A0A060WM35_ONCMY Loading...

Arpin

AlphaFold DB , UniProt , Accession A0A060WM35, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene arpin, Length 226 aa.

Structure Viewer

Loading PAE data...

(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	43	Very low	51.9	Low	240 Å²	240	151.6 Å²	151.6	100%	1.182	77%	0.774	S	S	*	*				0	93.5	0	-69.2	178.7	-155.9	0	0	108.1	R3	M1-R3 PolarHBondContact O-N 3.32Å
2	S	49	Very low	52.8	Low	116 Å²	116	150 Å²	150	81%	0.811	77%	0.768	S	S	*	*			trans	-76.8	110	177.6	-51.1	0	0	0	0	108	I4	S2-I4 VanDerWaalsContact C-N 3.35Å; S2-I4 PolarHBondContact O-N 2.72Å
3	R	54.4	Low	54.4	Low	219 Å²	219	144.8 Å²	144.8	83%	0.826	74%	0.737	S	S	*	*			trans	-65.1	99.6	167.1	-74.8	179.2	177.7	164.6	-1.2	106.7	M1 Y5	M1-R3 PolarHBondContact O-N 3.32Å; R3-Y5 PolarHBondContact O-N 2.93Å
4	I	57.3	Low	56.1	Low	157 Å²	157	141 Å²	141	81%	0.805	73%	0.726	S	S	*	*			trans	-68.5	100.1	172.3	-57.8	172.8	0	0	0	105.6	S2 N6	S2-I4 VanDerWaalsContact C-N 3.35Å; S2-I4 PolarHBondContact O-N 2.72Å; I4-N6 PolarHBondContact O-N 2.98Å
5	Y	56	Low	58.1	Low	199 Å²	199	136.2 Å²	136.2	78%	0.78	71%	0.706	S	S	*	*			trans	-62.6	107.2	170.9	-85.5	-95.1	0	0	0	107.7	R3 N7	R3-Y5 PolarHBondContact O-N 2.93Å; Y5-N7 PolarHBondContact O-N 2.87Å
6	N	51.8	Low	60	Low	132 Å²	132	130.1 Å²	130.1	71%	0.706	67%	0.673	S	S	*	*			trans	-76.2	91.4	174.8	-168.1	-3.8	0	0	0	108.4	I4 T8	I4-N6 PolarHBondContact O-N 2.98Å; N6-T8 VanDerWaalsContact C-N 3.27Å; N6-T8 PolarHBondContact O-N 3.2Å; N6-T8 PolarHBondContact OD1-OG1 3.04Å
7	N	53.7	Low	61.8	Low	95 Å²	95	128.9 Å²	128.9	51%	0.508	67%	0.668	S	S	.	*			trans	-89.5	15.8	-170.6	-154	16.9	0	0	0	113.7	Y5 S9 L10	Y5-N7 PolarHBondContact O-N 2.87Å; N7-S9 PolarHBondContact O-N 3.24Å; N7-L10 PolarHBondContact O-N 2.83Å; N7-L10 VanDerWaalsContact O-N 3.11Å; N7-L10 WeakPolarHBondContact OD1-CB 3.34Å; N7-L10 WeakPolarHBondContact OD1-CD1 3.44Å
8	T	55.1	Low	63.4	Low	97 Å²	97	124.2 Å²	124.2	60%	0.595	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-61.5	-30.8	-172.1	-47.2	0	0	0	0	112.5	N6 L10 Q11	N6-T8 VanDerWaalsContact C-N 3.27Å; N6-T8 PolarHBondContact O-N 3.2Å; N6-T8 PolarHBondContact OD1-OG1 3.04Å; T8-L10 VanDerWaalsContact C-N 3.28Å; T8-L10 PolarHBondContact O-N 2.82Å; T8-Q11 PolarHBondContact O-N 3.16Å
9	S	47.6	Very low	64.8	Low	123 Å²	123	126.1 Å²	126.1	86%	0.86	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-70.8	-17.3	178.3	-47.1	0	0	0	0	114.6	N7	N7-S9 PolarHBondContact O-N 3.24Å
10	L	49.6	Very low	66	Low	142 Å²	142	121 Å²	121	74%	0.743	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-100.9	0.2	-179.5	-72.4	170.6	0	0	0	113.1	N7 T8 N12	N7-L10 PolarHBondContact O-N 2.83Å; N7-L10 VanDerWaalsContact O-N 3.11Å; N7-L10 WeakPolarHBondContact OD1-CB 3.34Å; N7-L10 WeakPolarHBondContact OD1-CD1 3.44Å; T8-L10 VanDerWaalsContact C-N 3.28Å; T8-L10 PolarHBondContact O-N 2.82Å; L10-N12 PolarHBondContact O-N 2.96Å
11	Q	53.6	Low	67	Low	148 Å²	148	124.3 Å²	124.3	69%	0.692	63%	0.632	S	S	*	*	S	Bend	trans	-76.2	124.1	174.6	-67.1	-151.8	-17.9	0	0	110.5	T8 K13	T8-Q11 PolarHBondContact O-N 3.16Å; Q11-K13 PolarHBondContact O-N 2.95Å; Q11-K13 VanDerWaalsContact O-N 3.11Å
12	N	62.9	Low	69.2	Low	132 Å²	132	116.6 Å²	116.6	71%	0.706	59%	0.593	S	S	*	*			trans	-64.9	114.2	174.8	-159.3	9.9	0	0	0	108.3	L10 R46	L10-N12 PolarHBondContact O-N 2.96Å; N12-R46 PolarHBondContact OD1-NH1 2.83Å
13	K	72.9	Confident	71.1	Confident	83 Å²	83	113.8 Å²	113.8	36%	0.361	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-64.7	143.6	-180	-70.9	-170.7	-176.3	177.9	0	110.6	Q11 D43 V44	Q11-K13 PolarHBondContact O-N 2.95Å; Q11-K13 VanDerWaalsContact O-N 3.11Å; K13-D43 IonicContact NZ-OD1 2.9Å; K13-D43 PolarHBondContact NZ-OD1 2.83Å; K13-V44 WeakPolarHBondContact CD-O 3.38Å; K13-V44 PolarHBondContact NZ-O 3.42Å
14	P	78.3	Confident	72.9	Confident	91 Å²	91	104.5 Å²	104.5	59%	0.591	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-59.5	144.3	179	26.1	-34.2	0	0	0	110.5
15	V	86.3	Confident	74.5	Confident	69 Å²	69	98.9 Å²	98.9	42%	0.418	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	118.5	173	-179.5	0	0	0	0	108	N17 R46 V48	V15-N17 PolarHBondContact O-ND2 3.49Å; V15-R46 HydrophobicContact CB-CB 4.47Å; V15-R46 HydrophobicContact CG1-CB 4.38Å; V15-R46 HydrophobicContact CG2-CB 4.05Å; V15-V48 HydrophobicContact CG1-CG2 3.47Å; V15-V48 VanDerWaalsContact CG1-CG2 3.47Å
16	H	89.1	Confident	76.1	Confident	38 Å²	38	90.8 Å²	90.8	18%	0.176	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	126.6	177.3	-58.3	-75.5	0	0	0	109	R46 H47 V48 H132	H16-R46 PolarHBondContact CD2-O 2.83Å; H16-R46 PolarHBondContact N-O 2.81Å; H16-H47 AromaticContact CD2-CE1 3.83Å; H16-H47 AromaticContact CD2-NE2 3.92Å; H16-H47 AromaticContact CG-CE1 3.91Å; H16-H47 CarbonylContact O-C 3.55Å; H16-H47 WeakPolarHBondContact O-CA 3.35Å; H16-V48 PolarHBondContact O-N 3.1Å; H16-H132 AromaticContact CE1-CE1 3.45Å; H16-H132 PolarHBondContact CE1-CE1 2.99Å; H16-H132 VanDerWaalsContact CE1-CE1 3.45Å; H16-H132 AromaticContact CE1-NE2 3.21Å; H16-H132 PolarHBondContact CE1-NE2 3.02Å; H16-H132 AromaticContact ND1-NE2 3.73Å; H16-H132 AromaticContact NE2-CE1 3.74Å; H16-H132 AromaticContact NE2-NE2 3.54Å
17	N	89.8	Confident	77.8	Confident	111 Å²	111	88.7 Å²	88.7	59%	0.594	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	116.5	176.7	-69.5	-93.8	0	0	0	107.6	V15	V15-N17 PolarHBondContact O-ND2 3.49Å
18	E	90.2	Very high	79.6	Confident	43 Å²	43	87.7 Å²	87.7	20%	0.201	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	130.9	-176.9	-61.1	-67.4	167.4	0	0	108.6	V48 I49 T50 V128	E18-V48 PolarHBondContact N-O 3.08Å; E18-I49 HydrophobicContact CB-CD1 3.85Å; E18-I49 HydrophobicContact CG-CD1 4.43Å; E18-I49 WeakPolarHBondContact O-CA 3.36Å; E18-T50 PolarHBondContact O-N 3.17Å; E18-V128 HydrophobicContact CB-CG2 4.2Å; E18-V128 HydrophobicContact CG-CB 4.37Å; E18-V128 HydrophobicContact CG-CG1 3.73Å; E18-V128 HydrophobicContact CG-CG2 4.04Å
19	K	89.9	Confident	81.1	Confident	160 Å²	160	84.6 Å²	84.6	70%	0.696	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	123.9	176.7	-168	177.2	-177.7	-178.6	0	108.4	T50	K19-T50 WeakPolarHBondContact CA-O 3.46Å
20	I	88.8	Confident	83	Confident	25 Å²	25	81.6 Å²	81.6	13%	0.128	44%	0.437	C	S	.	.			trans	-103.1	150	177.9	63	169.8	0	0	0	110.2	H22 W24 I49 T50 D51	I20-H22 VanDerWaalsContact C-N 3.35Å; I20-H22 WeakPolarHBondContact CD1-O 2.9Å; I20-H22 WeakPolarHBondContact CG1-O 3.26Å; I20-W24 HydrophobicContact CD1-CB 3.53Å; I20-W24 HydrophobicContact CD1-CD2 4.02Å; I20-W24 HydrophobicContact CD1-CE3 3.5Å; I20-W24 HydrophobicContact CD1-CG 4.08Å; I20-W24 HydrophobicContact CD1-CZ3 4.48Å; I20-I49 HydrophobicContact CD1-CG2 3.86Å; I20-I49 HydrophobicContact CG1-CG2 4.07Å; I20-I49 HydrophobicContact CG2-CG2 3.97Å; I20-T50 PolarHBondContact N-O 3.29Å; I20-D51 HydrophobicContact CD1-CB 4.17Å; I20-D51 HydrophobicContact CG1-CB 4.18Å
21	E	88.2	Confident	84.9	Confident	190 Å²	190	78.8 Å²	78.8	89%	0.888	43%	0.429	S	S	*	.	S	Bend	trans	-87.3	-5.3	-174	-61.2	-175.6	167.2	0	0	113.5
22	H	88.6	Confident	86.6	Confident	78 Å²	78	74.3 Å²	74.3	36%	0.361	42%	0.422	S	S	.	.	S	Bend	trans	-122.7	171.1	-179.7	61	79.2	0	0	0	111.7	I20 W24 V52	I20-H22 VanDerWaalsContact C-N 3.35Å; I20-H22 WeakPolarHBondContact CD1-O 2.9Å; I20-H22 WeakPolarHBondContact CG1-O 3.26Å; H22-W24 PolarHBondContact O-N 3.2Å; H22-V52 PolarHBondContact O-N 3.44Å
23	A	89.9	Confident	87.8	Confident	57 Å²	57	71.4 Å²	71.4	47%	0.471	41%	0.407	S	S	.	.			trans	-63	131.2	171.4	0	0	0	0	0	109.7	V52	A23-V52 HydrophobicContact CB-CG1 4.46Å
24	W	91.3	Very high	88.7	Confident	24 Å²	24	67.5 Å²	67.5	9%	0.091	39%	0.389	C	S	.	.			trans	-79.7	122.5	179.9	-178.7	-119	0	0	0	110	I20 H22 P26 Y29 I49 D51 D57 F59 L125 W141 F168	I20-W24 HydrophobicContact CD1-CB 3.53Å; I20-W24 HydrophobicContact CD1-CD2 4.02Å; I20-W24 HydrophobicContact CD1-CE3 3.5Å; I20-W24 HydrophobicContact CD1-CG 4.08Å; I20-W24 HydrophobicContact CD1-CZ3 4.48Å; H22-W24 PolarHBondContact O-N 3.2Å; W24-P26 HydrophobicContact CD2-CG 4.45Å; W24-P26 HydrophobicContact CZ2-CG 3.93Å; W24-P26 VanDerWaalsContact NE1-CG 3.32Å; W24-Y29 HydrophobicContact CZ3-CE2 4.24Å; W24-I49 HydrophobicContact CD2-CG2 3.83Å; W24-I49 HydrophobicContact CE3-CG2 3.97Å; W24-I49 HydrophobicContact CG-CG2 4.15Å; W24-I49 HydrophobicContact CH2-CG1 4.47Å; W24-I49 HydrophobicContact CZ2-CG1 4.24Å; W24-I49 HydrophobicContact CZ3-CG2 4.39Å; W24-D51 HydrophobicContact CB-CB 3.66Å; W24-D57 PolarHBondContact NE1-OD2 3.04Å; W24-D57 VanDerWaalsContact NE1-OD2 3.16Å; W24-F59 AromaticContact CE2-CE2 3.88Å; W24-F59 HydrophobicContact CZ2-CD2 4.49Å; W24-F59 AromaticContact CZ2-CE2 3.66Å; W24-F59 HydrophobicContact CZ2-CE2 3.66Å; W24-F59 AromaticContact CZ2-CZ 3.9Å; W24-F59 HydrophobicContact CZ2-CZ 3.9Å; W24-F59 AromaticContact NE1-CE2 3.57Å; W24-F59 AromaticContact NE1-CZ 3.74Å; W24-L125 HydrophobicContact CH2-CD2 3.68Å; W24-L125 HydrophobicContact CZ3-CD2 3.83Å; W24-W141 HydrophobicContact CH2-CH2 4.48Å; W24-W141 HydrophobicContact CH2-CZ3 4.18Å; W24-W141 HydrophobicContact CZ2-CZ3 4.35Å; W24-F168 AromaticContact CH2-CZ 3.97Å; W24-F168 HydrophobicContact CH2-CZ 3.97Å; W24-F168 HydrophobicContact CZ2-CE1 4.24Å; W24-F168 HydrophobicContact CZ2-CZ 4.01Å
25	A	90.5	Very high	89.3	Confident	40 Å²	40	63.2 Å²	63.2	33%	0.331	36%	0.362	S	S	.	.			trans	-142.7	88	178.8	0	0	0	0	0	110.2	S27 S28	A25-S27 PolarHBondContact O-N 2.86Å; A25-S27 VanDerWaalsContact O-N 3.08Å; A25-S28 WeakPolarHBondContact O-CB 3.22Å; A25-S28 PolarHBondContact O-N 3.34Å; A25-S28 VanDerWaalsContact O-N 3.07Å; A25-S28 PolarHBondContact O-OG 3.09Å
26	P	89.1	Confident	89.5	Confident	29 Å²	29	60.1 Å²	60.1	19%	0.188	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-53.8	-30.7	179.5	-29.1	35.7	0	0	0	114.2	W24 S28 Y29 Q30 F59 F168	W24-P26 HydrophobicContact CD2-CG 4.45Å; W24-P26 HydrophobicContact CZ2-CG 3.93Å; W24-P26 VanDerWaalsContact NE1-CG 3.32Å; P26-S28 PolarHBondContact O-N 2.92Å; P26-Y29 PolarHBondContact O-N 2.97Å; P26-Q30 VanDerWaalsContact C-NE2 3.33Å; P26-Q30 WeakPolarHBondContact O-CG 3.38Å; P26-Q30 PolarHBondContact O-NE2 3.22Å; P26-Q30 VanDerWaalsContact O-NE2 3.1Å; P26-F59 HydrophobicContact CG-CZ 4.17Å; P26-F168 HydrophobicContact CB-CD1 4.31Å; P26-F168 HydrophobicContact CB-CE1 3.88Å; P26-F168 HydrophobicContact CB-CE2 4.38Å; P26-F168 HydrophobicContact CB-CZ 3.91Å; P26-F168 HydrophobicContact CG-CE1 4.45Å
27	S	88.9	Confident	89.7	Confident	88 Å²	88	58.3 Å²	58.3	62%	0.615	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-63.2	-24	-179.8	51.6	0	0	0	0	113.6	A25 Y29 Q30	A25-S27 PolarHBondContact O-N 2.86Å; A25-S27 VanDerWaalsContact O-N 3.08Å; S27-Y29 PolarHBondContact O-N 2.79Å; S27-Q30 PolarHBondContact O-N 3.37Å; S27-Q30 VanDerWaalsContact O-N 3.14Å
28	S	90.2	Very high	89.7	Confident	74 Å²	74	54.2 Å²	54.2	52%	0.517	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-65	-24.2	176.3	69.8	0	0	0	0	112.5	A25 P26	A25-S28 WeakPolarHBondContact O-CB 3.22Å; A25-S28 PolarHBondContact O-N 3.34Å; A25-S28 VanDerWaalsContact O-N 3.07Å; A25-S28 PolarHBondContact O-OG 3.09Å; P26-S28 PolarHBondContact O-N 2.92Å
29	Y	87.6	Confident	89.8	Confident	31 Å²	31	52.3 Å²	52.3	12%	0.122	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-95.5	7.8	178.6	-53	-72.9	0	0	0	113.1	W24 P26 S27 K122 L125 G166 F168	W24-Y29 HydrophobicContact CZ3-CE2 4.24Å; P26-Y29 PolarHBondContact O-N 2.97Å; S27-Y29 PolarHBondContact O-N 2.79Å; Y29-K122 HydrophobicContact CD1-CB 4.25Å; Y29-K122 HydrophobicContact CD1-CD 4.44Å; Y29-K122 HydrophobicContact CD1-CG 3.86Å; Y29-K122 HydrophobicContact CE1-CB 4.31Å; Y29-K122 HydrophobicContact CE1-CG 4.42Å; Y29-L125 HydrophobicContact CD2-CD1 4.5Å; Y29-L125 HydrophobicContact CE2-CD2 4.42Å; Y29-L125 HydrophobicContact CG-CD1 4.43Å; Y29-G166 WeakPolarHBondContact O-CA 3.32Å; Y29-F168 AromaticContact CD2-CE2 3.64Å; Y29-F168 HydrophobicContact CD2-CE2 3.64Å; Y29-F168 HydrophobicContact CD2-CZ 4.2Å; Y29-F168 AromaticContact CG-CE2 3.97Å; Y29-F168 HydrophobicContact CG-CE2 3.97Å
30	Q	88.6	Confident	90	Very high	61 Å²	61	49.6 Å²	49.6	29%	0.285	29%	0.292	S	S	.	.			trans	-111.5	19.8	-171.7	-62.5	172.5	27.3	0	0	113.4	P26 S27 K163 F168	P26-Q30 VanDerWaalsContact C-NE2 3.33Å; P26-Q30 WeakPolarHBondContact O-CG 3.38Å; P26-Q30 PolarHBondContact O-NE2 3.22Å; P26-Q30 VanDerWaalsContact O-NE2 3.1Å; S27-Q30 PolarHBondContact O-N 3.37Å; S27-Q30 VanDerWaalsContact O-N 3.14Å; Q30-K163 WeakPolarHBondContact CA-O 3.45Å; Q30-K163 HydrophobicContact CB-CB 4.14Å; Q30-K163 VanDerWaalsContact CB-O 3.26Å; Q30-K163 WeakPolarHBondContact CB-O 3.46Å; Q30-K163 HydrophobicContact CG-CB 3.75Å; Q30-K163 WeakPolarHBondContact CG-O 3.45Å; Q30-F168 HydrophobicContact CG-CB 4.32Å; Q30-F168 HydrophobicContact CG-CD2 4.29Å
