CG 3.76Å; F126-Y141 HydrophobicContact CE2-CG 3.76Å; F126-Y141 AromaticContact CZ-CD1 3.82Å; F126-Y141 HydrophobicContact CZ-CD1 3.82Å; F126-Y141 AromaticContact CZ-CD2 3.58Å; F126-Y141 HydrophobicContact CZ-CD2 3.58Å; F126-Y141 HydrophobicContact CZ-CE1 4.44Å; F126-Y141 HydrophobicContact CZ-CE2 4.21Å; F126-Y141 AromaticContact CZ-CG 3.36Å; F126-Y141 HydrophobicContact CZ-CG 3.36Å; F126-Y141 PolarHBondContact N-O 3.15Å; F126-Y141 VanDerWaalsContact N-O 3.1Å; F126-Y141 PolarHBondContact O-N 2.81Å
127	V	98	Very high	95.5	Very high	28 Å²	28	62.7 Å²	62.7	17%	0.17	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.2	179.6	176	0	0	0	0	110	L95 T97 I106 P108 L129 I138 Y139 D140	L95-V127 HydrophobicContact CD1-CG2 3.41Å; L95-V127 VanDerWaalsContact CD1-CG2 3.41Å; T97-V127 HydrophobicContact CG2-CG2 4.23Å; I106-V127 HydrophobicContact CG2-CB 4.28Å; I106-V127 HydrophobicContact CG2-CG1 4.22Å; I106-V127 HydrophobicContact CG2-CG2 4.04Å; P108-V127 HydrophobicContact CB-CB 4.37Å; P108-V127 HydrophobicContact CB-CG2 4.1Å; V127-L129 HydrophobicContact CG1-CD2 3.72Å; V127-L129 HydrophobicContact CG1-CG 4.26Å; V127-I138 HydrophobicContact CG1-CG2 3.65Å; V127-Y139 WeakPolarHBondContact CA-O 3.49Å; V127-D140 WeakPolarHBondContact CG2-OD1 3.36Å
128	L	96.8	Very high	95.6	Very high	61 Å²	61	57.7 Å²	57.7	32%	0.319	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	131.7	168.6	-172	154.4	0	0	0	109.5	D130 Y139 Y141	L128-D130 HydrophobicContact CD2-CB 4.45Å; L128-Y139 HydrophobicContact CD2-CD2 3.84Å; L128-Y139 HydrophobicContact CD2-CE2 4.37Å; L128-Y139 PolarHBondContact N-O 3.44Å; L128-Y139 PolarHBondContact O-N 3.02Å; L128-Y141 HydrophobicContact CB-CD2 4.47Å; L128-Y141 HydrophobicContact CB-CE2 3.9Å
129	L	96.3	Very high	95.7	Very high	40 Å²	40	56.4 Å²	56.4	21%	0.209	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.2	177.4	-56.2	179	0	0	0	110	I88 I106 V127 F131 V136 F137 I138	I88-L129 HydrophobicContact CD1-CD1 4.38Å; I106-L129 HydrophobicContact CD1-CD1 4.06Å; I106-L129 HydrophobicContact CD1-CD2 3.73Å; I106-L129 HydrophobicContact CD1-CG 4.49Å; V127-L129 HydrophobicContact CG1-CD2 3.72Å; V127-L129 HydrophobicContact CG1-CG 4.26Å; L129-F131 HydrophobicContact CB-CD2 4.18Å; L129-F131 HydrophobicContact CB-CE2 3.47Å; L129-F131 VanDerWaalsContact CB-CE2 3.47Å; L129-F131 HydrophobicContact CB-CZ 3.88Å; L129-F131 HydrophobicContact CD1-CE2 4.1Å; L129-F131 HydrophobicContact CD1-CZ 3.83Å; L129-F131 HydrophobicContact CG-CE2 4.43Å; L129-F131 HydrophobicContact CG-CZ 4.48Å; L129-V136 HydrophobicContact CB-CG2 4.04Å; L129-V136 HydrophobicContact CD2-CG2 4.22Å; L129-F137 WeakPolarHBondContact CA-O 3.15Å; L129-I138 HydrophobicContact CD2-CB 4.14Å; L129-I138 HydrophobicContact CD2-CD1 4.27Å; L129-I138 HydrophobicContact CD2-CG1 3.73Å; L129-I138 HydrophobicContact CD2-CG2 3.87Å
