A0A087XJR0_POEFO Loading...

Rho GDP-dissociation inhibitor 1

Controls Rho proteins homeostasis. Regulates the GDP/GTP exchange reaction of the Rho proteins by inhibiting the dissociation of GDP from them, and the subsequent binding of GTP to them. Retains Rho proteins such as CDC42, RAC1 and RHOA in an inactive cytosolic pool, regulating their stability and protecting them from degradation. Actively involved in the recycling and distribution of activated Rho GTPases in the cell, mediates extraction from membranes of both inactive and activated molecules due its exceptionally high affinity for prenylated forms. Through the modulation of Rho proteins, may play a role in cell motility regulation. In glioma cells, inhibits cell migration and invasion by mediating the signals of SEMA5A and PLXNB3 that lead to inactivation of RAC1.

AlphaFold DB , UniProt , Accession A0A087XJR0, Species POEFO (Poecilia formosa, Amazon molly), Gene ARHGDIA, Length 205 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.9	Very low	69.2	Low	234 Å²	234	101.4 Å²	101.4	100%	1.153	54%	0.538	S	S	*	.				0	123.9	0	-79.6	-174.7	-93.4	0	0	106.4	E3	M1-E3 PolarHBondContact O-N 2.66Å
2	A	42.2	Very low	70.6	Confident	87 Å²	87	104.8 Å²	104.8	72%	0.719	55%	0.545	S	S	*	.			trans	-61.7	123.4	-177.2	0	0	0	0	0	109.6	Q4 M170	A2-Q4 PolarHBondContact O-N 3.34Å; A2-M170 WeakPolarHBondContact O-CE 3.4Å
3	E	49.6	Very low	71.8	Confident	166 Å²	166	107.2 Å²	107.2	78%	0.776	55%	0.552	S	S	*	*			trans	-57.3	106.7	161.8	-63.7	179.6	136	0	0	105.7	M1 D5	M1-E3 PolarHBondContact O-N 2.66Å; E3-D5 VanDerWaalsContact C-N 3.29Å; E3-D5 PolarHBondContact O-N 2.6Å
4	Q	57.1	Low	72.8	Confident	140 Å²	140	104.2 Å²	104.2	65%	0.654	54%	0.536	S	S	*	.			trans	-69	101.8	168.4	-89.2	-175	-3.3	0	0	106.1	A2 L6 M170	A2-Q4 PolarHBondContact O-N 3.34Å; Q4-L6 PolarHBondContact O-N 2.82Å; Q4-M170 HydrophobicContact CB-CE 4.35Å
5	D	68.1	Low	73.6	Confident	110 Å²	110	98.9 Å²	98.9	59%	0.588	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-60	117	176.2	-89.6	-27.8	0	0	0	109.6	E3 T7 K135	E3-D5 VanDerWaalsContact C-N 3.29Å; E3-D5 PolarHBondContact O-N 2.6Å; D5-T7 PolarHBondContact O-N 2.97Å; D5-K135 VanDerWaalsContact CB-NZ 3.31Å; D5-K135 IonicContact OD1-NZ 2.7Å; D5-K135 PolarHBondContact OD1-NZ 2.8Å; D5-K135 IonicContact OD2-NZ 2.69Å; D5-K135 PolarHBondContact OD2-NZ 2.88Å
6	L	77.9	Confident	74.3	Confident	10 Å²	10	96.7 Å²	96.7	5%	0.052	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-50.7	134.4	172.5	-80.9	177.2	0	0	0	110.4	Q4 Q10 L11 I14 L171	Q4-L6 PolarHBondContact O-N 2.82Å; L6-Q10 HydrophobicContact CD2-CB 3.94Å; L6-L11 HydrophobicContact CB-CD2 4.24Å; L6-L11 HydrophobicContact CB-CG 4.16Å; L6-L11 HydrophobicContact CD1-CD2 3.64Å; L6-L11 HydrophobicContact CD1-CG 4.38Å; L6-I14 HydrophobicContact CD1-CD1 4.26Å; L6-L171 WeakPolarHBondContact CD1-O 3.48Å; L6-L171 HydrophobicContact CD2-CB 4.06Å; L6-L171 HydrophobicContact CD2-CD1 4.47Å; L6-L171 HydrophobicContact CD2-CD2 3.78Å; L6-L171 HydrophobicContact CD2-CG 4.3Å
7	T	84.5	Confident	74.9	Confident	61 Å²	61	95.7 Å²	95.7	37%	0.374	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-72.5	156.3	175.1	72.6	0	0	0	0	110.4	D5 E9 Q10 L11	D5-T7 PolarHBondContact O-N 2.97Å; T7-E9 PolarHBondContact O-N 3.46Å; T7-Q10 PolarHBondContact O-N 3.04Å; T7-Q10 WeakPolarHBondContact OG1-CG 3.35Å; T7-Q10 PolarHBondContact OG1-N 3.36Å; T7-L11 PolarHBondContact O-N 3.38Å; T7-L11 VanDerWaalsContact O-N 3.13Å
8	P	84.2	Confident	75.4	Confident	90 Å²	90	94.3 Å²	94.3	58%	0.584	52%	0.515	S	S	*	.	H	α-helix	trans	-57	-29.9	173.2	-26	35.4	0	0	0	113.5	K12	P8-K12 WeakPolarHBondContact O-CG 3.38Å; P8-K12 PolarHBondContact O-N 3.36Å; P8-K12 VanDerWaalsContact O-N 3.17Å
9	E	85.9	Confident	75.6	Confident	145 Å²	145	97.3 Å²	97.3	68%	0.678	53%	0.525	S	S	*	.	H	α-helix	trans	-69.1	-47.2	177.7	-65.4	-179.2	159.5	0	0	111.1	T7 L11 K12 E13	T7-E9 PolarHBondContact O-N 3.46Å; E9-L11 VanDerWaalsContact C-N 3.29Å; E9-L11 PolarHBondContact O-N 2.95Å; E9-K12 WeakPolarHBondContact O-CB 3.44Å; E9-K12 PolarHBondContact O-N 2.99Å; E9-E13 PolarHBondContact O-N 3.01Å
10	Q	86.1	Confident	75.1	Confident	68 Å²	68	100.8 Å²	100.8	32%	0.318	54%	0.538	S	S	.	.	H	α-helix	trans	-61.3	-37.7	176.4	-68.6	173.8	-46.8	0	0	112.2	L6 T7 K12 E13 I14	L6-Q10 HydrophobicContact CD2-CB 3.94Å; T7-Q10 PolarHBondContact O-N 3.04Å; T7-Q10 WeakPolarHBondContact OG1-CG 3.35Å; T7-Q10 PolarHBondContact OG1-N 3.36Å; Q10-K12 VanDerWaalsContact C-N 3.32Å; Q10-K12 PolarHBondContact O-N 3.48Å; Q10-E13 PolarHBondContact O-N 2.94Å; Q10-I14 WeakPolarHBondContact O-CG1 3.43Å; Q10-I14 PolarHBondContact O-N 3.01Å
11	L	85.8	Confident	74.3	Confident	4 Å²	4	105.4 Å²	105.4	2%	0.021	55%	0.553	C	S	.	*	H	α-helix	trans	-65	-36.3	175.1	-70.5	172.6	0	0	0	112.4	L6 T7 E9 A15 R134 K135 V137 V139	L6-L11 HydrophobicContact CB-CD2 4.24Å; L6-L11 HydrophobicContact CB-CG 4.16Å; L6-L11 HydrophobicContact CD1-CD2 3.64Å; L6-L11 HydrophobicContact CD1-CG 4.38Å; T7-L11 PolarHBondContact O-N 3.38Å; T7-L11 VanDerWaalsContact O-N 3.13Å; E9-L11 VanDerWaalsContact C-N 3.29Å; E9-L11 PolarHBondContact O-N 2.95Å; L11-A15 WeakPolarHBondContact O-CB 3.49Å; L11-A15 PolarHBondContact O-N 2.94Å; L11-R134 HydrophobicContact CD2-CB 4.01Å; L11-R134 HydrophobicContact CD2-CG 4.03Å; L11-K135 HydrophobicContact CD1-CB 4.26Å; L11-V137 HydrophobicContact CB-CB 4.24Å; L11-V137 HydrophobicContact CB-CG1 4.13Å; L11-V137 HydrophobicContact CB-CG2 4.36Å; L11-V137 HydrophobicContact CD1-CB 4.38Å; L11-V137 HydrophobicContact CD1-CG2 4.15Å; L11-V139 HydrophobicContact CD2-CG1 3.86Å
12	K	85.9	Confident	75.1	Confident	142 Å²	142	102.3 Å²	102.3	62%	0.617	54%	0.536	S	S	*	.	H	α-helix	trans	-70.2	-38.3	175.4	-74.8	176.2	-179.4	-178.1	0	112.1	P8 E9 Q10 A15 A16	P8-K12 WeakPolarHBondContact O-CG 3.38Å; P8-K12 PolarHBondContact O-N 3.36Å; P8-K12 VanDerWaalsContact O-N 3.17Å; E9-K12 WeakPolarHBondContact O-CB 3.44Å; E9-K12 PolarHBondContact O-N 2.99Å; Q10-K12 VanDerWaalsContact C-N 3.32Å; Q10-K12 PolarHBondContact O-N 3.48Å; K12-A15 PolarHBondContact O-N 3.1Å; K12-A16 WeakPolarHBondContact O-CB 3.33Å; K12-A16 PolarHBondContact O-N 3.19Å
13	E	86.1	Confident	75.8	Confident	137 Å²	137	102.3 Å²	102.3	64%	0.64	53%	0.531	S	S	*	.	H	α-helix	trans	-62.1	-43.6	174.8	-72	177.2	172.4	0	0	111.4	E9 Q10 A16 A17	E9-E13 PolarHBondContact O-N 3.01Å; Q10-E13 PolarHBondContact O-N 2.94Å; E13-A16 PolarHBondContact O-N 3.47Å; E13-A17 WeakPolarHBondContact O-CB 3.39Å; E13-A17 PolarHBondContact O-N 3.3Å
14	I	85.5	Confident	76.1	Confident	65 Å²	65	102.7 Å²	102.7	33%	0.333	54%	0.538	S	S	.	.	H	α-helix	trans	-60.2	-47.2	173.6	-66.1	164.9	0	0	0	110.5	L6 Q10 A16 A17 N18 V139	L6-I14 HydrophobicContact CD1-CD1 4.26Å; Q10-I14 WeakPolarHBondContact O-CG1 3.43Å; Q10-I14 PolarHBondContact O-N 3.01Å; I14-A16 VanDerWaalsContact C-N 3.31Å; I14-A16 PolarHBondContact O-N 3.47Å; I14-A17 PolarHBondContact O-N 3.48Å; I14-N18 PolarHBondContact O-N 3.3Å; I14-V139 HydrophobicContact CG2-CB 4.15Å
15	A	85.3	Confident	76.8	Confident	25 Å²	25	102.4 Å²	102.4	21%	0.207	54%	0.54	C	S	.	.	H	α-helix	trans	-59.7	-41.2	178.9	0	0	0	0	0	112.4	L11 K12 N18 E19 K138	L11-A15 WeakPolarHBondContact O-CB 3.49Å; L11-A15 PolarHBondContact O-N 2.94Å; K12-A15 PolarHBondContact O-N 3.1Å; A15-N18 PolarHBondContact O-N 2.85Å; A15-E19 PolarHBondContact O-N 2.61Å; A15-K138 WeakPolarHBondContact CB-O 3.43Å
16	A	85.4	Confident	77.5	Confident	63 Å²	63	103.5 Å²	103.5	52%	0.521	55%	0.546	S	S	.	.	H	α-helix	trans	-69.8	-34.2	177.8	0	0	0	0	0	112.4	K12 E13 I14 N18 E19	K12-A16 WeakPolarHBondContact O-CB 3.33Å; K12-A16 PolarHBondContact O-N 3.19Å; E13-A16 PolarHBondContact O-N 3.47Å; I14-A16 VanDerWaalsContact C-N 3.31Å; I14-A16 PolarHBondContact O-N 3.47Å; A16-N18 VanDerWaalsContact C-N 3.34Å; A16-E19 PolarHBondContact O-N 3.1Å
17	A	84.5	Confident	77.9	Confident	80 Å²	80	109.5 Å²	109.5	66%	0.661	57%	0.568	S	S	*	*	H	α-helix	trans	-69.5	-32.9	176.3	0	0	0	0	0	112.6	E13 I14	E13-A17 WeakPolarHBondContact O-CB 3.39Å; E13-A17 PolarHBondContact O-N 3.3Å; I14-A17 PolarHBondContact O-N 3.48Å
18	N	83.3	Confident	78.1	Confident	70 Å²	70	114 Å²	114	37%	0.374	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.5	2.9	178.2	-66.6	-16.9	0	0	0	113.2	I14 A15 A16 E20 V139	I14-N18 PolarHBondContact O-N 3.3Å; A15-N18 PolarHBondContact O-N 2.85Å; A16-N18 VanDerWaalsContact C-N 3.34Å; N18-E20 PolarHBondContact O-N 3.42Å; N18-V139 PolarHBondContact ND2-O 2.7Å
19	E	79.3	Confident	78.4	Confident	152 Å²	152	112.9 Å²	112.9	71%	0.71	58%	0.576	S	S	*	*			trans	-74.1	95.2	177.8	-166	166.3	-151.3	0	0	109.4	A15 A16 K21	A15-E19 PolarHBondContact O-N 2.61Å; A16-E19 PolarHBondContact O-N 3.1Å; E19-K21 PolarHBondContact O-N 2.59Å
20	E	65.4	Low	78.6	Confident	167 Å²	167	109.1 Å²	109.1	78%	0.78	56%	0.564	S	S	*	*			trans	-65.4	126.5	169.7	-64.6	-164.5	158.3	0	0	109.6	N18 E22	N18-E20 PolarHBondContact O-N 3.42Å; E20-E22 PolarHBondContact O-N 3.06Å
21	K	58	Low	78.8	Confident	198 Å²	198	109.9 Å²	109.9	86%	0.861	58%	0.582	S	S	*	*			trans	-66.2	115.6	170.1	-68.2	-179.7	-177.3	176.8	0	107.4	E19 S23	E19-K21 PolarHBondContact O-N 2.59Å; K21-S23 PolarHBondContact O-N 2.69Å
22	E	57	Low	78.9	Confident	169 Å²	169	115.6 Å²	115.6	79%	0.79	61%	0.609	S	S	*	*			trans	-50.9	111.5	169.7	-79.9	-174.5	166.8	0	0	108.1	E20 D24	E20-E22 PolarHBondContact O-N 3.06Å; E22-D24 PolarHBondContact O-N 3.42Å
23	S	56.7	Low	79.1	Confident	87 Å²	87	114.3 Å²	114.3	61%	0.608	60%	0.603	S	S	*	*			trans	-65.3	119.5	170.6	53.4	0	0	0	0	106.9	K21 I25	K21-S23 PolarHBondContact O-N 2.69Å; S23-I25 PolarHBondContact O-N 3.27Å; S23-I25 WeakPolarHBondContact OG-CD1 3.28Å
24	D	57.2	Low	79.3	Confident	174 Å²	174	109.4 Å²	109.4	93%	0.93	58%	0.583	S	S	*	*			trans	-63.7	59.6	175.1	-98	-43.9	0	0	0	111.7	E22 N26	E22-D24 PolarHBondContact O-N 3.42Å; D24-N26 PolarHBondContact O-N 2.8Å
25	I	70.9	Confident	79.3	Confident	133 Å²	133	107.1 Å²	107.1	68%	0.682	57%	0.572	S	S	*	*			trans	-87.8	104.7	172.9	-47.6	173.6	0	0	0	105.6	S23 Y27	S23-I25 PolarHBondContact O-N 3.27Å; S23-I25 WeakPolarHBondContact OG-CD1 3.28Å; I25-Y27 PolarHBondContact O-N 2.91Å
26	N	83.4	Confident	79.5	Confident	134 Å²	134	112.6 Å²	112.6	72%	0.717	59%	0.593	S	S	*	*			trans	-74.1	58.2	-179.1	-171.8	19.9	0	0	0	112	D24	D24-N26 PolarHBondContact O-N 2.8Å
27	Y	86.1	Confident	79.7	Confident	135 Å²	135	114.2 Å²	114.2	53%	0.529	59%	0.59	S	S	.	*			trans	-65.7	131.6	171.4	176	-103.8	0	0	0	109.7	I25 P29 P30 D185	I25-Y27 PolarHBondContact O-N 2.91Å; Y27-P29 HydrophobicContact CE1-CG 4.35Å; Y27-P30 WeakPolarHBondContact OH-CD 3.44Å; Y27-D185 WeakPolarHBondContact CE1-OD2 3.4Å; Y27-D185 PolarHBondContact OH-OD2 3.24Å
28	K	88.7	Confident	79.8	Confident	156 Å²	156	112.2 Å²	112.2	68%	0.678	57%	0.568	S	S	*	*			trans	-109.5	118.3	175.1	-65.9	-175.5	-179	-178.7	0	108.6
29	P	89.7	Confident	79.9	Confident	67 Å²	67	112.7 Å²	112.7	44%	0.435	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-49.7	144.4	173	-32.2	38.5	0	0	0	112.4	Y27 D185	Y27-P29 HydrophobicContact CE1-CG 4.35Å; P29-D185 HydrophobicContact CB-CB 4.01Å; P29-D185 HydrophobicContact CG-CB 4.13Å
30	P	90.6	Very high	80.4	Confident	65 Å²	65	112 Å²	112	42%	0.422	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-63.4	158.6	173.7	29.6	-35.3	0	0	0	110.8	Y27	Y27-P30 WeakPolarHBondContact OH-CD 3.44Å
31	A	90.5	Very high	81.6	Confident	85 Å²	85	107.5 Å²	107.5	70%	0.702	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-66.5	136.5	169.3	0	0	0	0	0	109.8	K33	A31-K33 PolarHBondContact O-N 3.28Å
32	Q	88.2	Confident	83.1	Confident	124 Å²	124	102.7 Å²	102.7	58%	0.579	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-60.3	129.8	174.7	-69.2	-174.4	-19.4	0	0	110.3	D186	Q32-D186 WeakPolarHBondContact CG-OD1 3.18Å; Q32-D186 PolarHBondContact NE2-OD1 3.2Å
33	K	89.4	Confident	84.6	Confident	115 Å²	115	101.2 Å²	101.2	50%	0.5	52%	0.52	S	S	.	.			trans	-141.3	136.5	171.5	-70.6	-170.2	176.2	-173.6	0	108.6	A31 I38 L41	A31-K33 PolarHBondContact O-N 3.28Å; K33-I38 HydrophobicContact CB-CD1 4.3Å; K33-I38 HydrophobicContact CB-CG1 4.08Å; K33-L41 HydrophobicContact CD-CD1 4.24Å
34	S	89.6	Confident	86.2	Confident	33 Å²	33	105 Å²	105	23%	0.231	53%	0.533	C	S	.	.			trans	-71	158.7	172.9	64.9	0	0	0	0	111.4	Q36 E37 I38 E121	S34-Q36 PolarHBondContact O-N 3.42Å; S34-E37 WeakPolarHBondContact CB-OE2 3.34Å; S34-E37 PolarHBondContact N-OE2 2.91Å; S34-E37 PolarHBondContact O-N 3.09Å; S34-E37 VanDerWaalsContact OG-CG 3.24Å; S34-E37 WeakPolarHBondContact OG-CG 3.41Å; S34-E37 PolarHBondContact OG-N 3.34Å; S34-E37 PolarHBondContact OG-OE2 3.31Å; S34-I38 WeakPolarHBondContact O-CG1 3.27Å; S34-I38 PolarHBondContact O-N 2.95Å; S34-E121 WeakPolarHBondContact CA-OE2 3.12Å
35	L	87.1	Confident	88	Confident	17 Å²	17	99.8 Å²	99.8	9%	0.089	51%	0.506	C	S	.	.	H	α-helix	trans	-57	-37.2	171.4	-78.8	163.4	0	0	0	112.9	I38 Q39 L56 K120 E121 I122 P151	L35-I38 PolarHBondContact O-N 3.3Å; L35-Q39 VanDerWaalsContact O-CG 3.3Å; L35-Q39 WeakPolarHBondContact O-CG 3.24Å; L35-Q39 PolarHBondContact O-N 3.08Å; L35-L56 HydrophobicContact CD2-CD1 3.75Å; L35-L56 HydrophobicContact CD2-CD2 3.77Å; L35-L56 HydrophobicContact CD2-CG 4.26Å; L35-K120 WeakPolarHBondContact CD1-O 3.41Å; L35-E121 WeakPolarHBondContact CG-OE2 3.3Å; L35-E121 PolarHBondContact N-OE2 2.98Å; L35-I122 HydrophobicContact CD2-CD1 3.85Å; L35-I122 HydrophobicContact CD2-CG1 3.54Å; L35-I122 HydrophobicContact CG-CG1 4.08Å; L35-P151 HydrophobicContact CD1-CG 3.52Å; L35-P151 HydrophobicContact CD2-CG 4.49Å
36	Q	87.6	Confident	89.1	Confident	141 Å²	141	98.5 Å²	98.5	66%	0.659	50%	0.497	S	S	*	.	H	α-helix	trans	-63	-49.5	178.4	-67.5	-175.5	-2.1	0	0	110.4	S34 I38 Q39 E40	S34-Q36 PolarHBondContact O-N 3.42Å; Q36-I38 VanDerWaalsContact C-N 3.28Å; Q36-I38 PolarHBondContact O-N 2.7Å; Q36-Q39 PolarHBondContact O-N 2.69Å; Q36-Q39 VanDerWaalsContact O-N 3.09Å; Q36-E40 WeakPolarHBondContact O-CG 3.21Å; Q36-E40 PolarHBondContact O-N 3.21Å
37	E	89.8	Confident	89.6	Confident	97 Å²	97	95.8 Å²	95.8	45%	0.453	49%	0.488	S	S	.	.	H	α-helix	trans	-59	-41.5	175.4	-69.8	167.1	100.9	0	0	111.5	S34 Q39 E40 L41	S34-E37 WeakPolarHBondContact CB-OE2 3.34Å; S34-E37 PolarHBondContact N-OE2 2.91Å; S34-E37 PolarHBondContact O-N 3.09Å; S34-E37 VanDerWaalsContact OG-CG 3.24Å; S34-E37 WeakPolarHBondContact OG-CG 3.41Å; S34-E37 PolarHBondContact OG-N 3.34Å; S34-E37 PolarHBondContact OG-OE2 3.31Å; E37-Q39 VanDerWaalsContact C-N 3.31Å; E37-Q39 PolarHBondContact O-N 3.28Å; E37-E40 PolarHBondContact O-N 2.84Å; E37-L41 VanDerWaalsContact O-CG 3.24Å; E37-L41 WeakPolarHBondContact O-CG 3.06Å; E37-L41 PolarHBondContact O-N 2.8Å