31	S	88.4	Confident	90.2	Very high	83 Å²	83	48.4 Å²	48.4	58%	0.58	29%	0.285	S	S	*	.			trans	-78.8	154.2	174.4	59	0	0	0	0	111.4	D165	S31-D165 WeakPolarHBondContact O-CA 3.3Å; S31-D165 VanDerWaalsContact O-CB 3.27Å; S31-D165 WeakPolarHBondContact O-CB 3.32Å; S31-D165 PolarHBondContact O-N 3.06Å
32	G	89.3	Confident	90.4	Very high	53 Å²	53	41.8 Å²	41.8	55%	0.546	26%	0.258	S	S	.	.	S	Bend	trans	94.3	-171.7	178.4	0	0	0	0	0	114.2	D165	G32-D165 WeakPolarHBondContact CA-OD2 3.35Å
33	L	88.9	Confident	90.5	Very high	72 Å²	72	40.6 Å²	40.6	38%	0.377	25%	0.254	S	S	.	.			trans	-82	-35.9	-171.3	-61.2	176.2	0	0	0	111.6	Q71 R72 F74 D165	L33-Q71 HydrophobicContact CB-CG 4.4Å; L33-Q71 HydrophobicContact CD1-CG 4.39Å; L33-R72 WeakPolarHBondContact O-CB 3.29Å; L33-F74 HydrophobicContact CD2-CD2 3.87Å; L33-F74 HydrophobicContact CD2-CE2 4.27Å; L33-D165 PolarHBondContact N-OD1 3.16Å
34	G	90.7	Very high	90.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	24%	0.237	C	C	.	.			trans	77.8	-176.3	-173.2	0	0	0	0	0	114.1	R72 T162 G164 D165	G34-R72 PolarHBondContact O-N 3.28Å; G34-T162 WeakPolarHBondContact CA-OG1 3.39Å; G34-G164 WeakPolarHBondContact CA-O 3.3Å; G34-D165 WeakPolarHBondContact CA-OD1 3.42Å; G34-D165 PolarHBondContact N-OD1 3.05Å
35	V	91.9	Very high	90.4	Very high	1 Å²	1	38 Å²	38	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	151.4	-170.3	-59.8	0	0	0	0	111.6	H70 L111 L116 L119 V120 K161 T162	V35-H70 CarbonylContact C-O 3.54Å; V35-H70 VanDerWaalsContact CA-O 3.3Å; V35-H70 WeakPolarHBondContact CA-O 3.41Å; V35-L111 HydrophobicContact CG1-CD1 3.66Å; V35-L116 HydrophobicContact CG1-CD1 4.45Å; V35-L116 HydrophobicContact CG2-CD1 3.92Å; V35-L119 HydrophobicContact CG1-CD1 3.73Å; V35-V120 HydrophobicContact CG2-CG1 4.4Å; V35-K161 WeakPolarHBondContact O-CA 3.29Å; V35-T162 HydrophobicContact CG2-CG2 3.61Å; V35-T162 PolarHBondContact N-OG1 3.39Å; V35-T162 PolarHBondContact O-N 3.21Å
36	I	90.9	Very high	90.5	Very high	5 Å²	5	39.6 Å²	39.6	3%	0.026	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.1	163.5	-48.4	-162	0	0	0	107.1	H70 R72 P83 F85 R159 L160 K161	I36-H70 PolarHBondContact N-O 2.74Å; I36-H70 PolarHBondContact O-N 3.3Å; I36-R72 HydrophobicContact CD1-CG 4.26Å; I36-R72 HydrophobicContact CG1-CG 3.55Å; I36-P83 HydrophobicContact CD1-CG 3.49Å; I36-P83 VanDerWaalsContact CD1-CG 3.49Å; I36-P83 HydrophobicContact CG1-CG 4.11Å; I36-F85 HydrophobicContact CG2-CZ 4.35Å; I36-R159 HydrophobicContact CG2-CG 4.09Å; I36-L160 WeakPolarHBondContact CA-O 3.37Å; I36-K161 HydrophobicContact CD1-CD 4.26Å; I36-K161 HydrophobicContact CD1-CG 4.34Å; I36-K161 HydrophobicContact CG1-CG 4.19Å; I36-K161 HydrophobicContact CG2-CG 4.41Å
37	L	91.7	Very high	90.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.7	-176.9	-178.6	149.3	0	0	0	109.8	I64 P66 R68 I69 L116 F140 R159 L160	L37-I64 HydrophobicContact CD2-CG2 3.61Å; L37-P66 HydrophobicContact CD1-CB 3.99Å; L37-P66 HydrophobicContact CG-CB 4.35Å; L37-R68 WeakPolarHBondContact CA-O 3.47Å; L37-I69 HydrophobicContact CD1-CG1 4.36Å; L37-L116 HydrophobicContact CD1-CD1 4.06Å; L37-L116 HydrophobicContact CD1-CD2 3.5Å; L37-L116 VanDerWaalsContact CD1-CD2 3.5Å; L37-L116 HydrophobicContact CD1-CG 4.44Å; L37-F140 HydrophobicContact CD1-CE2 3.99Å; L37-F140 HydrophobicContact CD1-CZ 3.74Å; L37-R159 CarbonylContact O-C 3.52Å; L37-R159 VanDerWaalsContact O-CA 3.29Å; L37-R159 WeakPolarHBondContact O-CA 3.4Å; L37-L160 HydrophobicContact CB-CD1 3.87Å; L37-L160 HydrophobicContact CB-CG 4.11Å; L37-L160 HydrophobicContact CD2-CD2 4.38Å; L37-L160 HydrophobicContact CD2-CG 4.27Å; L37-L160 PolarHBondContact N-O 3.38Å; L37-L160 PolarHBondContact O-N 3.03Å
38	E	91.4	Very high	90.8	Very high	25 Å²	25	34.7 Å²	34.7	12%	0.117	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137.9	162.6	-71.7	168	-153.2	0	0	109	S67 R68 I158 R159	E38-S67 PolarHBondContact O-N 3.21Å; E38-R68 HydrophobicContact CB-CB 4.23Å; E38-R68 PolarHBondContact N-O 2.82Å; E38-R68 PolarHBondContact O-N 3.45Å; E38-I158 WeakPolarHBondContact CA-O 3.47Å; E38-R159 HydrophobicContact CG-CB 3.99Å; E38-R159 HydrophobicContact CG-CG 3.85Å; E38-R159 IonicContact OE1-CZ 2.96Å; E38-R159 IonicContact OE1-NE 3.67Å; E38-R159 PolarHBondContact OE1-NE 2.92Å; E38-R159 IonicContact OE1-NH2 3.69Å; E38-R159 PolarHBondContact OE1-NH2 3.4Å
39	G	92.3	Very high	91	Very high	2 Å²	2	31.2 Å²	31.2	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.4	-179.5	179.1	0	0	0	0	0	112.2	K65 I158	G39-K65 CarbonylContact C-O 3.6Å; G39-K65 WeakPolarHBondContact CA-O 3.44Å; G39-I158 PolarHBondContact N-O 2.91Å; G39-I158 WeakPolarHBondContact O-CG1 3.15Å; G39-I158 PolarHBondContact O-N 2.9Å
40	K	93.8	Very high	91.3	Very high	104 Å²	104	30.7 Å²	30.7	45%	0.452	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	128.5	-179.3	-164.8	173.8	-163.1	176.9	0	110.2	V42 I64 K65 G155	K40-V42 PolarHBondContact O-N 3.31Å; K40-I64 WeakPolarHBondContact O-CA 2.95Å; K40-K65 PolarHBondContact N-O 2.97Å; K40-K65 PolarHBondContact O-N 3.33Å; K40-G155 WeakPolarHBondContact CE-O 3.32Å
41	L	92.7	Very high	91.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	113.8	170.6	-177.7	61	0	0	0	108.9	V44 L62 I64 L152 G155 Q156 I158	L41-V44 HydrophobicContact CD1-CG2 3.94Å; L41-V44 HydrophobicContact CD2-CG2 3.91Å; L41-V44 HydrophobicContact CG-CG2 4.2Å; L41-L62 HydrophobicContact CD1-CB 3.85Å; L41-L62 HydrophobicContact CD1-CD2 4.34Å; L41-I64 HydrophobicContact CD1-CG1 4.11Å; L41-L152 HydrophobicContact CD2-CB 3.84Å; L41-L152 HydrophobicContact CD2-CD1 4.3Å; L41-G155 WeakPolarHBondContact O-CA 3.42Å; L41-G155 PolarHBondContact O-N 3.13Å; L41-Q156 PolarHBondContact N-O 2.83Å; L41-I158 HydrophobicContact CB-CD1 4.08Å; L41-I158 HydrophobicContact CB-CG1 4.43Å; L41-I158 HydrophobicContact CD1-CD1 4.37Å
42	V	91.9	Very high	91.7	Very high	51 Å²	51	27.7 Å²	27.7	31%	0.309	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-49	-177.5	-179.8	0	0	0	0	110.5	K40 Y63 K65 L134 T137	K40-V42 PolarHBondContact O-N 3.31Å; V42-Y63 WeakPolarHBondContact CB-O 3.27Å; V42-Y63 PolarHBondContact N-O 3.34Å; V42-K65 HydrophobicContact CG2-CB 3.83Å; V42-L134 HydrophobicContact CG1-CD1 3.89Å; V42-T137 HydrophobicContact CB-CG2 4.2Å; V42-T137 HydrophobicContact CG1-CG2 4.41Å; V42-T137 HydrophobicContact CG2-CG2 3.81Å
43	D	89.8	Confident	91.8	Very high	52 Å²	52	30 Å²	30	28%	0.278	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	166.5	-177	-162.7	19.5	0	0	0	111.5	K13 Y63	K13-D43 IonicContact NZ-OD1 2.9Å; K13-D43 PolarHBondContact NZ-OD1 2.83Å; D43-Y63 HydrophobicContact CB-CD2 3.87Å; D43-Y63 HydrophobicContact CB-CG 4.44Å; D43-Y63 PolarHBondContact N-O 2.82Å; D43-Y63 PolarHBondContact O-N 3.13Å
44	V	90.1	Very high	91.9	Very high	20 Å²	20	32.3 Å²	32.3	12%	0.121	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	130.6	179	-179.9	0	0	0	0	109.4	K13 L41 Y60 V61 L62	K13-V44 WeakPolarHBondContact CD-O 3.38Å; K13-V44 PolarHBondContact NZ-O 3.42Å; L41-V44 HydrophobicContact CD1-CG2 3.94Å; L41-V44 HydrophobicContact CD2-CG2 3.91Å; L41-V44 HydrophobicContact CG-CG2 4.2Å; V44-Y60 HydrophobicContact CG1-CD1 3.66Å; V44-Y60 HydrophobicContact CG1-CE1 4.48Å; V44-V61 WeakPolarHBondContact CA-O 3.41Å; V44-L62 HydrophobicContact CB-CD2 4.38Å; V44-L62 HydrophobicContact CG1-CD2 3.89Å; V44-L62 HydrophobicContact CG2-CD2 3.71Å
45	S	90.7	Very high	92	Very high	7 Å²	7	38 Å²	38	5%	0.049	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	158.6	172.5	63.4	0	0	0	0	111.3	H47 Y60 V61 Y63	S45-H47 PolarHBondContact OG-CD2 2.78Å; S45-H47 PolarHBondContact OG-NE2 2.87Å; S45-Y60 CarbonylContact O-C 3.51Å; S45-Y60 WeakPolarHBondContact O-CA 3.45Å; S45-V61 PolarHBondContact N-O 3.46Å; S45-V61 PolarHBondContact O-N 3.06Å; S45-Y63 VanDerWaalsContact OG-CE2 3.27Å; S45-Y63 WeakPolarHBondContact OG-CE2 3.3Å; S45-Y63 PolarHBondContact OG-OH 3.38Å
46	R	91.3	Very high	92	Very high	73 Å²	73	43.9 Å²	43.9	28%	0.275	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.4	178.3	-71.2	178.4	179.2	158.4	-1	109.7	N12 V15 H16 Y60	N12-R46 PolarHBondContact OD1-NH1 2.83Å; V15-R46 HydrophobicContact CB-CB 4.47Å; V15-R46 HydrophobicContact CG1-CB 4.38Å; V15-R46 HydrophobicContact CG2-CB 4.05Å; H16-R46 PolarHBondContact CD2-O 2.83Å; H16-R46 PolarHBondContact N-O 2.81Å; R46-Y60 HydrophobicContact CG-CD1 3.95Å; R46-Y60 HydrophobicContact CG-CE1 3.68Å; R46-Y60 HydrophobicContact CG-CE2 4.42Å; R46-Y60 HydrophobicContact CG-CG 4.48Å; R46-Y60 VanDerWaalsContact CZ-OH 3.23Å; R46-Y60 VanDerWaalsContact NE-CE1 3.29Å; R46-Y60 PolarHBondContact NE-OH 3.38Å; R46-Y60 PolarHBondContact NH2-OH 2.91Å
47	H	92	Very high	92.1	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.2	-177.1	-68.4	-95.5	0	0	0	110.6	H16 S45 I49 R58 F59 V61 V128	H16-H47 AromaticContact CD2-CE1 3.83Å; H16-H47 AromaticContact CD2-NE2 3.92Å; H16-H47 AromaticContact CG-CE1 3.91Å; H16-H47 CarbonylContact O-C 3.55Å; H16-H47 WeakPolarHBondContact O-CA 3.35Å; S45-H47 PolarHBondContact OG-CD2 2.78Å; S45-H47 PolarHBondContact OG-NE2 2.87Å; H47-I49 HydrophobicContact CB-CD1 4.46Å; H47-R58 WeakPolarHBondContact O-CA 3.38Å; H47-F59 PolarHBondContact N-O 3.14Å; H47-F59 PolarHBondContact O-N 2.82Å; H47-V61 WeakPolarHBondContact CD2-CG2 3.45Å; H47-V128 VanDerWaalsContact ND1-CG1 3.34Å; H47-V128 WeakPolarHBondContact ND1-CG1 3.46Å
48	V	93.6	Very high	92.2	Very high	13 Å²	13	53.4 Å²	53.4	8%	0.079	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	113.2	171.1	-178	0	0	0	0	107	V15 H16 E18 K56 D57 R58	V15-V48 HydrophobicContact CG1-CG2 3.47Å; V15-V48 VanDerWaalsContact CG1-CG2 3.47Å; H16-V48 PolarHBondContact O-N 3.1Å; E18-V48 PolarHBondContact N-O 3.08Å; V48-K56 HydrophobicContact CG1-CB 4.38Å; V48-D57 CarbonylContact C-O 3.56Å; V48-D57 WeakPolarHBondContact CA-O 3.28Å; V48-R58 HydrophobicContact CG1-CG 4.41Å; V48-R58 HydrophobicContact CG2-CG 4.1Å
49	I	93.5	Very high	92.3	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	121.3	177.4	-52	-51.7	0	0	0	107.8	E18 I20 W24 H47 K56 D57 F59 V128 W141	E18-I49 HydrophobicContact CB-CD1 3.85Å; E18-I49 HydrophobicContact CG-CD1 4.43Å; E18-I49 WeakPolarHBondContact O-CA 3.36Å; I20-I49 HydrophobicContact CD1-CG2 3.86Å; I20-I49 HydrophobicContact CG1-CG2 4.07Å; I20-I49 HydrophobicContact CG2-CG2 3.97Å; W24-I49 HydrophobicContact CD2-CG2 3.83Å; W24-I49 HydrophobicContact CE3-CG2 3.97Å; W24-I49 HydrophobicContact CG-CG2 4.15Å; W24-I49 HydrophobicContact CH2-CG1 4.47Å; W24-I49 HydrophobicContact CZ2-CG1 4.24Å; W24-I49 HydrophobicContact CZ3-CG2 4.39Å; H47-I49 HydrophobicContact CB-CD1 4.46Å; I49-K56 VanDerWaalsContact O-CA 3.32Å; I49-K56 WeakPolarHBondContact O-CA 3.49Å; I49-D57 PolarHBondContact N-O 2.91Å; I49-D57 PolarHBondContact O-N 3.1Å; I49-F59 HydrophobicContact CG1-CD2 4.08Å; I49-F59 HydrophobicContact CG1-CE2 4.27Å; I49-V128 HydrophobicContact CD1-CG1 4.47Å; I49-W141 HydrophobicContact CD1-CH2 3.86Å; I49-W141 HydrophobicContact CD1-CZ3 3.83Å; I49-W141 HydrophobicContact CG1-CH2 4.31Å; I49-W141 HydrophobicContact CG1-CZ3 3.82Å
50	T	93.6	Very high	92.2	Very high	19 Å²	19	54.2 Å²	54.2	12%	0.117	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119.1	172.3	-53	0	0	0	0	109.2	E18 K19 I20 Q55 K56	E18-T50 PolarHBondContact O-N 3.17Å; K19-T50 WeakPolarHBondContact CA-O 3.46Å; I20-T50 PolarHBondContact N-O 3.29Å; T50-Q55 WeakPolarHBondContact CA-O 3.4Å; T50-K56 HydrophobicContact CG2-CG 4.18Å
51	D	92.9	Very high	92.2	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	24%	0.242	C	C	.	.			trans	-84.8	177.1	-178.8	90.6	-24.3	0	0	0	113.1	I20 W24 N53 N54 Q55	I20-D51 HydrophobicContact CD1-CB 4.17Å; I20-D51 HydrophobicContact CG1-CB 4.18Å; W24-D51 HydrophobicContact CB-CB 3.66Å; D51-N53 PolarHBondContact O-N 3.11Å; D51-N53 VanDerWaalsContact OD1-C 3.23Å; D51-N53 VanDerWaalsContact OD1-CA 3.26Å; D51-N53 WeakPolarHBondContact OD1-CA 3.44Å; D51-N53 WeakPolarHBondContact OD1-CB 3.48Å; D51-N53 PolarHBondContact OD1-N 2.85Å; D51-N53 PolarHBondContact OD2-ND2 3.27Å; D51-N54 PolarHBondContact O-N 3.34Å; D51-N54 PolarHBondContact OD1-N 3.07Å; D51-Q55 PolarHBondContact N-O 2.92Å; D51-Q55 WeakPolarHBondContact OD1-CA 3.37Å; D51-Q55 WeakPolarHBondContact OD1-CB 3.3Å; D51-Q55 PolarHBondContact OD1-N 3.3Å