130	D	95.1	Very high	95.7	Very high	55 Å²	55	55.9 Å²	55.9	29%	0.294	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	108	173.6	172.8	23.7	0	0	0	109.2	L128 Q132 V136 F137 Y139	L128-D130 HydrophobicContact CD2-CB 4.45Å; D130-Q132 PolarHBondContact OD2-NE2 3.31Å; D130-V136 CarbonylContact O-C 3.56Å; D130-V136 WeakPolarHBondContact O-CA 3.13Å; D130-F137 HydrophobicContact CB-CB 4.23Å; D130-F137 PolarHBondContact N-O 3.3Å; D130-F137 PolarHBondContact O-N 3.1Å; D130-Y139 HydrophobicContact CB-CE2 3.97Å
131	F	94.2	Very high	95.9	Very high	52 Å²	52	49.6 Å²	49.6	23%	0.228	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.3	-176.2	-66.6	-87.5	0	0	0	111.1	V53 F56 I58 I86 L129 V136	V53-F131 HydrophobicContact CB-CD2 4.36Å; V53-F131 HydrophobicContact CB-CE2 4.25Å; V53-F131 HydrophobicContact CB-CZ 4.36Å; V53-F131 HydrophobicContact CG1-CB 4.32Å; V53-F131 HydrophobicContact CG1-CD1 4.36Å; V53-F131 HydrophobicContact CG1-CD2 3.56Å; V53-F131 HydrophobicContact CG1-CE2 3.87Å; V53-F131 HydrophobicContact CG1-CG 3.83Å; V53-F131 HydrophobicContact CG1-CZ 4.42Å; F56-F131 HydrophobicContact CB-CD1 4.46Å; F56-F131 HydrophobicContact CB-CE1 4.01Å; F56-F131 AromaticContact CD2-CD1 3.5Å; F56-F131 HydrophobicContact CD2-CD1 3.5Å; F56-F131 AromaticContact CD2-CE1 3.81Å; F56-F131 HydrophobicContact CD2-CE1 3.81Å; F56-F131 AromaticContact CE2-CD1 3.93Å; F56-F131 HydrophobicContact CE2-CD1 3.93Å; F56-F131 HydrophobicContact CE2-CE1 4.46Å; F56-F131 HydrophobicContact CG-CD1 4.14Å; F56-F131 AromaticContact CG-CE1 3.96Å; F56-F131 HydrophobicContact CG-CE1 3.96Å; I58-F131 HydrophobicContact CD1-CE1 4.13Å; I58-F131 HydrophobicContact CD1-CE2 4.25Å; I58-F131 HydrophobicContact CD1-CZ 3.48Å; I58-F131 VanDerWaalsContact CD1-CZ 3.48Å; I86-F131 HydrophobicContact CD1-CE1 4Å; I86-F131 HydrophobicContact CD1-CZ 4.34Å; L129-F131 HydrophobicContact CB-CD2 4.18Å; L129-F131 HydrophobicContact CB-CE2 3.47Å; L129-F131 VanDerWaalsContact CB-CE2 3.47Å; L129-F131 HydrophobicContact CB-CZ 3.88Å; L129-F131 HydrophobicContact CD1-CE2 4.1Å; L129-F131 HydrophobicContact CD1-CZ 3.83Å; L129-F131 HydrophobicContact CG-CE2 4.43Å; L129-F131 HydrophobicContact CG-CZ 4.48Å; F131-V136 HydrophobicContact CD1-CB 3.82Å; F131-V136 HydrophobicContact CD1-CG2 3.71Å; F131-V136 HydrophobicContact CD2-CG2 4.45Å; F131-V136 HydrophobicContact CE1-CB 3.91Å; F131-V136 HydrophobicContact CE1-CG2 3.58Å; F131-V136 HydrophobicContact CE2-CG2 4.35Å; F131-V136 HydrophobicContact CG-CG2 4.15Å; F131-V136 HydrophobicContact CZ-CG2 3.91Å
132	Q	92.5	Very high	96.1	Very high	98 Å²	98	45.6 Å²	45.6	46%	0.458	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	98.7	178	-61.1	-173.7	10.1	0	0	110	D130 S134 V135 F137	D130-Q132 PolarHBondContact OD2-NE2 3.31Å; Q132-S134 PolarHBondContact O-N 3.23Å; Q132-V135 CarbonylContact C-O 3.52Å; Q132-V135 PolarHBondContact N-O 3.12Å; Q132-V135 PolarHBondContact O-N 3.22Å; Q132-F137 HydrophobicContact CG-CE2 4.43Å