38	I	87.8	Confident	89.8	Confident	37 Å²	37	92.2 Å²	92.2	19%	0.19	48%	0.478	C	S	.	.	H	α-helix	trans	-62.4	-38.8	177.1	-68.9	168.3	0	0	0	111.3	K33 S34 L35 Q36 K52 L56 I122	K33-I38 HydrophobicContact CB-CD1 4.3Å; K33-I38 HydrophobicContact CB-CG1 4.08Å; S34-I38 WeakPolarHBondContact O-CG1 3.27Å; S34-I38 PolarHBondContact O-N 2.95Å; L35-I38 PolarHBondContact O-N 3.3Å; Q36-I38 VanDerWaalsContact C-N 3.28Å; Q36-I38 PolarHBondContact O-N 2.7Å; I38-K52 HydrophobicContact CG2-CD 4.29Å; I38-K52 WeakPolarHBondContact O-CD 3.34Å; I38-K52 VanDerWaalsContact O-CE 3.27Å; I38-K52 WeakPolarHBondContact O-CE 3.5Å; I38-K52 PolarHBondContact O-NZ 2.92Å; I38-L56 HydrophobicContact CG2-CD1 4.25Å; I38-I122 HydrophobicContact CD1-CD1 3.57Å
39	Q	85.9	Confident	89.9	Confident	81 Å²	81	91.3 Å²	91.3	38%	0.379	47%	0.47	S	S	.	.	H	α-helix	trans	-72.4	-32.9	177.9	-73.5	176	10.7	0	0	113	L35 Q36 E37	L35-Q39 VanDerWaalsContact O-CG 3.3Å; L35-Q39 WeakPolarHBondContact O-CG 3.24Å; L35-Q39 PolarHBondContact O-N 3.08Å; Q36-Q39 PolarHBondContact O-N 2.69Å; Q36-Q39 VanDerWaalsContact O-N 3.09Å; E37-Q39 VanDerWaalsContact C-N 3.31Å; E37-Q39 PolarHBondContact O-N 3.28Å
40	E	89.2	Confident	90	Very high	136 Å²	136	93.7 Å²	93.7	64%	0.636	47%	0.474	S	S	*	.	H	α-helix	trans	-77.1	-28.6	180	-70.8	-171.8	128	0	0	113.3	Q36 E37 D42	Q36-E40 WeakPolarHBondContact O-CG 3.21Å; Q36-E40 PolarHBondContact O-N 3.21Å; E37-E40 PolarHBondContact O-N 2.84Å; E40-D42 PolarHBondContact O-N 3.13Å
41	L	89.6	Confident	90	Very high	73 Å²	73	97.6 Å²	97.6	38%	0.382	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	133	173.5	-72.8	166.4	0	0	0	110.7	K33 E37 K43 K52	K33-L41 HydrophobicContact CD-CD1 4.24Å; E37-L41 VanDerWaalsContact O-CG 3.24Å; E37-L41 WeakPolarHBondContact O-CG 3.06Å; E37-L41 PolarHBondContact O-N 2.8Å; L41-K43 PolarHBondContact O-N 2.8Å; L41-K43 VanDerWaalsContact O-N 3.1Å; L41-K52 PolarHBondContact O-NZ 3.15Å
42	D	90.1	Very high	90	Very high	97 Å²	97	95.1 Å²	95.1	52%	0.519	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	34.8	173.2	-43.9	-64.9	0	0	0	114	E40 D44 D45 L48	E40-D42 PolarHBondContact O-N 3.13Å; D42-D44 PolarHBondContact O-N 3.34Å; D42-D44 VanDerWaalsContact O-N 3.1Å; D42-D45 HydrophobicContact CB-CB 4.3Å; D42-D45 WeakPolarHBondContact O-CB 3.49Å; D42-D45 PolarHBondContact O-N 2.72Å; D42-L48 HydrophobicContact CB-CB 4.49Å; D42-L48 HydrophobicContact CB-CD1 3.51Å
43	K	88.6	Confident	90	Very high	138 Å²	138	94 Å²	94	60%	0.6	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-26.5	-175.2	-171.4	174.7	-177.9	174.4	0	114	L41 D45	L41-K43 PolarHBondContact O-N 2.8Å; L41-K43 VanDerWaalsContact O-N 3.1Å; K43-D45 VanDerWaalsContact C-N 3.33Å
44	D	91.4	Very high	90	Very high	166 Å²	166	92.6 Å²	92.6	89%	0.888	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-11.5	179	-56.1	-50.8	0	0	0	112.9	D42	D42-D44 PolarHBondContact O-N 3.34Å; D42-D44 VanDerWaalsContact O-N 3.1Å
45	D	95	Very high	89.9	Confident	66 Å²	66	96.3 Å²	96.3	35%	0.353	48%	0.476	S	S	.	.			trans	-88	110.2	176.7	-170.3	-49.2	0	0	0	110.8	D42 K43 S47 L48 R49	D42-D45 HydrophobicContact CB-CB 4.3Å; D42-D45 WeakPolarHBondContact O-CB 3.49Å; D42-D45 PolarHBondContact O-N 2.72Å; K43-D45 VanDerWaalsContact C-N 3.33Å; D45-S47 VanDerWaalsContact C-N 3.28Å; D45-S47 PolarHBondContact O-N 2.93Å; D45-S47 WeakPolarHBondContact OD1-CA 3.37Å; D45-S47 WeakPolarHBondContact OD1-CB 3.38Å; D45-S47 PolarHBondContact OD1-N 3.09Å; D45-S47 PolarHBondContact OD1-OG 2.98Å; D45-L48 HydrophobicContact CB-CB 4.12Å; D45-L48 HydrophobicContact CB-CD1 4.12Å; D45-L48 HydrophobicContact CB-CG 4.28Å; D45-L48 PolarHBondContact O-N 2.83Å; D45-L48 PolarHBondContact OD1-N 3.28Å; D45-R49 WeakPolarHBondContact O-CB 3.4Å; D45-R49 PolarHBondContact O-N 3.21Å
46	E	92.4	Very high	89.8	Confident	106 Å²	106	96.8 Å²	96.8	50%	0.495	48%	0.478	S	S	.	.	H	α-helix	trans	-61.5	-36	-179.4	-169.4	-172.3	160.7	0	0	112.8	K50	E46-K50 HydrophobicContact CG-CD 4.38Å; E46-K50 WeakPolarHBondContact O-CG 3.4Å; E46-K50 PolarHBondContact O-N 3.35Å; E46-K50 WeakPolarHBondContact OE1-CE 3.13Å; E46-K50 IonicContact OE1-NZ 2.66Å; E46-K50 PolarHBondContact OE1-NZ 3.42Å
47	S	93.8	Very high	89.5	Confident	77 Å²	77	91.8 Å²	91.8	54%	0.538	47%	0.465	S	S	.	.	H	α-helix	trans	-70.4	-44.6	-177.2	75.5	0	0	0	0	111.1	D45 K50 Y51	D45-S47 VanDerWaalsContact C-N 3.28Å; D45-S47 PolarHBondContact O-N 2.93Å; D45-S47 WeakPolarHBondContact OD1-CA 3.37Å; D45-S47 WeakPolarHBondContact OD1-CB 3.38Å; D45-S47 PolarHBondContact OD1-N 3.09Å; D45-S47 PolarHBondContact OD1-OG 2.98Å; S47-K50 PolarHBondContact O-N 3.21Å; S47-Y51 WeakPolarHBondContact O-CB 3.35Å; S47-Y51 PolarHBondContact O-N 2.68Å
48	L	91.4	Very high	88.5	Confident	60 Å²	60	95.4 Å²	95.4	31%	0.314	48%	0.479	S	S	.	.	H	α-helix	trans	-68.9	-35.3	177	-69.4	177.3	0	0	0	111.7	D42 D45 Y51 K52	D42-L48 HydrophobicContact CB-CB 4.49Å; D42-L48 HydrophobicContact CB-CD1 3.51Å; D45-L48 HydrophobicContact CB-CB 4.12Å; D45-L48 HydrophobicContact CB-CD1 4.12Å; D45-L48 HydrophobicContact CB-CG 4.28Å; D45-L48 PolarHBondContact O-N 2.83Å; D45-L48 PolarHBondContact OD1-N 3.28Å; L48-Y51 PolarHBondContact O-N 2.9Å; L48-K52 VanDerWaalsContact O-CG 3.28Å; L48-K52 WeakPolarHBondContact O-CG 3.41Å; L48-K52 PolarHBondContact O-N 3.32Å
49	R	89.9	Confident	87.2	Confident	136 Å²	136	96.7 Å²	96.7	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-62.4	-47.1	173.8	-170.6	177.4	66.8	-154.1	-1.2	111.8	D45 Y51 K52 E53	D45-R49 WeakPolarHBondContact O-CB 3.4Å; D45-R49 PolarHBondContact O-N 3.21Å; R49-Y51 VanDerWaalsContact C-N 3.33Å; R49-Y51 PolarHBondContact O-N 2.68Å; R49-K52 PolarHBondContact O-N 3.02Å; R49-E53 WeakPolarHBondContact O-CB 3.03Å; R49-E53 PolarHBondContact O-N 2.82Å
50	K	91.4	Very high	85.8	Confident	118 Å²	118	94.8 Å²	94.8	51%	0.513	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-39.1	175.7	-78.6	173.8	169.9	166.8	0	112.1	E46 S47 E53 A54	E46-K50 HydrophobicContact CG-CD 4.38Å; E46-K50 WeakPolarHBondContact O-CG 3.4Å; E46-K50 PolarHBondContact O-N 3.35Å; E46-K50 WeakPolarHBondContact OE1-CE 3.13Å; E46-K50 IonicContact OE1-NZ 2.66Å; E46-K50 PolarHBondContact OE1-NZ 3.42Å; S47-K50 PolarHBondContact O-N 3.21Å; K50-E53 PolarHBondContact O-N 2.9Å; K50-A54 WeakPolarHBondContact O-CB 3.24Å; K50-A54 PolarHBondContact O-N 3.21Å
51	Y	91.5	Very high	84.4	Confident	147 Å²	147	94.5 Å²	94.5	58%	0.576	50%	0.501	S	S	*	.	H	α-helix	trans	-62.6	-46.3	176.1	179	-106.1	0	0	0	112.2	S47 L48 R49 A54 L55	S47-Y51 WeakPolarHBondContact O-CB 3.35Å; S47-Y51 PolarHBondContact O-N 2.68Å; L48-Y51 PolarHBondContact O-N 2.9Å; R49-Y51 VanDerWaalsContact C-N 3.33Å; R49-Y51 PolarHBondContact O-N 2.68Å; Y51-A54 PolarHBondContact O-N 2.81Å; Y51-L55 HydrophobicContact CD1-CD1 4.16Å; Y51-L55 HydrophobicContact CE1-CD1 3.53Å; Y51-L55 HydrophobicContact CE2-CD1 4.01Å; Y51-L55 HydrophobicContact CE2-CG 4.48Å; Y51-L55 VanDerWaalsContact CZ-CD1 3.44Å; Y51-L55 PolarHBondContact O-N 2.78Å
52	K	90.4	Very high	83.2	Confident	33 Å²	33	94 Å²	94	14%	0.143	50%	0.501	C	S	.	.	H	α-helix	trans	-63.1	-42.6	176.5	-70	169.3	-169.1	-178.6	0	111.8	I38 L41 L48 R49 A54 L55 L56	I38-K52 HydrophobicContact CG2-CD 4.29Å; I38-K52 WeakPolarHBondContact O-CD 3.34Å; I38-K52 VanDerWaalsContact O-CE 3.27Å; I38-K52 WeakPolarHBondContact O-CE 3.5Å; I38-K52 PolarHBondContact O-NZ 2.92Å; L41-K52 PolarHBondContact O-NZ 3.15Å; L48-K52 VanDerWaalsContact O-CG 3.28Å; L48-K52 WeakPolarHBondContact O-CG 3.41Å; L48-K52 PolarHBondContact O-N 3.32Å; R49-K52 PolarHBondContact O-N 3.02Å; K52-A54 VanDerWaalsContact C-N 3.33Å; K52-A54 PolarHBondContact O-N 2.9Å; K52-L55 PolarHBondContact O-N 2.96Å; K52-L56 WeakPolarHBondContact O-CB 3.33Å; K52-L56 PolarHBondContact O-N 2.84Å
53	E	88.2	Confident	82.1	Confident	100 Å²	100	92.8 Å²	92.8	47%	0.467	50%	0.504	S	S	.	.	H	α-helix	trans	-64	-37.5	176.6	-173	175	-168	0	0	112.1	R49 K50 L55 G57	R49-E53 WeakPolarHBondContact O-CB 3.03Å; R49-E53 PolarHBondContact O-N 2.82Å; K50-E53 PolarHBondContact O-N 2.9Å; E53-L55 VanDerWaalsContact C-N 3.33Å; E53-L55 PolarHBondContact O-N 2.91Å; E53-G57 WeakPolarHBondContact O-CA 3.46Å; E53-G57 PolarHBondContact O-N 2.94Å
54	A	89.3	Confident	81.6	Confident	86 Å²	86	89.8 Å²	89.8	71%	0.711	50%	0.495	S	S	*	.	H	α-helix	trans	-66.3	-34	176.7	0	0	0	0	0	113	K50 Y51 K52	K50-A54 WeakPolarHBondContact O-CB 3.24Å; K50-A54 PolarHBondContact O-N 3.21Å; Y51-A54 PolarHBondContact O-N 2.81Å; K52-A54 VanDerWaalsContact C-N 3.33Å; K52-A54 PolarHBondContact O-N 2.9Å
55	L	88.1	Confident	81	Confident	110 Å²	110	86.6 Å²	86.6	58%	0.576	48%	0.483	S	S	*	.	H	α-helix	trans	-86	-42.1	-179.4	-70.1	179.6	0	0	0	113.7	Y51 K52 E53	Y51-L55 HydrophobicContact CD1-CD1 4.16Å; Y51-L55 HydrophobicContact CE1-CD1 3.53Å; Y51-L55 HydrophobicContact CE2-CD1 4.01Å; Y51-L55 HydrophobicContact CE2-CG 4.48Å; Y51-L55 VanDerWaalsContact CZ-CD1 3.44Å; Y51-L55 PolarHBondContact O-N 2.78Å; K52-L55 PolarHBondContact O-N 2.96Å; E53-L55 VanDerWaalsContact C-N 3.33Å; E53-L55 PolarHBondContact O-N 2.91Å
56	L	84.8	Confident	80.6	Confident	27 Å²	27	89.3 Å²	89.3	14%	0.141	50%	0.502	C	S	.	.	H	α-helix	trans	-101.1	-5.7	-171.5	-56.8	170.5	0	0	0	112.4	L35 I38 K52 I122	L35-L56 HydrophobicContact CD2-CD1 3.75Å; L35-L56 HydrophobicContact CD2-CD2 3.77Å; L35-L56 HydrophobicContact CD2-CG 4.26Å; I38-L56 HydrophobicContact CG2-CD1 4.25Å; K52-L56 WeakPolarHBondContact O-CB 3.33Å; K52-L56 PolarHBondContact O-N 2.84Å; L56-I122 HydrophobicContact CD2-CD1 3.7Å; L56-I122 HydrophobicContact CD2-CG1 3.91Å
57	G	80.6	Confident	80.4	Confident	37 Å²	37	84.8 Å²	84.8	38%	0.381	48%	0.483	S	S	.	.			trans	64	-160.4	-170.3	0	0	0	0	0	111.9	E53	E53-G57 WeakPolarHBondContact O-CA 3.46Å; E53-G57 PolarHBondContact O-N 2.94Å
58	K	70.1	Confident	80.3	Confident	172 Å²	172	84.6 Å²	84.6	75%	0.748	48%	0.48	S	S	*	.	S	Bend	trans	-76.3	130.5	167.5	-68	-177.4	-179.8	179.2	0	107.7	A60	K58-A60 PolarHBondContact O-N 3.05Å
59	A	59.1	Low	80.4	Confident	65 Å²	65	83.7 Å²	83.7	54%	0.537	48%	0.475	S	S	.	.			trans	-41.3	101.1	179.6	0	0	0	0	0	110.5	V61	A59-V61 PolarHBondContact O-N 3.19Å
60	A	56.8	Low	80.7	Confident	41 Å²	41	77.3 Å²	77.3	34%	0.339	45%	0.452	S	S	.	.			trans	-70	123.8	-178.1	0	0	0	0	0	107.2	K58 V62 P153	K58-A60 PolarHBondContact O-N 3.05Å; A60-V62 PolarHBondContact O-N 3.35Å; A60-P153 HydrophobicContact CB-CG 3.93Å
61	V	59.7	Low	80.9	Confident	129 Å²	129	74.5 Å²	74.5	78%	0.782	44%	0.44	S	S	*	.			trans	-60.1	129.6	169.3	179	0	0	0	0	106.4	A59 A63	A59-V61 PolarHBondContact O-N 3.19Å; V61-A63 PolarHBondContact O-N 2.78Å
62	V	64.9	Low	81.1	Confident	63 Å²	63	67.8 Å²	67.8	38%	0.382	42%	0.415	S	S	.	.			trans	-51.8	106	174.6	175.8	0	0	0	0	108	A60 D64 K120	A60-V62 PolarHBondContact O-N 3.35Å; V62-D64 VanDerWaalsContact C-N 3.35Å; V62-D64 WeakPolarHBondContact CG1-O 3.45Å; V62-K120 HydrophobicContact CG1-CD 4.48Å; V62-K120 HydrophobicContact CG1-CG 3.98Å; V62-K120 HydrophobicContact CG2-CG 4.14Å
63	A	67.4	Low	81.4	Confident	72 Å²	72	66.6 Å²	66.6	60%	0.595	41%	0.41	S	S	*	.	S	Bend	trans	-68.7	-37.6	-172.5	0	0	0	0	0	111.4	V61 P153	V61-A63 PolarHBondContact O-N 2.78Å; A63-P153 HydrophobicContact CB-CB 4.08Å; A63-P153 HydrophobicContact CB-CG 4.4Å
64	D	76.8	Confident	81.8	Confident	75 Å²	75	66 Å²	66	40%	0.401	40%	0.404	S	S	.	.			trans	-132.1	111	175.2	-177.3	-6.3	0	0	0	110.1	V62 T66 A67	V62-D64 VanDerWaalsContact C-N 3.35Å; V62-D64 WeakPolarHBondContact CG1-O 3.45Å; D64-T66 PolarHBondContact O-N 2.92Å; D64-T66 WeakPolarHBondContact OD1-CA 3.36Å; D64-T66 WeakPolarHBondContact OD1-CB 3.5Å; D64-T66 PolarHBondContact OD1-N 2.97Å; D64-T66 PolarHBondContact OD1-OG1 3.28Å; D64-T66 PolarHBondContact OD2-OG1 2.81Å; D64-A67 HydrophobicContact CB-CB 3.97Å; D64-A67 PolarHBondContact O-N 2.8Å
65	P	79.6	Confident	82.1	Confident	99 Å²	99	62 Å²	62	64%	0.643	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-18.9	179.3	27.3	-33.2	0	0	0	113	K120	P65-K120 PolarHBondContact O-NZ 3.17Å
66	T	86.6	Confident	82.4	Confident	122 Å²	122	57.8 Å²	57.8	75%	0.748	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-22	179.9	70.8	0	0	0	0	113.1	D64	D64-T66 PolarHBondContact O-N 2.92Å; D64-T66 WeakPolarHBondContact OD1-CA 3.36Å; D64-T66 WeakPolarHBondContact OD1-CB 3.5Å; D64-T66 PolarHBondContact OD1-N 2.97Å; D64-T66 PolarHBondContact OD1-OG1 3.28Å; D64-T66 PolarHBondContact OD2-OG1 2.81Å
67	A	87.6	Confident	82.8	Confident	12 Å²	12	57 Å²	57	10%	0.099	35%	0.345	C	S	.	.	S	Bend	trans	-64.4	144.2	179.4	0	0	0	0	0	112	D64 K120	D64-A67 HydrophobicContact CB-CB 3.97Å; D64-A67 PolarHBondContact O-N 2.8Å; A67-K120 WeakPolarHBondContact O-CE 3.48Å; A67-K120 PolarHBondContact O-NZ 3.47Å
68	P	92.6	Very high	83.4	Confident	73 Å²	73	59.6 Å²	59.6	47%	0.474	35%	0.348	S	S	.	.			trans	-64.9	162.8	172.2	29.1	-35	0	0	0	111.1	Q71 N119	P68-Q71 HydrophobicContact CG-CB 4.24Å; P68-N119 PolarHBondContact O-ND2 2.67Å
69	N	93.3	Very high	84.4	Confident	40 Å²	40	52.2 Å²	52.2	21%	0.214	32%	0.318	C	S	.	.	S	Bend	trans	-63	-50.1	178.6	-174.3	35.8	0	0	0	111.4	V118 N119 K120 E121	N69-V118 CarbonylContact O-C 3.58Å; N69-V118 WeakPolarHBondContact O-CA 3.32Å; N69-N119 PolarHBondContact O-N 2.93Å; N69-K120 WeakPolarHBondContact OD1-CA 3.36Å; N69-K120 WeakPolarHBondContact OD1-CB 3.24Å; N69-K120 PolarHBondContact OD1-N 3.38Å; N69-E121 PolarHBondContact ND2-O 2.81Å; N69-E121 PolarHBondContact OD1-N 3.22Å; N69-E121 PolarHBondContact OD1-O 3.45Å
70	V	95.5	Very high	85.7	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.012	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.2	172.6	-178.2	0	0	0	0	108.3	V72 F116 K117 V123 L126 H190	V70-V72 HydrophobicContact CG1-CG2 4.47Å; V70-F116 HydrophobicContact CG1-CD2 4.5Å; V70-K117 WeakPolarHBondContact CA-O 3.43Å; V70-V123 HydrophobicContact CG2-CB 3.91Å; V70-V123 HydrophobicContact CG2-CG1 4.21Å; V70-V123 HydrophobicContact CG2-CG2 3.9Å; V70-L126 HydrophobicContact CG1-CD1 4.44Å; V70-H190 HydrophobicContact CB-CB 4.15Å; V70-H190 HydrophobicContact CG1-CB 4.23Å
71	Q	95.4	Very high	87.1	Confident	59 Å²	59	61.6 Å²	61.6	28%	0.276	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	105.4	175.6	-172	179.1	23.5	0	0	108.8	P68 T73 Q91 F116 K117	P68-Q71 HydrophobicContact CG-CB 4.24Å; Q71-T73 HydrophobicContact CG-CG2 4.46Å; Q71-T73 PolarHBondContact O-N 2.75Å; Q71-Q91 VanDerWaalsContact CD-NE2 3.28Å; Q71-F116 CarbonylContact O-C 3.54Å; Q71-F116 VanDerWaalsContact O-CA 3.22Å; Q71-F116 WeakPolarHBondContact O-CA 3.45Å; Q71-K117 HydrophobicContact CB-CB 4.43Å; Q71-K117 PolarHBondContact N-O 3.36Å; Q71-K117 PolarHBondContact O-N 3.16Å