52	V	92.8	Very high	92.3	Very high	81 Å²	81	49.3 Å²	49.3	49%	0.491	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-26.1	176.3	69.2	0	0	0	0	113.4	H22 A23 N54	H22-V52 PolarHBondContact O-N 3.44Å; A23-V52 HydrophobicContact CB-CG1 4.46Å; V52-N54 VanDerWaalsContact C-N 3.28Å
53	N	92.4	Very high	92.3	Very high	102 Å²	102	47 Å²	47	55%	0.545	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	5.8	177.9	-53.8	-60.7	0	0	0	112.8	D51 Q55	D51-N53 PolarHBondContact O-N 3.11Å; D51-N53 VanDerWaalsContact OD1-C 3.23Å; D51-N53 VanDerWaalsContact OD1-CA 3.26Å; D51-N53 WeakPolarHBondContact OD1-CA 3.44Å; D51-N53 WeakPolarHBondContact OD1-CB 3.48Å; D51-N53 PolarHBondContact OD1-N 2.85Å; D51-N53 PolarHBondContact OD2-ND2 3.27Å; N53-Q55 HydrophobicContact CB-CG 4.2Å; N53-Q55 PolarHBondContact O-N 3.03Å
54	N	90.2	Very high	92.5	Very high	119 Å²	119	44.5 Å²	44.5	64%	0.636	21%	0.214	S	C	*	.			trans	60.8	20.1	-171.5	-58.3	-64.6	0	0	0	114.7	D51 V52	D51-N54 PolarHBondContact O-N 3.34Å; D51-N54 PolarHBondContact OD1-N 3.07Å; V52-N54 VanDerWaalsContact C-N 3.28Å
55	Q	91.9	Very high	92.7	Very high	119 Å²	119	49.3 Å²	49.3	56%	0.556	23%	0.234	S	C	*	.			trans	-70.6	139.9	166.3	-61.8	-174.2	-11	0	0	109.4	T50 D51 N53	T50-Q55 WeakPolarHBondContact CA-O 3.4Å; D51-Q55 PolarHBondContact N-O 2.92Å; D51-Q55 WeakPolarHBondContact OD1-CA 3.37Å; D51-Q55 WeakPolarHBondContact OD1-CB 3.3Å; D51-Q55 PolarHBondContact OD1-N 3.3Å; N53-Q55 HydrophobicContact CB-CG 4.2Å; N53-Q55 PolarHBondContact O-N 3.03Å
56	K	93.1	Very high	92.8	Very high	126 Å²	126	49.3 Å²	49.3	55%	0.548	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	116.1	-176	-68.1	-173.2	178.8	-177.6	0	110.5	V48 I49 T50	V48-K56 HydrophobicContact CG1-CB 4.38Å; I49-K56 VanDerWaalsContact O-CA 3.32Å; I49-K56 WeakPolarHBondContact O-CA 3.49Å; T50-K56 HydrophobicContact CG2-CG 4.18Å
57	D	92.9	Very high	92.8	Very high	64 Å²	64	50.1 Å²	50.1	34%	0.342	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	140.9	173.6	-76.3	-12.7	0	0	0	111	W24 V48 I49 F59	W24-D57 PolarHBondContact NE1-OD2 3.04Å; W24-D57 VanDerWaalsContact NE1-OD2 3.16Å; V48-D57 CarbonylContact C-O 3.56Å; V48-D57 WeakPolarHBondContact CA-O 3.28Å; I49-D57 PolarHBondContact N-O 2.91Å; I49-D57 PolarHBondContact O-N 3.1Å; D57-F59 HydrophobicContact CB-CD2 4.37Å; D57-F59 HydrophobicContact CB-CE2 3.53Å; D57-F59 HydrophobicContact CB-CZ 4.11Å
58	R	93.1	Very high	92.6	Very high	141 Å²	141	56.7 Å²	56.7	53%	0.532	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.6	-174.8	-55	-170.9	-179.1	100.5	-2.8	110.7	H47 V48 E144	H47-R58 WeakPolarHBondContact O-CA 3.38Å; V48-R58 HydrophobicContact CG1-CG 4.41Å; V48-R58 HydrophobicContact CG2-CG 4.1Å; R58-E144 HydrophobicContact CB-CB 3.97Å; R58-E144 WeakPolarHBondContact CB-OE2 3.3Å; R58-E144 WeakPolarHBondContact CD-OE2 3.36Å; R58-E144 PolarHBondContact O-N 3.33Å
59	F	92.8	Very high	92.4	Very high	13 Å²	13	56.4 Å²	56.4	6%	0.057	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	147.2	-176.7	-64	-85.3	0	0	0	111.5	W24 P26 H47 I49 D57 W141 Y142 P143 F168	W24-F59 AromaticContact CE2-CE2 3.88Å; W24-F59 HydrophobicContact CZ2-CD2 4.49Å; W24-F59 AromaticContact CZ2-CE2 3.66Å; W24-F59 HydrophobicContact CZ2-CE2 3.66Å; W24-F59 AromaticContact CZ2-CZ 3.9Å; W24-F59 HydrophobicContact CZ2-CZ 3.9Å; W24-F59 AromaticContact NE1-CE2 3.57Å; W24-F59 AromaticContact NE1-CZ 3.74Å; P26-F59 HydrophobicContact CG-CZ 4.17Å; H47-F59 PolarHBondContact N-O 3.14Å; H47-F59 PolarHBondContact O-N 2.82Å; I49-F59 HydrophobicContact CG1-CD2 4.08Å; I49-F59 HydrophobicContact CG1-CE2 4.27Å; D57-F59 HydrophobicContact CB-CD2 4.37Å; D57-F59 HydrophobicContact CB-CE2 3.53Å; D57-F59 HydrophobicContact CB-CZ 4.11Å; F59-W141 HydrophobicContact CB-CE3 3.81Å; F59-W141 HydrophobicContact CB-CZ3 4.29Å; F59-W141 HydrophobicContact CD1-CB 4.47Å; F59-W141 HydrophobicContact CD1-CE3 4.15Å; F59-W141 AromaticContact CD2-CE3 3.89Å; F59-W141 HydrophobicContact CD2-CE3 3.89Å; F59-W141 AromaticContact CD2-CZ3 3.98Å; F59-W141 HydrophobicContact CD2-CZ3 3.98Å; F59-W141 AromaticContact CG-CE3 3.68Å; F59-W141 HydrophobicContact CG-CE3 3.68Å; F59-W141 HydrophobicContact CG-CZ3 4.2Å; F59-Y142 CarbonylContact C-O 3.6Å; F59-Y142 WeakPolarHBondContact CA-O 3.26Å; F59-P143 HydrophobicContact CE1-CG 4.32Å; F59-F168 HydrophobicContact CE1-CD1 4.42Å; F59-F168 HydrophobicContact CE1-CE1 4.04Å; F59-F168 HydrophobicContact CZ-CE1 4.35Å
60	Y	92.1	Very high	92.3	Very high	31 Å²	31	56.8 Å²	56.8	12%	0.122	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.8	157.2	-76	-106.2	0	0	0	108	V44 S45 R46 Y142 E144 M147	V44-Y60 HydrophobicContact CG1-CD1 3.66Å; V44-Y60 HydrophobicContact CG1-CE1 4.48Å; S45-Y60 CarbonylContact O-C 3.51Å; S45-Y60 WeakPolarHBondContact O-CA 3.45Å; R46-Y60 HydrophobicContact CG-CD1 3.95Å; R46-Y60 HydrophobicContact CG-CE1 3.68Å; R46-Y60 HydrophobicContact CG-CE2 4.42Å; R46-Y60 HydrophobicContact CG-CG 4.48Å; R46-Y60 VanDerWaalsContact CZ-OH 3.23Å; R46-Y60 VanDerWaalsContact NE-CE1 3.29Å; R46-Y60 PolarHBondContact NE-OH 3.38Å; R46-Y60 PolarHBondContact NH2-OH 2.91Å; Y60-Y142 PolarHBondContact N-O 3.17Å; Y60-Y142 PolarHBondContact O-N 2.89Å; Y60-E144 HydrophobicContact CD2-CB 4.1Å; Y60-E144 HydrophobicContact CD2-CG 4.48Å; Y60-E144 HydrophobicContact CE2-CB 3.98Å; Y60-E144 HydrophobicContact CE2-CG 3.86Å; Y60-M147 HydrophobicContact CD1-CE 4.5Å; Y60-M147 HydrophobicContact CD1-CG 3.83Å; Y60-M147 HydrophobicContact CD1-SD 4.44Å; Y60-M147 HydrophobicContact CD2-CB 3.59Å; Y60-M147 HydrophobicContact CD2-CG 3.59Å; Y60-M147 HydrophobicContact CE1-CG 3.94Å; Y60-M147 HydrophobicContact CE2-CB 3.85Å; Y60-M147 HydrophobicContact CE2-CG 3.73Å; Y60-M147 HydrophobicContact CG-CB 4.04Å; Y60-M147 HydrophobicContact CG-CG 3.63Å; Y60-M147 HydrophobicContact CG-SD 4.38Å
61	V	93.3	Very high	92	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	116.2	171.6	176.4	0	0	0	0	107.6	V44 S45 H47 Y63 T129 A139 F140 W141	V44-V61 WeakPolarHBondContact CA-O 3.41Å; S45-V61 PolarHBondContact N-O 3.46Å; S45-V61 PolarHBondContact O-N 3.06Å; H47-V61 WeakPolarHBondContact CD2-CG2 3.45Å; V61-Y63 HydrophobicContact CG1-CE1 3.98Å; V61-Y63 HydrophobicContact CG1-CE2 4.11Å; V61-T129 HydrophobicContact CG1-CG2 3.8Å; V61-T129 HydrophobicContact CG2-CG2 4.05Å; V61-A139 HydrophobicContact CG1-CB 3.74Å; V61-F140 CarbonylContact C-O 3.57Å; V61-F140 WeakPolarHBondContact CA-O 3.41Å; V61-W141 HydrophobicContact CG2-CD2 3.98Å; V61-W141 HydrophobicContact CG2-CE3 4.27Å; V61-W141 HydrophobicContact CG2-CG 4.32Å; V61-W141 HydrophobicContact CG2-CZ2 4.47Å
62	L	93.4	Very high	91.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	120.4	178.2	-51	-173.8	0	0	0	108.5	L41 V44 I64 F140 L152 I169 L172	L41-L62 HydrophobicContact CD1-CB 3.85Å; L41-L62 HydrophobicContact CD1-CD2 4.34Å; V44-L62 HydrophobicContact CB-CD2 4.38Å; V44-L62 HydrophobicContact CG1-CD2 3.89Å; V44-L62 HydrophobicContact CG2-CD2 3.71Å; L62-I64 HydrophobicContact CB-CD1 4.01Å; L62-I64 HydrophobicContact CB-CG1 4.14Å; L62-F140 PolarHBondContact N-O 3.02Å; L62-F140 PolarHBondContact O-N 2.81Å; L62-L152 HydrophobicContact CD1-CD1 3.87Å; L62-L152 HydrophobicContact CD2-CD1 4.09Å; L62-I169 HydrophobicContact CD1-CD1 3.66Å; L62-I169 HydrophobicContact CG-CD1 4.34Å; L62-L172 HydrophobicContact CD1-CD2 3.79Å
63	Y	93.6	Very high	91.4	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.008	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	115.4	174.7	-58.8	-83	0	0	0	109	V42 D43 S45 V61 H132 C133 Y138 A139	V42-Y63 WeakPolarHBondContact CB-O 3.27Å; V42-Y63 PolarHBondContact N-O 3.34Å; D43-Y63 HydrophobicContact CB-CD2 3.87Å; D43-Y63 HydrophobicContact CB-CG 4.44Å; D43-Y63 PolarHBondContact N-O 2.82Å; D43-Y63 PolarHBondContact O-N 3.13Å; S45-Y63 VanDerWaalsContact OG-CE2 3.27Å; S45-Y63 WeakPolarHBondContact OG-CE2 3.3Å; S45-Y63 PolarHBondContact OG-OH 3.38Å; V61-Y63 HydrophobicContact CG1-CE1 3.98Å; V61-Y63 HydrophobicContact CG1-CE2 4.11Å; Y63-H132 HydrophobicContact CE1-CB 4.14Å; Y63-H132 HydrophobicContact CE2-CB 4.15Å; Y63-H132 VanDerWaalsContact OH-CB 3.25Å; Y63-H132 WeakPolarHBondContact OH-CB 3.34Å; Y63-C133 HydrophobicContact CD1-CB 4.47Å; Y63-C133 HydrophobicContact CE1-CB 4.34Å; Y63-Y138 WeakPolarHBondContact CA-O 3.37Å; Y63-A139 HydrophobicContact CD1-CB 4.11Å; Y63-A139 HydrophobicContact CE1-CB 3.93Å
64	I	93.2	Very high	90.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.7	-168.2	-56.9	172.4	0	0	0	109.2	L37 K40 L41 L62 T137 Y138 F140 I158 L160	L37-I64 HydrophobicContact CD2-CG2 3.61Å; K40-I64 WeakPolarHBondContact O-CA 2.95Å; L41-I64 HydrophobicContact CD1-CG1 4.11Å; L62-I64 HydrophobicContact CB-CD1 4.01Å; L62-I64 HydrophobicContact CB-CG1 4.14Å; I64-T137 WeakPolarHBondContact O-CA 3.34Å; I64-Y138 PolarHBondContact N-O 3.21Å; I64-Y138 PolarHBondContact O-N 2.83Å; I64-F140 HydrophobicContact CB-CD2 4.21Å; I64-F140 HydrophobicContact CB-CE2 4.37Å; I64-F140 HydrophobicContact CD1-CB 4.42Å; I64-F140 HydrophobicContact CD1-CD2 3.77Å; I64-F140 HydrophobicContact CD1-CE2 4.46Å; I64-F140 HydrophobicContact CD1-CG 4.36Å; I64-F140 HydrophobicContact CG1-CD2 4.24Å; I64-I158 HydrophobicContact CD1-CD1 3.33Å; I64-I158 HydrophobicContact CD1-CG1 4.41Å; I64-I158 HydrophobicContact CG1-CD1 3.82Å; I64-I158 HydrophobicContact CG2-CD1 4.42Å; I64-L160 HydrophobicContact CD1-CD2 3.2Å
65	K	94.4	Very high	90.5	Very high	122 Å²	122	55.3 Å²	55.3	53%	0.53	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	113.2	169.3	-176.5	170.1	-176.7	174.9	0	108.6	G39 K40 V42 T137	G39-K65 CarbonylContact C-O 3.6Å; G39-K65 WeakPolarHBondContact CA-O 3.44Å; K40-K65 PolarHBondContact N-O 2.97Å; K40-K65 PolarHBondContact O-N 3.33Å; V42-K65 HydrophobicContact CG2-CB 3.83Å; K65-T137 HydrophobicContact CB-CG2 4.3Å
66	P	93.1	Very high	90.2	Very high	7 Å²	7	55.2 Å²	55.2	5%	0.045	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	151.8	-177.7	26.9	-31.9	0	0	0	110.9	L37 I69 E113 L116 Y138	L37-P66 HydrophobicContact CD1-CB 3.99Å; L37-P66 HydrophobicContact CG-CB 4.35Å; P66-I69 HydrophobicContact CB-CD1 3.88Å; P66-I69 HydrophobicContact CB-CG1 3.88Å; P66-I69 HydrophobicContact CG-CD1 4.36Å; P66-E113 HydrophobicContact CG-CG 4.21Å; P66-L116 HydrophobicContact CB-CD2 4.26Å; P66-L116 HydrophobicContact CG-CD2 4.31Å; P66-Y138 HydrophobicContact CG-CD2 3.9Å; P66-Y138 HydrophobicContact CG-CE2 3.7Å
67	S	90.3	Very high	89.6	Confident	89 Å²	89	58 Å²	58	62%	0.622	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	-37.8	171.7	-62.6	0	0	0	0	111.1	E38	E38-S67 PolarHBondContact O-N 3.21Å
68	R	87.8	Confident	88.8	Confident	139 Å²	139	57.5 Å²	57.5	53%	0.525	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	135.6	171.5	-61.1	178.9	176	174.6	-5.2	109.7	L37 E38	L37-R68 WeakPolarHBondContact CA-O 3.47Å; E38-R68 HydrophobicContact CB-CB 4.23Å; E38-R68 PolarHBondContact N-O 2.82Å; E38-R68 PolarHBondContact O-N 3.45Å
69	I	90.8	Very high	87.9	Confident	8 Å²	8	55.6 Å²	55.6	4%	0.041	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	127	-175.9	-47.9	158.6	0	0	0	107.3	L37 P66 C110 L111 E113 L116	L37-I69 HydrophobicContact CD1-CG1 4.36Å; P66-I69 HydrophobicContact CB-CD1 3.88Å; P66-I69 HydrophobicContact CB-CG1 3.88Å; P66-I69 HydrophobicContact CG-CD1 4.36Å; I69-C110 CarbonylContact O-C 3.46Å; I69-C110 WeakPolarHBondContact O-CA 3.46Å; I69-L111 HydrophobicContact CB-CB 4.21Å; I69-L111 HydrophobicContact CG2-CB 3.8Å; I69-L111 HydrophobicContact CG2-CD1 4.21Å; I69-L111 PolarHBondContact O-N 2.83Å; I69-E113 HydrophobicContact CD1-CG 4.1Å; I69-L116 HydrophobicContact CD1-CB 3.96Å; I69-L116 HydrophobicContact CD1-CD2 3.69Å; I69-L116 HydrophobicContact CD1-CG 4.39Å; I69-L116 HydrophobicContact CG1-CD2 4.16Å; I69-L116 HydrophobicContact CG2-CB 4.23Å; I69-L116 HydrophobicContact CG2-CD1 3.95Å; I69-L116 HydrophobicContact CG2-CD2 4.49Å; I69-L116 HydrophobicContact CG2-CG 4.45Å
70	H	89.7	Confident	87.2	Confident	9 Å²	9	57 Å²	57	4%	0.042	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145.6	177.1	-62.7	75.9	0	0	0	110.1	V35 I36 P83 F85 D109	V35-H70 CarbonylContact C-O 3.54Å; V35-H70 VanDerWaalsContact CA-O 3.3Å; V35-H70 WeakPolarHBondContact CA-O 3.41Å; I36-H70 PolarHBondContact N-O 2.74Å; I36-H70 PolarHBondContact O-N 3.3Å; H70-P83 HydrophobicContact CB-CB 3.8Å; H70-P83 HydrophobicContact CB-CG 4.23Å; H70-F85 AromaticContact CE1-CD1 3.45Å; H70-F85 VanDerWaalsContact CE1-CD1 3.45Å; H70-F85 WeakPolarHBondContact CE1-CD1 3.04Å; H70-F85 AromaticContact CE1-CE1 3.92Å; H70-F85 AromaticContact ND1-CD1 3.69Å; H70-F85 AromaticContact ND1-CE1 3.66Å; H70-F85 AromaticContact NE2-CD1 3.82Å; H70-D109 CarbonylContact C-O 3.49Å; H70-D109 WeakPolarHBondContact CA-O 3.24Å