133	Q	90	Very high	96.1	Very high	164 Å²	164	47.7 Å²	47.7	77%	0.766	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.2	-113.3	-174.9	-56.8	176.3	13.3	0	0	111.2	H55	H55-Q133 PolarHBondContact CD2-O 2.82Å
134	S	92.1	Very high	96	Very high	40 Å²	40	46 Å²	46	28%	0.28	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	11.4	-180	74.1	0	0	0	0	113.5	F56 Q132 K156 K157	F56-S134 VanDerWaalsContact CZ-C 3.5Å; F56-S134 WeakPolarHBondContact CZ-O 3.46Å; Q132-S134 PolarHBondContact O-N 3.23Å; S134-K156 CarbonylContact O-C 3.59Å; S134-K156 WeakPolarHBondContact O-CA 3.48Å; S134-K157 PolarHBondContact O-N 2.9Å
135	V	94.3	Very high	95.8	Very high	32 Å²	32	51.2 Å²	51.2	19%	0.194	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	140.1	179	-175.8	0	0	0	0	109.1	Q132 F137 Y155 K156	Q132-V135 CarbonylContact C-O 3.52Å; Q132-V135 PolarHBondContact N-O 3.12Å; Q132-V135 PolarHBondContact O-N 3.22Å; V135-F137 HydrophobicContact CG1-CE2 4.13Å; V135-F137 HydrophobicContact CG1-CZ 4.22Å; V135-Y155 CarbonylContact C-O 3.6Å; V135-Y155 WeakPolarHBondContact CA-O 3.49Å; V135-K156 HydrophobicContact CG2-CB 4.27Å; V135-K156 HydrophobicContact CG2-CD 4.42Å; V135-K156 HydrophobicContact CG2-CG 4.08Å
136	V	94.9	Very high	95.5	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.1	167.8	61	0	0	0	0	108.9	F56 I86 L129 D130 F131 I138 Q154 Y155	F56-V136 HydrophobicContact CE1-CG1 4.2Å; F56-V136 HydrophobicContact CE2-CB 4.39Å; F56-V136 HydrophobicContact CZ-CB 4.22Å; F56-V136 HydrophobicContact CZ-CG1 4.16Å; I86-V136 HydrophobicContact CD1-CG1 4.15Å; L129-V136 HydrophobicContact CB-CG2 4.04Å; L129-V136 HydrophobicContact CD2-CG2 4.22Å; D130-V136 CarbonylContact O-C 3.56Å; D130-V136 WeakPolarHBondContact O-CA 3.13Å; F131-V136 HydrophobicContact CD1-CB 3.82Å; F131-V136 HydrophobicContact CD1-CG2 3.71Å; F131-V136 HydrophobicContact CD2-CG2 4.45Å; F131-V136 HydrophobicContact CE1-CB 3.91Å; F131-V136 HydrophobicContact CE1-CG2 3.58Å; F131-V136 HydrophobicContact CE2-CG2 4.35Å; F131-V136 HydrophobicContact CG-CG2 4.15Å; F131-V136 HydrophobicContact CZ-CG2 3.91Å; V136-I138 HydrophobicContact CG1-CD1 4.45Å; V136-I138 HydrophobicContact CG1-CG1 4.47Å; V136-I138 HydrophobicContact CG2-CG1 4.32Å; V136-Q154 CarbonylContact O-C 3.42Å; V136-Q154 WeakPolarHBondContact O-CA 3.41Å; V136-Y155 HydrophobicContact CG1-CD1 3.82Å; V136-Y155 HydrophobicContact CG1-CG 4.32Å; V136-Y155 PolarHBondContact N-O 2.93Å; V136-Y155 PolarHBondContact O-N 3.18Å