72	V	96.4	Very high	88.5	Confident	7 Å²	7	56.6 Å²	56.6	4%	0.042	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	122.8	174.1	-166.8	0	0	0	0	107.9	V70 L90 I114 F116 F182 L191	V70-V72 HydrophobicContact CG1-CG2 4.47Å; V72-L90 HydrophobicContact CB-CD1 4.41Å; V72-L90 HydrophobicContact CG1-CD1 3.53Å; V72-I114 HydrophobicContact CG1-CG2 3.71Å; V72-F116 HydrophobicContact CG2-CB 4.46Å; V72-F182 HydrophobicContact CG1-CD2 4.17Å; V72-F182 HydrophobicContact CG1-CE2 4.05Å; V72-F182 HydrophobicContact CG2-CB 3.98Å; V72-F182 HydrophobicContact CG2-CD1 4.2Å; V72-F182 HydrophobicContact CG2-CD2 3.87Å; V72-F182 HydrophobicContact CG2-CE2 4.42Å; V72-F182 HydrophobicContact CG2-CG 3.73Å; V72-L191 HydrophobicContact CB-CB 4.39Å; V72-L191 HydrophobicContact CB-CD2 3.84Å; V72-L191 HydrophobicContact CG1-CD2 4.34Å; V72-L191 HydrophobicContact CG2-CB 4.09Å; V72-L191 HydrophobicContact CG2-CD2 4.42Å
73	T	96.1	Very high	89.6	Confident	7 Å²	7	58.4 Å²	58.4	4%	0.043	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-42.6	-169.4	65.4	0	0	0	0	112	Q71 L90 N115 K117 E156	Q71-T73 HydrophobicContact CG-CG2 4.46Å; Q71-T73 PolarHBondContact O-N 2.75Å; T73-L90 PolarHBondContact O-N 2.81Å; T73-N115 PolarHBondContact N-O 3.01Å; T73-N115 WeakPolarHBondContact OG1-CB 3.24Å; T73-N115 PolarHBondContact OG1-O 3.27Å; T73-K117 HydrophobicContact CG2-CG 4.26Å; T73-E156 VanDerWaalsContact CB-OE1 3.24Å; T73-E156 WeakPolarHBondContact CB-OE1 3.48Å; T73-E156 VanDerWaalsContact CG2-OE1 3.24Å; T73-E156 WeakPolarHBondContact CG2-OE1 3.32Å; T73-E156 PolarHBondContact OG1-OE1 2.76Å
74	R	96.3	Very high	90.5	Very high	88 Å²	88	57.6 Å²	57.6	33%	0.332	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	144.7	-174	-175.3	180	64.2	-169.6	-5	112.1	I87 L88 N115	R74-I87 VanDerWaalsContact CD-CG2 3.46Å; R74-I87 HydrophobicContact CG-CG2 3.57Å; R74-L88 WeakPolarHBondContact CA-O 3.45Å; R74-L88 WeakPolarHBondContact CG-O 3.21Å; R74-N115 HydrophobicContact CB-CB 4.19Å; R74-N115 PolarHBondContact N-O 3.07Å; R74-N115 PolarHBondContact NE-OD1 3.45Å; R74-N115 PolarHBondContact NH2-OD1 3.4Å; R74-N115 PolarHBondContact O-N 3.08Å
75	M	95.8	Very high	91	Very high	3 Å²	3	59 Å²	59	2%	0.015	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.1	164	-172.5	-176.3	91.5	0	0	109.4	I87 L88 L90 I112 K113 I114 W193 W195	M75-I87 WeakPolarHBondContact O-CA 3.34Å; M75-L88 HydrophobicContact CB-CB 4.21Å; M75-L88 HydrophobicContact CB-CD1 4.4Å; M75-L88 HydrophobicContact CE-CD1 3.23Å; M75-L88 HydrophobicContact CE-CG 3.97Å; M75-L88 PolarHBondContact N-O 3.28Å; M75-L88 PolarHBondContact O-N 3.22Å; M75-L88 HydrophobicContact SD-CD1 4.17Å; M75-L90 HydrophobicContact CB-CD1 4.01Å; M75-I112 HydrophobicContact CG-CG2 3.58Å; M75-I112 HydrophobicContact SD-CG2 3.92Å; M75-K113 CarbonylContact C-O 3.53Å; M75-K113 WeakPolarHBondContact CA-O 3.45Å; M75-I114 HydrophobicContact CG-CG1 4.34Å; M75-W193 HydrophobicContact SD-CZ2 3.8Å; M75-W195 HydrophobicContact CE-CD2 4.05Å; M75-W195 HydrophobicContact CE-CE3 4.24Å; M75-W195 HydrophobicContact CE-CH2 3.66Å; M75-W195 HydrophobicContact CE-CZ2 3.43Å; M75-W195 VanDerWaalsContact CE-CZ2 3.43Å; M75-W195 HydrophobicContact CE-CZ3 4.05Å; M75-W195 HydrophobicContact SD-CZ2 4.3Å
76	T	95.2	Very high	91.5	Very high	20 Å²	20	55.4 Å²	55.4	12%	0.123	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	125.4	178	-57.2	0	0	0	0	109.5	M78 L86 I87 K113	T76-M78 HydrophobicContact CG2-CG 4.26Å; T76-M78 PolarHBondContact O-N 2.69Å; T76-L86 CarbonylContact C-O 3.51Å; T76-L86 WeakPolarHBondContact CA-O 3.22Å; T76-I87 HydrophobicContact CG2-CG1 3.94Å; T76-K113 PolarHBondContact N-O 2.7Å; T76-K113 PolarHBondContact O-N 3.4Å
77	L	92.8	Very high	91.8	Very high	11 Å²	11	52.9 Å²	52.9	6%	0.058	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	103.7	171	-153.5	71.3	0	0	0	108.1	C79 L86 L104 Y110 I112 L197	L77-C79 PolarHBondContact O-N 2.8Å; L77-L86 HydrophobicContact CB-CB 3.85Å; L77-L86 HydrophobicContact CB-CD1 4.17Å; L77-L86 HydrophobicContact CD2-CD1 3.89Å; L77-L86 PolarHBondContact N-O 3.41Å; L77-L104 HydrophobicContact CD2-CD1 3.96Å; L77-L104 HydrophobicContact CD2-CD2 4.36Å; L77-Y110 HydrophobicContact CD1-CD2 3.51Å; L77-Y110 HydrophobicContact CD1-CE2 3.96Å; L77-Y110 HydrophobicContact CD1-CG 4.36Å; L77-Y110 HydrophobicContact CG-CD2 4.05Å; L77-Y110 HydrophobicContact CG-CG 4.45Å; L77-I112 HydrophobicContact CD1-CG1 3.61Å; L77-L197 HydrophobicContact CD2-CD1 4.35Å
78	M	93.1	Very high	92.1	Very high	92 Å²	92	52.5 Å²	52.5	45%	0.453	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	108.3	179.5	-60.1	-165.9	70.3	0	0	109.4	T76 Y110 R111 K113 L160	T76-M78 HydrophobicContact CG2-CG 4.26Å; T76-M78 PolarHBondContact O-N 2.69Å; M78-Y110 CarbonylContact O-C 3.46Å; M78-Y110 WeakPolarHBondContact O-CA 3.3Å; M78-R111 HydrophobicContact CB-CB 4.41Å; M78-R111 PolarHBondContact N-O 2.74Å; M78-R111 PolarHBondContact O-N 2.91Å; M78-K113 HydrophobicContact CG-CB 3.93Å; M78-K113 HydrophobicContact SD-CB 3.77Å; M78-K113 HydrophobicContact SD-CD 3.79Å; M78-K113 HydrophobicContact SD-CG 4.36Å; M78-L160 HydrophobicContact SD-CD2 3.58Å; M78-L160 VanDerWaalsContact SD-CD2 3.58Å
79	C	91.5	Very high	92.2	Very high	16 Å²	16	53.1 Å²	53.1	11%	0.108	29%	0.291	C	S	.	.			trans	-135.9	118.2	173.7	-178.6	0	0	0	0	108.6	L77 N81 A82 E109 W203	L77-C79 PolarHBondContact O-N 2.8Å; C79-N81 PolarHBondContact O-N 2.79Å; C79-A82 HydrophobicContact CB-CB 4.04Å; C79-A82 WeakPolarHBondContact O-CB 3.39Å; C79-A82 PolarHBondContact O-N 3.34Å; C79-A82 VanDerWaalsContact O-N 3.11Å; C79-E109 PolarHBondContact SG-O 2.81Å; C79-W203 HydrophobicContact CB-CH2 4.2Å
80	E	87.3	Confident	92.3	Very high	195 Å²	195	51.6 Å²	51.6	91%	0.911	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.6	-176.2	-63.9	-173.5	166.9	0	0	112.6	A82	E80-A82 VanDerWaalsContact C-N 3.34Å
81	N	85.3	Confident	92.2	Very high	109 Å²	109	56.8 Å²	56.8	58%	0.583	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-1.4	-177.8	-64	-43.6	0	0	0	113.5	C79 W203	C79-N81 PolarHBondContact O-N 2.79Å; N81-W203 HydrophobicContact CB-CZ2 4.35Å; N81-W203 PolarHBondContact O-NE1 3.41Å
82	A	88.8	Confident	92	Very high	23 Å²	23	56 Å²	56	19%	0.19	31%	0.314	C	S	.	.			trans	-73	135	-179.3	0	0	0	0	0	110.7	C79 E80 A84 W203	C79-A82 HydrophobicContact CB-CB 4.04Å; C79-A82 WeakPolarHBondContact O-CB 3.39Å; C79-A82 PolarHBondContact O-N 3.34Å; C79-A82 VanDerWaalsContact O-N 3.11Å; E80-A82 VanDerWaalsContact C-N 3.34Å; A82-A84 PolarHBondContact O-N 3.11Å; A82-W203 HydrophobicContact CB-CH2 3.68Å; A82-W203 HydrophobicContact CB-CZ2 4.06Å; A82-W203 HydrophobicContact CB-CZ3 4Å
83	P	88.6	Confident	91.7	Very high	102 Å²	102	60.1 Å²	60.1	66%	0.662	34%	0.336	S	S	*	.	S	Bend	trans	-71.8	-19.6	-179.6	29.3	-35.8	0	0	0	113.3	W203	P83-W203 HydrophobicContact CG-CB 3.97Å; P83-W203 HydrophobicContact CG-CG 4.26Å
84	A	87.1	Confident	91.4	Very high	54 Å²	54	62 Å²	62	45%	0.446	35%	0.345	S	S	.	.	S	Bend	trans	-146	153.6	-178.7	0	0	0	0	0	109.8	A82 L86	A82-A84 PolarHBondContact O-N 3.11Å; A84-L86 PolarHBondContact O-N 3.04Å
85	P	86.5	Confident	91	Very high	105 Å²	105	64.4 Å²	64.4	68%	0.682	36%	0.361	S	S	*	.			trans	-65.8	133	176.1	28.5	-34.7	0	0	0	110.5	I87	P85-I87 HydrophobicContact CB-CD1 3.85Å; P85-I87 HydrophobicContact CB-CG1 4.11Å; P85-I87 HydrophobicContact CG-CD1 4.43Å
86	L	89.7	Confident	90.7	Very high	23 Å²	23	67.3 Å²	67.3	12%	0.12	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	98.8	178.1	-55.7	170.7	0	0	0	107.7	T76 L77 A84 F102 W203	T76-L86 CarbonylContact C-O 3.51Å; T76-L86 WeakPolarHBondContact CA-O 3.22Å; L77-L86 HydrophobicContact CB-CB 3.85Å; L77-L86 HydrophobicContact CB-CD1 4.17Å; L77-L86 HydrophobicContact CD2-CD1 3.89Å; L77-L86 PolarHBondContact N-O 3.41Å; A84-L86 PolarHBondContact O-N 3.04Å; L86-F102 HydrophobicContact CB-CD1 3.83Å; L86-F102 HydrophobicContact CB-CE1 4.18Å; L86-F102 HydrophobicContact CD2-CD1 3.65Å; L86-F102 HydrophobicContact CD2-CE1 4.37Å; L86-F102 HydrophobicContact CG-CD1 4.26Å; L86-W203 HydrophobicContact CD1-CZ3 4.16Å
87	I	93.3	Very high	90.4	Very high	70 Å²	70	67.7 Å²	67.7	36%	0.359	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	132.1	-170.3	-62.7	173.7	0	0	0	110.1	R74 M75 T76 P85	R74-I87 VanDerWaalsContact CD-CG2 3.46Å; R74-I87 HydrophobicContact CG-CG2 3.57Å; M75-I87 WeakPolarHBondContact O-CA 3.34Å; T76-I87 HydrophobicContact CG2-CG1 3.94Å; P85-I87 HydrophobicContact CB-CD1 3.85Å; P85-I87 HydrophobicContact CB-CG1 4.11Å; P85-I87 HydrophobicContact CG-CD1 4.43Å
88	L	93.6	Very high	90.2	Very high	3 Å²	3	72 Å²	72	2%	0.016	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	118.7	166	-57.4	-177.6	0	0	0	109.4	R74 M75 L90 F97 F102 W195	R74-L88 WeakPolarHBondContact CA-O 3.45Å; R74-L88 WeakPolarHBondContact CG-O 3.21Å; M75-L88 HydrophobicContact CB-CB 4.21Å; M75-L88 HydrophobicContact CB-CD1 4.4Å; M75-L88 HydrophobicContact CE-CD1 3.23Å; M75-L88 HydrophobicContact CE-CG 3.97Å; M75-L88 PolarHBondContact N-O 3.28Å; M75-L88 PolarHBondContact O-N 3.22Å; M75-L88 HydrophobicContact SD-CD1 4.17Å; L88-L90 HydrophobicContact CB-CD2 4.02Å; L88-L90 HydrophobicContact CB-CG 4.48Å; L88-L90 HydrophobicContact CD1-CD2 4.49Å; L88-L90 PolarHBondContact O-N 3.26Å; L88-F97 HydrophobicContact CB-CE1 4.3Å; L88-F97 HydrophobicContact CB-CE2 4.06Å; L88-F97 HydrophobicContact CB-CZ 3.94Å; L88-F97 HydrophobicContact CD1-CD2 4.44Å; L88-F97 HydrophobicContact CD2-CB 4.15Å; L88-F97 HydrophobicContact CD2-CD1 3.44Å; L88-F97 VanDerWaalsContact CD2-CD1 3.44Å; L88-F97 HydrophobicContact CD2-CD2 4.06Å; L88-F97 HydrophobicContact CD2-CE1 3.7Å; L88-F97 HydrophobicContact CD2-CE2 4.28Å; L88-F97 HydrophobicContact CD2-CG 3.64Å; L88-F97 HydrophobicContact CD2-CZ 4.11Å; L88-F102 HydrophobicContact CD2-CD2 4.1Å; L88-F102 HydrophobicContact CD2-CE2 3.16Å; L88-F102 HydrophobicContact CD2-CZ 3.49Å; L88-F102 VanDerWaalsContact CD2-CZ 3.49Å; L88-F102 HydrophobicContact CG-CE2 4.3Å; L88-F102 HydrophobicContact CG-CZ 4.46Å; L88-W195 HydrophobicContact CD1-CB 4.18Å; L88-W195 HydrophobicContact CD1-CD2 4.06Å; L88-W195 HydrophobicContact CD1-CE3 4.39Å; L88-W195 HydrophobicContact CD1-CG 3.97Å
89	D	95.1	Very high	90	Very high	87 Å²	87	74 Å²	74	47%	0.465	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	100.8	168.3	-179	-0.3	0	0	0	109.8	Q91 G92 F97	D89-Q91 PolarHBondContact O-N 2.76Å; D89-Q91 PolarHBondContact OD1-N 3.38Å; D89-Q91 VanDerWaalsContact OD1-N 3.08Å; D89-G92 PolarHBondContact O-N 2.69Å; D89-F97 VanDerWaalsContact O-CZ 3.24Å; D89-F97 WeakPolarHBondContact O-CZ 3.49Å
90	L	95.7	Very high	89.8	Confident	8 Å²	8	78.9 Å²	78.9	4%	0.042	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	0.9	-173	-62	178	0	0	0	113.2	V72 T73 M75 L88 L94 F97 L191 W193	V72-L90 HydrophobicContact CB-CD1 4.41Å; V72-L90 HydrophobicContact CG1-CD1 3.53Å; T73-L90 PolarHBondContact O-N 2.81Å; M75-L90 HydrophobicContact CB-CD1 4.01Å; L88-L90 HydrophobicContact CB-CD2 4.02Å; L88-L90 HydrophobicContact CB-CG 4.48Å; L88-L90 HydrophobicContact CD1-CD2 4.49Å; L88-L90 PolarHBondContact O-N 3.26Å; L90-L94 HydrophobicContact CB-CD2 4.42Å; L90-L94 HydrophobicContact CD2-CD2 4.06Å; L90-F97 HydrophobicContact CD2-CE2 4.03Å; L90-L191 HydrophobicContact CB-CD2 3.81Å; L90-L191 HydrophobicContact CD1-CD2 4Å; L90-L191 HydrophobicContact CD2-CD2 4.43Å; L90-L191 HydrophobicContact CG-CD2 4.29Å; L90-W193 HydrophobicContact CD1-CH2 4.01Å; L90-W193 HydrophobicContact CD1-CZ2 3.93Å; L90-W193 HydrophobicContact CD1-CZ3 4.44Å; L90-W193 HydrophobicContact CD2-CD2 3.93Å; L90-W193 HydrophobicContact CD2-CG 4.09Å; L90-W193 HydrophobicContact CD2-CZ2 4.18Å
91	Q	93.3	Very high	89.8	Confident	111 Å²	111	72.3 Å²	72.3	52%	0.519	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-9.7	172	-52.6	-165.6	-38.2	0	0	112.7	Q71 D89	Q71-Q91 VanDerWaalsContact CD-NE2 3.28Å; D89-Q91 PolarHBondContact O-N 2.76Å; D89-Q91 PolarHBondContact OD1-N 3.38Å; D89-Q91 VanDerWaalsContact OD1-N 3.08Å
92	G	90.8	Very high	90.1	Very high	41 Å²	41	69.2 Å²	69.2	42%	0.423	38%	0.377	S	S	.	.	S	Bend	trans	-92.8	-148.6	-179.9	0	0	0	0	0	113.9	D89 L94	D89-G92 PolarHBondContact O-N 2.69Å; G92-L94 PolarHBondContact O-N 2.79Å
93	D	89.1	Confident	90.2	Very high	95 Å²	95	69.8 Å²	69.8	51%	0.508	38%	0.378	S	S	.	.			trans	-80.4	98.5	178.2	178.9	13	0	0	0	111.6	E95 N96	D93-E95 VanDerWaalsContact C-N 3.28Å; D93-E95 PolarHBondContact O-N 2.81Å; D93-E95 WeakPolarHBondContact OD1-CB 3.36Å; D93-E95 PolarHBondContact OD1-N 3.37Å; D93-N96 PolarHBondContact O-N 2.87Å
94	L	90.9	Very high	90.5	Very high	45 Å²	45	65 Å²	65	24%	0.236	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-25.8	-179.9	-55	-179.6	0	0	0	113.3	L90 G92 N96 F97 L191 W193	L90-L94 HydrophobicContact CB-CD2 4.42Å; L90-L94 HydrophobicContact CD2-CD2 4.06Å; G92-L94 PolarHBondContact O-N 2.79Å; L94-N96 PolarHBondContact O-N 2.87Å; L94-F97 HydrophobicContact CB-CD2 4.47Å; L94-F97 HydrophobicContact CD2-CD2 4.23Å; L94-F97 HydrophobicContact CD2-CE2 3.64Å; L94-F97 WeakPolarHBondContact O-CD2 3.31Å; L94-F97 PolarHBondContact O-N 2.77Å; L94-L191 HydrophobicContact CD1-CD1 3.9Å; L94-W193 HydrophobicContact CB-CB 4.4Å; L94-W193 HydrophobicContact CD1-CB 4.18Å; L94-W193 HydrophobicContact CD2-CB 4.5Å
95	E	87.8	Confident	90.9	Very high	140 Å²	140	65.4 Å²	65.4	65%	0.654	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-24.6	-177.6	-61.6	-163.3	145.5	0	0	111.9	D93 F97	D93-E95 VanDerWaalsContact C-N 3.28Å; D93-E95 PolarHBondContact O-N 2.81Å; D93-E95 WeakPolarHBondContact OD1-CB 3.36Å; D93-E95 PolarHBondContact OD1-N 3.37Å; E95-F97 VanDerWaalsContact C-N 3.27Å; E95-F97 PolarHBondContact O-N 3.38Å
96	N	88.8	Confident	91.3	Very high	63 Å²	63	62 Å²	62	34%	0.337	31%	0.314	S	S	.	.	H	α-helix	trans	-70.6	-25.5	-176.8	-156	26.4	0	0	0	112.7	D93 L94 K98 K99 H100	D93-N96 PolarHBondContact O-N 2.87Å; L94-N96 PolarHBondContact O-N 2.87Å; N96-K98 PolarHBondContact O-N 3.49Å; N96-K99 PolarHBondContact O-N 2.83Å; N96-H100 PolarHBondContact O-N 2.87Å; N96-H100 PolarHBondContact OD1-CD2 2.84Å; N96-H100 PolarHBondContact OD1-NE2 2.69Å