71	Q	89.3	Confident	86.5	Confident	59 Å²	59	59.5 Å²	59.5	28%	0.276	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	139.9	169.2	-160.5	173.6	28.5	0	0	110	L33 D109 L111	L33-Q71 HydrophobicContact CB-CG 4.4Å; L33-Q71 HydrophobicContact CD1-CG 4.39Å; Q71-D109 PolarHBondContact N-O 2.8Å; Q71-L111 HydrophobicContact CB-CD1 3.96Å; Q71-L111 HydrophobicContact CB-CD2 4.36Å; Q71-L111 HydrophobicContact CB-CG 4.22Å; Q71-L111 HydrophobicContact CG-CD1 4.47Å
72	R	87.5	Confident	85.3	Confident	17 Å²	17	65 Å²	65	6%	0.064	34%	0.34	C	S	.	.			trans	-70.4	142.1	170.1	-66	177.4	75	-158	-4.6	109	L33 G34 I36 F74 E80 T162	L33-R72 WeakPolarHBondContact O-CB 3.29Å; G34-R72 PolarHBondContact O-N 3.28Å; I36-R72 HydrophobicContact CD1-CG 4.26Å; I36-R72 HydrophobicContact CG1-CG 3.55Å; R72-F74 HydrophobicContact CB-CE2 4.03Å; R72-F74 HydrophobicContact CB-CZ 4.48Å; R72-E80 IonicContact CZ-OE1 2.81Å; R72-E80 IonicContact CZ-OE2 2.93Å; R72-E80 IonicContact NE-OE1 2.57Å; R72-E80 PolarHBondContact NE-OE1 3.2Å; R72-E80 IonicContact NE-OE2 3.01Å; R72-E80 VanDerWaalsContact NH2-CD 3.28Å; R72-E80 IonicContact NH2-OE1 3.57Å; R72-E80 IonicContact NH2-OE2 3.55Å; R72-E80 PolarHBondContact NH2-OE2 2.76Å; R72-T162 PolarHBondContact NH1-O 2.76Å
73	K	84.3	Confident	84.1	Confident	78 Å²	78	65.2 Å²	65.2	34%	0.339	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	147.5	176.3	-73.9	-172.1	165.7	-176.3	0	109.8	E80 I81 D109	K73-E80 CarbonylContact O-C 3.52Å; K73-E80 WeakPolarHBondContact O-CA 3.41Å; K73-I81 HydrophobicContact CB-CB 4.26Å; K73-I81 PolarHBondContact O-N 3.13Å; K73-D109 WeakPolarHBondContact CE-OD1 3.48Å; K73-D109 IonicContact NZ-OD1 2.55Å; K73-D109 PolarHBondContact NZ-OD1 2.56Å
74	F	82	Confident	82.8	Confident	79 Å²	79	67.5 Å²	67.5	35%	0.346	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.9	178	-61.5	-94.3	0	0	0	108.8	L33 R72 M79 E80	L33-F74 HydrophobicContact CD2-CD2 3.87Å; L33-F74 HydrophobicContact CD2-CE2 4.27Å; R72-F74 HydrophobicContact CB-CE2 4.03Å; R72-F74 HydrophobicContact CB-CZ 4.48Å; F74-M79 CarbonylContact C-O 3.53Å; F74-M79 VanDerWaalsContact CA-O 3.3Å; F74-M79 WeakPolarHBondContact CA-O 3.17Å; F74-E80 HydrophobicContact CD1-CB 4.09Å; F74-E80 HydrophobicContact CE1-CB 3.9Å; F74-E80 HydrophobicContact CE1-CG 4.21Å; F74-E80 HydrophobicContact CZ-CG 4.5Å
75	D	83.1	Confident	81.3	Confident	58 Å²	58	70 Å²	70	31%	0.31	37%	0.365	S	S	.	.			trans	-75.2	173	172.7	76.7	0.7	0	0	0	110.9	K77 G78 M79 I81	D75-K77 PolarHBondContact O-N 2.98Å; D75-K77 WeakPolarHBondContact OD1-CA 3.2Å; D75-K77 VanDerWaalsContact OD1-CB 3.29Å; D75-K77 WeakPolarHBondContact OD1-CB 3.36Å; D75-K77 PolarHBondContact OD1-N 2.9Å; D75-G78 PolarHBondContact O-N 2.83Å; D75-G78 PolarHBondContact OD1-N 3.14Å; D75-M79 PolarHBondContact N-O 3.44Å; D75-M79 WeakPolarHBondContact OD1-CB 3.26Å; D75-M79 PolarHBondContact OD1-N 2.94Å; D75-I81 HydrophobicContact CB-CD1 3.75Å; D75-I81 HydrophobicContact CB-CG1 3.92Å
76	A	83.8	Confident	79.4	Confident	117 Å²	117	67 Å²	67	97%	0.967	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-11	176.3	0	0	0	0	0	113.7
77	K	80.9	Confident	77.4	Confident	184 Å²	184	72.7 Å²	72.7	80%	0.8	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	1.3	176.5	-56.8	178.8	178.5	179.9	0	112.1	D75	D75-K77 PolarHBondContact O-N 2.98Å; D75-K77 WeakPolarHBondContact OD1-CA 3.2Å; D75-K77 VanDerWaalsContact OD1-CB 3.29Å; D75-K77 WeakPolarHBondContact OD1-CB 3.36Å; D75-K77 PolarHBondContact OD1-N 2.9Å
78	G	76.1	Confident	75.4	Confident	54 Å²	54	72.1 Å²	72.1	56%	0.557	38%	0.382	S	S	*	.	S	Bend	trans	80.7	9.9	-178.7	0	0	0	0	0	114.7	D75	D75-G78 PolarHBondContact O-N 2.83Å; D75-G78 PolarHBondContact OD1-N 3.14Å
79	M	75.3	Confident	73.4	Confident	101 Å²	101	69.8 Å²	69.8	50%	0.498	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-84.7	133.1	177.3	-63.4	-69.8	-65.1	0	0	110.6	F74 D75 I81	F74-M79 CarbonylContact C-O 3.53Å; F74-M79 VanDerWaalsContact CA-O 3.3Å; F74-M79 WeakPolarHBondContact CA-O 3.17Å; D75-M79 PolarHBondContact N-O 3.44Å; D75-M79 WeakPolarHBondContact OD1-CB 3.26Å; D75-M79 PolarHBondContact OD1-N 2.94Å; M79-I81 PolarHBondContact O-N 3.05Å
80	E	77.6	Confident	71.5	Confident	44 Å²	44	76.6 Å²	76.6	21%	0.206	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	121.1	177.5	-168	176.6	176.7	0	0	110.6	R72 K73 F74 K161	R72-E80 IonicContact CZ-OE1 2.81Å; R72-E80 IonicContact CZ-OE2 2.93Å; R72-E80 IonicContact NE-OE1 2.57Å; R72-E80 PolarHBondContact NE-OE1 3.2Å; R72-E80 IonicContact NE-OE2 3.01Å; R72-E80 VanDerWaalsContact NH2-CD 3.28Å; R72-E80 IonicContact NH2-OE1 3.57Å; R72-E80 IonicContact NH2-OE2 3.55Å; R72-E80 PolarHBondContact NH2-OE2 2.76Å; K73-E80 CarbonylContact O-C 3.52Å; K73-E80 WeakPolarHBondContact O-CA 3.41Å; F74-E80 HydrophobicContact CD1-CB 4.09Å; F74-E80 HydrophobicContact CE1-CB 3.9Å; F74-E80 HydrophobicContact CE1-CG 4.21Å; F74-E80 HydrophobicContact CZ-CG 4.5Å; E80-K161 IonicContact OE1-NZ 2.56Å; E80-K161 PolarHBondContact OE1-NZ 3.01Å; E80-K161 IonicContact OE2-NZ 2.81Å; E80-K161 PolarHBondContact OE2-NZ 2.88Å
81	I	76.8	Confident	69.8	Low	83 Å²	83	77.8 Å²	77.8	43%	0.426	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	134.3	173.8	-57.7	170.5	0	0	0	107.7	K73 D75 M79 P83	K73-I81 HydrophobicContact CB-CB 4.26Å; K73-I81 PolarHBondContact O-N 3.13Å; D75-I81 HydrophobicContact CB-CD1 3.75Å; D75-I81 HydrophobicContact CB-CG1 3.92Å; M79-I81 PolarHBondContact O-N 3.05Å; I81-P83 WeakPolarHBondContact O-CD 3.27Å
82	E	68.2	Low	67.6	Low	114 Å²	114	80 Å²	80	53%	0.533	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-60.6	124.7	175.3	-172.9	167.6	-165.7	0	0	110.3	F85	E82-F85 HydrophobicContact CG-CD2 4.46Å; E82-F85 HydrophobicContact CG-CE2 4.09Å
83	P	69.3	Low	65.7	Low	6 Å²	6	82.1 Å²	82.1	4%	0.039	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-61.2	147.8	177.1	-21.9	32.7	0	0	0	110.8	I36 H70 I81 F85 D109	I36-P83 HydrophobicContact CD1-CG 3.49Å; I36-P83 VanDerWaalsContact CD1-CG 3.49Å; I36-P83 HydrophobicContact CG1-CG 4.11Å; H70-P83 HydrophobicContact CB-CB 3.8Å; H70-P83 HydrophobicContact CB-CG 4.23Å; I81-P83 WeakPolarHBondContact O-CD 3.27Å; P83-F85 HydrophobicContact CB-CE2 4.25Å; P83-F85 HydrophobicContact CB-CZ 4.33Å; P83-F85 HydrophobicContact CG-CE2 4.38Å; P83-F85 HydrophobicContact CG-CZ 4.29Å; P83-F85 WeakPolarHBondContact O-CD2 3.27Å; P83-F85 WeakPolarHBondContact O-CE2 2.71Å; P83-F85 PolarHBondContact O-N 3.23Å; P83-D109 HydrophobicContact CB-CB 4.35Å
84	N	66.1	Low	64.1	Low	50 Å²	50	82.2 Å²	82.2	27%	0.267	47%	0.465	S	S	.	.			trans	-75.3	95.5	174.7	-175.3	12.3	0	0	0	110.4	S86 D109	N84-S86 PolarHBondContact O-N 3.11Å; N84-S86 PolarHBondContact OD1-N 3.49Å; N84-S86 VanDerWaalsContact OD1-N 3.15Å; N84-S86 PolarHBondContact OD1-O 3.47Å; N84-S86 PolarHBondContact OD1-OG 3.38Å; N84-D109 PolarHBondContact N-OD2 2.9Å
85	F	60.6	Low	62.6	Low	53 Å²	53	87.6 Å²	87.6	23%	0.232	48%	0.484	C	S	.	.			trans	-74.7	1.8	176.1	-64.6	-82.6	0	0	0	114.2	I36 H70 E82 P83	I36-F85 HydrophobicContact CG2-CZ 4.35Å; H70-F85 AromaticContact CE1-CD1 3.45Å; H70-F85 VanDerWaalsContact CE1-CD1 3.45Å; H70-F85 WeakPolarHBondContact CE1-CD1 3.04Å; H70-F85 AromaticContact CE1-CE1 3.92Å; H70-F85 AromaticContact ND1-CD1 3.69Å; H70-F85 AromaticContact ND1-CE1 3.66Å; H70-F85 AromaticContact NE2-CD1 3.82Å; E82-F85 HydrophobicContact CG-CD2 4.46Å; E82-F85 HydrophobicContact CG-CE2 4.09Å; P83-F85 HydrophobicContact CB-CE2 4.25Å; P83-F85 HydrophobicContact CB-CZ 4.33Å; P83-F85 HydrophobicContact CG-CE2 4.38Å; P83-F85 HydrophobicContact CG-CZ 4.29Å; P83-F85 WeakPolarHBondContact O-CD2 3.27Å; P83-F85 WeakPolarHBondContact O-CE2 2.71Å; P83-F85 PolarHBondContact O-N 3.23Å
86	S	55.2	Low	61.1	Low	59 Å²	59	91 Å²	91	41%	0.413	50%	0.502	S	S	.	.			trans	-105.9	123.6	-176.7	68.2	0	0	0	0	112.4	N84 T88	N84-S86 PolarHBondContact O-N 3.11Å; N84-S86 PolarHBondContact OD1-N 3.49Å; N84-S86 VanDerWaalsContact OD1-N 3.15Å; N84-S86 PolarHBondContact OD1-O 3.47Å; N84-S86 PolarHBondContact OD1-OG 3.38Å; S86-T88 PolarHBondContact O-N 3.3Å
87	D	50.2	Low	59.3	Low	125 Å²	125	94 Å²	94	67%	0.668	50%	0.498	S	S	*	.	S	Bend	trans	-70.9	-18.6	176.5	-65.8	-37.2	0	0	0	113
88	T	48.6	Very low	57.5	Low	78 Å²	78	89.8 Å²	89.8	48%	0.479	49%	0.491	S	S	.	.			trans	-140.8	134.8	-172.1	52.2	0	0	0	0	112.1	S86 V102	S86-T88 PolarHBondContact O-N 3.3Å; T88-V102 HydrophobicContact CG2-CG1 3.41Å; T88-V102 VanDerWaalsContact CG2-CG1 3.41Å
89	K	46.8	Very low	55.9	Low	90 Å²	90	89.2 Å²	89.2	39%	0.391	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	124.4	166	-162.1	-158.6	-169.1	-178.1	0	108	V91 E103 K105	K89-V91 HydrophobicContact CD-CG1 3.87Å; K89-V91 PolarHBondContact O-N 3.44Å; K89-E103 PolarHBondContact N-O 3.48Å; K89-E103 PolarHBondContact O-N 2.75Å; K89-K105 HydrophobicContact CB-CB 3.5Å; K89-K105 HydrophobicContact CB-CD 3.71Å; K89-K105 HydrophobicContact CB-CG 3.81Å; K89-K105 HydrophobicContact CD-CB 4.5Å; K89-K105 HydrophobicContact CD-CD 3.58Å; K89-K105 VanDerWaalsContact CD-CE 3.47Å; K89-K105 HydrophobicContact CD-CG 3.86Å; K89-K105 HydrophobicContact CG-CD 3.87Å; K89-K105 HydrophobicContact CG-CG 4.32Å
90	K	50.3	Low	54.5	Low	150 Å²	150	90.3 Å²	90.3	65%	0.652	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	112.4	162.1	-68.7	-174.2	-179.6	-178.7	0	107.6	F100	K90-F100 HydrophobicContact CB-CD1 4.24Å; K90-F100 HydrophobicContact CD-CD1 4.44Å
91	V	53.6	Low	52.9	Low	34 Å²	34	93.6 Å²	93.6	21%	0.206	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	126.9	169.1	-83.9	0	0	0	0	108.3	K89 T93 K101 E103	K89-V91 HydrophobicContact CD-CG1 3.87Å; K89-V91 PolarHBondContact O-N 3.44Å; V91-T93 PolarHBondContact O-N 3.48Å; V91-K101 HydrophobicContact CG2-CB 4.4Å; V91-K101 VanDerWaalsContact CG2-O 3.23Å; V91-K101 WeakPolarHBondContact CG2-O 3.04Å; V91-K101 PolarHBondContact N-O 3.35Å; V91-K101 VanDerWaalsContact N-O 3.17Å; V91-K101 PolarHBondContact O-N 3.2Å; V91-E103 HydrophobicContact CG2-CB 3.88Å; V91-E103 HydrophobicContact CG2-CG 3.63Å
92	N	43.8	Very low	51.5	Low	107 Å²	107	94 Å²	94	57%	0.572	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	100.5	171.2	-174.7	-7.9	0	0	0	107.3	G94	N92-G94 PolarHBondContact O-N 3.02Å
93	T	46.6	Very low	50.3	Low	60 Å²	60	92.4 Å²	92.4	37%	0.368	49%	0.493	S	S	.	.			trans	-76.6	106.4	168	35.5	0	0	0	0	106.6	V91 Y95 S99 K101	V91-T93 PolarHBondContact O-N 3.48Å; T93-Y95 PolarHBondContact O-N 2.88Å; T93-S99 PolarHBondContact O-OG 3.31Å; T93-S99 PolarHBondContact OG1-O 3.48Å; T93-K101 HydrophobicContact CG2-CB 4.17Å
94	G	51.9	Low	49.1	Very low	81 Å²	81	96.7 Å²	96.7	84%	0.835	53%	0.529	S	S	*	.	S	Bend	trans	-65.1	57.6	-165.4	0	0	0	0	0	117.4	N92	N92-G94 PolarHBondContact O-N 3.02Å
95	Y	49.5	Very low	48	Very low	192 Å²	192	99.3 Å²	99.3	75%	0.753	54%	0.538	S	S	*	.	S	Bend	trans	-135.6	103.1	167.3	-161.6	-99.2	0	0	0	109.6	T93 S99	T93-Y95 PolarHBondContact O-N 2.88Å; Y95-S99 PolarHBondContact O-OG 3.36Å
96	L	51.9	Low	47.5	Very low	129 Å²	129	99.8 Å²	99.8	68%	0.675	56%	0.558	S	S	*	*	S	Bend	trans	62.3	143.1	-173.5	-111.8	77.6	0	0	0	115.1	S98 S99	L96-S98 PolarHBondContact O-N 3.22Å; L96-S99 PolarHBondContact O-N 2.95Å
97	M	46.8	Very low	47.3	Very low	181 Å²	181	105.9 Å²	105.9	89%	0.892	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	15.1	-178.3	-73.3	-72.2	179.3	0	0	116
98	S	42.7	Very low	47.6	Very low	94 Å²	94	103.1 Å²	103.1	66%	0.657	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.4	-5.5	-173.5	60	0	0	0	0	115.4	L96	L96-S98 PolarHBondContact O-N 3.22Å
99	S	41.8	Very low	48.8	Very low	42 Å²	42	100.4 Å²	100.4	29%	0.294	55%	0.55	S	S	.	*			trans	-101.3	88.3	-178.1	60.9	0	0	0	0	112.3	T93 Y95 L96	T93-S99 PolarHBondContact O-OG 3.31Å; T93-S99 PolarHBondContact OG1-O 3.48Å; Y95-S99 PolarHBondContact O-OG 3.36Å; L96-S99 PolarHBondContact O-N 2.95Å
100	F	45.5	Very low	50.5	Low	125 Å²	125	98.9 Å²	98.9	55%	0.548	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.7	114.4	166.9	-63.7	-78	0	0	0	109.3	K90	K90-F100 HydrophobicContact CB-CD1 4.24Å; K90-F100 HydrophobicContact CD-CD1 4.44Å
101	K	45.1	Very low	52.2	Low	113 Å²	113	92.8 Å²	92.8	49%	0.491	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	128.8	167.7	-164.2	177.4	173.2	-153.1	0	108.6	V91 T93 E103	V91-K101 HydrophobicContact CG2-CB 4.4Å; V91-K101 VanDerWaalsContact CG2-O 3.23Å; V91-K101 WeakPolarHBondContact CG2-O 3.04Å; V91-K101 PolarHBondContact N-O 3.35Å; V91-K101 VanDerWaalsContact N-O 3.17Å; V91-K101 PolarHBondContact O-N 3.2Å; T93-K101 HydrophobicContact CG2-CB 4.17Å; K101-E103 HydrophobicContact CD-CG 4.12Å; K101-E103 WeakPolarHBondContact CD-OE1 3.12Å; K101-E103 WeakPolarHBondContact CE-OE1 3.4Å; K101-E103 HydrophobicContact CG-CG 4.06Å; K101-E103 IonicContact NZ-OE1 2.79Å; K101-E103 PolarHBondContact NZ-OE1 3.09Å; K101-E103 PolarHBondContact O-N 3.35Å