137	F	95.5	Very high	95.4	Very high	33 Å²	33	62.2 Å²	62.2	15%	0.145	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	139.1	167.9	-62.9	-83.1	0	0	0	109.1	L129 D130 Q132 V135 Y139 A153 Q154	L129-F137 WeakPolarHBondContact CA-O 3.15Å; D130-F137 HydrophobicContact CB-CB 4.23Å; D130-F137 PolarHBondContact N-O 3.3Å; D130-F137 PolarHBondContact O-N 3.1Å; Q132-F137 HydrophobicContact CG-CE2 4.43Å; V135-F137 HydrophobicContact CG1-CE2 4.13Å; V135-F137 HydrophobicContact CG1-CZ 4.22Å; F137-Y139 HydrophobicContact CB-CD2 4.48Å; F137-Y139 HydrophobicContact CB-CE2 3.67Å; F137-A153 WeakPolarHBondContact CA-O 3.39Å; F137-Q154 HydrophobicContact CD1-CB 3.82Å; F137-Q154 HydrophobicContact CE1-CB 4.01Å
138	I	95.7	Very high	95.3	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120.5	-171.8	-52.2	-175.6	0	0	0	106.4	T97 F104 I106 V127 L129 V136 D140 K152 A153	T97-I138 HydrophobicContact CG2-CG2 4.07Å; F104-I138 HydrophobicContact CD1-CD1 3.43Å; F104-I138 VanDerWaalsContact CD1-CD1 3.43Å; F104-I138 HydrophobicContact CD2-CD1 4.47Å; F104-I138 HydrophobicContact CE1-CD1 2.96Å; F104-I138 HydrophobicContact CE1-CG1 4.4Å; F104-I138 HydrophobicContact CE2-CD1 4.08Å; F104-I138 HydrophobicContact CG-CD1 4.19Å; F104-I138 HydrophobicContact CZ-CD1 3.34Å; I106-I138 HydrophobicContact CD1-CD1 4.34Å; V127-I138 HydrophobicContact CG1-CG2 3.65Å; L129-I138 HydrophobicContact CD2-CB 4.14Å; L129-I138 HydrophobicContact CD2-CD1 4.27Å; L129-I138 HydrophobicContact CD2-CG1 3.73Å; L129-I138 HydrophobicContact CD2-CG2 3.87Å; V136-I138 HydrophobicContact CG1-CD1 4.45Å; V136-I138 HydrophobicContact CG1-CG1 4.47Å; V136-I138 HydrophobicContact CG2-CG1 4.32Å; I138-D140 WeakPolarHBondContact CG2-OD1 3.48Å; I138-K152 CarbonylContact O-C 3.18Å; I138-K152 WeakPolarHBondContact O-CA 3.28Å; I138-A153 HydrophobicContact CB-CB 4.38Å; I138-A153 PolarHBondContact N-O 3.25Å; I138-A153 PolarHBondContact O-N 2.88Å
139	Y	97.5	Very high	95.3	Very high	47 Å²	47	67.9 Å²	67.9	18%	0.184	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	112.8	-178.8	-59	-92.4	0	0	0	108.5	V127 L128 D130 F137 Y141 V150 E151 K152	V127-Y139 WeakPolarHBondContact CA-O 3.49Å; L128-Y139 HydrophobicContact CD2-CD2 3.84Å; L128-Y139 HydrophobicContact CD2-CE2 4.37Å; L128-Y139 PolarHBondContact N-O 3.44Å; L128-Y139 PolarHBondContact O-N 3.02Å; D130-Y139 HydrophobicContact CB-CE2 3.97Å; F137-Y139 HydrophobicContact CB-CD2 4.48Å; F137-Y139 HydrophobicContact CB-CE2 3.67Å; Y139-Y141 WeakPolarHBondContact O-CD2 3.49Å; Y139-V150 HydrophobicContact CD1-CG1 4.33Å; Y139-E151 CarbonylContact C-O 3.53Å; Y139-E151 WeakPolarHBondContact CA-O 3.38Å; Y139-K152 HydrophobicContact CD1-CB 4.31Å; Y139-K152 HydrophobicContact CD1-CD 4.34Å; Y139-K152 HydrophobicContact CD1-CG 4.11Å; Y139-K152 HydrophobicContact CE1-CB 4.4Å; Y139-K152 HydrophobicContact CE1-CD 3.61Å; Y139-K152 HydrophobicContact CE1-CG 3.84Å; Y139-K152 WeakPolarHBondContact OH-CE 3.33Å; Y139-K152 PolarHBondContact OH-NZ 2.91Å