97	F	90.4	Very high	91.4	Very high	28 Å²	28	62.4 Å²	62.4	12%	0.123	32%	0.323	C	S	.	.	H	α-helix	trans	-67	-22.8	-178.5	-57	-35.7	0	0	0	114	L88 D89 L90 L94 E95 W195 S196	L88-F97 HydrophobicContact CB-CE1 4.3Å; L88-F97 HydrophobicContact CB-CE2 4.06Å; L88-F97 HydrophobicContact CB-CZ 3.94Å; L88-F97 HydrophobicContact CD1-CD2 4.44Å; L88-F97 HydrophobicContact CD2-CB 4.15Å; L88-F97 HydrophobicContact CD2-CD1 3.44Å; L88-F97 VanDerWaalsContact CD2-CD1 3.44Å; L88-F97 HydrophobicContact CD2-CD2 4.06Å; L88-F97 HydrophobicContact CD2-CE1 3.7Å; L88-F97 HydrophobicContact CD2-CE2 4.28Å; L88-F97 HydrophobicContact CD2-CG 3.64Å; L88-F97 HydrophobicContact CD2-CZ 4.11Å; D89-F97 VanDerWaalsContact O-CZ 3.24Å; D89-F97 WeakPolarHBondContact O-CZ 3.49Å; L90-F97 HydrophobicContact CD2-CE2 4.03Å; L94-F97 HydrophobicContact CB-CD2 4.47Å; L94-F97 HydrophobicContact CD2-CD2 4.23Å; L94-F97 HydrophobicContact CD2-CE2 3.64Å; L94-F97 WeakPolarHBondContact O-CD2 3.31Å; L94-F97 PolarHBondContact O-N 2.77Å; E95-F97 VanDerWaalsContact C-N 3.27Å; E95-F97 PolarHBondContact O-N 3.38Å; F97-W195 HydrophobicContact CB-CB 3.67Å; F97-S196 PolarHBondContact O-N 3.34Å
98	K	88	Confident	91.5	Very high	103 Å²	103	59.6 Å²	59.6	45%	0.448	31%	0.309	S	S	.	.	H	α-helix	trans	-81.2	-27.2	173.6	-171	173.3	-177.8	167.6	0	112.7	N96 E194 S196	N96-K98 PolarHBondContact O-N 3.49Å; K98-E194 HydrophobicContact CD-CB 4.47Å; K98-E194 IonicContact NZ-OE2 2.68Å; K98-E194 PolarHBondContact NZ-OE2 3.38Å; K98-S196 PolarHBondContact O-OG 3.28Å
99	K	87.9	Confident	91.5	Very high	134 Å²	134	64.8 Å²	64.8	58%	0.583	33%	0.333	S	S	*	.	H	α-helix	trans	-81.2	-29.2	-178.3	-63.7	174.8	-168	163.4	0	112	N96 P101	N96-K99 PolarHBondContact O-N 2.83Å; K99-P101 WeakPolarHBondContact O-CD 3.22Å
100	H	87.3	Confident	91.4	Very high	118 Å²	118	61.9 Å²	61.9	55%	0.546	32%	0.316	S	S	.	.	S	Bend	trans	-118.5	91.2	-177.5	-61.4	-66.1	0	0	0	111	N96 F102	N96-H100 PolarHBondContact O-N 2.87Å; N96-H100 PolarHBondContact OD1-CD2 2.84Å; N96-H100 PolarHBondContact OD1-NE2 2.69Å; H100-F102 PolarHBondContact O-N 3.27Å
101	P	88.8	Confident	91.3	Very high	56 Å²	56	66.7 Å²	66.7	36%	0.364	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-66.5	134.9	-179	26.1	-33.4	0	0	0	111.9	K99 T175 S196 A198	K99-P101 WeakPolarHBondContact O-CD 3.22Å; P101-T175 HydrophobicContact CB-CG2 4.47Å; P101-S196 CarbonylContact C-O 3.52Å; P101-S196 VanDerWaalsContact CA-O 3.25Å; P101-S196 WeakPolarHBondContact CA-O 3.43Å; P101-A198 HydrophobicContact CB-CB 4.1Å
102	F	89.9	Confident	91.4	Very high	45 Å²	45	61.5 Å²	61.5	20%	0.197	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	132.7	170.6	-75	-94.2	0	0	0	109.5	L86 L88 H100 W195 S196 L197 A198	L86-F102 HydrophobicContact CB-CD1 3.83Å; L86-F102 HydrophobicContact CB-CE1 4.18Å; L86-F102 HydrophobicContact CD2-CD1 3.65Å; L86-F102 HydrophobicContact CD2-CE1 4.37Å; L86-F102 HydrophobicContact CG-CD1 4.26Å; L88-F102 HydrophobicContact CD2-CD2 4.1Å; L88-F102 HydrophobicContact CD2-CE2 3.16Å; L88-F102 HydrophobicContact CD2-CZ 3.49Å; L88-F102 VanDerWaalsContact CD2-CZ 3.49Å; L88-F102 HydrophobicContact CG-CE2 4.3Å; L88-F102 HydrophobicContact CG-CZ 4.46Å; H100-F102 PolarHBondContact O-N 3.27Å; F102-W195 HydrophobicContact CD2-CE3 4.5Å; F102-S196 PolarHBondContact N-O 3.49Å; F102-L197 HydrophobicContact CB-CD1 4.07Å; F102-L197 CarbonylContact O-C 3.48Å; F102-L197 WeakPolarHBondContact O-CA 3.45Å; F102-A198 PolarHBondContact O-N 3.01Å
103	T	92.7	Very high	91.6	Very high	35 Å²	35	61.2 Å²	61.2	22%	0.215	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	126.2	175	-63.6	0	0	0	0	109.4	A198 K200 W203	T103-A198 WeakPolarHBondContact CA-O 3.45Å; T103-K200 HydrophobicContact CG2-CB 4.12Å; T103-K200 HydrophobicContact CG2-CD 3.8Å; T103-K200 HydrophobicContact CG2-CG 4Å; T103-W203 VanDerWaalsContact O-CZ3 3.27Å; T103-W203 WeakPolarHBondContact O-CZ3 3.44Å
104	L	93.9	Very high	92	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	128	174	-173.2	67.6	0	0	0	108.9	L77 V108 Y110 A166 L197 A198 I199 K200 W203	L77-L104 HydrophobicContact CD2-CD1 3.96Å; L77-L104 HydrophobicContact CD2-CD2 4.36Å; L104-V108 HydrophobicContact CD1-CG2 3.71Å; L104-V108 HydrophobicContact CG-CG2 4.13Å; L104-Y110 HydrophobicContact CD2-CD1 3.96Å; L104-Y110 HydrophobicContact CD2-CE1 4Å; L104-A166 HydrophobicContact CD2-CB 3.68Å; L104-A166 HydrophobicContact CG-CB 4.11Å; L104-L197 HydrophobicContact CB-CD1 3.79Å; L104-L197 HydrophobicContact CB-CG 4.31Å; L104-L197 HydrophobicContact CD2-CD1 4.32Å; L104-L197 HydrophobicContact CD2-CD2 4.01Å; L104-A198 PolarHBondContact N-O 3.28Å; L104-I199 WeakPolarHBondContact O-CA 3.16Å; L104-K200 PolarHBondContact O-N 2.68Å; L104-W203 HydrophobicContact CD1-CH2 3.62Å; L104-W203 HydrophobicContact CD1-CZ3 3.92Å
105	K	94.6	Very high	92.3	Very high	62 Å²	62	54.5 Å²	54.5	27%	0.27	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	136.7	175.9	178.1	170.1	-179.1	161.1	0	110.1	V108 K200 K201 D202 W203	K105-V108 HydrophobicContact CB-CG1 3.73Å; K105-V108 HydrophobicContact CD-CG1 4.13Å; K105-V108 HydrophobicContact CG-CG1 3.84Å; K105-V108 WeakPolarHBondContact O-CG2 3.35Å; K105-K200 CarbonylContact C-O 3.6Å; K105-K200 WeakPolarHBondContact CA-O 3.43Å; K105-K201 WeakPolarHBondContact CE-O 3.48Å; K105-K201 WeakPolarHBondContact CG-O 3.15Å; K105-D202 IonicContact NZ-OD2 2.74Å; K105-D202 PolarHBondContact NZ-OD2 2.68Å; K105-W203 HydrophobicContact CB-CD2 3.69Å; K105-W203 VanDerWaalsContact CB-CE2 3.45Å; K105-W203 HydrophobicContact CB-CE3 4.28Å; K105-W203 HydrophobicContact CB-CG 4.03Å; K105-W203 HydrophobicContact CB-CH2 4.47Å; K105-W203 HydrophobicContact CB-CZ2 3.88Å; K105-W203 HydrophobicContact CD-CG 4.44Å
106	E	95	Very high	92.7	Very high	35 Å²	35	47.9 Å²	47.9	16%	0.164	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	142.8	177.9	73.7	-178.9	157.8	0	0	111.9	V108 P167 K168 G169 R173 I199 K200	E106-V108 PolarHBondContact O-N 2.81Å; E106-P167 WeakPolarHBondContact CB-O 3.44Å; E106-K168 HydrophobicContact CB-CB 4.37Å; E106-K168 HydrophobicContact CG-CB 4.47Å; E106-G169 PolarHBondContact OE2-N 2.48Å; E106-R173 IonicContact OE1-NE 3.27Å; E106-R173 WeakPolarHBondContact OE2-CD 3.43Å; E106-R173 WeakPolarHBondContact OE2-CG 3.49Å; E106-R173 IonicContact OE2-NE 3.24Å; E106-R173 PolarHBondContact OE2-NE 3.06Å; E106-I199 HydrophobicContact CB-CG2 3.87Å; E106-K200 PolarHBondContact N-O 2.79Å
107	G	93.2	Very high	93	Very high	30 Å²	30	47.4 Å²	47.4	31%	0.309	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	8.3	177.5	0	0	0	0	0	115.8	A166	G107-A166 WeakPolarHBondContact CA-O 3.23Å; G107-A166 PolarHBondContact N-O 3.31Å
108	V	94.4	Very high	93.2	Very high	11 Å²	11	46.1 Å²	46.1	7%	0.067	22%	0.219	C	C	.	.			trans	-84.1	146.1	172.5	-55.1	0	0	0	0	110.9	L104 K105 E106 A166 W203	L104-V108 HydrophobicContact CD1-CG2 3.71Å; L104-V108 HydrophobicContact CG-CG2 4.13Å; K105-V108 HydrophobicContact CB-CG1 3.73Å; K105-V108 HydrophobicContact CD-CG1 4.13Å; K105-V108 HydrophobicContact CG-CG1 3.84Å; K105-V108 WeakPolarHBondContact O-CG2 3.35Å; E106-V108 PolarHBondContact O-N 2.81Å; V108-A166 HydrophobicContact CG2-CB 4.29Å; V108-A166 PolarHBondContact O-N 2.93Å; V108-W203 HydrophobicContact CB-CZ2 4.44Å; V108-W203 HydrophobicContact CG1-CZ2 4.06Å; V108-W203 HydrophobicContact CG2-CH2 4.17Å; V108-W203 HydrophobicContact CG2-CZ2 4.04Å
109	E	94.4	Very high	93.4	Very high	112 Å²	112	41.8 Å²	41.8	52%	0.523	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	140.9	171	-60.3	178.9	120.6	0	0	110.6	C79 L163 E164	C79-E109 PolarHBondContact SG-O 2.81Å; E109-L163 HydrophobicContact CB-CD1 3.98Å; E109-L163 HydrophobicContact CB-CG 4.27Å; E109-L163 WeakPolarHBondContact OE1-CD2 3.24Å; E109-E164 CarbonylContact C-O 3.53Å; E109-E164 WeakPolarHBondContact CA-O 3.35Å
110	Y	93	Very high	93.4	Very high	27 Å²	27	38.3 Å²	38.3	11%	0.106	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	162.7	176.6	69.7	-87.4	0	0	0	112.1	L77 M78 L104 I112 E164 A166	L77-Y110 HydrophobicContact CD1-CD2 3.51Å; L77-Y110 HydrophobicContact CD1-CE2 3.96Å; L77-Y110 HydrophobicContact CD1-CG 4.36Å; L77-Y110 HydrophobicContact CG-CD2 4.05Å; L77-Y110 HydrophobicContact CG-CG 4.45Å; M78-Y110 CarbonylContact O-C 3.46Å; M78-Y110 WeakPolarHBondContact O-CA 3.3Å; L104-Y110 HydrophobicContact CD2-CD1 3.96Å; L104-Y110 HydrophobicContact CD2-CE1 4Å; Y110-I112 HydrophobicContact CE2-CG1 4.34Å; Y110-E164 HydrophobicContact CD1-CB 4.49Å; Y110-E164 HydrophobicContact CE1-CB 3.96Å; Y110-E164 HydrophobicContact CE2-CB 4.04Å; Y110-E164 WeakPolarHBondContact CE2-OE2 3.21Å; Y110-E164 VanDerWaalsContact CZ-OE2 3.27Å; Y110-E164 PolarHBondContact N-O 3.16Å; Y110-E164 PolarHBondContact O-N 3.02Å; Y110-E164 PolarHBondContact OH-OE2 2.97Å; Y110-A166 HydrophobicContact CD1-CB 4.36Å; Y110-A166 HydrophobicContact CE1-CB 4.19Å
111	R	94	Very high	93.6	Very high	109 Å²	109	36.1 Å²	36.1	41%	0.411	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	149	167.3	-64.5	-176.4	-176	179.2	2.5	109.6	M78 L163	M78-R111 HydrophobicContact CB-CB 4.41Å; M78-R111 PolarHBondContact N-O 2.74Å; M78-R111 PolarHBondContact O-N 2.91Å; R111-L163 HydrophobicContact CG-CB 4.49Å; R111-L163 HydrophobicContact CG-CD1 3.83Å
112	I	94.1	Very high	93.8	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123.3	169.2	-59.5	166.7	0	0	0	107.3	M75 L77 Y110 I114 Y128 L160 T161	M75-I112 HydrophobicContact CG-CG2 3.58Å; M75-I112 HydrophobicContact SD-CG2 3.92Å; L77-I112 HydrophobicContact CD1-CG1 3.61Å; Y110-I112 HydrophobicContact CE2-CG1 4.34Å; I112-I114 HydrophobicContact CG2-CD1 4.03Å; I112-I114 HydrophobicContact CG2-CG1 3.76Å; I112-Y128 HydrophobicContact CD1-CE1 4.16Å; I112-L160 WeakPolarHBondContact O-CA 3.46Å; I112-T161 HydrophobicContact CB-CG2 3.8Å; I112-T161 PolarHBondContact N-OG1 2.93Å; I112-T161 PolarHBondContact O-N 2.87Å
113	K	96.2	Very high	94	Very high	35 Å²	35	33.7 Å²	33.7	15%	0.152	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.2	169.6	-179.2	173.8	169.4	167.4	0	109.3	M75 T76 M78 E158 F159 L160	M75-K113 CarbonylContact C-O 3.53Å; M75-K113 WeakPolarHBondContact CA-O 3.45Å; T76-K113 PolarHBondContact N-O 2.7Å; T76-K113 PolarHBondContact O-N 3.4Å; M78-K113 HydrophobicContact CG-CB 3.93Å; M78-K113 HydrophobicContact SD-CB 3.77Å; M78-K113 HydrophobicContact SD-CD 3.79Å; M78-K113 HydrophobicContact SD-CG 4.36Å; K113-E158 WeakPolarHBondContact CE-OE1 3.38Å; K113-E158 WeakPolarHBondContact CE-OE2 3.43Å; K113-E158 IonicContact NZ-OE1 3.83Å; K113-E158 PolarHBondContact NZ-OE1 2.76Å; K113-E158 IonicContact NZ-OE2 3.89Å; K113-E158 PolarHBondContact NZ-OE2 2.79Å; K113-F159 CarbonylContact C-O 3.59Å; K113-F159 VanDerWaalsContact CA-O 3.3Å; K113-F159 WeakPolarHBondContact CA-O 3.48Å; K113-L160 HydrophobicContact CB-CD2 3.54Å; K113-L160 HydrophobicContact CD-CD2 4.14Å; K113-L160 HydrophobicContact CG-CD2 3.81Å
114	I	96.3	Very high	94.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126	179.6	-49.9	170.7	0	0	0	109.2	V72 M75 I112 Y128 F159 F182	V72-I114 HydrophobicContact CG1-CG2 3.71Å; M75-I114 HydrophobicContact CG-CG1 4.34Å; I112-I114 HydrophobicContact CG2-CD1 4.03Å; I112-I114 HydrophobicContact CG2-CG1 3.76Å; I114-Y128 HydrophobicContact CD1-CD1 3.58Å; I114-Y128 HydrophobicContact CD1-CD2 3.87Å; I114-Y128 HydrophobicContact CD1-CE1 3.94Å; I114-Y128 HydrophobicContact CD1-CE2 4.15Å; I114-Y128 HydrophobicContact CD1-CG 3.56Å; I114-F159 HydrophobicContact CD1-CD1 4.42Å; I114-F159 PolarHBondContact N-O 3.31Å; I114-F159 PolarHBondContact O-N 2.93Å; I114-F182 HydrophobicContact CB-CE2 4.4Å; I114-F182 HydrophobicContact CB-CZ 3.92Å; I114-F182 HydrophobicContact CD1-CE2 3.61Å; I114-F182 HydrophobicContact CD1-CZ 3.43Å; I114-F182 VanDerWaalsContact CD1-CZ 3.43Å; I114-F182 HydrophobicContact CG1-CE2 4.39Å; I114-F182 HydrophobicContact CG1-CZ 4.17Å; I114-F182 HydrophobicContact CG2-CE1 4.38Å; I114-F182 HydrophobicContact CG2-CE2 3.56Å; I114-F182 HydrophobicContact CG2-CZ 3.32Å
115	N	97.6	Very high	94.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	132.3	175.2	-70	101.7	0	0	0	109	T73 R74 E156 Y157 E158	T73-N115 PolarHBondContact N-O 3.01Å; T73-N115 WeakPolarHBondContact OG1-CB 3.24Å; T73-N115 PolarHBondContact OG1-O 3.27Å; R74-N115 HydrophobicContact CB-CB 4.19Å; R74-N115 PolarHBondContact N-O 3.07Å; R74-N115 PolarHBondContact NE-OD1 3.45Å; R74-N115 PolarHBondContact NH2-OD1 3.4Å; R74-N115 PolarHBondContact O-N 3.08Å; N115-E156 WeakPolarHBondContact CB-OE2 3.4Å; N115-E156 PolarHBondContact ND2-OE2 3.04Å; N115-Y157 WeakPolarHBondContact CA-O 3.42Å; N115-E158 WeakPolarHBondContact ND2-CG 3.44Å; N115-E158 PolarHBondContact ND2-OE1 2.95Å; N115-E158 VanDerWaalsContact ND2-OE1 3.08Å
116	F	96.9	Very high	94.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	158.7	178.5	63.4	-83.9	0	0	0	111.4	V70 Q71 V72 V118 L126 V146 Y149 E156 Y157 F159	V70-F116 HydrophobicContact CG1-CD2 4.5Å; Q71-F116 CarbonylContact O-C 3.54Å; Q71-F116 VanDerWaalsContact O-CA 3.22Å; Q71-F116 WeakPolarHBondContact O-CA 3.45Å; V72-F116 HydrophobicContact CG2-CB 4.46Å; F116-V118 HydrophobicContact CD2-CG2 4.18Å; F116-V118 HydrophobicContact CE2-CG2 4.09Å; F116-L126 HydrophobicContact CD2-CD2 3.95Å; F116-L126 HydrophobicContact CE1-CD2 4.34Å; F116-L126 HydrophobicContact CE2-CD2 3.59Å; F116-L126 HydrophobicContact CG-CD2 4.46Å; F116-L126 HydrophobicContact CZ-CD2 3.81Å; F116-V146 HydrophobicContact CE1-CG1 3.92Å; F116-V146 HydrophobicContact CZ-CG1 3.95Å; F116-Y149 HydrophobicContact CE2-CD1 4.38Å; F116-Y149 HydrophobicContact CE2-CD2 4.05Å; F116-Y149 HydrophobicContact CE2-CE2 4.4Å; F116-Y149 HydrophobicContact CE2-CG 4.07Å; F116-Y149 HydrophobicContact CZ-CD1 4.19Å; F116-Y149 AromaticContact CZ-CD2 3.95Å; F116-Y149 HydrophobicContact CZ-CD2 3.95Å; F116-Y149 HydrophobicContact CZ-CE1 4.03Å; F116-Y149 AromaticContact CZ-CE2 3.84Å; F116-Y149 HydrophobicContact CZ-CE2 3.84Å; F116-Y149 HydrophobicContact CZ-CG 4.16Å; F116-Y149 AromaticContact CZ-CZ 3.87Å; F116-E156 WeakPolarHBondContact O-CA 3.32Å; F116-Y157 HydrophobicContact CD2-CD2 4.46Å; F116-Y157 HydrophobicContact CE2-CD2 4.03Å; F116-Y157 HydrophobicContact CE2-CG 4.1Å; F116-Y157 VanDerWaalsContact CZ-CB 3.47Å; F116-Y157 HydrophobicContact CZ-CG 4.22Å; F116-Y157 PolarHBondContact N-O 3.17Å; F116-Y157 VanDerWaalsContact N-O 3.15Å; F116-Y157 PolarHBondContact O-N 2.97Å; F116-F159 HydrophobicContact CE1-CB 4.15Å