102	V	47.9	Very low	53.9	Low	90 Å²	90	95 Å²	95	55%	0.545	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	104.7	172.7	-179.9	0	0	0	0	106.3	T88	T88-V102 HydrophobicContact CG2-CG1 3.41Å; T88-V102 VanDerWaalsContact CG2-CG1 3.41Å
103	E	41.9	Very low	56	Low	81 Å²	81	94.8 Å²	94.8	38%	0.379	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	137.9	173.9	-66.3	-166.9	157.9	0	0	109.6	K89 V91 K101 K105	K89-E103 PolarHBondContact N-O 3.48Å; K89-E103 PolarHBondContact O-N 2.75Å; V91-E103 HydrophobicContact CG2-CB 3.88Å; V91-E103 HydrophobicContact CG2-CG 3.63Å; K101-E103 HydrophobicContact CD-CG 4.12Å; K101-E103 WeakPolarHBondContact CD-OE1 3.12Å; K101-E103 WeakPolarHBondContact CE-OE1 3.4Å; K101-E103 HydrophobicContact CG-CG 4.06Å; K101-E103 IonicContact NZ-OE1 2.79Å; K101-E103 PolarHBondContact NZ-OE1 3.09Å; K101-E103 PolarHBondContact O-N 3.35Å; E103-K105 PolarHBondContact O-N 2.98Å
104	A	43.4	Very low	58	Low	96 Å²	96	96.3 Å²	96.3	79%	0.793	54%	0.543	S	S	*	.			trans	-63.6	107	170.5	0	0	0	0	0	107.7	G106	A104-G106 PolarHBondContact O-N 3.14Å
105	K	44.7	Very low	59.8	Low	106 Å²	106	96.6 Å²	96.6	46%	0.461	52%	0.523	S	S	.	.			trans	-91.5	91.1	-172.7	-167.7	-145.9	-168.9	169.8	0	110.1	K89 E103	K89-K105 HydrophobicContact CB-CB 3.5Å; K89-K105 HydrophobicContact CB-CD 3.71Å; K89-K105 HydrophobicContact CB-CG 3.81Å; K89-K105 HydrophobicContact CD-CB 4.5Å; K89-K105 HydrophobicContact CD-CD 3.58Å; K89-K105 VanDerWaalsContact CD-CE 3.47Å; K89-K105 HydrophobicContact CD-CG 3.86Å; K89-K105 HydrophobicContact CG-CD 3.87Å; K89-K105 HydrophobicContact CG-CG 4.32Å; E103-K105 PolarHBondContact O-N 2.98Å
106	G	49.1	Very low	61.8	Low	63 Å²	63	87.5 Å²	87.5	65%	0.649	49%	0.487	S	S	*	.	S	Bend	trans	65.9	173.5	165.1	0	0	0	0	0	115.4	A104 T108	A104-G106 PolarHBondContact O-N 3.14Å; G106-T108 PolarHBondContact O-N 3.32Å
107	E	50.5	Low	63.6	Low	187 Å²	187	85.6 Å²	85.6	87%	0.874	48%	0.475	S	S	*	.	S	Bend	trans	-49.6	111.2	172.1	-83.2	177.1	149.7	0	0	109.3
108	T	58.3	Low	65.7	Low	66 Å²	66	82.8 Å²	82.8	41%	0.405	46%	0.463	S	S	.	.			trans	-67.7	139	173.8	49.4	0	0	0	0	108	G106 C110	G106-T108 PolarHBondContact O-N 3.32Å; T108-C110 PolarHBondContact O-N 2.89Å
109	D	71.8	Confident	67.9	Low	21 Å²	21	79.9 Å²	79.9	11%	0.112	44%	0.44	C	S	.	.	S	Bend	trans	-70.4	6.2	175.2	-56.9	-30.7	0	0	0	112.1	H70 Q71 K73 P83 N84	H70-D109 CarbonylContact C-O 3.49Å; H70-D109 WeakPolarHBondContact CA-O 3.24Å; Q71-D109 PolarHBondContact N-O 2.8Å; K73-D109 WeakPolarHBondContact CE-OD1 3.48Å; K73-D109 IonicContact NZ-OD1 2.55Å; K73-D109 PolarHBondContact NZ-OD1 2.56Å; P83-D109 HydrophobicContact CB-CB 4.35Å; N84-D109 PolarHBondContact N-OD2 2.9Å
110	C	82.9	Confident	70.2	Confident	59 Å²	59	78.2 Å²	78.2	40%	0.399	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-74.2	128.5	-175.1	-170.5	0	0	0	0	109.7	I69 T108	I69-C110 CarbonylContact O-C 3.46Å; I69-C110 WeakPolarHBondContact O-CA 3.46Å; T108-C110 PolarHBondContact O-N 2.89Å
111	L	85.7	Confident	72.2	Confident	22 Å²	22	74.9 Å²	74.9	12%	0.115	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-102.2	144.7	176.1	-62.4	175	0	0	0	109.9	V35 I69 Q71 Q115 L119	V35-L111 HydrophobicContact CG1-CD1 3.66Å; I69-L111 HydrophobicContact CB-CB 4.21Å; I69-L111 HydrophobicContact CG2-CB 3.8Å; I69-L111 HydrophobicContact CG2-CD1 4.21Å; I69-L111 PolarHBondContact O-N 2.83Å; Q71-L111 HydrophobicContact CB-CD1 3.96Å; Q71-L111 HydrophobicContact CB-CD2 4.36Å; Q71-L111 HydrophobicContact CB-CG 4.22Å; Q71-L111 HydrophobicContact CG-CD1 4.47Å; L111-Q115 HydrophobicContact CB-CB 4.3Å; L111-Q115 HydrophobicContact CD2-CB 4.34Å; L111-L119 HydrophobicContact CD1-CD1 3.85Å
112	T	89.1	Confident	74.3	Confident	79 Å²	79	72.1 Å²	72.1	49%	0.485	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-74.5	158.9	168.6	59.5	0	0	0	0	111.1	V114 Q115 L116	T112-V114 PolarHBondContact O-N 3.09Å; T112-Q115 PolarHBondContact O-N 3.33Å; T112-Q115 VanDerWaalsContact O-N 3.09Å; T112-Q115 VanDerWaalsContact OG1-CG 3.3Å; T112-Q115 WeakPolarHBondContact OG1-CG 3.23Å; T112-Q115 PolarHBondContact OG1-N 3.34Å; T112-Q115 PolarHBondContact OG1-OE1 3.18Å; T112-L116 PolarHBondContact O-N 3.47Å
113	E	88.8	Confident	76.1	Confident	103 Å²	103	75.4 Å²	75.4	48%	0.481	42%	0.416	S	S	.	.	H	α-helix	trans	-58	-36.2	174.9	-68.7	-177	-170.7	0	0	112.3	P66 I69 Q115 L116 E117 Y138	P66-E113 HydrophobicContact CG-CG 4.21Å; I69-E113 HydrophobicContact CD1-CG 4.1Å; E113-Q115 PolarHBondContact O-N 3.43Å; E113-L116 WeakPolarHBondContact O-CB 3.33Å; E113-L116 PolarHBondContact O-N 2.81Å; E113-E117 WeakPolarHBondContact O-CB 3.27Å; E113-E117 PolarHBondContact O-N 2.97Å; E113-Y138 PolarHBondContact O-OH 3.22Å
114	V	89.2	Confident	78.2	Confident	93 Å²	93	75.1 Å²	75.1	56%	0.564	42%	0.417	S	S	*	.	H	α-helix	trans	-64.7	-39.9	176	-178.2	0	0	0	0	111.4	T112 E117 N118	T112-V114 PolarHBondContact O-N 3.09Å; V114-E117 PolarHBondContact O-N 2.85Å; V114-N118 VanDerWaalsContact O-CG 3.32Å; V114-N118 PolarHBondContact O-N 2.96Å; V114-N118 VanDerWaalsContact O-N 3.14Å; V114-N118 PolarHBondContact O-ND2 2.76Å
115	Q	90.1	Very high	80.2	Confident	87 Å²	87	70.8 Å²	70.8	41%	0.407	38%	0.38	S	S	.	.	H	α-helix	trans	-68.5	-40.2	175.4	-74.3	166.4	-44.5	0	0	111.6	L111 T112 E113 E117 N118 L119	L111-Q115 HydrophobicContact CB-CB 4.3Å; L111-Q115 HydrophobicContact CD2-CB 4.34Å; T112-Q115 PolarHBondContact O-N 3.33Å; T112-Q115 VanDerWaalsContact O-N 3.09Å; T112-Q115 VanDerWaalsContact OG1-CG 3.3Å; T112-Q115 WeakPolarHBondContact OG1-CG 3.23Å; T112-Q115 PolarHBondContact OG1-N 3.34Å; T112-Q115 PolarHBondContact OG1-OE1 3.18Å; E113-Q115 PolarHBondContact O-N 3.43Å; Q115-E117 VanDerWaalsContact C-N 3.34Å; Q115-N118 PolarHBondContact O-N 2.87Å; Q115-L119 VanDerWaalsContact O-CG 3.29Å; Q115-L119 WeakPolarHBondContact O-CG 3.27Å; Q115-L119 PolarHBondContact O-N 2.8Å
116	L	90.7	Very high	82.2	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-57.9	-49.3	173.6	176	69	0	0	0	110.8	V35 L37 P66 I69 T112 E113 N118 L119 V120 Y138 F140	V35-L116 HydrophobicContact CG1-CD1 4.45Å; V35-L116 HydrophobicContact CG2-CD1 3.92Å; L37-L116 HydrophobicContact CD1-CD1 4.06Å; L37-L116 HydrophobicContact CD1-CD2 3.5Å; L37-L116 VanDerWaalsContact CD1-CD2 3.5Å; L37-L116 HydrophobicContact CD1-CG 4.44Å; P66-L116 HydrophobicContact CB-CD2 4.26Å; P66-L116 HydrophobicContact CG-CD2 4.31Å; I69-L116 HydrophobicContact CD1-CB 3.96Å; I69-L116 HydrophobicContact CD1-CD2 3.69Å; I69-L116 HydrophobicContact CD1-CG 4.39Å; I69-L116 HydrophobicContact CG1-CD2 4.16Å; I69-L116 HydrophobicContact CG2-CB 4.23Å; I69-L116 HydrophobicContact CG2-CD1 3.95Å; I69-L116 HydrophobicContact CG2-CD2 4.49Å; I69-L116 HydrophobicContact CG2-CG 4.45Å; T112-L116 PolarHBondContact O-N 3.47Å; E113-L116 WeakPolarHBondContact O-CB 3.33Å; E113-L116 PolarHBondContact O-N 2.81Å; L116-N118 VanDerWaalsContact C-N 3.32Å; L116-N118 PolarHBondContact O-N 2.8Å; L116-L119 PolarHBondContact O-N 2.94Å; L116-V120 HydrophobicContact CD1-CG1 3.69Å; L116-V120 HydrophobicContact CD1-CG2 4.35Å; L116-V120 HydrophobicContact CG-CG1 4.44Å; L116-V120 HydrophobicContact CG-CG2 4.23Å; L116-V120 WeakPolarHBondContact O-CG2 3.25Å; L116-V120 PolarHBondContact O-N 2.94Å; L116-Y138 HydrophobicContact CD2-CD2 3.75Å; L116-Y138 HydrophobicContact CD2-CE2 3.87Å; L116-Y138 HydrophobicContact CD2-CG 4.12Å; L116-F140 HydrophobicContact CD1-CZ 4.42Å
117	E	89.9	Confident	83.8	Confident	90 Å²	90	72.2 Å²	72.2	42%	0.421	37%	0.373	S	S	.	.	H	α-helix	trans	-53.4	-49.9	178.7	-172.1	170	-169.4	0	0	111.1	E113 V114 Q115 L119 V120 T121 Y138	E113-E117 WeakPolarHBondContact O-CB 3.27Å; E113-E117 PolarHBondContact O-N 2.97Å; V114-E117 PolarHBondContact O-N 2.85Å; Q115-E117 VanDerWaalsContact C-N 3.34Å; E117-L119 PolarHBondContact O-N 2.81Å; E117-V120 PolarHBondContact O-N 2.81Å; E117-T121 WeakPolarHBondContact CG-OG1 3.37Å; E117-T121 WeakPolarHBondContact O-CA 3.37Å; E117-T121 WeakPolarHBondContact O-CB 3.33Å; E117-T121 PolarHBondContact O-N 3.25Å; E117-T121 PolarHBondContact O-OG1 2.93Å; E117-Y138 HydrophobicContact CB-CE1 3.69Å; E117-Y138 HydrophobicContact CG-CE1 3.97Å
118	N	89.9	Confident	85.3	Confident	121 Å²	121	63.8 Å²	63.8	65%	0.647	34%	0.335	S	S	*	.	H	α-helix	trans	-61.3	-29.7	178.7	-68.7	-28.1	0	0	0	113.5	V114 Q115 L116	V114-N118 VanDerWaalsContact O-CG 3.32Å; V114-N118 PolarHBondContact O-N 2.96Å; V114-N118 VanDerWaalsContact O-N 3.14Å; V114-N118 PolarHBondContact O-ND2 2.76Å; Q115-N118 PolarHBondContact O-N 2.87Å; L116-N118 VanDerWaalsContact C-N 3.32Å; L116-N118 PolarHBondContact O-N 2.8Å
119	L	90	Very high	86.5	Confident	34 Å²	34	61 Å²	61	18%	0.178	32%	0.318	C	S	.	.	H	α-helix	trans	-79.9	-48.1	179.2	-67.3	169.6	0	0	0	111.7	V35 L111 Q115 L116 E117 K122 D165	V35-L119 HydrophobicContact CG1-CD1 3.73Å; L111-L119 HydrophobicContact CD1-CD1 3.85Å; Q115-L119 VanDerWaalsContact O-CG 3.29Å; Q115-L119 WeakPolarHBondContact O-CG 3.27Å; Q115-L119 PolarHBondContact O-N 2.8Å; L116-L119 PolarHBondContact O-N 2.94Å; E117-L119 PolarHBondContact O-N 2.81Å; L119-K122 WeakPolarHBondContact O-CE 3.25Å; L119-K122 PolarHBondContact O-NZ 2.87Å; L119-D165 HydrophobicContact CD2-CB 3.93Å; L119-D165 CarbonylContact O-C 3.52Å; L119-D165 VanDerWaalsContact O-O 3.06Å
120	V	89.3	Confident	86.7	Confident	6 Å²	6	61.6 Å²	61.6	4%	0.036	33%	0.329	C	S	.	.	H	α-helix	trans	-94.5	-23.5	-168.4	-53.3	0	0	0	0	113.7	V35 L116 E117 K122 Y138 F140 P167	V35-V120 HydrophobicContact CG2-CG1 4.4Å; L116-V120 HydrophobicContact CD1-CG1 3.69Å; L116-V120 HydrophobicContact CD1-CG2 4.35Å; L116-V120 HydrophobicContact CG-CG1 4.44Å; L116-V120 HydrophobicContact CG-CG2 4.23Å; L116-V120 WeakPolarHBondContact O-CG2 3.25Å; L116-V120 PolarHBondContact O-N 2.94Å; E117-V120 PolarHBondContact O-N 2.81Å; V120-K122 PolarHBondContact O-N 2.7Å; V120-Y138 HydrophobicContact CG2-CD1 4.08Å; V120-F140 HydrophobicContact CB-CE1 4.37Å; V120-F140 HydrophobicContact CG1-CE1 3.91Å; V120-F140 HydrophobicContact CG1-CZ 4.26Å; V120-F140 HydrophobicContact CG2-CZ 4.48Å; V120-P167 HydrophobicContact CB-CB 4.37Å; V120-P167 WeakPolarHBondContact O-CD 3.29Å; V120-P167 WeakPolarHBondContact O-CG 3.48Å
121	T	88.3	Confident	86.3	Confident	55 Å²	55	66.5 Å²	66.5	34%	0.337	34%	0.343	S	S	.	.			trans	-82.4	109.4	-177.9	-58.2	0	0	0	0	109.8	E117 V126	E117-T121 WeakPolarHBondContact CG-OG1 3.37Å; E117-T121 WeakPolarHBondContact O-CA 3.37Å; E117-T121 WeakPolarHBondContact O-CB 3.33Å; E117-T121 PolarHBondContact O-N 3.25Å; E117-T121 PolarHBondContact O-OG1 2.93Å; T121-V126 HydrophobicContact CG2-CG2 3.37Å
122	K	89.8	Confident	85.5	Confident	55 Å²	55	68.5 Å²	68.5	24%	0.239	35%	0.352	C	S	.	.			trans	-111.2	127.2	173.2	-52.4	-59	-176.5	-162.8	0	108.9	Y29 L119 V120 D124 L125 V126 D165	Y29-K122 HydrophobicContact CD1-CB 4.25Å; Y29-K122 HydrophobicContact CD1-CD 4.44Å; Y29-K122 HydrophobicContact CD1-CG 3.86Å; Y29-K122 HydrophobicContact CE1-CB 4.31Å; Y29-K122 HydrophobicContact CE1-CG 4.42Å; L119-K122 WeakPolarHBondContact O-CE 3.25Å; L119-K122 PolarHBondContact O-NZ 2.87Å; V120-K122 PolarHBondContact O-N 2.7Å; K122-D124 VanDerWaalsContact C-N 3.26Å; K122-D124 PolarHBondContact O-N 2.91Å; K122-D124 VanDerWaalsContact O-N 3.14Å; K122-L125 HydrophobicContact CB-CB 4.41Å; K122-L125 HydrophobicContact CB-CD1 4.08Å; K122-L125 HydrophobicContact CB-CG 4.14Å; K122-L125 HydrophobicContact CG-CD1 4.27Å; K122-L125 PolarHBondContact O-N 3.2Å; K122-V126 WeakPolarHBondContact O-CG2 3.38Å; K122-V126 PolarHBondContact O-N 3.23Å; K122-D165 WeakPolarHBondContact CE-O 2.95Å; K122-D165 PolarHBondContact NZ-O 2.92Å
123	E	85.6	Confident	84.8	Confident	160 Å²	160	67 Å²	67	75%	0.748	34%	0.344	S	S	*	.	H	α-helix	trans	-52.6	-41.6	-170.9	-64.5	-173.2	171.7	0	0	113.5	L125 V126 K127	E123-L125 VanDerWaalsContact C-N 3.33Å; E123-L125 PolarHBondContact O-N 3Å; E123-V126 PolarHBondContact O-N 2.76Å; E123-K127 PolarHBondContact O-N 3.34Å
124	D	84.6	Confident	84.3	Confident	74 Å²	74	67.1 Å²	67.1	40%	0.396	35%	0.348	S	S	.	.	H	α-helix	trans	-67.9	-32.7	-180	-63.4	-35.2	0	0	0	113.2	K122 K127	K122-D124 VanDerWaalsContact C-N 3.26Å; K122-D124 PolarHBondContact O-N 2.91Å; K122-D124 VanDerWaalsContact O-N 3.14Å; D124-K127 IonicContact OD1-NZ 2.82Å; D124-K127 PolarHBondContact OD1-NZ 3.03Å