140	D	97.6	Very high	95.3	Very high	12 Å²	12	69.6 Å²	69.6	6%	0.064	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	106	-175.5	-75.2	-0.1	0	0	0	107.5	L95 T97 V127 I138 V150 E151	L95-D140 HydrophobicContact CD2-CB 3.99Å; T97-D140 VanDerWaalsContact CG2-OD1 3.25Å; T97-D140 WeakPolarHBondContact CG2-OD1 3.27Å; T97-D140 VanDerWaalsContact CG2-OD2 3.26Å; T97-D140 WeakPolarHBondContact CG2-OD2 3.47Å; T97-D140 PolarHBondContact OG1-OD2 3.22Å; V127-D140 WeakPolarHBondContact CG2-OD1 3.36Å; I138-D140 WeakPolarHBondContact CG2-OD1 3.48Å; D140-V150 VanDerWaalsContact O-CA 3.31Å; D140-V150 WeakPolarHBondContact O-CA 3.42Å; D140-E151 HydrophobicContact CB-CB 4.17Å; D140-E151 PolarHBondContact N-O 3.43Å; D140-E151 PolarHBondContact O-N 2.83Å
141	Y	98.1	Very high	95.4	Very high	56 Å²	56	73.1 Å²	73.1	22%	0.22	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	130	-178.6	-70.5	-95.9	0	0	0	110.2	S125 F126 L128 Y139 V148 K149 V150	S125-Y141 WeakPolarHBondContact CA-O 3.46Å; S125-Y141 WeakPolarHBondContact CB-O 3.43Å; F126-Y141 HydrophobicContact CD1-CG 4.49Å; F126-Y141 HydrophobicContact CD2-CD2 4.11Å; F126-Y141 HydrophobicContact CD2-CG 4.47Å; F126-Y141 VanDerWaalsContact CE1-CB 3.41Å; F126-Y141 HydrophobicContact CE1-CD1 4.31Å; F126-Y141 HydrophobicContact CE1-CD2 4.33Å; F126-Y141 AromaticContact CE1-CG 3.79Å; F126-Y141 HydrophobicContact CE1-CG 3.79Å; F126-Y141 AromaticContact CE2-CD2 3.44Å; F126-Y141 HydrophobicContact CE2-CD2 3.44Å; F126-Y141 VanDerWaalsContact CE2-CD2 3.44Å; F126-Y141 AromaticContact CE2-CE2 3.99Å; F126-Y141 HydrophobicContact CE2-CE2 3.99Å; F126-Y141 AromaticContact CE2-CG 3.76Å; F126-Y141 HydrophobicContact CE2-CG 3.76Å; F126-Y141 AromaticContact CZ-CD1 3.82Å; F126-Y141 HydrophobicContact CZ-CD1 3.82Å; F126-Y141 AromaticContact CZ-CD2 3.58Å; F126-Y141 HydrophobicContact CZ-CD2 3.58Å; F126-Y141 HydrophobicContact CZ-CE1 4.44Å; F126-Y141 HydrophobicContact CZ-CE2 4.21Å; F126-Y141 AromaticContact CZ-CG 3.36Å; F126-Y141 HydrophobicContact CZ-CG 3.36Å; F126-Y141 PolarHBondContact N-O 3.15Å; F126-Y141 VanDerWaalsContact N-O 3.1Å; F126-Y141 PolarHBondContact O-N 2.81Å; L128-Y141 HydrophobicContact CB-CD2 4.47Å; L128-Y141 HydrophobicContact CB-CE2 3.9Å; Y139-Y141 WeakPolarHBondContact O-CD2 3.49Å; Y141-V148 HydrophobicContact CD1-CG1 3.86Å; Y141-K149 WeakPolarHBondContact CA-O 3.44Å; Y141-V150 HydrophobicContact CD1-CB 4.49Å; Y141-V150 HydrophobicContact CD1-CG1 4.34Å; Y141-V150 HydrophobicContact CD1-CG2 3.53Å; Y141-V150 HydrophobicContact CE1-CB 4.37Å; Y141-V150 HydrophobicContact CE1-CG1 4.02Å; Y141-V150 HydrophobicContact CE1-CG2 3.4Å; Y141-V150 VanDerWaalsContact CE1-CG2 3.4Å; Y141-V150 HydrophobicContact CE2-CG1 4.36Å; Y141-V150 HydrophobicContact CG-CG2 4.41Å