117	K	95.1	Very high	94.4	Very high	54 Å²	54	32.8 Å²	32.8	24%	0.235	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	147.7	174.3	-62.8	-174	175.3	-166.8	0	110.6	V70 Q71 T73 E156	V70-K117 WeakPolarHBondContact CA-O 3.43Å; Q71-K117 HydrophobicContact CB-CB 4.43Å; Q71-K117 PolarHBondContact N-O 3.36Å; Q71-K117 PolarHBondContact O-N 3.16Å; T73-K117 HydrophobicContact CG2-CG 4.26Å; K117-E156 HydrophobicContact CD-CG 4.37Å; K117-E156 HydrophobicContact CG-CG 3.84Å
118	V	93.9	Very high	94.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	119.3	168.7	-175.1	0	0	0	0	107.2	N69 F116 E121 V123 G150 P151 R152 Y157	N69-V118 CarbonylContact O-C 3.58Å; N69-V118 WeakPolarHBondContact O-CA 3.32Å; F116-V118 HydrophobicContact CD2-CG2 4.18Å; F116-V118 HydrophobicContact CE2-CG2 4.09Å; V118-E121 WeakPolarHBondContact CG1-O 3.38Å; V118-V123 HydrophobicContact CG1-CG1 4.38Å; V118-V123 HydrophobicContact CG2-CG1 3.86Å; V118-G150 WeakPolarHBondContact CB-O 3.47Å; V118-P151 HydrophobicContact CG1-CB 4.46Å; V118-P151 CarbonylContact O-C 3.5Å; V118-P151 VanDerWaalsContact O-CA 3.31Å; V118-P151 WeakPolarHBondContact O-CA 3.37Å; V118-R152 CarbonylContact O-C 3.56Å; V118-R152 PolarHBondContact O-N 3.25Å; V118-Y157 HydrophobicContact CB-CE2 4.25Å; V118-Y157 HydrophobicContact CG2-CD2 4.11Å; V118-Y157 HydrophobicContact CG2-CE2 4.09Å
119	N	91.4	Very high	94.7	Very high	13 Å²	13	32.5 Å²	32.5	7%	0.07	15%	0.147	C	C	.	.			trans	-105.4	-34.8	-162.8	-67.1	-42	0	0	0	113.8	P68 N69	P68-N119 PolarHBondContact O-ND2 2.67Å; N69-N119 PolarHBondContact O-N 2.93Å
120	K	89.3	Confident	94.7	Very high	61 Å²	61	27.5 Å²	27.5	27%	0.265	12%	0.123	S	C	.	.	S	Bend	trans	-125.6	-56.6	-164.5	-64.5	175.1	173.6	172.3	0	113.5	L35 V62 P65 A67 N69	L35-K120 WeakPolarHBondContact CD1-O 3.41Å; V62-K120 HydrophobicContact CG1-CD 4.48Å; V62-K120 HydrophobicContact CG1-CG 3.98Å; V62-K120 HydrophobicContact CG2-CG 4.14Å; P65-K120 PolarHBondContact O-NZ 3.17Å; A67-K120 WeakPolarHBondContact O-CE 3.48Å; A67-K120 PolarHBondContact O-NZ 3.47Å; N69-K120 WeakPolarHBondContact OD1-CA 3.36Å; N69-K120 WeakPolarHBondContact OD1-CB 3.24Å; N69-K120 PolarHBondContact OD1-N 3.38Å
121	E	91.4	Very high	94.8	Very high	72 Å²	72	29.4 Å²	29.4	34%	0.336	13%	0.133	S	C	.	.	S	Bend	trans	-129.1	161.1	-170.4	-66.5	-62	156	0	0	110.8	S34 L35 N69 V118 V123	S34-E121 WeakPolarHBondContact CA-OE2 3.12Å; L35-E121 WeakPolarHBondContact CG-OE2 3.3Å; L35-E121 PolarHBondContact N-OE2 2.98Å; N69-E121 PolarHBondContact ND2-O 2.81Å; N69-E121 PolarHBondContact OD1-N 3.22Å; N69-E121 PolarHBondContact OD1-O 3.45Å; V118-E121 WeakPolarHBondContact CG1-O 3.38Å; E121-V123 PolarHBondContact O-N 2.86Å
122	I	92.5	Very high	94.9	Very high	49 Å²	49	25 Å²	25	25%	0.251	12%	0.118	S	C	.	.			trans	-60	131.2	172.5	-57.9	178.2	0	0	0	109	L35 I38 L56 Y149	L35-I122 HydrophobicContact CD2-CD1 3.85Å; L35-I122 HydrophobicContact CD2-CG1 3.54Å; L35-I122 HydrophobicContact CG-CG1 4.08Å; I38-I122 HydrophobicContact CD1-CD1 3.57Å; L56-I122 HydrophobicContact CD2-CD1 3.7Å; L56-I122 HydrophobicContact CD2-CG1 3.91Å; I122-Y149 WeakPolarHBondContact CA-O 3.39Å
123	V	94.8	Very high	94.9	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.006	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	127.3	165.9	61.5	0	0	0	0	109.3	V70 V118 E121 L126 S148 Y149 D184	V70-V123 HydrophobicContact CG2-CB 3.91Å; V70-V123 HydrophobicContact CG2-CG1 4.21Å; V70-V123 HydrophobicContact CG2-CG2 3.9Å; V118-V123 HydrophobicContact CG1-CG1 4.38Å; V118-V123 HydrophobicContact CG2-CG1 3.86Å; E121-V123 PolarHBondContact O-N 2.86Å; V123-L126 HydrophobicContact CG1-CB 4.49Å; V123-L126 HydrophobicContact CG2-CB 4.1Å; V123-L126 HydrophobicContact CG2-CD1 4.02Å; V123-S148 CarbonylContact O-C 3.55Å; V123-S148 WeakPolarHBondContact O-CA 3.27Å; V123-S148 WeakPolarHBondContact O-CB 3.38Å; V123-Y149 HydrophobicContact CG1-CD2 4.36Å; V123-Y149 PolarHBondContact N-O 3.46Å; V123-Y149 PolarHBondContact O-N 2.9Å; V123-D184 HydrophobicContact CG2-CB 3.88Å
124	S	95.3	Very high	94.8	Very high	27 Å²	27	25.8 Å²	25.8	19%	0.189	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123	-177.3	-64.1	0	0	0	0	111.2	L126 S148 D184 D185	S124-L126 PolarHBondContact O-N 3.36Å; S124-S148 WeakPolarHBondContact CA-OG 3.47Å; S124-D184 WeakPolarHBondContact O-CB 3.35Å; S124-D185 WeakPolarHBondContact O-CB 3.16Å; S124-D185 PolarHBondContact O-N 2.81Å
125	G	95.7	Very high	94.4	Very high	3 Å²	3	31.2 Å²	31.2	3%	0.031	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	62	43.6	175.5	0	0	0	0	0	113.6	R127 S148 D184 D185	G125-R127 PolarHBondContact O-N 2.96Å; G125-S148 PolarHBondContact N-OG 2.98Å; G125-D184 WeakPolarHBondContact O-CA 3.48Å; G125-D185 WeakPolarHBondContact CA-OD2 3.42Å
126	L	97.3	Very high	94	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	134.6	172	-171	65.7	0	0	0	109.1	V70 F116 V123 S124 V146 G147 F182 T183	V70-L126 HydrophobicContact CG1-CD1 4.44Å; F116-L126 HydrophobicContact CD2-CD2 3.95Å; F116-L126 HydrophobicContact CE1-CD2 4.34Å; F116-L126 HydrophobicContact CE2-CD2 3.59Å; F116-L126 HydrophobicContact CG-CD2 4.46Å; F116-L126 HydrophobicContact CZ-CD2 3.81Å; V123-L126 HydrophobicContact CG1-CB 4.49Å; V123-L126 HydrophobicContact CG2-CB 4.1Å; V123-L126 HydrophobicContact CG2-CD1 4.02Å; S124-L126 PolarHBondContact O-N 3.36Å; L126-V146 HydrophobicContact CB-CB 4.14Å; L126-V146 HydrophobicContact CD2-CB 4.34Å; L126-V146 HydrophobicContact CD2-CG1 4.03Å; L126-V146 HydrophobicContact CG-CB 4.17Å; L126-V146 HydrophobicContact CG-CG1 4.42Å; L126-V146 WeakPolarHBondContact O-CA 3.48Å; L126-V146 VanDerWaalsContact O-CB 3.23Å; L126-V146 WeakPolarHBondContact O-CB 3.47Å; L126-V146 PolarHBondContact O-N 3.46Å; L126-G147 WeakPolarHBondContact CB-O 3.14Å; L126-G147 PolarHBondContact N-O 2.95Å; L126-G147 PolarHBondContact O-N 3.2Å; L126-G147 VanDerWaalsContact O-N 3.09Å; L126-F182 HydrophobicContact CD1-CD1 3.86Å; L126-F182 HydrophobicContact CD2-CD1 4.15Å; L126-F182 HydrophobicContact CD2-CE1 4.13Å; L126-F182 HydrophobicContact CG-CD1 3.94Å; L126-F182 HydrophobicContact CG-CE1 4.21Å; L126-T183 CarbonylContact C-O 3.56Å; L126-T183 WeakPolarHBondContact CA-O 3.15Å
127	R	96.1	Very high	93.7	Very high	84 Å²	84	36.3 Å²	36.3	32%	0.317	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	139.1	-174.5	-81.2	180	-86.5	176.7	-9.3	110.3	G125 Y144 M145 F182 T183 D185	G125-R127 PolarHBondContact O-N 2.96Å; R127-Y144 WeakPolarHBondContact CA-O 3.39Å; R127-M145 HydrophobicContact CG-CE 3.86Å; R127-M145 HydrophobicContact CG-SD 3.89Å; R127-F182 WeakPolarHBondContact O-CA 3.42Å; R127-T183 HydrophobicContact CB-CG2 4.13Å; R127-T183 PolarHBondContact N-O 3.05Å; R127-T183 PolarHBondContact O-N 2.99Å; R127-D185 IonicContact CZ-OD1 2.67Å; R127-D185 IonicContact NE-OD1 2.81Å; R127-D185 IonicContact NH2-OD1 3.97Å; R127-D185 PolarHBondContact NH2-OD1 3.05Å
128	Y	96.8	Very high	93.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	116.9	170.6	172.5	-122	0	0	0	108.8	I112 I114 Q130 Y144 S180 F182 W193	I112-Y128 HydrophobicContact CD1-CE1 4.16Å; I114-Y128 HydrophobicContact CD1-CD1 3.58Å; I114-Y128 HydrophobicContact CD1-CD2 3.87Å; I114-Y128 HydrophobicContact CD1-CE1 3.94Å; I114-Y128 HydrophobicContact CD1-CE2 4.15Å; I114-Y128 HydrophobicContact CD1-CG 3.56Å; Y128-Q130 HydrophobicContact CE1-CB 4.16Å; Y128-Q130 PolarHBondContact OH-OE1 2.95Å; Y128-Y144 AromaticContact CD1-CD2 3.41Å; Y128-Y144 HydrophobicContact CD1-CD2 3.41Å; Y128-Y144 VanDerWaalsContact CD1-CD2 3.41Å; Y128-Y144 AromaticContact CD1-CE2 3.89Å; Y128-Y144 HydrophobicContact CD1-CE2 3.89Å; Y128-Y144 HydrophobicContact CD1-CG 4.3Å; Y128-Y144 HydrophobicContact CE1-CD2 4.01Å; Y128-Y144 AromaticContact CE1-CE2 3.99Å; Y128-Y144 HydrophobicContact CE1-CE2 3.99Å; Y128-Y144 HydrophobicContact CG-CD2 4.34Å; Y128-Y144 PolarHBondContact N-O 3.45Å; Y128-Y144 WeakPolarHBondContact O-CD2 3.21Å; Y128-Y144 PolarHBondContact O-N 3.08Å; Y128-S180 PolarHBondContact OH-OG 2.74Å; Y128-F182 AromaticContact CD2-CD2 3.78Å; Y128-F182 HydrophobicContact CD2-CD2 3.78Å; Y128-F182 AromaticContact CD2-CE2 3.41Å; Y128-F182 HydrophobicContact CD2-CE2 3.41Å; Y128-F182 VanDerWaalsContact CD2-CE2 3.41Å; Y128-F182 HydrophobicContact CD2-CZ 4.05Å; Y128-F182 HydrophobicContact CE2-CE2 4.13Å; Y128-F182 AromaticContact CG-CE2 3.99Å; Y128-F182 HydrophobicContact CG-CE2 3.99Å; Y128-F182 HydrophobicContact CG-CZ 4.17Å; Y128-W193 HydrophobicContact CD2-CH2 4.25Å; Y128-W193 AromaticContact CE2-CH2 3.66Å; Y128-W193 HydrophobicContact CE2-CH2 3.66Å; Y128-W193 HydrophobicContact CE2-CZ2 4.02Å
129	N	95.8	Very high	93.7	Very high	34 Å²	34	38.7 Å²	38.7	18%	0.182	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.2	179.6	-57.3	-7.5	0	0	0	108.6	D143 S180 K181	N129-D143 WeakPolarHBondContact CB-OD1 3.38Å; N129-D143 PolarHBondContact OD1-OD1 2.86Å; N129-D143 VanDerWaalsContact OD1-OD1 3.08Å; N129-S180 CarbonylContact O-C 3.56Å; N129-S180 WeakPolarHBondContact O-CA 3.37Å; N129-K181 PolarHBondContact N-O 3.25Å; N129-K181 PolarHBondContact O-N 3.49Å
130	Q	95.2	Very high	93.7	Very high	7 Å²	7	40.1 Å²	40.1	3%	0.033	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.1	179.1	-176.5	173.6	-99	0	0	109.4	Y128 K141 S142 Y144 I178	Y128-Q130 HydrophobicContact CE1-CB 4.16Å; Y128-Q130 PolarHBondContact OH-OE1 2.95Å; Q130-K141 CarbonylContact O-C 3.57Å; Q130-K141 WeakPolarHBondContact O-CA 3.37Å; Q130-S142 PolarHBondContact N-O 2.8Å; Q130-S142 PolarHBondContact O-N 2.89Å; Q130-Y144 HydrophobicContact CB-CE2 4.41Å; Q130-I178 HydrophobicContact CG-CG2 3.53Å
131	Q	96	Very high	93.9	Very high	67 Å²	67	40.3 Å²	40.3	31%	0.313	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.5	172.5	-64.5	-178.7	4.1	0	0	109.4	F133 K141 I178 K179	Q131-F133 HydrophobicContact CB-CD2 4.35Å; Q131-F133 HydrophobicContact CB-CE2 3.52Å; Q131-F133 HydrophobicContact CB-CZ 4.15Å; Q131-K141 HydrophobicContact CG-CG 4.3Å; Q131-I178 CarbonylContact O-C 3.59Å; Q131-I178 WeakPolarHBondContact O-CA 3.28Å; Q131-K179 HydrophobicContact CB-CB 4.43Å; Q131-K179 PolarHBondContact N-O 2.91Å; Q131-K179 PolarHBondContact O-N 3.02Å
132	T	95.1	Very high	94	Very high	16 Å²	16	38 Å²	38	10%	0.098	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.4	-175.7	-54.9	0	0	0	0	109.4	V139 D140 Y176 I178	T132-V139 HydrophobicContact CG2-CG2 4.07Å; T132-V139 WeakPolarHBondContact O-CG2 3.22Å; T132-V139 PolarHBondContact O-N 2.96Å; T132-D140 PolarHBondContact N-O 2.91Å; T132-D140 PolarHBondContact O-N 3.14Å; T132-Y176 HydrophobicContact CG2-CD1 3.63Å; T132-Y176 HydrophobicContact CG2-CE1 4.44Å; T132-Y176 HydrophobicContact CG2-CG 4.25Å; T132-I178 HydrophobicContact CG2-CG1 4.26Å
133	F	94.8	Very high	94	Very high	35 Å²	35	39.5 Å²	39.5	15%	0.154	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.3	-177.9	-62.6	-102.2	0	0	0	111.1	Q131 V137 K138 Y176 N177 K179	Q131-F133 HydrophobicContact CB-CD2 4.35Å; Q131-F133 HydrophobicContact CB-CE2 3.52Å; Q131-F133 HydrophobicContact CB-CZ 4.15Å; F133-V137 CarbonylContact C-O 3.51Å; F133-V137 WeakPolarHBondContact CA-O 3.07Å; F133-K138 HydrophobicContact CD1-CB 3.82Å; F133-K138 HydrophobicContact CD1-CG 4.46Å; F133-K138 HydrophobicContact CE1-CB 3.56Å; F133-K138 HydrophobicContact CE1-CG 4.07Å; F133-K138 HydrophobicContact CZ-CB 4.12Å; F133-K138 HydrophobicContact CZ-CD 4.35Å; F133-K138 HydrophobicContact CZ-CG 4.12Å; F133-Y176 CarbonylContact O-C 3.56Å; F133-Y176 WeakPolarHBondContact O-CA 3.4Å; F133-N177 WeakPolarHBondContact CA-O 3.49Å; F133-N177 HydrophobicContact CB-CB 4.39Å; F133-N177 WeakPolarHBondContact CB-O 3.39Å; F133-N177 PolarHBondContact N-O 2.98Å; F133-N177 PolarHBondContact O-N 2.89Å; F133-K179 HydrophobicContact CD2-CG 4.12Å; F133-K179 HydrophobicContact CE2-CB 4.27Å; F133-K179 HydrophobicContact CE2-CD 3.81Å; F133-K179 HydrophobicContact CE2-CG 3.73Å; F133-K179 HydrophobicContact CZ-CD 4.29Å
134	R	92.6	Very high	93.9	Very high	18 Å²	18	40.5 Å²	40.5	7%	0.068	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	123.7	169.9	-171.6	165.8	-179.7	-170.5	-10.3	109.3	L11 G136 V137 V139 L171 A172 R173 Y176	L11-R134 HydrophobicContact CD2-CB 4.01Å; L11-R134 HydrophobicContact CD2-CG 4.03Å; R134-G136 PolarHBondContact O-N 2.81Å; R134-V137 PolarHBondContact N-O 3.18Å; R134-V137 PolarHBondContact O-N 2.83Å; R134-V139 HydrophobicContact CB-CG1 4.01Å; R134-V139 HydrophobicContact CB-CG2 4.21Å; R134-L171 PolarHBondContact NH1-O 2.84Å; R134-L171 PolarHBondContact NH2-O 3.1Å; R134-A172 PolarHBondContact NH1-O 3.31Å; R134-R173 PolarHBondContact NH2-O 3.26Å; R134-Y176 HydrophobicContact CB-CD1 4Å; R134-Y176 HydrophobicContact CB-CE1 4.05Å; R134-Y176 HydrophobicContact CG-CD1 4.47Å; R134-Y176 HydrophobicContact CG-CE1 4.35Å; R134-Y176 PolarHBondContact NH1-OH 3.34Å
135	K	88.4	Confident	93.9	Very high	114 Å²	114	44.4 Å²	44.4	50%	0.496	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	39.5	-174.9	-60.8	-172.1	173.7	-172.3	0	113.5	D5 L11 V137	D5-K135 VanDerWaalsContact CB-NZ 3.31Å; D5-K135 IonicContact OD1-NZ 2.7Å; D5-K135 PolarHBondContact OD1-NZ 2.8Å; D5-K135 IonicContact OD2-NZ 2.69Å; D5-K135 PolarHBondContact OD2-NZ 2.88Å; L11-K135 HydrophobicContact CD1-CB 4.26Å; K135-V137 PolarHBondContact O-N 2.77Å
136	G	89.1	Confident	93.9	Very high	65 Å²	65	44.7 Å²	44.7	67%	0.67	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.6	-6.1	-179.7	0	0	0	0	0	115.5	R134	R134-G136 PolarHBondContact O-N 2.81Å
137	V	91.5	Very high	93.8	Very high	42 Å²	42	45.6 Å²	45.6	26%	0.255	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	128.9	173.8	-176.8	0	0	0	0	109	L11 F133 R134 K135 V139	L11-V137 HydrophobicContact CB-CB 4.24Å; L11-V137 HydrophobicContact CB-CG1 4.13Å; L11-V137 HydrophobicContact CB-CG2 4.36Å; L11-V137 HydrophobicContact CD1-CB 4.38Å; L11-V137 HydrophobicContact CD1-CG2 4.15Å; F133-V137 CarbonylContact C-O 3.51Å; F133-V137 WeakPolarHBondContact CA-O 3.07Å; R134-V137 PolarHBondContact N-O 3.18Å; R134-V137 PolarHBondContact O-N 2.83Å; K135-V137 PolarHBondContact O-N 2.77Å; V137-V139 PolarHBondContact O-N 3.44Å
138	K	94.4	Very high	93.8	Very high	97 Å²	97	45.3 Å²	45.3	42%	0.422	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	114	171.3	-170.5	-179.9	63.9	171	0	108.1	A15 F133	A15-K138 WeakPolarHBondContact CB-O 3.43Å; F133-K138 HydrophobicContact CD1-CB 3.82Å; F133-K138 HydrophobicContact CD1-CG 4.46Å; F133-K138 HydrophobicContact CE1-CB 3.56Å; F133-K138 HydrophobicContact CE1-CG 4.07Å; F133-K138 HydrophobicContact CZ-CB 4.12Å; F133-K138 HydrophobicContact CZ-CD 4.35Å; F133-K138 HydrophobicContact CZ-CG 4.12Å