125	L	86.6	Confident	83.9	Confident	6 Å²	6	69 Å²	69	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-79.2	-31.1	177.6	-57.1	-178.3	0	0	0	111.7	W24 Y29 K122 E123 K127 V128 T129 W141 P167 F168	W24-L125 HydrophobicContact CH2-CD2 3.68Å; W24-L125 HydrophobicContact CZ3-CD2 3.83Å; Y29-L125 HydrophobicContact CD2-CD1 4.5Å; Y29-L125 HydrophobicContact CE2-CD2 4.42Å; Y29-L125 HydrophobicContact CG-CD1 4.43Å; K122-L125 HydrophobicContact CB-CB 4.41Å; K122-L125 HydrophobicContact CB-CD1 4.08Å; K122-L125 HydrophobicContact CB-CG 4.14Å; K122-L125 HydrophobicContact CG-CD1 4.27Å; K122-L125 PolarHBondContact O-N 3.2Å; E123-L125 VanDerWaalsContact C-N 3.33Å; E123-L125 PolarHBondContact O-N 3Å; L125-K127 VanDerWaalsContact C-N 3.29Å; L125-K127 PolarHBondContact O-N 3.22Å; L125-V128 WeakPolarHBondContact O-CB 3.35Å; L125-V128 PolarHBondContact O-N 2.85Å; L125-V128 VanDerWaalsContact O-N 3.13Å; L125-T129 PolarHBondContact O-N 2.97Å; L125-T129 PolarHBondContact O-OG1 2.95Å; L125-W141 HydrophobicContact CB-CZ2 4.09Å; L125-W141 HydrophobicContact CD2-CH2 4.23Å; L125-W141 HydrophobicContact CD2-CZ2 3.91Å; L125-W141 HydrophobicContact CG-CZ2 4.48Å; L125-P167 HydrophobicContact CD1-CG 3.46Å; L125-P167 VanDerWaalsContact CD1-CG 3.46Å; L125-F168 HydrophobicContact CD1-CE2 4Å; L125-F168 HydrophobicContact CD1-CZ 4.3Å
126	V	85.6	Confident	83.5	Confident	60 Å²	60	66.4 Å²	66.4	36%	0.364	36%	0.361	S	S	.	.	H	α-helix	trans	-64.8	-33.8	175.8	175.3	0	0	0	0	111.5	T121 K122 E123 V128 T129 G130	T121-V126 HydrophobicContact CG2-CG2 3.37Å; K122-V126 WeakPolarHBondContact O-CG2 3.38Å; K122-V126 PolarHBondContact O-N 3.23Å; E123-V126 PolarHBondContact O-N 2.76Å; V126-V128 PolarHBondContact O-N 2.72Å; V126-T129 PolarHBondContact O-N 2.8Å; V126-G130 VanDerWaalsContact O-CA 3.3Å; V126-G130 WeakPolarHBondContact O-CA 3.25Å; V126-G130 PolarHBondContact O-N 3.33Å
127	K	84.1	Confident	83.4	Confident	138 Å²	138	67 Å²	67	60%	0.6	37%	0.365	S	S	*	.	H	α-helix	trans	-57.6	-32.7	174.6	-67.2	167.2	-168.8	159.8	0	111.9	E123 D124 L125	E123-K127 PolarHBondContact O-N 3.34Å; D124-K127 IonicContact OD1-NZ 2.82Å; D124-K127 PolarHBondContact OD1-NZ 3.03Å; L125-K127 VanDerWaalsContact C-N 3.29Å; L125-K127 PolarHBondContact O-N 3.22Å
128	V	81.9	Confident	83.6	Confident	10 Å²	10	63.8 Å²	63.8	6%	0.061	35%	0.349	C	S	.	.	H	α-helix	trans	-81.2	-48.2	178.2	171.9	0	0	0	0	111.5	E18 H47 I49 L125 V126 W141	E18-V128 HydrophobicContact CB-CG2 4.2Å; E18-V128 HydrophobicContact CG-CB 4.37Å; E18-V128 HydrophobicContact CG-CG1 3.73Å; E18-V128 HydrophobicContact CG-CG2 4.04Å; H47-V128 VanDerWaalsContact ND1-CG1 3.34Å; H47-V128 WeakPolarHBondContact ND1-CG1 3.46Å; I49-V128 HydrophobicContact CD1-CG1 4.47Å; L125-V128 WeakPolarHBondContact O-CB 3.35Å; L125-V128 PolarHBondContact O-N 2.85Å; L125-V128 VanDerWaalsContact O-N 3.13Å; V126-V128 PolarHBondContact O-N 2.72Å; V128-W141 HydrophobicContact CB-CH2 4.24Å; V128-W141 HydrophobicContact CB-CZ2 4.27Å; V128-W141 HydrophobicContact CG1-CH2 3.75Å; V128-W141 HydrophobicContact CG1-CZ2 4.04Å
129	T	83.5	Confident	83.8	Confident	8 Å²	8	58.7 Å²	58.7	5%	0.049	32%	0.324	C	S	.	.	H	α-helix	trans	-94.9	-20	-169	61.7	0	0	0	0	114.5	V61 L125 V126 K131 H132 C133 A139 W141	V61-T129 HydrophobicContact CG1-CG2 3.8Å; V61-T129 HydrophobicContact CG2-CG2 4.05Å; L125-T129 PolarHBondContact O-N 2.97Å; L125-T129 PolarHBondContact O-OG1 2.95Å; V126-T129 PolarHBondContact O-N 2.8Å; T129-K131 VanDerWaalsContact C-N 3.29Å; T129-K131 PolarHBondContact O-N 3Å; T129-H132 PolarHBondContact O-N 3.36Å; T129-H132 VanDerWaalsContact O-N 3.1Å; T129-C133 PolarHBondContact O-N 3.32Å; T129-A139 HydrophobicContact CG2-CB 4.01Å; T129-W141 HydrophobicContact CG2-CZ2 3.6Å
130	G	74.9	Confident	84	Confident	34 Å²	34	57.1 Å²	57.1	35%	0.351	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-62.3	-30.7	-169.4	0	0	0	0	0	114.3	V126 H132 C133	V126-G130 VanDerWaalsContact O-CA 3.3Å; V126-G130 WeakPolarHBondContact O-CA 3.25Å; V126-G130 PolarHBondContact O-N 3.33Å; G130-H132 PolarHBondContact O-N 3.43Å; G130-H132 VanDerWaalsContact O-N 3.13Å; G130-C133 PolarHBondContact O-N 3.23Å
131	K	74.6	Confident	84.2	Confident	161 Å²	161	56.9 Å²	56.9	70%	0.7	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-61.4	-22.9	177.5	-64	174.1	-172.9	161.5	0	113.5	T129	T129-K131 VanDerWaalsContact C-N 3.29Å; T129-K131 PolarHBondContact O-N 3Å
132	H	69.9	Low	84.4	Confident	64 Å²	64	54.9 Å²	54.9	30%	0.296	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-115.4	-2.3	-174.6	-59.7	-69.1	0	0	0	112.2	H16 Y63 T129 G130 L134	H16-H132 AromaticContact CE1-CE1 3.45Å; H16-H132 PolarHBondContact CE1-CE1 2.99Å; H16-H132 VanDerWaalsContact CE1-CE1 3.45Å; H16-H132 AromaticContact CE1-NE2 3.21Å; H16-H132 PolarHBondContact CE1-NE2 3.02Å; H16-H132 AromaticContact ND1-NE2 3.73Å; H16-H132 AromaticContact NE2-CE1 3.74Å; H16-H132 AromaticContact NE2-NE2 3.54Å; Y63-H132 HydrophobicContact CE1-CB 4.14Å; Y63-H132 HydrophobicContact CE2-CB 4.15Å; Y63-H132 VanDerWaalsContact OH-CB 3.25Å; Y63-H132 WeakPolarHBondContact OH-CB 3.34Å; T129-H132 PolarHBondContact O-N 3.36Å; T129-H132 VanDerWaalsContact O-N 3.1Å; G130-H132 PolarHBondContact O-N 3.43Å; G130-H132 VanDerWaalsContact O-N 3.13Å; H132-L134 PolarHBondContact O-N 3.14Å
133	C	74.4	Confident	84.5	Confident	48 Å²	48	53.9 Å²	53.9	32%	0.324	30%	0.299	S	S	.	.			trans	-80.9	116	-177.4	-150.7	0	0	0	0	109.5	Y63 T129 G130 T137	Y63-C133 HydrophobicContact CD1-CB 4.47Å; Y63-C133 HydrophobicContact CE1-CB 4.34Å; T129-C133 PolarHBondContact O-N 3.32Å; G130-C133 PolarHBondContact O-N 3.23Å; C133-T137 PolarHBondContact SG-O 2.86Å
134	L	78	Confident	84.6	Confident	106 Å²	106	49.6 Å²	49.6	56%	0.555	28%	0.279	S	S	*	.			trans	-77.7	154.3	173.1	-64.9	173	0	0	0	109.9	V42 H132 G136 T137	V42-L134 HydrophobicContact CG1-CD1 3.89Å; H132-L134 PolarHBondContact O-N 3.14Å; L134-G136 PolarHBondContact O-N 2.99Å; L134-T137 HydrophobicContact CB-CG2 4.15Å; L134-T137 PolarHBondContact N-OG1 2.67Å; L134-T137 VanDerWaalsContact N-OG1 3.14Å; L134-T137 PolarHBondContact O-N 3.02Å; L134-T137 PolarHBondContact O-OG1 3.09Å
135	S	79.9	Confident	84.6	Confident	132 Å²	132	48.5 Å²	48.5	92%	0.923	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	130.9	178.1	-172.9	0	0	0	0	111.4	T137	S135-T137 VanDerWaalsContact C-N 3.31Å; S135-T137 PolarHBondContact O-N 3.39Å
136	G	82.4	Confident	84.4	Confident	32 Å²	32	51 Å²	51	33%	0.33	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	18.4	-176.9	0	0	0	0	0	114.7	L134	L134-G136 PolarHBondContact O-N 2.99Å
137	T	89	Confident	84.2	Confident	13 Å²	13	49.3 Å²	49.3	8%	0.08	29%	0.286	C	S	.	.			trans	-116.3	148.2	170.1	66	0	0	0	0	110.5	V42 I64 K65 C133 L134 S135	V42-T137 HydrophobicContact CB-CG2 4.2Å; V42-T137 HydrophobicContact CG1-CG2 4.41Å; V42-T137 HydrophobicContact CG2-CG2 3.81Å; I64-T137 WeakPolarHBondContact O-CA 3.34Å; K65-T137 HydrophobicContact CB-CG2 4.3Å; C133-T137 PolarHBondContact SG-O 2.86Å; L134-T137 HydrophobicContact CB-CG2 4.15Å; L134-T137 PolarHBondContact N-OG1 2.67Å; L134-T137 VanDerWaalsContact N-OG1 3.14Å; L134-T137 PolarHBondContact O-N 3.02Å; L134-T137 PolarHBondContact O-OG1 3.09Å; S135-T137 VanDerWaalsContact C-N 3.31Å; S135-T137 PolarHBondContact O-N 3.39Å
138	Y	92.4	Very high	83.5	Confident	23 Å²	23	47.4 Å²	47.4	9%	0.09	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	142.3	177.8	-61.2	-87.3	0	0	0	110	Y63 I64 P66 E113 L116 E117 V120	Y63-Y138 WeakPolarHBondContact CA-O 3.37Å; I64-Y138 PolarHBondContact N-O 3.21Å; I64-Y138 PolarHBondContact O-N 2.83Å; P66-Y138 HydrophobicContact CG-CD2 3.9Å; P66-Y138 HydrophobicContact CG-CE2 3.7Å; E113-Y138 PolarHBondContact O-OH 3.22Å; L116-Y138 HydrophobicContact CD2-CD2 3.75Å; L116-Y138 HydrophobicContact CD2-CE2 3.87Å; L116-Y138 HydrophobicContact CD2-CG 4.12Å; E117-Y138 HydrophobicContact CB-CE1 3.69Å; E117-Y138 HydrophobicContact CG-CE1 3.97Å; V120-Y138 HydrophobicContact CG2-CD1 4.08Å
139	A	94	Very high	83	Confident	14 Å²	14	53.9 Å²	53.9	12%	0.116	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	116.9	-177	0	0	0	0	0	110.8	V61 Y63 T129 P167	V61-A139 HydrophobicContact CG1-CB 3.74Å; Y63-A139 HydrophobicContact CD1-CB 4.11Å; Y63-A139 HydrophobicContact CE1-CB 3.93Å; T129-A139 HydrophobicContact CG2-CB 4.01Å; A139-P167 VanDerWaalsContact O-CB 3.26Å; A139-P167 WeakPolarHBondContact O-CB 3.5Å
140	F	94.8	Very high	82.5	Confident	0 Å²	0	54 Å²	54	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	135.9	176.8	-68.2	-86.8	0	0	0	111.4	L37 V61 L62 I64 L116 V120 L160 T162 P167 I169	L37-F140 HydrophobicContact CD1-CE2 3.99Å; L37-F140 HydrophobicContact CD1-CZ 3.74Å; V61-F140 CarbonylContact C-O 3.57Å; V61-F140 WeakPolarHBondContact CA-O 3.41Å; L62-F140 PolarHBondContact N-O 3.02Å; L62-F140 PolarHBondContact O-N 2.81Å; I64-F140 HydrophobicContact CB-CD2 4.21Å; I64-F140 HydrophobicContact CB-CE2 4.37Å; I64-F140 HydrophobicContact CD1-CB 4.42Å; I64-F140 HydrophobicContact CD1-CD2 3.77Å; I64-F140 HydrophobicContact CD1-CE2 4.46Å; I64-F140 HydrophobicContact CD1-CG 4.36Å; I64-F140 HydrophobicContact CG1-CD2 4.24Å; L116-F140 HydrophobicContact CD1-CZ 4.42Å; V120-F140 HydrophobicContact CB-CE1 4.37Å; V120-F140 HydrophobicContact CG1-CE1 3.91Å; V120-F140 HydrophobicContact CG1-CZ 4.26Å; V120-F140 HydrophobicContact CG2-CZ 4.48Å; F140-L160 HydrophobicContact CB-CD2 4.24Å; F140-L160 HydrophobicContact CD1-CD1 4.15Å; F140-L160 HydrophobicContact CD1-CD2 4.13Å; F140-L160 HydrophobicContact CD2-CD2 3.98Å; F140-L160 HydrophobicContact CE1-CD1 4.06Å; F140-L160 HydrophobicContact CE2-CD2 4.35Å; F140-L160 HydrophobicContact CG-CD2 3.85Å; F140-L160 HydrophobicContact CZ-CD1 4.49Å; F140-T162 HydrophobicContact CD1-CG2 4.03Å; F140-T162 HydrophobicContact CE1-CG2 3.74Å; F140-P167 CarbonylContact C-O 3.36Å; F140-P167 VanDerWaalsContact CA-O 3.25Å; F140-P167 WeakPolarHBondContact CA-O 3.01Å; F140-I169 HydrophobicContact CB-CD1 3.75Å; F140-I169 HydrophobicContact CB-CG1 3.78Å
141	W	94.3	Very high	82.7	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.008	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	125.3	-171.9	-67	61.7	0	0	0	110.3	W24 I49 F59 V61 L125 V128 T129 P167 F168 I169	W24-W141 HydrophobicContact CH2-CH2 4.48Å; W24-W141 HydrophobicContact CH2-CZ3 4.18Å; W24-W141 HydrophobicContact CZ2-CZ3 4.35Å; I49-W141 HydrophobicContact CD1-CH2 3.86Å; I49-W141 HydrophobicContact CD1-CZ3 3.83Å; I49-W141 HydrophobicContact CG1-CH2 4.31Å; I49-W141 HydrophobicContact CG1-CZ3 3.82Å; F59-W141 HydrophobicContact CB-CE3 3.81Å; F59-W141 HydrophobicContact CB-CZ3 4.29Å; F59-W141 HydrophobicContact CD1-CB 4.47Å; F59-W141 HydrophobicContact CD1-CE3 4.15Å; F59-W141 AromaticContact CD2-CE3 3.89Å; F59-W141 HydrophobicContact CD2-CE3 3.89Å; F59-W141 AromaticContact CD2-CZ3 3.98Å; F59-W141 HydrophobicContact CD2-CZ3 3.98Å; F59-W141 AromaticContact CG-CE3 3.68Å; F59-W141 HydrophobicContact CG-CE3 3.68Å; F59-W141 HydrophobicContact CG-CZ3 4.2Å; V61-W141 HydrophobicContact CG2-CD2 3.98Å; V61-W141 HydrophobicContact CG2-CE3 4.27Å; V61-W141 HydrophobicContact CG2-CG 4.32Å; V61-W141 HydrophobicContact CG2-CZ2 4.47Å; L125-W141 HydrophobicContact CB-CZ2 4.09Å; L125-W141 HydrophobicContact CD2-CH2 4.23Å; L125-W141 HydrophobicContact CD2-CZ2 3.91Å; L125-W141 HydrophobicContact CG-CZ2 4.48Å; V128-W141 HydrophobicContact CB-CH2 4.24Å; V128-W141 HydrophobicContact CB-CZ2 4.27Å; V128-W141 HydrophobicContact CG1-CH2 3.75Å; V128-W141 HydrophobicContact CG1-CZ2 4.04Å; T129-W141 HydrophobicContact CG2-CZ2 3.6Å; W141-P167 PolarHBondContact N-O 2.91Å; W141-F168 HydrophobicContact CB-CD1 3.67Å; W141-F168 HydrophobicContact CB-CE1 3.78Å; W141-F168 HydrophobicContact CB-CG 4.41Å; W141-F168 HydrophobicContact CD2-CE1 4.39Å; W141-F168 HydrophobicContact CE3-CE1 4.37Å; W141-F168 HydrophobicContact CG-CD1 4.47Å; W141-F168 HydrophobicContact CG-CE1 4.18Å; W141-I169 PolarHBondContact O-N 2.86Å
142	Y	92.8	Very high	83.1	Confident	12 Å²	12	53.9 Å²	53.9	5%	0.047	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.1	179.1	-158.5	-138	0	0	0	110.8	F59 Y60 E144 E146 M147 I169 L172	F59-Y142 CarbonylContact C-O 3.6Å; F59-Y142 WeakPolarHBondContact CA-O 3.26Å; Y60-Y142 PolarHBondContact N-O 3.17Å; Y60-Y142 PolarHBondContact O-N 2.89Å; Y142-E144 PolarHBondContact O-N 2.73Å; Y142-E146 HydrophobicContact CD1-CB 4.43Å; Y142-E146 HydrophobicContact CD2-CB 4.36Å; Y142-E146 HydrophobicContact CE1-CB 3.8Å; Y142-E146 HydrophobicContact CE2-CB 3.75Å; Y142-E146 HydrophobicContact CE2-CG 4.48Å; Y142-E146 WeakPolarHBondContact CE2-OE2 3.41Å; Y142-E146 VanDerWaalsContact CZ-CB 3.41Å; Y142-E146 WeakPolarHBondContact OH-CB 3.06Å; Y142-M147 HydrophobicContact CD1-CB 3.95Å; Y142-M147 HydrophobicContact CD1-SD 3.96Å; Y142-M147 HydrophobicContact CE1-CB 4.31Å; Y142-M147 HydrophobicContact CE1-SD 4.37Å; Y142-I169 HydrophobicContact CD2-CB 3.69Å; Y142-I169 HydrophobicContact CD2-CD1 4.34Å; Y142-I169 HydrophobicContact CD2-CG2 3.78Å; Y142-I169 HydrophobicContact CE2-CB 4.26Å; Y142-I169 HydrophobicContact CE2-CG2 3.86Å; Y142-I169 HydrophobicContact CG-CD1 4.4Å; Y142-L172 HydrophobicContact CE1-CD2 4.36Å