142	Q	98.1	Very high	95.5	Very high	53 Å²	53	76.6 Å²	76.6	25%	0.248	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	144.8	175.1	-64.6	-167.8	-66.5	0	0	111.3	L95 I123 P124 V144 V148 K149	L95-Q142 HydrophobicContact CD2-CG 3.33Å; I123-Q142 HydrophobicContact CG2-CB 3.95Å; I123-Q142 HydrophobicContact CG2-CG 4.42Å; P124-Q142 WeakPolarHBondContact O-CA 3.29Å; Q142-V144 HydrophobicContact CB-CG2 4.15Å; Q142-V148 CarbonylContact O-C 3.58Å; Q142-V148 WeakPolarHBondContact O-CA 3.31Å; Q142-K149 PolarHBondContact N-O 2.95Å; Q142-K149 PolarHBondContact O-N 2.96Å
143	L	98	Very high	95.5	Very high	71 Å²	71	73.7 Å²	73.7	37%	0.372	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	101.7	171.2	-174.2	66.1	0	0	0	110.2	I123 P124 V148	I123-L143 WeakPolarHBondContact CG2-O 3.42Å; P124-L143 HydrophobicContact CB-CB 4.01Å; P124-L143 HydrophobicContact CG-CB 4.25Å; P124-L143 HydrophobicContact CG-CD2 4.32Å; P124-L143 PolarHBondContact O-N 3.16Å; L143-V148 HydrophobicContact CD1-CG2 4.23Å
144	V	96.2	Very high	95.6	Very high	29 Å²	29	72.4 Å²	72.4	18%	0.176	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.5	-178.7	-177.4	0	0	0	0	109	I123 Q142 N146 E147 K149	I123-V144 HydrophobicContact CD1-CG2 4.41Å; I123-V144 HydrophobicContact CG2-CG2 4.04Å; Q142-V144 HydrophobicContact CB-CG2 4.15Å; V144-N146 VanDerWaalsContact C-N 3.29Å; V144-N146 PolarHBondContact O-N 3.28Å; V144-E147 PolarHBondContact N-O 3.35Å; V144-E147 PolarHBondContact O-N 3.24Å; V144-E147 VanDerWaalsContact O-O 3.12Å; V144-K149 HydrophobicContact CB-CD 4Å; V144-K149 HydrophobicContact CB-CG 4.39Å; V144-K149 HydrophobicContact CG2-CD 4.07Å
145	N	94	Very high	95.4	Very high	147 Å²	147	70.9 Å²	70.9	79%	0.786	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	41.8	-178.7	-57.4	-25.8	0	0	0	113.6	E147	N145-E147 PolarHBondContact O-N 3.21Å
146	N	92.3	Very high	95.3	Very high	153 Å²	153	75.7 Å²	75.7	82%	0.818	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	9	-174.7	-58.3	-38.7	0	0	0	115.6	V144	V144-N146 VanDerWaalsContact C-N 3.29Å; V144-N146 PolarHBondContact O-N 3.28Å
147	E	96.3	Very high	94.8	Very high	136 Å²	136	78.7 Å²	78.7	64%	0.636	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	139	173.7	-64.4	-174.7	161.3	0	0	110.5	V144 N145 K149	V144-E147 PolarHBondContact N-O 3.35Å; V144-E147 PolarHBondContact O-N 3.24Å; V144-E147 VanDerWaalsContact O-O 3.12Å; N145-E147 PolarHBondContact O-N 3.21Å; E147-K149 PolarHBondContact O-N 2.93Å
148	V	96	Very high	94	Very high	98 Å²	98	86.4 Å²	86.4	59%	0.594	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	115.4	175.9	179.4	0	0	0	0	108.7	Y141 Q142 L143 V150	Y141-V148 HydrophobicContact CD1-CG1 3.86Å; Q142-V148 CarbonylContact O-C 3.58Å; Q142-V148 WeakPolarHBondContact O-CA 3.31Å; L143-V148 HydrophobicContact CD1-CG2 4.23Å; V148-V150 HydrophobicContact CG1-CG2 4.27Å