139	V	93.5	Very high	93.7	Very high	7 Å²	7	47.5 Å²	47.5	4%	0.042	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-16.7	-176.9	-68.6	0	0	0	0	112.7	L11 I14 N18 T132 R134 V137 Y176	L11-V139 HydrophobicContact CD2-CG1 3.86Å; I14-V139 HydrophobicContact CG2-CB 4.15Å; N18-V139 PolarHBondContact ND2-O 2.7Å; T132-V139 HydrophobicContact CG2-CG2 4.07Å; T132-V139 WeakPolarHBondContact O-CG2 3.22Å; T132-V139 PolarHBondContact O-N 2.96Å; R134-V139 HydrophobicContact CB-CG1 4.01Å; R134-V139 HydrophobicContact CB-CG2 4.21Å; V137-V139 PolarHBondContact O-N 3.44Å; V139-Y176 HydrophobicContact CG2-CD1 4.21Å; V139-Y176 HydrophobicContact CG2-CE1 4.08Å
140	D	92.8	Very high	93.5	Very high	43 Å²	43	46.4 Å²	46.4	23%	0.23	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	153.9	179.4	173.6	58.6	0	0	0	111	T132	T132-D140 PolarHBondContact N-O 2.91Å; T132-D140 PolarHBondContact O-N 3.14Å
141	K	93.4	Very high	93.3	Very high	66 Å²	66	46.8 Å²	46.8	29%	0.287	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	127.3	174.7	-179.8	-171.6	-176	-122.6	0	107.8	Q130 Q131 D143	Q130-K141 CarbonylContact O-C 3.57Å; Q130-K141 WeakPolarHBondContact O-CA 3.37Å; Q131-K141 HydrophobicContact CG-CG 4.3Å; K141-D143 WeakPolarHBondContact CE-OD2 3.44Å; K141-D143 IonicContact NZ-OD1 3.41Å; K141-D143 IonicContact NZ-OD2 3.59Å; K141-D143 PolarHBondContact NZ-OD2 3.17Å
142	S	92.4	Very high	93	Very high	24 Å²	24	48.3 Å²	48.3	17%	0.168	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.2	175.6	-64.1	0	0	0	0	109.8	Q130 Y144	Q130-S142 PolarHBondContact N-O 2.8Å; Q130-S142 PolarHBondContact O-N 2.89Å; S142-Y144 WeakPolarHBondContact CB-OH 3.44Å
143	D	92.6	Very high	92.3	Very high	79 Å²	79	48.2 Å²	48.2	42%	0.422	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	110.8	177.6	-64.4	-72.9	0	0	0	109	N129 K141	N129-D143 WeakPolarHBondContact CB-OD1 3.38Å; N129-D143 PolarHBondContact OD1-OD1 2.86Å; N129-D143 VanDerWaalsContact OD1-OD1 3.08Å; K141-D143 WeakPolarHBondContact CE-OD2 3.44Å; K141-D143 IonicContact NZ-OD1 3.41Å; K141-D143 IonicContact NZ-OD2 3.59Å; K141-D143 PolarHBondContact NZ-OD2 3.17Å
144	Y	94.1	Very high	91.8	Very high	23 Å²	23	53 Å²	53	9%	0.09	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	119	-178	-50.4	-92.9	0	0	0	110.4	R127 Y128 Q130 S142 V146 T161 E164	R127-Y144 WeakPolarHBondContact CA-O 3.39Å; Y128-Y144 AromaticContact CD1-CD2 3.41Å; Y128-Y144 HydrophobicContact CD1-CD2 3.41Å; Y128-Y144 VanDerWaalsContact CD1-CD2 3.41Å; Y128-Y144 AromaticContact CD1-CE2 3.89Å; Y128-Y144 HydrophobicContact CD1-CE2 3.89Å; Y128-Y144 HydrophobicContact CD1-CG 4.3Å; Y128-Y144 HydrophobicContact CE1-CD2 4.01Å; Y128-Y144 AromaticContact CE1-CE2 3.99Å; Y128-Y144 HydrophobicContact CE1-CE2 3.99Å; Y128-Y144 HydrophobicContact CG-CD2 4.34Å; Y128-Y144 PolarHBondContact N-O 3.45Å; Y128-Y144 WeakPolarHBondContact O-CD2 3.21Å; Y128-Y144 PolarHBondContact O-N 3.08Å; Q130-Y144 HydrophobicContact CB-CE2 4.41Å; S142-Y144 WeakPolarHBondContact CB-OH 3.44Å; Y144-V146 PolarHBondContact O-N 3.04Å; Y144-T161 HydrophobicContact CD1-CG2 3.8Å; Y144-T161 HydrophobicContact CD2-CG2 4.24Å; Y144-T161 HydrophobicContact CE1-CG2 3.87Å; Y144-T161 HydrophobicContact CE2-CG2 4.29Å; Y144-T161 HydrophobicContact CG-CG2 3.98Å; Y144-E164 PolarHBondContact OH-OE1 2.83Å
145	M	94.1	Very high	91.7	Very high	108 Å²	108	56.9 Å²	56.9	53%	0.532	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	113.9	169.4	179.6	59.4	72.4	0	0	109.7	R127	R127-M145 HydrophobicContact CG-CE 3.86Å; R127-M145 HydrophobicContact CG-SD 3.89Å
146	V	95.8	Very high	91.9	Very high	10 Å²	10	54.8 Å²	54.8	6%	0.061	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-38.9	178.7	-174.4	0	0	0	0	110.1	F116 L126 Y144 Y149 F159 F182	F116-V146 HydrophobicContact CE1-CG1 3.92Å; F116-V146 HydrophobicContact CZ-CG1 3.95Å; L126-V146 HydrophobicContact CB-CB 4.14Å; L126-V146 HydrophobicContact CD2-CB 4.34Å; L126-V146 HydrophobicContact CD2-CG1 4.03Å; L126-V146 HydrophobicContact CG-CB 4.17Å; L126-V146 HydrophobicContact CG-CG1 4.42Å; L126-V146 WeakPolarHBondContact O-CA 3.48Å; L126-V146 VanDerWaalsContact O-CB 3.23Å; L126-V146 WeakPolarHBondContact O-CB 3.47Å; L126-V146 PolarHBondContact O-N 3.46Å; Y144-V146 PolarHBondContact O-N 3.04Å; V146-Y149 HydrophobicContact CG1-CE2 3.77Å; V146-Y149 WeakPolarHBondContact O-CE2 3.49Å; V146-Y149 PolarHBondContact O-OH 3.39Å; V146-F159 HydrophobicContact CB-CD2 4.24Å; V146-F159 HydrophobicContact CB-CE2 4.42Å; V146-F159 HydrophobicContact CB-CG 4.31Å; V146-F159 HydrophobicContact CG1-CB 3.77Å; V146-F159 HydrophobicContact CG1-CD1 4.27Å; V146-F159 HydrophobicContact CG1-CD2 3.75Å; V146-F159 HydrophobicContact CG1-CE2 4.41Å; V146-F159 HydrophobicContact CG1-CG 3.66Å; V146-F159 HydrophobicContact CG2-CD1 3.92Å; V146-F159 HydrophobicContact CG2-CD2 4.4Å; V146-F159 HydrophobicContact CG2-CE1 3.95Å; V146-F159 HydrophobicContact CG2-CE2 4.44Å; V146-F159 HydrophobicContact CG2-CG 4.14Å; V146-F159 HydrophobicContact CG2-CZ 4.22Å; V146-F182 HydrophobicContact CG2-CE1 4.06Å
147	G	95.3	Very high	92.2	Very high	19 Å²	19	54 Å²	54	20%	0.196	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	115	-165.5	174.5	0	0	0	0	0	114.1	L126	L126-G147 WeakPolarHBondContact CB-O 3.14Å; L126-G147 PolarHBondContact N-O 2.95Å; L126-G147 PolarHBondContact O-N 3.2Å; L126-G147 VanDerWaalsContact O-N 3.09Å
148	S	95.3	Very high	92.5	Very high	77 Å²	77	57.2 Å²	57.2	54%	0.538	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.6	179.8	-55.3	0	0	0	0	111.1	V123 S124 G125	V123-S148 CarbonylContact O-C 3.55Å; V123-S148 WeakPolarHBondContact O-CA 3.27Å; V123-S148 WeakPolarHBondContact O-CB 3.38Å; S124-S148 WeakPolarHBondContact CA-OG 3.47Å; G125-S148 PolarHBondContact N-OG 2.98Å
149	Y	94.6	Very high	92.6	Very high	47 Å²	47	54 Å²	54	18%	0.184	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	136.6	-172.5	-62.1	-95.5	0	0	0	110.6	F116 I122 V123 V146 Y157	F116-Y149 HydrophobicContact CE2-CD1 4.38Å; F116-Y149 HydrophobicContact CE2-CD2 4.05Å; F116-Y149 HydrophobicContact CE2-CE2 4.4Å; F116-Y149 HydrophobicContact CE2-CG 4.07Å; F116-Y149 HydrophobicContact CZ-CD1 4.19Å; F116-Y149 AromaticContact CZ-CD2 3.95Å; F116-Y149 HydrophobicContact CZ-CD2 3.95Å; F116-Y149 HydrophobicContact CZ-CE1 4.03Å; F116-Y149 AromaticContact CZ-CE2 3.84Å; F116-Y149 HydrophobicContact CZ-CE2 3.84Å; F116-Y149 HydrophobicContact CZ-CG 4.16Å; F116-Y149 AromaticContact CZ-CZ 3.87Å; I122-Y149 WeakPolarHBondContact CA-O 3.39Å; V123-Y149 HydrophobicContact CG1-CD2 4.36Å; V123-Y149 PolarHBondContact N-O 3.46Å; V123-Y149 PolarHBondContact O-N 2.9Å; V146-Y149 HydrophobicContact CG1-CE2 3.77Å; V146-Y149 WeakPolarHBondContact O-CE2 3.49Å; V146-Y149 PolarHBondContact O-OH 3.39Å; Y149-Y157 AromaticContact CD1-CD1 3.5Å; Y149-Y157 HydrophobicContact CD1-CD1 3.5Å; Y149-Y157 VanDerWaalsContact CD1-CD1 3.5Å; Y149-Y157 HydrophobicContact CD1-CD2 4.18Å; Y149-Y157 AromaticContact CD1-CE1 3.71Å; Y149-Y157 HydrophobicContact CD1-CE1 3.71Å; Y149-Y157 HydrophobicContact CD1-CE2 4.36Å; Y149-Y157 AromaticContact CD1-CG 3.75Å; Y149-Y157 HydrophobicContact CD1-CG 3.75Å; Y149-Y157 AromaticContact CE1-CD1 3.86Å; Y149-Y157 HydrophobicContact CE1-CD1 3.86Å; Y149-Y157 HydrophobicContact CE1-CE1 4.4Å; Y149-Y157 HydrophobicContact CE1-CG 4.19Å
150	G	92.4	Very high	92.7	Very high	11 Å²	11	57.4 Å²	57.4	11%	0.113	29%	0.292	C	S	.	.			trans	-80.1	168.9	169.8	0	0	0	0	0	111.9	V118 Y157	V118-G150 WeakPolarHBondContact CB-O 3.47Å; G150-Y157 PolarHBondContact O-OH 2.88Å; G150-Y157 VanDerWaalsContact O-OH 3.13Å
151	P	91.2	Very high	92.7	Very high	15 Å²	15	55.7 Å²	55.7	10%	0.097	28%	0.283	C	S	.	.			trans	-69.8	134.1	177.4	32.4	-39	0	0	0	111.9	L35 V118	L35-P151 HydrophobicContact CD1-CG 3.52Å; L35-P151 HydrophobicContact CD2-CG 4.49Å; V118-P151 HydrophobicContact CG1-CB 4.46Å; V118-P151 CarbonylContact O-C 3.5Å; V118-P151 VanDerWaalsContact O-CA 3.31Å; V118-P151 WeakPolarHBondContact O-CA 3.37Å
152	R	88.9	Confident	92.6	Very high	99 Å²	99	57.2 Å²	57.2	37%	0.374	30%	0.299	S	S	.	.			trans	-147.3	74.8	172.6	-168.6	-175.9	-171.4	-169.9	7.5	108.5	V118 D154 E155 Y157	V118-R152 CarbonylContact O-C 3.56Å; V118-R152 PolarHBondContact O-N 3.25Å; R152-D154 PolarHBondContact O-N 2.88Å; R152-E155 HydrophobicContact CG-CB 4.04Å; R152-E155 IonicContact CZ-OE1 2.7Å; R152-E155 VanDerWaalsContact CZ-OE1 3.24Å; R152-E155 IonicContact CZ-OE2 2.75Å; R152-E155 IonicContact NE-OE1 3.31Å; R152-E155 PolarHBondContact NE-OE1 2.94Å; R152-E155 IonicContact NE-OE2 2.79Å; R152-E155 IonicContact NH1-OE2 3.76Å; R152-E155 PolarHBondContact NH1-OE2 3.06Å; R152-E155 IonicContact NH2-OE1 2.59Å; R152-E155 PolarHBondContact NH2-OE1 3.23Å; R152-E155 IonicContact NH2-OE2 3.59Å; R152-E155 PolarHBondContact NH2-OE2 3.41Å; R152-E155 PolarHBondContact O-N 2.75Å; R152-Y157 HydrophobicContact CB-CE2 3.87Å; R152-Y157 WeakPolarHBondContact CB-OH 3.45Å
153	P	81.1	Confident	92.6	Very high	13 Å²	13	60 Å²	60	8%	0.084	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-28.4	-168.7	23.9	-33.9	0	0	0	113.9	A60 A63 E155	A60-P153 HydrophobicContact CB-CG 3.93Å; A63-P153 HydrophobicContact CB-CB 4.08Å; A63-P153 HydrophobicContact CB-CG 4.4Å; P153-E155 VanDerWaalsContact C-N 3.35Å
154	D	84.9	Confident	92.4	Very high	137 Å²	137	58 Å²	58	73%	0.733	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-13.6	-175.9	-59.2	-46	0	0	0	113.7	R152	R152-D154 PolarHBondContact O-N 2.88Å
155	E	89	Confident	92.3	Very high	98 Å²	98	61.7 Å²	61.7	46%	0.458	32%	0.317	S	S	.	.	S	Bend	trans	-139	148.8	-173.8	-64.1	-173.7	-119.3	0	0	112.5	R152 P153	R152-E155 HydrophobicContact CG-CB 4.04Å; R152-E155 IonicContact CZ-OE1 2.7Å; R152-E155 VanDerWaalsContact CZ-OE1 3.24Å; R152-E155 IonicContact CZ-OE2 2.75Å; R152-E155 IonicContact NE-OE1 3.31Å; R152-E155 PolarHBondContact NE-OE1 2.94Å; R152-E155 IonicContact NE-OE2 2.79Å; R152-E155 IonicContact NH1-OE2 3.76Å; R152-E155 PolarHBondContact NH1-OE2 3.06Å; R152-E155 IonicContact NH2-OE1 2.59Å; R152-E155 PolarHBondContact NH2-OE1 3.23Å; R152-E155 IonicContact NH2-OE2 3.59Å; R152-E155 PolarHBondContact NH2-OE2 3.41Å; R152-E155 PolarHBondContact O-N 2.75Å; P153-E155 VanDerWaalsContact C-N 3.35Å
156	E	93.6	Very high	92.2	Very high	71 Å²	71	56.5 Å²	56.5	33%	0.332	29%	0.292	S	S	.	.			trans	-86.2	142.4	176.6	-61.2	-173.1	150.8	0	0	111.1	T73 N115 F116 K117	T73-E156 VanDerWaalsContact CB-OE1 3.24Å; T73-E156 WeakPolarHBondContact CB-OE1 3.48Å; T73-E156 VanDerWaalsContact CG2-OE1 3.24Å; T73-E156 WeakPolarHBondContact CG2-OE1 3.32Å; T73-E156 PolarHBondContact OG1-OE1 2.76Å; N115-E156 WeakPolarHBondContact CB-OE2 3.4Å; N115-E156 PolarHBondContact ND2-OE2 3.04Å; F116-E156 WeakPolarHBondContact O-CA 3.32Å; K117-E156 HydrophobicContact CD-CG 4.37Å; K117-E156 HydrophobicContact CG-CG 3.84Å
157	Y	96.1	Very high	92	Very high	49 Å²	49	58.8 Å²	58.8	19%	0.192	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	150.5	160.1	-68.3	-76.6	0	0	0	109.8	N115 F116 V118 Y149 G150 R152	N115-Y157 WeakPolarHBondContact CA-O 3.42Å; F116-Y157 HydrophobicContact CD2-CD2 4.46Å; F116-Y157 HydrophobicContact CE2-CD2 4.03Å; F116-Y157 HydrophobicContact CE2-CG 4.1Å; F116-Y157 VanDerWaalsContact CZ-CB 3.47Å; F116-Y157 HydrophobicContact CZ-CG 4.22Å; F116-Y157 PolarHBondContact N-O 3.17Å; F116-Y157 VanDerWaalsContact N-O 3.15Å; F116-Y157 PolarHBondContact O-N 2.97Å; V118-Y157 HydrophobicContact CB-CE2 4.25Å; V118-Y157 HydrophobicContact CG2-CD2 4.11Å; V118-Y157 HydrophobicContact CG2-CE2 4.09Å; Y149-Y157 AromaticContact CD1-CD1 3.5Å; Y149-Y157 HydrophobicContact CD1-CD1 3.5Å; Y149-Y157 VanDerWaalsContact CD1-CD1 3.5Å; Y149-Y157 HydrophobicContact CD1-CD2 4.18Å; Y149-Y157 AromaticContact CD1-CE1 3.71Å; Y149-Y157 HydrophobicContact CD1-CE1 3.71Å; Y149-Y157 HydrophobicContact CD1-CE2 4.36Å; Y149-Y157 AromaticContact CD1-CG 3.75Å; Y149-Y157 HydrophobicContact CD1-CG 3.75Å; Y149-Y157 AromaticContact CE1-CD1 3.86Å; Y149-Y157 HydrophobicContact CE1-CD1 3.86Å; Y149-Y157 HydrophobicContact CE1-CE1 4.4Å; Y149-Y157 HydrophobicContact CE1-CG 4.19Å; G150-Y157 PolarHBondContact O-OH 2.88Å; G150-Y157 VanDerWaalsContact O-OH 3.13Å; R152-Y157 HydrophobicContact CB-CE2 3.87Å; R152-Y157 WeakPolarHBondContact CB-OH 3.45Å
158	E	96.6	Very high	91.8	Very high	108 Å²	108	64.5 Å²	64.5	51%	0.505	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.5	175.6	-48.9	-158.2	133.6	0	0	109.5	K113 N115	K113-E158 WeakPolarHBondContact CE-OE1 3.38Å; K113-E158 WeakPolarHBondContact CE-OE2 3.43Å; K113-E158 IonicContact NZ-OE1 3.83Å; K113-E158 PolarHBondContact NZ-OE1 2.76Å; K113-E158 IonicContact NZ-OE2 3.89Å; K113-E158 PolarHBondContact NZ-OE2 2.79Å; N115-E158 WeakPolarHBondContact ND2-CG 3.44Å; N115-E158 PolarHBondContact ND2-OE1 2.95Å; N115-E158 VanDerWaalsContact ND2-OE1 3.08Å
159	F	96.1	Very high	91.6	Very high	30 Å²	30	62.3 Å²	62.3	13%	0.132	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	138.8	170.9	176	-106.9	0	0	0	109.9	K113 I114 F116 V146 T161	K113-F159 CarbonylContact C-O 3.59Å; K113-F159 VanDerWaalsContact CA-O 3.3Å; K113-F159 WeakPolarHBondContact CA-O 3.48Å; I114-F159 HydrophobicContact CD1-CD1 4.42Å; I114-F159 PolarHBondContact N-O 3.31Å; I114-F159 PolarHBondContact O-N 2.93Å; F116-F159 HydrophobicContact CE1-CB 4.15Å; V146-F159 HydrophobicContact CB-CD2 4.24Å; V146-F159 HydrophobicContact CB-CE2 4.42Å; V146-F159 HydrophobicContact CB-CG 4.31Å; V146-F159 HydrophobicContact CG1-CB 3.77Å; V146-F159 HydrophobicContact CG1-CD1 4.27Å; V146-F159 HydrophobicContact CG1-CD2 3.75Å; V146-F159 HydrophobicContact CG1-CE2 4.41Å; V146-F159 HydrophobicContact CG1-CG 3.66Å; V146-F159 HydrophobicContact CG2-CD1 3.92Å; V146-F159 HydrophobicContact CG2-CD2 4.4Å; V146-F159 HydrophobicContact CG2-CE1 3.95Å; V146-F159 HydrophobicContact CG2-CE2 4.44Å; V146-F159 HydrophobicContact CG2-CG 4.14Å; V146-F159 HydrophobicContact CG2-CZ 4.22Å; F159-T161 HydrophobicContact CE1-CG2 3.9Å
160	L	95.5	Very high	91.1	Very high	79 Å²	79	64.5 Å²	64.5	41%	0.414	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.7	175.7	-72.2	167.3	0	0	0	108.6	M78 I112 K113	M78-L160 HydrophobicContact SD-CD2 3.58Å; M78-L160 VanDerWaalsContact SD-CD2 3.58Å; I112-L160 WeakPolarHBondContact O-CA 3.46Å; K113-L160 HydrophobicContact CB-CD2 3.54Å; K113-L160 HydrophobicContact CD-CD2 4.14Å; K113-L160 HydrophobicContact CG-CD2 3.81Å