143	P	91	Very high	83.8	Confident	34 Å²	34	57.1 Å²	57.1	22%	0.221	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	137.4	178.9	-23.1	33.8	0	0	0	111.6	F59 G145 E146 M147	F59-P143 HydrophobicContact CE1-CG 4.32Å; P143-G145 PolarHBondContact O-N 2.81Å; P143-E146 HydrophobicContact CB-CG 4.22Å; P143-E146 HydrophobicContact CG-CG 4.37Å; P143-E146 PolarHBondContact O-N 2.98Å; P143-M147 PolarHBondContact O-N 2.8Å
144	E	88.6	Confident	84.5	Confident	70 Å²	70	58.8 Å²	58.8	33%	0.327	34%	0.336	S	S	.	.	H	α-helix	trans	-57.4	-35.7	-179.5	168.7	166	-119.9	0	0	113	R58 Y60 Y142 E146 M147 S148	R58-E144 HydrophobicContact CB-CB 3.97Å; R58-E144 WeakPolarHBondContact CB-OE2 3.3Å; R58-E144 WeakPolarHBondContact CD-OE2 3.36Å; R58-E144 PolarHBondContact O-N 3.33Å; Y60-E144 HydrophobicContact CD2-CB 4.1Å; Y60-E144 HydrophobicContact CD2-CG 4.48Å; Y60-E144 HydrophobicContact CE2-CB 3.98Å; Y60-E144 HydrophobicContact CE2-CG 3.86Å; Y142-E144 PolarHBondContact O-N 2.73Å; E144-E146 PolarHBondContact O-N 2.85Å; E144-M147 PolarHBondContact O-N 3.36Å; E144-S148 PolarHBondContact O-N 2.92Å; E144-S148 VanDerWaalsContact O-N 3.09Å
145	G	83.6	Confident	84.9	Confident	52 Å²	52	55.5 Å²	55.5	54%	0.536	33%	0.327	S	S	.	.	H	α-helix	trans	-60	-33.6	176	0	0	0	0	0	113.2	P143 S148	P143-G145 PolarHBondContact O-N 2.81Å; G145-S148 PolarHBondContact O-OG 2.94Å
146	E	81.7	Confident	85.3	Confident	59 Å²	59	51.1 Å²	51.1	28%	0.276	29%	0.292	S	S	.	.	H	α-helix	trans	-81.3	-36	176.9	-59.3	-176.2	-158	0	0	111.4	Y142 P143 E144 S148 K149 T150 K163	Y142-E146 HydrophobicContact CD1-CB 4.43Å; Y142-E146 HydrophobicContact CD2-CB 4.36Å; Y142-E146 HydrophobicContact CE1-CB 3.8Å; Y142-E146 HydrophobicContact CE2-CB 3.75Å; Y142-E146 HydrophobicContact CE2-CG 4.48Å; Y142-E146 WeakPolarHBondContact CE2-OE2 3.41Å; Y142-E146 VanDerWaalsContact CZ-CB 3.41Å; Y142-E146 WeakPolarHBondContact OH-CB 3.06Å; P143-E146 HydrophobicContact CB-CG 4.22Å; P143-E146 HydrophobicContact CG-CG 4.37Å; P143-E146 PolarHBondContact O-N 2.98Å; E144-E146 PolarHBondContact O-N 2.85Å; E146-S148 VanDerWaalsContact C-N 3.29Å; E146-S148 PolarHBondContact O-N 2.81Å; E146-K149 PolarHBondContact O-N 3.26Å; E146-T150 PolarHBondContact O-OG1 3.4Å; E146-K163 IonicContact OE1-NZ 3.67Å
147	M	81.6	Confident	85.7	Confident	23 Å²	23	53.5 Å²	53.5	11%	0.113	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-34.1	176.2	-171.2	65.4	-165	0	0	113	Y60 Y142 P143 E144 K149 T150 L152	Y60-M147 HydrophobicContact CD1-CE 4.5Å; Y60-M147 HydrophobicContact CD1-CG 3.83Å; Y60-M147 HydrophobicContact CD1-SD 4.44Å; Y60-M147 HydrophobicContact CD2-CB 3.59Å; Y60-M147 HydrophobicContact CD2-CG 3.59Å; Y60-M147 HydrophobicContact CE1-CG 3.94Å; Y60-M147 HydrophobicContact CE2-CB 3.85Å; Y60-M147 HydrophobicContact CE2-CG 3.73Å; Y60-M147 HydrophobicContact CG-CB 4.04Å; Y60-M147 HydrophobicContact CG-CG 3.63Å; Y60-M147 HydrophobicContact CG-SD 4.38Å; Y142-M147 HydrophobicContact CD1-CB 3.95Å; Y142-M147 HydrophobicContact CD1-SD 3.96Å; Y142-M147 HydrophobicContact CE1-CB 4.31Å; Y142-M147 HydrophobicContact CE1-SD 4.37Å; P143-M147 PolarHBondContact O-N 2.8Å; E144-M147 PolarHBondContact O-N 3.36Å; M147-K149 PolarHBondContact O-N 3.31Å; M147-T150 WeakPolarHBondContact CE-O 3.45Å; M147-T150 PolarHBondContact O-N 3.23Å; M147-L152 HydrophobicContact CE-CB 4.04Å; M147-L152 HydrophobicContact CE-CD1 3.76Å; M147-L152 HydrophobicContact CE-CG 3.99Å; M147-L152 HydrophobicContact SD-CD1 3.84Å; M147-L152 HydrophobicContact SD-CG 4.5Å
148	S	71	Confident	85.8	Confident	98 Å²	98	52.9 Å²	52.9	69%	0.685	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-21.1	178.2	69.2	0	0	0	0	114.2	E144 G145 E146	E144-S148 PolarHBondContact O-N 2.92Å; E144-S148 VanDerWaalsContact O-N 3.09Å; G145-S148 PolarHBondContact O-OG 2.94Å; E146-S148 VanDerWaalsContact C-N 3.29Å; E146-S148 PolarHBondContact O-N 2.81Å
149	K	71.4	Confident	85.7	Confident	147 Å²	147	54.5 Å²	54.5	64%	0.639	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-3.9	179.5	-55.4	178.6	-176.1	179.5	0	112.9	E146 M147	E146-K149 PolarHBondContact O-N 3.26Å; M147-K149 PolarHBondContact O-N 3.31Å
150	T	71.4	Confident	85.6	Confident	11 Å²	11	53.9 Å²	53.9	7%	0.067	29%	0.294	C	S	.	.			trans	-124.9	111.8	-170.7	-47	0	0	0	0	109.8	E146 M147 L152 L172 C183	E146-T150 PolarHBondContact O-OG1 3.4Å; M147-T150 WeakPolarHBondContact CE-O 3.45Å; M147-T150 PolarHBondContact O-N 3.23Å; T150-L152 HydrophobicContact CG2-CD1 4.46Å; T150-L152 HydrophobicContact CG2-CD2 3.9Å; T150-L152 HydrophobicContact CG2-CG 3.94Å; T150-L172 HydrophobicContact CG2-CD2 4.24Å; T150-C183 HydrophobicContact CG2-CB 4.32Å
151	E	79.5	Confident	85.6	Confident	162 Å²	162	56.4 Å²	56.4	76%	0.757	31%	0.305	S	S	*	.			trans	-79.7	121.8	170.9	-64.2	177	174.6	0	0	108.2	K174	E151-K174 WeakPolarHBondContact O-CE 3.08Å; E151-K174 PolarHBondContact O-NZ 2.78Å
152	L	82.9	Confident	85.5	Confident	30 Å²	30	56.3 Å²	56.3	16%	0.157	31%	0.305	C	S	.	.			trans	-129.2	142.3	174.4	-60.9	171.4	0	0	0	109.6	L41 L62 M147 T150 I158 L172	L41-L152 HydrophobicContact CD2-CB 3.84Å; L41-L152 HydrophobicContact CD2-CD1 4.3Å; L62-L152 HydrophobicContact CD1-CD1 3.87Å; L62-L152 HydrophobicContact CD2-CD1 4.09Å; M147-L152 HydrophobicContact CE-CB 4.04Å; M147-L152 HydrophobicContact CE-CD1 3.76Å; M147-L152 HydrophobicContact CE-CG 3.99Å; M147-L152 HydrophobicContact SD-CD1 3.84Å; M147-L152 HydrophobicContact SD-CG 4.5Å; T150-L152 HydrophobicContact CG2-CD1 4.46Å; T150-L152 HydrophobicContact CG2-CD2 3.9Å; T150-L152 HydrophobicContact CG2-CG 3.94Å; L152-I158 HydrophobicContact CD2-CG2 4.27Å; L152-L172 HydrophobicContact CD1-CD2 3.48Å; L152-L172 VanDerWaalsContact CD1-CD2 3.48Å; L152-L172 HydrophobicContact CD2-CD2 3.97Å; L152-L172 HydrophobicContact CG-CD2 4.25Å
153	E	85	Confident	85.5	Confident	132 Å²	132	58.3 Å²	58.3	62%	0.617	31%	0.314	S	S	*	.			trans	-120.2	138.6	172.5	-55.9	177.2	162.6	0	0	110	G155 Q156	E153-G155 PolarHBondContact O-N 3.1Å; E153-Q156 HydrophobicContact CB-CG 4.03Å; E153-Q156 WeakPolarHBondContact O-CB 3.48Å; E153-Q156 WeakPolarHBondContact O-CG 3.41Å; E153-Q156 PolarHBondContact O-N 2.77Å; E153-Q156 PolarHBondContact OE2-NE2 3.1Å
154	T	88.4	Confident	85.5	Confident	83 Å²	83	57 Å²	57	51%	0.509	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	131.8	172.5	51.9	0	0	0	0	109.5
155	G	87.4	Confident	85.6	Confident	36 Å²	36	55.4 Å²	55.4	37%	0.371	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.9	-7.5	-177	0	0	0	0	0	114.3	K40 L41 E153	K40-G155 WeakPolarHBondContact CE-O 3.32Å; L41-G155 WeakPolarHBondContact O-CA 3.42Å; L41-G155 PolarHBondContact O-N 3.13Å; E153-G155 PolarHBondContact O-N 3.1Å
156	Q	88.7	Confident	86	Confident	40 Å²	40	52.9 Å²	52.9	19%	0.187	27%	0.274	C	S	.	.			trans	-75.8	146.9	175.1	-71	177.4	-19.7	0	0	112	L41 E153	L41-Q156 PolarHBondContact N-O 2.83Å; E153-Q156 HydrophobicContact CB-CG 4.03Å; E153-Q156 WeakPolarHBondContact O-CB 3.48Å; E153-Q156 WeakPolarHBondContact O-CG 3.41Å; E153-Q156 PolarHBondContact O-N 2.77Å; E153-Q156 PolarHBondContact OE2-NE2 3.1Å
157	D	90.3	Very high	86.6	Confident	83 Å²	83	50.2 Å²	50.2	44%	0.444	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	130.3	167.7	-67.6	-61.3	0	0	0	109.4	V175	D157-V175 HydrophobicContact CB-CB 4.1Å; D157-V175 PolarHBondContact O-N 2.91Å
158	I	90.9	Very high	87.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	151.1	-175.7	57	167.2	0	0	0	110.4	E38 G39 L41 I64 L152 L172 A173	E38-I158 WeakPolarHBondContact CA-O 3.47Å; G39-I158 PolarHBondContact N-O 2.91Å; G39-I158 WeakPolarHBondContact O-CG1 3.15Å; G39-I158 PolarHBondContact O-N 2.9Å; L41-I158 HydrophobicContact CB-CD1 4.08Å; L41-I158 HydrophobicContact CB-CG1 4.43Å; L41-I158 HydrophobicContact CD1-CD1 4.37Å; I64-I158 HydrophobicContact CD1-CD1 3.33Å; I64-I158 HydrophobicContact CD1-CG1 4.41Å; I64-I158 HydrophobicContact CG1-CD1 3.82Å; I64-I158 HydrophobicContact CG2-CD1 4.42Å; L152-I158 HydrophobicContact CD2-CG2 4.27Å; I158-L172 HydrophobicContact CB-CD1 4.22Å; I158-L172 HydrophobicContact CD1-CD1 3.94Å; I158-A173 CarbonylContact C-O 3.5Å; I158-A173 VanDerWaalsContact CA-O 3.27Å; I158-A173 WeakPolarHBondContact CA-O 3.47Å
159	R	90.9	Very high	88.3	Confident	57 Å²	57	44.8 Å²	44.8	22%	0.215	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	128.1	168	-174.4	-177.9	-74.8	176.7	0.6	108.4	I36 L37 E38 L172 A173 V175	I36-R159 HydrophobicContact CG2-CG 4.09Å; L37-R159 CarbonylContact O-C 3.52Å; L37-R159 VanDerWaalsContact O-CA 3.29Å; L37-R159 WeakPolarHBondContact O-CA 3.4Å; E38-R159 HydrophobicContact CG-CB 3.99Å; E38-R159 HydrophobicContact CG-CG 3.85Å; E38-R159 IonicContact OE1-CZ 2.96Å; E38-R159 IonicContact OE1-NE 3.67Å; E38-R159 PolarHBondContact OE1-NE 2.92Å; E38-R159 IonicContact OE1-NH2 3.69Å; E38-R159 PolarHBondContact OE1-NH2 3.4Å; R159-L172 CarbonylContact O-C 3.55Å; R159-A173 PolarHBondContact N-O 3.06Å; R159-A173 PolarHBondContact O-N 2.85Å; R159-V175 HydrophobicContact CB-CG2 3.89Å
160	L	92.3	Very high	89.2	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	159.4	174.5	67.7	79.3	0	0	0	112.1	I36 L37 I64 F140 T162 I169 S171 L172	I36-L160 WeakPolarHBondContact CA-O 3.37Å; L37-L160 HydrophobicContact CB-CD1 3.87Å; L37-L160 HydrophobicContact CB-CG 4.11Å; L37-L160 HydrophobicContact CD2-CD2 4.38Å; L37-L160 HydrophobicContact CD2-CG 4.27Å; L37-L160 PolarHBondContact N-O 3.38Å; L37-L160 PolarHBondContact O-N 3.03Å; I64-L160 HydrophobicContact CD1-CD2 3.2Å; F140-L160 HydrophobicContact CB-CD2 4.24Å; F140-L160 HydrophobicContact CD1-CD1 4.15Å; F140-L160 HydrophobicContact CD1-CD2 4.13Å; F140-L160 HydrophobicContact CD2-CD2 3.98Å; F140-L160 HydrophobicContact CE1-CD1 4.06Å; F140-L160 HydrophobicContact CE2-CD2 4.35Å; F140-L160 HydrophobicContact CG-CD2 3.85Å; F140-L160 HydrophobicContact CZ-CD1 4.49Å; L160-T162 HydrophobicContact CD1-CG2 3.98Å; L160-I169 HydrophobicContact CB-CG2 4.46Å; L160-I169 HydrophobicContact CD2-CD1 4.09Å; L160-I169 HydrophobicContact CD2-CG1 4.36Å; L160-S171 CarbonylContact C-O 3.53Å; L160-S171 VanDerWaalsContact CA-O 3.25Å; L160-S171 WeakPolarHBondContact CA-O 3.44Å; L160-L172 HydrophobicContact CB-CD1 3.8Å
161	K	93	Very high	90	Very high	52 Å²	52	40.5 Å²	40.5	23%	0.226	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	141.5	166.7	-58.2	-169.8	-178.1	-157.7	0	108.9	V35 I36 E80 F170 S171	V35-K161 WeakPolarHBondContact O-CA 3.29Å; I36-K161 HydrophobicContact CD1-CD 4.26Å; I36-K161 HydrophobicContact CD1-CG 4.34Å; I36-K161 HydrophobicContact CG1-CG 4.19Å; I36-K161 HydrophobicContact CG2-CG 4.41Å; E80-K161 IonicContact OE1-NZ 2.56Å; E80-K161 PolarHBondContact OE1-NZ 3.01Å; E80-K161 IonicContact OE2-NZ 2.81Å; E80-K161 PolarHBondContact OE2-NZ 2.88Å; K161-F170 HydrophobicContact CB-CB 4.38Å; K161-F170 HydrophobicContact CB-CD1 4.35Å; K161-F170 WeakPolarHBondContact O-CB 3.1Å; K161-F170 PolarHBondContact O-N 2.57Å; K161-S171 PolarHBondContact N-O 2.94Å; K161-S171 PolarHBondContact O-N 2.92Å
162	T	93.5	Very high	90.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	152.5	175.2	62.5	0	0	0	0	112.6	G34 V35 R72 F140 L160 G164 G166 F168	G34-T162 WeakPolarHBondContact CA-OG1 3.39Å; V35-T162 HydrophobicContact CG2-CG2 3.61Å; V35-T162 PolarHBondContact N-OG1 3.39Å; V35-T162 PolarHBondContact O-N 3.21Å; R72-T162 PolarHBondContact NH1-O 2.76Å; F140-T162 HydrophobicContact CD1-CG2 4.03Å; F140-T162 HydrophobicContact CE1-CG2 3.74Å; L160-T162 HydrophobicContact CD1-CG2 3.98Å; T162-G164 WeakPolarHBondContact CB-O 3.33Å; T162-G164 PolarHBondContact O-N 3.18Å; T162-G164 PolarHBondContact OG1-O 3.14Å; T162-G166 WeakPolarHBondContact CB-O 3.41Å; T162-G166 WeakPolarHBondContact CG2-O 3.5Å; T162-F168 CarbonylContact C-O 3.59Å; T162-F168 VanDerWaalsContact CA-O 3.24Å; T162-F168 WeakPolarHBondContact CA-O 3.49Å