149	K	97.1	Very high	93.9	Very high	110 Å²	110	90.7 Å²	90.7	48%	0.478	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	144.4	170.3	-64.4	-170.6	178.4	-178.5	0	109.8	Y141 Q142 V144 E147	Y141-K149 WeakPolarHBondContact CA-O 3.44Å; Q142-K149 PolarHBondContact N-O 2.95Å; Q142-K149 PolarHBondContact O-N 2.96Å; V144-K149 HydrophobicContact CB-CD 4Å; V144-K149 HydrophobicContact CB-CG 4.39Å; V144-K149 HydrophobicContact CG2-CD 4.07Å; E147-K149 PolarHBondContact O-N 2.93Å
150	V	97	Very high	93.7	Very high	75 Å²	75	93 Å²	93	46%	0.455	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	122.3	179.7	-168.8	0	0	0	0	109.1	Y139 D140 Y141 V148	Y139-V150 HydrophobicContact CD1-CG1 4.33Å; D140-V150 VanDerWaalsContact O-CA 3.31Å; D140-V150 WeakPolarHBondContact O-CA 3.42Å; Y141-V150 HydrophobicContact CD1-CB 4.49Å; Y141-V150 HydrophobicContact CD1-CG1 4.34Å; Y141-V150 HydrophobicContact CD1-CG2 3.53Å; Y141-V150 HydrophobicContact CE1-CB 4.37Å; Y141-V150 HydrophobicContact CE1-CG1 4.02Å; Y141-V150 HydrophobicContact CE1-CG2 3.4Å; Y141-V150 VanDerWaalsContact CE1-CG2 3.4Å; Y141-V150 HydrophobicContact CE2-CG1 4.36Å; Y141-V150 HydrophobicContact CG-CG2 4.41Å; V148-V150 HydrophobicContact CG1-CG2 4.27Å
151	E	96.5	Very high	93.5	Very high	129 Å²	129	97.5 Å²	97.5	60%	0.603	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	147.9	167.3	-63	-171.7	176.4	0	0	109.7	Y139 D140	Y139-E151 CarbonylContact C-O 3.53Å; Y139-E151 WeakPolarHBondContact CA-O 3.38Å; D140-E151 HydrophobicContact CB-CB 4.17Å; D140-E151 PolarHBondContact N-O 3.43Å; D140-E151 PolarHBondContact O-N 2.83Å
152	K	95.4	Very high	93.2	Very high	125 Å²	125	99.9 Å²	99.9	54%	0.543	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	126.2	-177.5	-176.5	-179.5	179.2	164.8	0	110.4	I138 Y139	I138-K152 CarbonylContact O-C 3.18Å; I138-K152 WeakPolarHBondContact O-CA 3.28Å; Y139-K152 HydrophobicContact CD1-CB 4.31Å; Y139-K152 HydrophobicContact CD1-CD 4.34Å; Y139-K152 HydrophobicContact CD1-CG 4.11Å; Y139-K152 HydrophobicContact CE1-CB 4.4Å; Y139-K152 HydrophobicContact CE1-CD 3.61Å; Y139-K152 HydrophobicContact CE1-CG 3.84Å; Y139-K152 WeakPolarHBondContact OH-CE 3.33Å; Y139-K152 PolarHBondContact OH-NZ 2.91Å
153	A	92.4	Very high	92.9	Very high	37 Å²	37	102.9 Å²	102.9	31%	0.306	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	167.8	168.9	0	0	0	0	0	110.9	F137 I138	F137-A153 WeakPolarHBondContact CA-O 3.39Å; I138-A153 HydrophobicContact CB-CB 4.38Å; I138-A153 PolarHBondContact N-O 3.25Å; I138-A153 PolarHBondContact O-N 2.88Å
154	Q	92.5	Very high	92.6	Very high	138 Å²	138	105 Å²	105	65%	0.645	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.9	145.7	172	69.9	176.6	14.5	0	0	111	V136 F137	V136-Q154 CarbonylContact O-C 3.42Å; V136-Q154 WeakPolarHBondContact O-CA 3.41Å; F137-Q154 HydrophobicContact CD1-CB 3.82Å; F137-Q154 HydrophobicContact CE1-CB 4.01Å