161	T	93.6	Very high	90.8	Very high	6 Å²	6	67.9 Å²	67.9	4%	0.037	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-67.7	168	170.7	64.5	0	0	0	0	111	I112 Y144 F159	I112-T161 HydrophobicContact CB-CG2 3.8Å; I112-T161 PolarHBondContact N-OG1 2.93Å; I112-T161 PolarHBondContact O-N 2.87Å; Y144-T161 HydrophobicContact CD1-CG2 3.8Å; Y144-T161 HydrophobicContact CD2-CG2 4.24Å; Y144-T161 HydrophobicContact CE1-CG2 3.87Å; Y144-T161 HydrophobicContact CE2-CG2 4.29Å; Y144-T161 HydrophobicContact CG-CG2 3.98Å; F159-T161 HydrophobicContact CE1-CG2 3.9Å
162	T	91.3	Very high	90.6	Very high	99 Å²	99	67.9 Å²	67.9	61%	0.607	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-58.3	157.3	166	44.8	0	0	0	0	111
163	L	91.9	Very high	90.8	Very high	82 Å²	82	67.1 Å²	67.1	43%	0.429	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-68	130.3	174.9	-169.7	69.9	0	0	0	109.6	E109 R111	E109-L163 HydrophobicContact CB-CD1 3.98Å; E109-L163 HydrophobicContact CB-CG 4.27Å; E109-L163 WeakPolarHBondContact OE1-CD2 3.24Å; R111-L163 HydrophobicContact CG-CB 4.49Å; R111-L163 HydrophobicContact CG-CD1 3.83Å
164	E	89.9	Confident	91.4	Very high	37 Å²	37	67.4 Å²	67.4	17%	0.173	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	149.1	179.2	-69.5	178.8	-178.4	0	0	110.6	E109 Y110 Y144	E109-E164 CarbonylContact C-O 3.53Å; E109-E164 WeakPolarHBondContact CA-O 3.35Å; Y110-E164 HydrophobicContact CD1-CB 4.49Å; Y110-E164 HydrophobicContact CE1-CB 3.96Å; Y110-E164 HydrophobicContact CE2-CB 4.04Å; Y110-E164 WeakPolarHBondContact CE2-OE2 3.21Å; Y110-E164 VanDerWaalsContact CZ-OE2 3.27Å; Y110-E164 PolarHBondContact N-O 3.16Å; Y110-E164 PolarHBondContact O-N 3.02Å; Y110-E164 PolarHBondContact OH-OE2 2.97Å; Y144-E164 PolarHBondContact OH-OE1 2.83Å
165	E	91.6	Very high	91.9	Very high	100 Å²	100	64.4 Å²	64.4	47%	0.467	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.1	172.7	-175.8	-179.1	128.1	0	0	109.1	K168	E165-K168 IonicContact OE1-NZ 3.42Å; E165-K168 PolarHBondContact OE1-NZ 2.77Å
166	A	92.3	Very high	92.1	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-61.5	133.6	173.8	0	0	0	0	0	110.1	L104 G107 V108 Y110	L104-A166 HydrophobicContact CD2-CB 3.68Å; L104-A166 HydrophobicContact CG-CB 4.11Å; G107-A166 WeakPolarHBondContact CA-O 3.23Å; G107-A166 PolarHBondContact N-O 3.31Å; V108-A166 HydrophobicContact CG2-CB 4.29Å; V108-A166 PolarHBondContact O-N 2.93Å; Y110-A166 HydrophobicContact CD1-CB 4.36Å; Y110-A166 HydrophobicContact CE1-CB 4.19Å
167	P	91.6	Very high	92.3	Very high	58 Å²	58	60 Å²	60	38%	0.377	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-62.1	146.9	-177.3	28.8	-38.4	0	0	0	111.1	E106 A172 I199	E106-P167 WeakPolarHBondContact CB-O 3.44Å; P167-A172 HydrophobicContact CB-CB 3.8Å; P167-A172 HydrophobicContact CG-CB 4.24Å; P167-I199 HydrophobicContact CG-CD1 3.39Å
168	K	91.4	Very high	92.3	Very high	139 Å²	139	57.9 Å²	57.9	60%	0.604	31%	0.306	S	S	*	.			trans	-121.5	155.3	-172.7	67	-171.1	168.6	-138.6	0	113.8	E106 E165	E106-K168 HydrophobicContact CB-CB 4.37Å; E106-K168 HydrophobicContact CG-CB 4.47Å; E165-K168 IonicContact OE1-NZ 3.42Å; E165-K168 PolarHBondContact OE1-NZ 2.77Å
169	G	89.6	Confident	92.3	Very high	31 Å²	31	57 Å²	57	32%	0.32	30%	0.301	S	S	.	.	S	Bend	trans	105.9	163.6	177.2	0	0	0	0	0	112.7	E106 L171 A172 R173	E106-G169 PolarHBondContact OE2-N 2.48Å; G169-L171 PolarHBondContact O-N 2.94Å; G169-L171 VanDerWaalsContact O-N 3.16Å; G169-A172 PolarHBondContact O-N 2.74Å; G169-R173 PolarHBondContact O-N 2.85Å; G169-R173 VanDerWaalsContact O-N 3.17Å
170	M	85.3	Confident	92.3	Very high	93 Å²	93	55.7 Å²	55.7	46%	0.458	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-34.3	-178.2	-170.2	168.3	171.6	0	0	113.3	A2 Q4 R173	A2-M170 WeakPolarHBondContact O-CE 3.4Å; Q4-M170 HydrophobicContact CB-CE 4.35Å; M170-R173 VanDerWaalsContact CA-NH2 3.26Å
171	L	84.4	Confident	92.4	Very high	82 Å²	82	55 Å²	55	43%	0.429	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-32	178.1	-64.5	-176.6	0	0	0	112.6	L6 R134 G169	L6-L171 WeakPolarHBondContact CD1-O 3.48Å; L6-L171 HydrophobicContact CD2-CB 4.06Å; L6-L171 HydrophobicContact CD2-CD1 4.47Å; L6-L171 HydrophobicContact CD2-CD2 3.78Å; L6-L171 HydrophobicContact CD2-CG 4.3Å; R134-L171 PolarHBondContact NH1-O 2.84Å; R134-L171 PolarHBondContact NH2-O 3.1Å; G169-L171 PolarHBondContact O-N 2.94Å; G169-L171 VanDerWaalsContact O-N 3.16Å
172	A	87.9	Confident	92.5	Very high	14 Å²	14	54.8 Å²	54.8	12%	0.116	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-29.9	179.6	0	0	0	0	0	113.1	R134 P167 G169 Y176	R134-A172 PolarHBondContact NH1-O 3.31Å; P167-A172 HydrophobicContact CB-CB 3.8Å; P167-A172 HydrophobicContact CG-CB 4.24Å; G169-A172 PolarHBondContact O-N 2.74Å; A172-Y176 VanDerWaalsContact O-CE2 3.31Å; A172-Y176 WeakPolarHBondContact O-CE2 3.25Å; A172-Y176 PolarHBondContact O-OH 3.39Å
173	R	93.8	Very high	92.8	Very high	84 Å²	84	50.7 Å²	50.7	32%	0.317	26%	0.263	S	S	.	.			trans	-62	138.5	179.1	-72.3	-179.9	-81.7	150	-2.8	112	E106 R134 G169 M170 I199	E106-R173 IonicContact OE1-NE 3.27Å; E106-R173 WeakPolarHBondContact OE2-CD 3.43Å; E106-R173 WeakPolarHBondContact OE2-CG 3.49Å; E106-R173 IonicContact OE2-NE 3.24Å; E106-R173 PolarHBondContact OE2-NE 3.06Å; R134-R173 PolarHBondContact NH2-O 3.26Å; G169-R173 PolarHBondContact O-N 2.85Å; G169-R173 VanDerWaalsContact O-N 3.17Å; M170-R173 VanDerWaalsContact CA-NH2 3.26Å; R173-I199 VanDerWaalsContact CA-O 3.32Å; R173-I199 WeakPolarHBondContact CA-O 3.21Å; R173-I199 HydrophobicContact CG-CG2 4.44Å
174	G	92.9	Very high	93	Very high	19 Å²	19	47 Å²	47	20%	0.196	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.2	-177.4	-178.7	0	0	0	0	0	113.5	Y176 I199	G174-Y176 WeakPolarHBondContact O-CD2 3.32Å; G174-I199 PolarHBondContact N-O 3.19Å; G174-I199 PolarHBondContact O-N 2.95Å
175	T	94.6	Very high	93.2	Very high	73 Å²	73	45.7 Å²	45.7	45%	0.448	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	129.4	-179.3	-52.9	0	0	0	0	111.7	P101 L197	P101-T175 HydrophobicContact CB-CG2 4.47Å; T175-L197 WeakPolarHBondContact CA-O 3.37Å
176	Y	94.9	Very high	93.3	Very high	21 Å²	21	43.4 Å²	43.4	8%	0.082	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	141.7	175.4	-65.3	-98.6	0	0	0	109.3	T132 F133 R134 V139 A172 G174 S196 L197 I199	T132-Y176 HydrophobicContact CG2-CD1 3.63Å; T132-Y176 HydrophobicContact CG2-CE1 4.44Å; T132-Y176 HydrophobicContact CG2-CG 4.25Å; F133-Y176 CarbonylContact O-C 3.56Å; F133-Y176 WeakPolarHBondContact O-CA 3.4Å; R134-Y176 HydrophobicContact CB-CD1 4Å; R134-Y176 HydrophobicContact CB-CE1 4.05Å; R134-Y176 HydrophobicContact CG-CD1 4.47Å; R134-Y176 HydrophobicContact CG-CE1 4.35Å; R134-Y176 PolarHBondContact NH1-OH 3.34Å; V139-Y176 HydrophobicContact CG2-CD1 4.21Å; V139-Y176 HydrophobicContact CG2-CE1 4.08Å; A172-Y176 VanDerWaalsContact O-CE2 3.31Å; A172-Y176 WeakPolarHBondContact O-CE2 3.25Å; A172-Y176 PolarHBondContact O-OH 3.39Å; G174-Y176 WeakPolarHBondContact O-CD2 3.32Å; Y176-S196 VanDerWaalsContact O-CA 3.3Å; Y176-S196 WeakPolarHBondContact O-CA 3.3Å; Y176-L197 PolarHBondContact N-O 3.17Å; Y176-L197 PolarHBondContact O-N 3.07Å; Y176-I199 HydrophobicContact CD2-CD1 3.98Å; Y176-I199 HydrophobicContact CD2-CG1 4.01Å; Y176-I199 HydrophobicContact CE2-CB 4.24Å; Y176-I199 HydrophobicContact CE2-CD1 3.6Å; Y176-I199 HydrophobicContact CE2-CG1 3.9Å
177	N	96.2	Very high	93.3	Very high	56 Å²	56	51.8 Å²	51.8	30%	0.299	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123	171.6	-66.1	-95.7	0	0	0	107.2	F133 S196	F133-N177 WeakPolarHBondContact CA-O 3.49Å; F133-N177 HydrophobicContact CB-CB 4.39Å; F133-N177 WeakPolarHBondContact CB-O 3.39Å; F133-N177 PolarHBondContact N-O 2.98Å; F133-N177 PolarHBondContact O-N 2.89Å; N177-S196 PolarHBondContact OD1-OG 3.25Å
178	I	96	Very high	93.5	Very high	5 Å²	5	55 Å²	55	3%	0.026	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	129.3	-175	-58.7	167.9	0	0	0	107.4	Q130 Q131 T132 E194 W195 L197	Q130-I178 HydrophobicContact CG-CG2 3.53Å; Q131-I178 CarbonylContact O-C 3.59Å; Q131-I178 WeakPolarHBondContact O-CA 3.28Å; T132-I178 HydrophobicContact CG2-CG1 4.26Å; I178-E194 CarbonylContact O-C 3.59Å; I178-E194 VanDerWaalsContact O-CA 3.28Å; I178-E194 WeakPolarHBondContact O-CA 3.35Å; I178-W195 HydrophobicContact CB-CD2 4.13Å; I178-W195 HydrophobicContact CB-CG 4.32Å; I178-W195 HydrophobicContact CB-CZ2 4.12Å; I178-W195 HydrophobicContact CD1-CD2 4.14Å; I178-W195 HydrophobicContact CD1-CE3 4.15Å; I178-W195 HydrophobicContact CD1-CH2 3.46Å; I178-W195 VanDerWaalsContact CD1-CH2 3.46Å; I178-W195 HydrophobicContact CD1-CZ2 3.42Å; I178-W195 VanDerWaalsContact CD1-CZ2 3.42Å; I178-W195 HydrophobicContact CD1-CZ3 3.85Å; I178-W195 HydrophobicContact CG1-CZ2 4.36Å; I178-W195 HydrophobicContact CG2-CZ2 3.84Å; I178-W195 VanDerWaalsContact CG2-NE1 3.34Å; I178-W195 PolarHBondContact N-O 3.29Å; I178-W195 PolarHBondContact O-N 2.95Å; I178-L197 HydrophobicContact CD1-CB 3.75Å; I178-L197 HydrophobicContact CD1-CD2 4.1Å
179	K	97.1	Very high	93.7	Very high	88 Å²	88	52.5 Å²	52.5	38%	0.383	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	124.2	169.5	-54.4	-166.1	-176.6	-138	0	108.1	Q131 F133 E194	Q131-K179 HydrophobicContact CB-CB 4.43Å; Q131-K179 PolarHBondContact N-O 2.91Å; Q131-K179 PolarHBondContact O-N 3.02Å; F133-K179 HydrophobicContact CD2-CG 4.12Å; F133-K179 HydrophobicContact CE2-CB 4.27Å; F133-K179 HydrophobicContact CE2-CD 3.81Å; F133-K179 HydrophobicContact CE2-CG 3.73Å; F133-K179 HydrophobicContact CZ-CD 4.29Å; K179-E194 WeakPolarHBondContact CD-OE1 3.31Å; K179-E194 WeakPolarHBondContact CE-OE1 3.37Å; K179-E194 HydrophobicContact CG-CG 4.04Å; K179-E194 IonicContact NZ-OE1 3.31Å; K179-E194 PolarHBondContact NZ-OE1 3.32Å
180	S	96.6	Very high	94.1	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.021	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	139.9	-175.6	-75.4	0	0	0	0	109.8	Y128 N129 S192 W193 W195	Y128-S180 PolarHBondContact OH-OG 2.74Å; N129-S180 CarbonylContact O-C 3.56Å; N129-S180 WeakPolarHBondContact O-CA 3.37Å; S180-S192 WeakPolarHBondContact O-CA 3.34Å; S180-W193 PolarHBondContact N-O 2.97Å; S180-W193 PolarHBondContact O-N 3.18Å; S180-W195 PolarHBondContact OG-NE1 2.61Å
181	K	97	Very high	94.6	Very high	66 Å²	66	50 Å²	50	29%	0.287	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	134.1	-179.4	173.3	166.1	176.4	151.5	0	111.4	N129 D189 L191 S192	N129-K181 PolarHBondContact N-O 3.25Å; N129-K181 PolarHBondContact O-N 3.49Å; K181-D189 WeakPolarHBondContact CE-OD2 3.46Å; K181-D189 VanDerWaalsContact NZ-CG 3.29Å; K181-D189 IonicContact NZ-OD1 2.75Å; K181-D189 IonicContact NZ-OD2 2.71Å; K181-D189 PolarHBondContact NZ-OD2 2.82Å; K181-L191 CarbonylContact C-O 3.52Å; K181-L191 WeakPolarHBondContact CA-O 3.32Å; K181-S192 WeakPolarHBondContact CG-OG 3.32Å
182	F	96.2	Very high	95.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	124.9	164.1	-94	-94.7	0	0	0	110.3	V72 I114 L126 R127 Y128 V146 H190 L191 W193	V72-F182 HydrophobicContact CG1-CD2 4.17Å; V72-F182 HydrophobicContact CG1-CE2 4.05Å; V72-F182 HydrophobicContact CG2-CB 3.98Å; V72-F182 HydrophobicContact CG2-CD1 4.2Å; V72-F182 HydrophobicContact CG2-CD2 3.87Å; V72-F182 HydrophobicContact CG2-CE2 4.42Å; V72-F182 HydrophobicContact CG2-CG 3.73Å; I114-F182 HydrophobicContact CB-CE2 4.4Å; I114-F182 HydrophobicContact CB-CZ 3.92Å; I114-F182 HydrophobicContact CD1-CE2 3.61Å; I114-F182 HydrophobicContact CD1-CZ 3.43Å; I114-F182 VanDerWaalsContact CD1-CZ 3.43Å; I114-F182 HydrophobicContact CG1-CE2 4.39Å; I114-F182 HydrophobicContact CG1-CZ 4.17Å; I114-F182 HydrophobicContact CG2-CE1 4.38Å; I114-F182 HydrophobicContact CG2-CE2 3.56Å; I114-F182 HydrophobicContact CG2-CZ 3.32Å; L126-F182 HydrophobicContact CD1-CD1 3.86Å; L126-F182 HydrophobicContact CD2-CD1 4.15Å; L126-F182 HydrophobicContact CD2-CE1 4.13Å; L126-F182 HydrophobicContact CG-CD1 3.94Å; L126-F182 HydrophobicContact CG-CE1 4.21Å; R127-F182 WeakPolarHBondContact O-CA 3.42Å; Y128-F182 AromaticContact CD2-CD2 3.78Å; Y128-F182 HydrophobicContact CD2-CD2 3.78Å; Y128-F182 AromaticContact CD2-CE2 3.41Å; Y128-F182 HydrophobicContact CD2-CE2 3.41Å; Y128-F182 VanDerWaalsContact CD2-CE2 3.41Å; Y128-F182 HydrophobicContact CD2-CZ 4.05Å; Y128-F182 HydrophobicContact CE2-CE2 4.13Å; Y128-F182 AromaticContact CG-CE2 3.99Å; Y128-F182 HydrophobicContact CG-CE2 3.99Å; Y128-F182 HydrophobicContact CG-CZ 4.17Å; V146-F182 HydrophobicContact CG2-CE1 4.06Å; F182-H190 HydrophobicContact CB-CB 4.11Å; F182-H190 PolarHBondContact O-N 3.2Å; F182-L191 PolarHBondContact N-O 2.85Å; F182-W193 AromaticContact CD2-CH2 3.8Å; F182-W193 HydrophobicContact CD2-CH2 3.8Å; F182-W193 AromaticContact CD2-CZ3 3.85Å; F182-W193 HydrophobicContact CD2-CZ3 3.85Å; F182-W193 AromaticContact CE2-CH2 3.93Å; F182-W193 HydrophobicContact CE2-CH2 3.93Å; F182-W193 HydrophobicContact CE2-CZ3 4.43Å
183	T	97.3	Very high	95.6	Very high	14 Å²	14	48.6 Å²	48.6	9%	0.086	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	170.8	179.4	-170.3	0	0	0	0	110.3	L126 R127 Y188	L126-T183 CarbonylContact C-O 3.56Å; L126-T183 WeakPolarHBondContact CA-O 3.15Å; R127-T183 HydrophobicContact CB-CG2 4.13Å; R127-T183 PolarHBondContact N-O 3.05Å; R127-T183 PolarHBondContact O-N 2.99Å; T183-Y188 WeakPolarHBondContact CA-O 3.33Å; T183-Y188 PolarHBondContact OG1-O 2.87Å
184	D	96.3	Very high	95.7	Very high	5 Å²	5	47.6 Å²	47.6	3%	0.027	24%	0.237	C	C	.	.			trans	-133.6	-173.8	175.9	59.8	15.7	0	0	0	112	V123 S124 G125 D186 K187 Y188 H190	V123-D184 HydrophobicContact CG2-CB 3.88Å; S124-D184 WeakPolarHBondContact O-CB 3.35Å; G125-D184 WeakPolarHBondContact O-CA 3.48Å; D184-D186 PolarHBondContact O-N 3.41Å; D184-D186 WeakPolarHBondContact OD1-CA 3.44Å; D184-D186 WeakPolarHBondContact OD1-CB 3.44Å; D184-D186 PolarHBondContact OD1-N 3.38Å; D184-D186 VanDerWaalsContact OD1-N 3.16Å; D184-K187 PolarHBondContact O-N 3.4Å; D184-K187 PolarHBondContact OD1-N 3.41Å; D184-Y188 PolarHBondContact OD1-N 3.28Å; D184-H190 VanDerWaalsContact CG-NE2 3.34Å; D184-H190 IonicContact OD2-CD2 2.69Å; D184-H190 IonicContact OD2-CE1 3.6Å; D184-H190 PolarHBondContact OD2-CE1 2.85Å; D184-H190 VanDerWaalsContact OD2-CE1 3.31Å; D184-H190 IonicContact OD2-NE2 2.98Å; D184-H190 PolarHBondContact OD2-NE2 2.67Å
185	D	94.4	Very high	95.8	Very high	9 Å²	9	47 Å²	47	5%	0.048	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-23.8	178.5	-71.6	-22.4	0	0	0	113.4	Y27 P29 S124 G125 R127 K187	Y27-D185 WeakPolarHBondContact CE1-OD2 3.4Å; Y27-D185 PolarHBondContact OH-OD2 3.24Å; P29-D185 HydrophobicContact CB-CB 4.01Å; P29-D185 HydrophobicContact CG-CB 4.13Å; S124-D185 WeakPolarHBondContact O-CB 3.16Å; S124-D185 PolarHBondContact O-N 2.81Å; G125-D185 WeakPolarHBondContact CA-OD2 3.42Å; R127-D185 IonicContact CZ-OD1 2.67Å; R127-D185 IonicContact NE-OD1 2.81Å; R127-D185 IonicContact NH2-OD1 3.97Å; R127-D185 PolarHBondContact NH2-OD1 3.05Å; D185-K187 PolarHBondContact O-N 3.3Å