155	Y	89.5	Confident	92.3	Very high	8 Å²	8	110.4 Å²	110.4	3%	0.031	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.3	129.2	173.8	171.4	-107.8	0	0	0	109.8	F56 K99 G102 F104 V135 V136	F56-Y155 HydrophobicContact CD1-CD1 4.47Å; F56-Y155 HydrophobicContact CD1-CE1 4.19Å; F56-Y155 AromaticContact CE1-CD1 3.71Å; F56-Y155 HydrophobicContact CE1-CD1 3.71Å; F56-Y155 AromaticContact CE1-CE1 3.61Å; F56-Y155 HydrophobicContact CE1-CE1 3.61Å; K99-Y155 HydrophobicContact CD-CD2 4.04Å; K99-Y155 HydrophobicContact CD-CE2 4.24Å; K99-Y155 HydrophobicContact CG-CD2 4.45Å; K99-Y155 HydrophobicContact CG-CE2 4.48Å; G102-Y155 VanDerWaalsContact O-CE2 3.29Å; G102-Y155 WeakPolarHBondContact O-CE2 3.46Å; G102-Y155 VanDerWaalsContact O-CZ 3.28Å; G102-Y155 PolarHBondContact O-OH 2.9Å; F104-Y155 HydrophobicContact CB-CD1 4.29Å; F104-Y155 HydrophobicContact CB-CD2 4.5Å; F104-Y155 HydrophobicContact CB-CE1 4.48Å; F104-Y155 HydrophobicContact CB-CG 4.31Å; F104-Y155 AromaticContact CD2-CD2 3.97Å; F104-Y155 HydrophobicContact CD2-CD2 3.97Å; F104-Y155 AromaticContact CD2-CG 3.97Å; F104-Y155 HydrophobicContact CD2-CG 3.97Å; F104-Y155 HydrophobicContact CG-CG 4.32Å; V135-Y155 CarbonylContact C-O 3.6Å; V135-Y155 WeakPolarHBondContact CA-O 3.49Å; V136-Y155 HydrophobicContact CG1-CD1 3.82Å; V136-Y155 HydrophobicContact CG1-CG 4.32Å; V136-Y155 PolarHBondContact N-O 2.93Å; V136-Y155 PolarHBondContact O-N 3.18Å
156	K	90.6	Very high	92.2	Very high	133 Å²	133	107.6 Å²	107.6	58%	0.578	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.1	174.2	-177	174.6	179	-179.3	0	108.9	S134 V135 V158	S134-K156 CarbonylContact O-C 3.59Å; S134-K156 WeakPolarHBondContact O-CA 3.48Å; V135-K156 HydrophobicContact CG2-CB 4.27Å; V135-K156 HydrophobicContact CG2-CD 4.42Å; V135-K156 HydrophobicContact CG2-CG 4.08Å; K156-V158 PolarHBondContact O-N 3.32Å
157	K	84.8	Confident	92.2	Very high	63 Å²	63	103.8 Å²	103.8	27%	0.274	53%	0.527	S	S	.	.			trans	-67.7	123.1	169.2	-167.7	165.6	177.4	169	0	108.1	H55 F56 D85 S134	H55-K157 PolarHBondContact O-NZ 2.88Å; F56-K157 HydrophobicContact CD1-CD 4.34Å; F56-K157 HydrophobicContact CE1-CB 3.76Å; F56-K157 HydrophobicContact CE1-CD 4.36Å; F56-K157 HydrophobicContact CZ-CB 4.03Å; D85-K157 IonicContact OD1-NZ 3.91Å; D85-K157 PolarHBondContact OD1-NZ 3.24Å; D85-K157 IonicContact OD2-NZ 2.84Å; D85-K157 PolarHBondContact OD2-NZ 2.98Å; S134-K157 PolarHBondContact O-N 2.9Å
158	V	78.6	Confident	91.8	Very high	194 Å²	194	100.9 Å²	100.9	100%	1.176	52%	0.517	S	S	*	.			trans	-87.3	0	174.5	-176.4	0	0	0	0	108.6	K156	K156-V158 PolarHBondContact O-N 3.32Å

Retrieved 158 of 158 residues in 78.3 ms (Link to these results)

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