186	D	92.6	Very high	95.8	Very high	51 Å²	51	43.7 Å²	43.7	27%	0.273	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-2.7	173.9	-63.5	-54.2	0	0	0	112.7	Q32 D184 Y188	Q32-D186 WeakPolarHBondContact CG-OD1 3.18Å; Q32-D186 PolarHBondContact NE2-OD1 3.2Å; D184-D186 PolarHBondContact O-N 3.41Å; D184-D186 WeakPolarHBondContact OD1-CA 3.44Å; D184-D186 WeakPolarHBondContact OD1-CB 3.44Å; D184-D186 PolarHBondContact OD1-N 3.38Å; D184-D186 VanDerWaalsContact OD1-N 3.16Å; D186-Y188 HydrophobicContact CB-CD2 3.53Å; D186-Y188 HydrophobicContact CB-CE2 3.44Å; D186-Y188 VanDerWaalsContact CB-CE2 3.44Å; D186-Y188 HydrophobicContact CB-CG 4.39Å; D186-Y188 PolarHBondContact O-N 3.06Å
187	K	93.1	Very high	95.8	Very high	177 Å²	177	43.3 Å²	43.3	77%	0.77	21%	0.208	S	C	*	.			trans	64.7	23.6	-179.9	-50.2	177	-179	178	0	113.5	D184 D185	D184-K187 PolarHBondContact O-N 3.4Å; D184-K187 PolarHBondContact OD1-N 3.41Å; D185-K187 PolarHBondContact O-N 3.3Å
188	Y	95.4	Very high	95.7	Very high	125 Å²	125	40.8 Å²	40.8	49%	0.49	20%	0.195	S	C	.	.			trans	-68.5	136.1	171.9	-66.3	-54	0	0	0	110.4	T183 D184 D186 H190	T183-Y188 WeakPolarHBondContact CA-O 3.33Å; T183-Y188 PolarHBondContact OG1-O 2.87Å; D184-Y188 PolarHBondContact OD1-N 3.28Å; D186-Y188 HydrophobicContact CB-CD2 3.53Å; D186-Y188 HydrophobicContact CB-CE2 3.44Å; D186-Y188 VanDerWaalsContact CB-CE2 3.44Å; D186-Y188 HydrophobicContact CB-CG 4.39Å; D186-Y188 PolarHBondContact O-N 3.06Å; Y188-H190 PolarHBondContact O-N 2.75Å
189	D	96.5	Very high	95.6	Very high	87 Å²	87	40.9 Å²	40.9	47%	0.465	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	98	171.2	-161.6	-27.1	0	0	0	108.6	K181 S192	K181-D189 WeakPolarHBondContact CE-OD2 3.46Å; K181-D189 VanDerWaalsContact NZ-CG 3.29Å; K181-D189 IonicContact NZ-OD1 2.75Å; K181-D189 IonicContact NZ-OD2 2.71Å; K181-D189 PolarHBondContact NZ-OD2 2.82Å; D189-S192 PolarHBondContact OD1-OG 3.47Å; D189-S192 PolarHBondContact OD2-OG 2.71Å; D189-S192 VanDerWaalsContact OD2-OG 3.1Å
190	H	96.8	Very high	95.5	Very high	39 Å²	39	39.7 Å²	39.7	18%	0.181	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-37.6	-177.2	-65.5	-58.4	0	0	0	111.7	V70 F182 D184 Y188	V70-H190 HydrophobicContact CB-CB 4.15Å; V70-H190 HydrophobicContact CG1-CB 4.23Å; F182-H190 HydrophobicContact CB-CB 4.11Å; F182-H190 PolarHBondContact O-N 3.2Å; D184-H190 VanDerWaalsContact CG-NE2 3.34Å; D184-H190 IonicContact OD2-CD2 2.69Å; D184-H190 IonicContact OD2-CE1 3.6Å; D184-H190 PolarHBondContact OD2-CE1 2.85Å; D184-H190 VanDerWaalsContact OD2-CE1 3.31Å; D184-H190 IonicContact OD2-NE2 2.98Å; D184-H190 PolarHBondContact OD2-NE2 2.67Å; Y188-H190 PolarHBondContact O-N 2.75Å
191	L	97.1	Very high	95.4	Very high	32 Å²	32	45.7 Å²	45.7	17%	0.168	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	135.3	173.3	-174	66.2	0	0	0	109.9	V72 L90 L94 K181 F182 W193	V72-L191 HydrophobicContact CB-CB 4.39Å; V72-L191 HydrophobicContact CB-CD2 3.84Å; V72-L191 HydrophobicContact CG1-CD2 4.34Å; V72-L191 HydrophobicContact CG2-CB 4.09Å; V72-L191 HydrophobicContact CG2-CD2 4.42Å; L90-L191 HydrophobicContact CB-CD2 3.81Å; L90-L191 HydrophobicContact CD1-CD2 4Å; L90-L191 HydrophobicContact CD2-CD2 4.43Å; L90-L191 HydrophobicContact CG-CD2 4.29Å; L94-L191 HydrophobicContact CD1-CD1 3.9Å; K181-L191 CarbonylContact C-O 3.52Å; K181-L191 WeakPolarHBondContact CA-O 3.32Å; F182-L191 PolarHBondContact N-O 2.85Å; L191-W193 HydrophobicContact CB-CE3 4.44Å; L191-W193 HydrophobicContact CB-CZ3 4.38Å; L191-W193 HydrophobicContact CD2-CD2 4.48Å; L191-W193 HydrophobicContact CD2-CE3 3.72Å; L191-W193 HydrophobicContact CD2-CZ3 3.88Å; L191-W193 HydrophobicContact CG-CE3 3.76Å; L191-W193 HydrophobicContact CG-CZ3 4.1Å
192	S	96.9	Very high	95.1	Very high	56 Å²	56	45.4 Å²	45.4	39%	0.392	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.1	170.5	-71.7	0	0	0	0	110	S180 K181 D189	S180-S192 WeakPolarHBondContact O-CA 3.34Å; K181-S192 WeakPolarHBondContact CG-OG 3.32Å; D189-S192 PolarHBondContact OD1-OG 3.47Å; D189-S192 PolarHBondContact OD2-OG 2.71Å; D189-S192 VanDerWaalsContact OD2-OG 3.1Å
193	W	96.1	Very high	94.7	Very high	10 Å²	10	47.1 Å²	47.1	4%	0.038	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	160.4	179.4	73	103.3	0	0	0	112	M75 L90 L94 Y128 S180 F182 L191 W195	M75-W193 HydrophobicContact SD-CZ2 3.8Å; L90-W193 HydrophobicContact CD1-CH2 4.01Å; L90-W193 HydrophobicContact CD1-CZ2 3.93Å; L90-W193 HydrophobicContact CD1-CZ3 4.44Å; L90-W193 HydrophobicContact CD2-CD2 3.93Å; L90-W193 HydrophobicContact CD2-CG 4.09Å; L90-W193 HydrophobicContact CD2-CZ2 4.18Å; L94-W193 HydrophobicContact CB-CB 4.4Å; L94-W193 HydrophobicContact CD1-CB 4.18Å; L94-W193 HydrophobicContact CD2-CB 4.5Å; Y128-W193 HydrophobicContact CD2-CH2 4.25Å; Y128-W193 AromaticContact CE2-CH2 3.66Å; Y128-W193 HydrophobicContact CE2-CH2 3.66Å; Y128-W193 HydrophobicContact CE2-CZ2 4.02Å; S180-W193 PolarHBondContact N-O 2.97Å; S180-W193 PolarHBondContact O-N 3.18Å; F182-W193 AromaticContact CD2-CH2 3.8Å; F182-W193 HydrophobicContact CD2-CH2 3.8Å; F182-W193 AromaticContact CD2-CZ3 3.85Å; F182-W193 HydrophobicContact CD2-CZ3 3.85Å; F182-W193 AromaticContact CE2-CH2 3.93Å; F182-W193 HydrophobicContact CE2-CH2 3.93Å; F182-W193 HydrophobicContact CE2-CZ3 4.43Å; L191-W193 HydrophobicContact CB-CE3 4.44Å; L191-W193 HydrophobicContact CB-CZ3 4.38Å; L191-W193 HydrophobicContact CD2-CD2 4.48Å; L191-W193 HydrophobicContact CD2-CE3 3.72Å; L191-W193 HydrophobicContact CD2-CZ3 3.88Å; L191-W193 HydrophobicContact CG-CE3 3.76Å; L191-W193 HydrophobicContact CG-CZ3 4.1Å; W193-W195 AromaticContact CD1-CD1 3.58Å; W193-W195 AromaticContact NE1-CD1 3.33Å; W193-W195 VanDerWaalsContact NE1-CD1 3.33Å; W193-W195 AromaticContact NE1-NE1 3.75Å
194	E	96	Very high	93.7	Very high	63 Å²	63	55.7 Å²	55.7	29%	0.294	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	140.1	174.2	-57.2	-167.3	170.3	0	0	109.7	K98 I178 K179	K98-E194 HydrophobicContact CD-CB 4.47Å; K98-E194 IonicContact NZ-OE2 2.68Å; K98-E194 PolarHBondContact NZ-OE2 3.38Å; I178-E194 CarbonylContact O-C 3.59Å; I178-E194 VanDerWaalsContact O-CA 3.28Å; I178-E194 WeakPolarHBondContact O-CA 3.35Å; K179-E194 WeakPolarHBondContact CD-OE1 3.31Å; K179-E194 WeakPolarHBondContact CE-OE1 3.37Å; K179-E194 HydrophobicContact CG-CG 4.04Å; K179-E194 IonicContact NZ-OE1 3.31Å; K179-E194 PolarHBondContact NZ-OE1 3.32Å
195	W	95.4	Very high	92	Very high	6 Å²	6	61.1 Å²	61.1	2%	0.023	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	163.1	177.9	59.5	-72	0	0	0	110.6	M75 L88 F97 F102 I178 S180 W193 L197	M75-W195 HydrophobicContact CE-CD2 4.05Å; M75-W195 HydrophobicContact CE-CE3 4.24Å; M75-W195 HydrophobicContact CE-CH2 3.66Å; M75-W195 HydrophobicContact CE-CZ2 3.43Å; M75-W195 VanDerWaalsContact CE-CZ2 3.43Å; M75-W195 HydrophobicContact CE-CZ3 4.05Å; M75-W195 HydrophobicContact SD-CZ2 4.3Å; L88-W195 HydrophobicContact CD1-CB 4.18Å; L88-W195 HydrophobicContact CD1-CD2 4.06Å; L88-W195 HydrophobicContact CD1-CE3 4.39Å; L88-W195 HydrophobicContact CD1-CG 3.97Å; F97-W195 HydrophobicContact CB-CB 3.67Å; F102-W195 HydrophobicContact CD2-CE3 4.5Å; I178-W195 HydrophobicContact CB-CD2 4.13Å; I178-W195 HydrophobicContact CB-CG 4.32Å; I178-W195 HydrophobicContact CB-CZ2 4.12Å; I178-W195 HydrophobicContact CD1-CD2 4.14Å; I178-W195 HydrophobicContact CD1-CE3 4.15Å; I178-W195 HydrophobicContact CD1-CH2 3.46Å; I178-W195 VanDerWaalsContact CD1-CH2 3.46Å; I178-W195 HydrophobicContact CD1-CZ2 3.42Å; I178-W195 VanDerWaalsContact CD1-CZ2 3.42Å; I178-W195 HydrophobicContact CD1-CZ3 3.85Å; I178-W195 HydrophobicContact CG1-CZ2 4.36Å; I178-W195 HydrophobicContact CG2-CZ2 3.84Å; I178-W195 VanDerWaalsContact CG2-NE1 3.34Å; I178-W195 PolarHBondContact N-O 3.29Å; I178-W195 PolarHBondContact O-N 2.95Å; S180-W195 PolarHBondContact OG-NE1 2.61Å; W193-W195 AromaticContact CD1-CD1 3.58Å; W193-W195 AromaticContact NE1-CD1 3.33Å; W193-W195 VanDerWaalsContact NE1-CD1 3.33Å; W193-W195 AromaticContact NE1-NE1 3.75Å; W195-L197 HydrophobicContact CZ3-CB 4.21Å; W195-L197 HydrophobicContact CZ3-CD1 4.1Å
196	S	94.4	Very high	91.9	Very high	4 Å²	4	63.7 Å²	63.7	3%	0.028	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	142.5	-178.6	-61.1	0	0	0	0	112.1	F97 K98 P101 F102 Y176 N177	F97-S196 PolarHBondContact O-N 3.34Å; K98-S196 PolarHBondContact O-OG 3.28Å; P101-S196 CarbonylContact C-O 3.52Å; P101-S196 VanDerWaalsContact CA-O 3.25Å; P101-S196 WeakPolarHBondContact CA-O 3.43Å; F102-S196 PolarHBondContact N-O 3.49Å; Y176-S196 VanDerWaalsContact O-CA 3.3Å; Y176-S196 WeakPolarHBondContact O-CA 3.3Å; N177-S196 PolarHBondContact OD1-OG 3.25Å
197	L	93.9	Very high	91.9	Very high	13 Å²	13	64.4 Å²	64.4	7%	0.068	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	125.5	177.9	-174.5	73.2	0	0	0	108.5	L77 F102 L104 T175 Y176 I178 W195 I199	L77-L197 HydrophobicContact CD2-CD1 4.35Å; F102-L197 HydrophobicContact CB-CD1 4.07Å; F102-L197 CarbonylContact O-C 3.48Å; F102-L197 WeakPolarHBondContact O-CA 3.45Å; L104-L197 HydrophobicContact CB-CD1 3.79Å; L104-L197 HydrophobicContact CB-CG 4.31Å; L104-L197 HydrophobicContact CD2-CD1 4.32Å; L104-L197 HydrophobicContact CD2-CD2 4.01Å; T175-L197 WeakPolarHBondContact CA-O 3.37Å; Y176-L197 PolarHBondContact N-O 3.17Å; Y176-L197 PolarHBondContact O-N 3.07Å; I178-L197 HydrophobicContact CD1-CB 3.75Å; I178-L197 HydrophobicContact CD1-CD2 4.1Å; W195-L197 HydrophobicContact CZ3-CB 4.21Å; W195-L197 HydrophobicContact CZ3-CD1 4.1Å; L197-I199 HydrophobicContact CD2-CG1 4.44Å
198	A	94.3	Very high	91.8	Very high	4 Å²	4	58.1 Å²	58.1	3%	0.033	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	112.3	175.7	0	0	0	0	0	109.5	P101 F102 T103 L104	P101-A198 HydrophobicContact CB-CB 4.1Å; F102-A198 PolarHBondContact O-N 3.01Å; T103-A198 WeakPolarHBondContact CA-O 3.45Å; L104-A198 PolarHBondContact N-O 3.28Å
199	I	94.4	Very high	91.6	Very high	7 Å²	7	54.2 Å²	54.2	4%	0.036	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	118.9	175.7	-58.8	-174.9	0	0	0	108.8	L104 E106 P167 R173 G174 Y176 L197	L104-I199 WeakPolarHBondContact O-CA 3.16Å; E106-I199 HydrophobicContact CB-CG2 3.87Å; P167-I199 HydrophobicContact CG-CD1 3.39Å; R173-I199 VanDerWaalsContact CA-O 3.32Å; R173-I199 WeakPolarHBondContact CA-O 3.21Å; R173-I199 HydrophobicContact CG-CG2 4.44Å; G174-I199 PolarHBondContact N-O 3.19Å; G174-I199 PolarHBondContact O-N 2.95Å; Y176-I199 HydrophobicContact CD2-CD1 3.98Å; Y176-I199 HydrophobicContact CD2-CG1 4.01Å; Y176-I199 HydrophobicContact CE2-CB 4.24Å; Y176-I199 HydrophobicContact CE2-CD1 3.6Å; Y176-I199 HydrophobicContact CE2-CG1 3.9Å; L197-I199 HydrophobicContact CD2-CG1 4.44Å
200	K	94.7	Very high	91.3	Very high	62 Å²	62	52.1 Å²	52.1	27%	0.27	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	166.7	-175.7	-61.5	-165.2	-175.1	-177.9	0	111.9	T103 L104 K105 E106 D202 D205	T103-K200 HydrophobicContact CG2-CB 4.12Å; T103-K200 HydrophobicContact CG2-CD 3.8Å; T103-K200 HydrophobicContact CG2-CG 4Å; L104-K200 PolarHBondContact O-N 2.68Å; K105-K200 CarbonylContact C-O 3.6Å; K105-K200 WeakPolarHBondContact CA-O 3.43Å; E106-K200 PolarHBondContact N-O 2.79Å; K200-D202 WeakPolarHBondContact CB-O 3.39Å; K200-D205 HydrophobicContact CB-CB 4.1Å; K200-D205 HydrophobicContact CD-CB 3.73Å; K200-D205 WeakPolarHBondContact CD-O 3.35Å; K200-D205 WeakPolarHBondContact CE-O 3.45Å; K200-D205 PolarHBondContact NZ-O 3.2Å; K200-D205 PolarHBondContact NZ-OXT 3.24Å
201	K	93.8	Very high	90.9	Very high	130 Å²	130	53 Å²	53	57%	0.565	26%	0.256	S	S	*	.	S	Bend	trans	-71.1	-37.3	179.9	-175.2	-180	179.6	-173.6	0	111.2	K105	K105-K201 WeakPolarHBondContact CE-O 3.48Å; K105-K201 WeakPolarHBondContact CG-O 3.15Å
202	D	91.6	Very high	90.5	Very high	59 Å²	59	54.5 Å²	54.5	32%	0.316	26%	0.263	S	S	.	.	S	Bend	trans	-134	165.6	172.1	-148.9	-82	0	0	0	112.1	K105 K200 K204 D205	K105-D202 IonicContact NZ-OD2 2.74Å; K105-D202 PolarHBondContact NZ-OD2 2.68Å; K200-D202 WeakPolarHBondContact CB-O 3.39Å; D202-K204 VanDerWaalsContact C-N 3.26Å; D202-K204 PolarHBondContact O-N 3.31Å; D202-D205 PolarHBondContact N-OD2 3.13Å; D202-D205 PolarHBondContact O-N 3.37Å
203	W	86.9	Confident	90	Very high	36 Å²	36	54.4 Å²	54.4	14%	0.136	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-24	-177.8	-63.7	106.6	0	0	0	113.6	C79 N81 A82 P83 L86 T103 L104 K105 V108	C79-W203 HydrophobicContact CB-CH2 4.2Å; N81-W203 HydrophobicContact CB-CZ2 4.35Å; N81-W203 PolarHBondContact O-NE1 3.41Å; A82-W203 HydrophobicContact CB-CH2 3.68Å; A82-W203 HydrophobicContact CB-CZ2 4.06Å; A82-W203 HydrophobicContact CB-CZ3 4Å; P83-W203 HydrophobicContact CG-CB 3.97Å; P83-W203 HydrophobicContact CG-CG 4.26Å; L86-W203 HydrophobicContact CD1-CZ3 4.16Å; T103-W203 VanDerWaalsContact O-CZ3 3.27Å; T103-W203 WeakPolarHBondContact O-CZ3 3.44Å; L104-W203 HydrophobicContact CD1-CH2 3.62Å; L104-W203 HydrophobicContact CD1-CZ3 3.92Å; K105-W203 HydrophobicContact CB-CD2 3.69Å; K105-W203 VanDerWaalsContact CB-CE2 3.45Å; K105-W203 HydrophobicContact CB-CE3 4.28Å; K105-W203 HydrophobicContact CB-CG 4.03Å; K105-W203 HydrophobicContact CB-CH2 4.47Å; K105-W203 HydrophobicContact CB-CZ2 3.88Å; K105-W203 HydrophobicContact CD-CG 4.44Å; V108-W203 HydrophobicContact CB-CZ2 4.44Å; V108-W203 HydrophobicContact CG1-CZ2 4.06Å; V108-W203 HydrophobicContact CG2-CH2 4.17Å; V108-W203 HydrophobicContact CG2-CZ2 4.04Å
204	K	76.3	Confident	89.5	Confident	194 Å²	194	58.1 Å²	58.1	84%	0.843	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-3.1	-177.5	-63.9	-176.2	-179.7	179.2	0	113.7	D202	D202-K204 VanDerWaalsContact C-N 3.26Å; D202-K204 PolarHBondContact O-N 3.31Å
205	D	62	Low	88.9	Confident	119 Å²	119	57.6 Å²	57.6	64%	0.636	27%	0.269	S	S	*	.			trans	-73.7	0	177.6	-68.3	-21.8	0	0	0	111.4	K200 D202	K200-D205 HydrophobicContact CB-CB 4.1Å; K200-D205 HydrophobicContact CD-CB 3.73Å; K200-D205 WeakPolarHBondContact CD-O 3.35Å; K200-D205 WeakPolarHBondContact CE-O 3.45Å; K200-D205 PolarHBondContact NZ-O 3.2Å; K200-D205 PolarHBondContact NZ-OXT 3.24Å; D202-D205 PolarHBondContact N-OD2 3.13Å; D202-D205 PolarHBondContact O-N 3.37Å

Retrieved 205 of 205 residues in 230.8 ms (Link to these results)

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