163	K	91.7	Very high	90.6	Very high	55 Å²	55	31.9 Å²	31.9	24%	0.239	17%	0.168	C	C	.	.	S	Bend	trans	-78.4	87.1	165.6	-65.1	-178.1	-176.7	172.8	0	107.2	Q30 E146 F168 I169 F170	Q30-K163 WeakPolarHBondContact CA-O 3.45Å; Q30-K163 HydrophobicContact CB-CB 4.14Å; Q30-K163 VanDerWaalsContact CB-O 3.26Å; Q30-K163 WeakPolarHBondContact CB-O 3.46Å; Q30-K163 HydrophobicContact CG-CB 3.75Å; Q30-K163 WeakPolarHBondContact CG-O 3.45Å; E146-K163 IonicContact OE1-NZ 3.67Å; K163-F168 HydrophobicContact CB-CB 4.43Å; K163-F168 PolarHBondContact N-O 3.28Å; K163-I169 VanDerWaalsContact CE-O 3.27Å; K163-I169 WeakPolarHBondContact CE-O 2.9Å; K163-F170 HydrophobicContact CG-CB 3.58Å; K163-F170 HydrophobicContact CG-CD2 3.96Å; K163-F170 HydrophobicContact CG-CG 4.26Å
164	G	90.7	Very high	90.7	Very high	6 Å²	6	27.2 Å²	27.2	6%	0.062	15%	0.146	C	C	.	.	S	Bend	trans	68.6	-163.5	-176.9	0	0	0	0	0	114.4	G34 T162 G166	G34-G164 WeakPolarHBondContact CA-O 3.3Å; T162-G164 WeakPolarHBondContact CB-O 3.33Å; T162-G164 PolarHBondContact O-N 3.18Å; T162-G164 PolarHBondContact OG1-O 3.14Å; G164-G166 PolarHBondContact O-N 2.98Å
165	D	91.8	Very high	90.4	Very high	36 Å²	36	24.3 Å²	24.3	19%	0.193	13%	0.128	C	C	.	.	S	Bend	trans	-80.8	68.5	-177.7	-58.6	-15.7	0	0	0	110.3	S31 G32 L33 G34 L119 K122	S31-D165 WeakPolarHBondContact O-CA 3.3Å; S31-D165 VanDerWaalsContact O-CB 3.27Å; S31-D165 WeakPolarHBondContact O-CB 3.32Å; S31-D165 PolarHBondContact O-N 3.06Å; G32-D165 WeakPolarHBondContact CA-OD2 3.35Å; L33-D165 PolarHBondContact N-OD1 3.16Å; G34-D165 WeakPolarHBondContact CA-OD1 3.42Å; G34-D165 PolarHBondContact N-OD1 3.05Å; L119-D165 HydrophobicContact CD2-CB 3.93Å; L119-D165 CarbonylContact O-C 3.52Å; L119-D165 VanDerWaalsContact O-O 3.06Å; K122-D165 WeakPolarHBondContact CE-O 2.95Å; K122-D165 PolarHBondContact NZ-O 2.92Å
166	G	92.4	Very high	89.8	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	-165.1	174.6	177.5	0	0	0	0	0	112.2	Y29 T162 G164 F168	Y29-G166 WeakPolarHBondContact O-CA 3.32Å; T162-G166 WeakPolarHBondContact CB-O 3.41Å; T162-G166 WeakPolarHBondContact CG2-O 3.5Å; G164-G166 PolarHBondContact O-N 2.98Å; G166-F168 PolarHBondContact O-N 3.43Å
167	P	93.7	Very high	88.4	Confident	3 Å²	3	29.4 Å²	29.4	2%	0.019	17%	0.169	C	C	.	.	S	Bend	trans	-83.8	4.5	-171.6	34.2	-34.8	0	0	0	113.2	V120 L125 A139 F140 W141	V120-P167 HydrophobicContact CB-CB 4.37Å; V120-P167 WeakPolarHBondContact O-CD 3.29Å; V120-P167 WeakPolarHBondContact O-CG 3.48Å; L125-P167 HydrophobicContact CD1-CG 3.46Å; L125-P167 VanDerWaalsContact CD1-CG 3.46Å; A139-P167 VanDerWaalsContact O-CB 3.26Å; A139-P167 WeakPolarHBondContact O-CB 3.5Å; F140-P167 CarbonylContact C-O 3.36Å; F140-P167 VanDerWaalsContact CA-O 3.25Å; F140-P167 WeakPolarHBondContact CA-O 3.01Å; W141-P167 PolarHBondContact N-O 2.91Å
168	F	94.7	Very high	86.8	Confident	5 Å²	5	28.7 Å²	28.7	2%	0.022	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-80.2	126.9	-178.7	-68.1	-81.8	0	0	0	111.3	W24 P26 Y29 Q30 F59 L125 W141 T162 K163 G166	W24-F168 AromaticContact CH2-CZ 3.97Å; W24-F168 HydrophobicContact CH2-CZ 3.97Å; W24-F168 HydrophobicContact CZ2-CE1 4.24Å; W24-F168 HydrophobicContact CZ2-CZ 4.01Å; P26-F168 HydrophobicContact CB-CD1 4.31Å; P26-F168 HydrophobicContact CB-CE1 3.88Å; P26-F168 HydrophobicContact CB-CE2 4.38Å; P26-F168 HydrophobicContact CB-CZ 3.91Å; P26-F168 HydrophobicContact CG-CE1 4.45Å; Y29-F168 AromaticContact CD2-CE2 3.64Å; Y29-F168 HydrophobicContact CD2-CE2 3.64Å; Y29-F168 HydrophobicContact CD2-CZ 4.2Å; Y29-F168 AromaticContact CG-CE2 3.97Å; Y29-F168 HydrophobicContact CG-CE2 3.97Å; Q30-F168 HydrophobicContact CG-CB 4.32Å; Q30-F168 HydrophobicContact CG-CD2 4.29Å; F59-F168 HydrophobicContact CE1-CD1 4.42Å; F59-F168 HydrophobicContact CE1-CE1 4.04Å; F59-F168 HydrophobicContact CZ-CE1 4.35Å; L125-F168 HydrophobicContact CD1-CE2 4Å; L125-F168 HydrophobicContact CD1-CZ 4.3Å; W141-F168 HydrophobicContact CB-CD1 3.67Å; W141-F168 HydrophobicContact CB-CE1 3.78Å; W141-F168 HydrophobicContact CB-CG 4.41Å; W141-F168 HydrophobicContact CD2-CE1 4.39Å; W141-F168 HydrophobicContact CE3-CE1 4.37Å; W141-F168 HydrophobicContact CG-CD1 4.47Å; W141-F168 HydrophobicContact CG-CE1 4.18Å; T162-F168 CarbonylContact C-O 3.59Å; T162-F168 VanDerWaalsContact CA-O 3.24Å; T162-F168 WeakPolarHBondContact CA-O 3.49Å; K163-F168 HydrophobicContact CB-CB 4.43Å; K163-F168 PolarHBondContact N-O 3.28Å; G166-F168 PolarHBondContact O-N 3.43Å
169	I	93.7	Very high	84.9	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	133.4	-178.1	-59.5	179.3	0	0	0	109.9	L62 F140 W141 Y142 L160 K163 S171 L172	L62-I169 HydrophobicContact CD1-CD1 3.66Å; L62-I169 HydrophobicContact CG-CD1 4.34Å; F140-I169 HydrophobicContact CB-CD1 3.75Å; F140-I169 HydrophobicContact CB-CG1 3.78Å; W141-I169 PolarHBondContact O-N 2.86Å; Y142-I169 HydrophobicContact CD2-CB 3.69Å; Y142-I169 HydrophobicContact CD2-CD1 4.34Å; Y142-I169 HydrophobicContact CD2-CG2 3.78Å; Y142-I169 HydrophobicContact CE2-CB 4.26Å; Y142-I169 HydrophobicContact CE2-CG2 3.86Å; Y142-I169 HydrophobicContact CG-CD1 4.4Å; L160-I169 HydrophobicContact CB-CG2 4.46Å; L160-I169 HydrophobicContact CD2-CD1 4.09Å; L160-I169 HydrophobicContact CD2-CG1 4.36Å; K163-I169 VanDerWaalsContact CE-O 3.27Å; K163-I169 WeakPolarHBondContact CE-O 2.9Å; I169-S171 WeakPolarHBondContact CG2-O 3.43Å; I169-L172 HydrophobicContact CG2-CB 4.24Å
170	F	90.6	Very high	83.3	Confident	55 Å²	55	31.7 Å²	31.7	24%	0.241	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-46.6	170.6	177	-109.4	0	0	0	111.8	K161 K163 A191	K161-F170 HydrophobicContact CB-CB 4.38Å; K161-F170 HydrophobicContact CB-CD1 4.35Å; K161-F170 WeakPolarHBondContact O-CB 3.1Å; K161-F170 PolarHBondContact O-N 2.57Å; K163-F170 HydrophobicContact CG-CB 3.58Å; K163-F170 HydrophobicContact CG-CD2 3.96Å; K163-F170 HydrophobicContact CG-CG 4.26Å; F170-A191 HydrophobicContact CE1-CB 3.5Å; F170-A191 HydrophobicContact CE2-CB 4.46Å; F170-A191 HydrophobicContact CZ-CB 3.45Å; F170-A191 VanDerWaalsContact CZ-CB 3.45Å
171	S	88.3	Confident	81.4	Confident	14 Å²	14	34.8 Å²	34.8	10%	0.098	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	147.4	-179.8	174.4	0	0	0	0	109.5	L160 K161 I169 N184	L160-S171 CarbonylContact C-O 3.53Å; L160-S171 VanDerWaalsContact CA-O 3.25Å; L160-S171 WeakPolarHBondContact CA-O 3.44Å; K161-S171 PolarHBondContact N-O 2.94Å; K161-S171 PolarHBondContact O-N 2.92Å; I169-S171 WeakPolarHBondContact CG2-O 3.43Å; S171-N184 PolarHBondContact OG-ND2 2.96Å; S171-N184 PolarHBondContact OG-OD1 3.29Å
172	L	88.8	Confident	79.3	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	138.8	-177.8	-174.2	63.8	0	0	0	109.6	L62 Y142 T150 L152 I158 R159 L160 I169	L62-L172 HydrophobicContact CD1-CD2 3.79Å; Y142-L172 HydrophobicContact CE1-CD2 4.36Å; T150-L172 HydrophobicContact CG2-CD2 4.24Å; L152-L172 HydrophobicContact CD1-CD2 3.48Å; L152-L172 VanDerWaalsContact CD1-CD2 3.48Å; L152-L172 HydrophobicContact CD2-CD2 3.97Å; L152-L172 HydrophobicContact CG-CD2 4.25Å; I158-L172 HydrophobicContact CB-CD1 4.22Å; I158-L172 HydrophobicContact CD1-CD1 3.94Å; R159-L172 CarbonylContact O-C 3.55Å; L160-L172 HydrophobicContact CB-CD1 3.8Å; I169-L172 HydrophobicContact CG2-CB 4.24Å
173	A	86.4	Confident	76.9	Confident	9 Å²	9	37.4 Å²	37.4	7%	0.074	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	149.8	178.2	0	0	0	0	0	110.7	I158 R159 V180	I158-A173 CarbonylContact C-O 3.5Å; I158-A173 VanDerWaalsContact CA-O 3.27Å; I158-A173 WeakPolarHBondContact CA-O 3.47Å; R159-A173 PolarHBondContact N-O 3.06Å; R159-A173 PolarHBondContact O-N 2.85Å; A173-V180 HydrophobicContact CB-CG1 3.78Å
174	K	87.3	Confident	74.6	Confident	34 Å²	34	37.2 Å²	37.2	15%	0.148	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	150.9	169.5	-68.1	177.1	-178.8	175.8	0	110	E151 T181	E151-K174 WeakPolarHBondContact O-CE 3.08Å; E151-K174 PolarHBondContact O-NZ 2.78Å; K174-T181 PolarHBondContact N-O 2.94Å; K174-T181 PolarHBondContact O-N 2.98Å
175	V	82	Confident	72.3	Confident	23 Å²	23	46.1 Å²	46.1	14%	0.139	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	104.1	175.3	-175.1	0	0	0	0	108.1	D157 R159 V180	D157-V175 HydrophobicContact CB-CB 4.1Å; D157-V175 PolarHBondContact O-N 2.91Å; R159-V175 HydrophobicContact CB-CG2 3.89Å; V175-V180 HydrophobicContact CG1-CG2 4.5Å; V175-V180 HydrophobicContact CG2-CG2 4.16Å
176	D	73.5	Confident	69.5	Low	95 Å²	95	48.1 Å²	48.1	51%	0.508	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113.8	179.2	-67.8	-45.8	0	0	0	109.7	G178 T179 T181	D176-G178 PolarHBondContact O-N 2.68Å; D176-G178 VanDerWaalsContact O-N 3.16Å; D176-T179 PolarHBondContact N-O 3.34Å; D176-T179 WeakPolarHBondContact O-CB 3.45Å; D176-T179 PolarHBondContact O-N 3.14Å; D176-T181 PolarHBondContact OD2-OG1 3.05Å; D176-T181 VanDerWaalsContact OD2-OG1 3.09Å
177	G	60.5	Low	66.7	Low	88 Å²	88	51.8 Å²	51.8	91%	0.907	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	30.4	175.2	0	0	0	0	0	114.6	T179	G177-T179 VanDerWaalsContact C-N 3.26Å; G177-T179 PolarHBondContact O-N 3.5Å
178	G	57.1	Low	63.9	Low	67 Å²	67	56.2 Å²	56.2	69%	0.691	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	-3.7	-175.9	0	0	0	0	0	114.6	D176	D176-G178 PolarHBondContact O-N 2.68Å; D176-G178 VanDerWaalsContact O-N 3.16Å
179	T	50.6	Low	61.5	Low	100 Å²	100	65.5 Å²	65.5	61%	0.613	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.8	169.9	-53.8	0	0	0	0	108.9	D176 G177 T181	D176-T179 PolarHBondContact N-O 3.34Å; D176-T179 WeakPolarHBondContact O-CB 3.45Å; D176-T179 PolarHBondContact O-N 3.14Å; G177-T179 VanDerWaalsContact C-N 3.26Å; G177-T179 PolarHBondContact O-N 3.5Å; T179-T181 PolarHBondContact O-N 3.27Å
180	V	56.1	Low	59.2	Low	21 Å²	21	73.9 Å²	73.9	13%	0.127	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	99.1	178.2	179.9	0	0	0	0	107.8	A173 V175 K182 W195	A173-V180 HydrophobicContact CB-CG1 3.78Å; V175-V180 HydrophobicContact CG1-CG2 4.5Å; V175-V180 HydrophobicContact CG2-CG2 4.16Å; V180-K182 PolarHBondContact O-N 2.89Å; V180-K182 VanDerWaalsContact O-N 3.14Å; V180-W195 HydrophobicContact CB-CH2 4.49Å
181	T	53.1	Low	57.1	Low	66 Å²	66	72.6 Å²	72.6	41%	0.405	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	98.2	172.2	1.9	0	0	0	0	107.4	K174 D176 T179 C183	K174-T181 PolarHBondContact N-O 2.94Å; K174-T181 PolarHBondContact O-N 2.98Å; D176-T181 PolarHBondContact OD2-OG1 3.05Å; D176-T181 VanDerWaalsContact OD2-OG1 3.09Å; T179-T181 PolarHBondContact O-N 3.27Å; T181-C183 PolarHBondContact O-N 3.23Å; T181-C183 VanDerWaalsContact O-N 3.09Å
182	K	48	Very low	55	Low	69 Å²	69	72.5 Å²	72.5	30%	0.3	44%	0.443	S	S	.	.			trans	-55.6	114	-179.9	-174.6	178.6	-179.8	-179.3	0	110.2	V180 N184 G192 W195	V180-K182 PolarHBondContact O-N 2.89Å; V180-K182 VanDerWaalsContact O-N 3.14Å; K182-N184 VanDerWaalsContact C-N 3.29Å; K182-N184 HydrophobicContact CD-CB 4.42Å; K182-N184 WeakPolarHBondContact CE-ND2 3.34Å; K182-N184 HydrophobicContact CG-CB 4Å; K182-N184 PolarHBondContact O-N 2.55Å; K182-G192 PolarHBondContact NZ-O 3.32Å; K182-G192 VanDerWaalsContact NZ-O 3.1Å; K182-W195 HydrophobicContact CB-CZ3 4.36Å; K182-W195 HydrophobicContact CD-CE3 4.5Å
183	C	43.2	Very low	52.9	Low	37 Å²	37	74.7 Å²	74.7	25%	0.25	46%	0.461	C	S	.	.			trans	-93.2	53.7	169.7	-60	0	0	0	0	110.7	T150 T181	T150-C183 HydrophobicContact CG2-CB 4.32Å; T181-C183 PolarHBondContact O-N 3.23Å; T181-C183 VanDerWaalsContact O-N 3.09Å
184	N	44.3	Very low	51	Low	51 Å²	51	77 Å²	77	27%	0.273	48%	0.477	S	S	.	.			trans	-115.8	97.8	166.4	-62.9	-19	0	0	0	106.9	S171 K182	S171-N184 PolarHBondContact OG-ND2 2.96Å; S171-N184 PolarHBondContact OG-OD1 3.29Å; K182-N184 VanDerWaalsContact C-N 3.29Å; K182-N184 HydrophobicContact CD-CB 4.42Å; K182-N184 WeakPolarHBondContact CE-ND2 3.34Å; K182-N184 HydrophobicContact CG-CB 4Å; K182-N184 PolarHBondContact O-N 2.55Å
185	F	42.1	Very low	48.9	Very low	194 Å²	194	80.2 Å²	80.2	85%	0.851	49%	0.488	S	S	*	.			trans	-131.3	132.5	174.6	-133	-98.3	0	0	0	113.8
186	A	32.1	Very low	47.2	Very low	77 Å²	77	81.9 Å²	81.9	64%	0.636	50%	0.498	S	S	*	.	S	Bend	trans	64.2	81.9	-177.3	0	0	0	0	0	117.2
187	G	33.9	Very low	46	Very low	78 Å²	78	82.1 Å²	82.1	80%	0.804	50%	0.499	S	S	*	.	S	Bend	trans	148.7	-23.7	142.3	0	0	0	0	0	118.4
188	D	35.8	Very low	45.6	Very low	95 Å²	95	84.4 Å²	84.4	51%	0.508	49%	0.485	S	S	.	.			trans	-99.1	102.5	-177.4	-168.5	11	0	0	0	111.1	E190	D188-E190 PolarHBondContact O-N 2.96Å; D188-E190 WeakPolarHBondContact OD1-CB 3.19Å; D188-E190 PolarHBondContact OD1-N 3.49Å; D188-E190 VanDerWaalsContact OD1-N 3.13Å
189	K	43.4	Very low	45.1	Very low	200 Å²	200	85.2 Å²	85.2	87%	0.87	47%	0.472	S	S	*	.	S	Bend	trans	-69.2	-16.4	177.4	-75.6	179.4	177.2	175	0	112
190	E	46.8	Very low	45.1	Very low	177 Å²	177	86.8 Å²	86.8	83%	0.827	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-35.3	-167.5	-145.8	164.4	-161.9	0	0	112.6	D188 G192	D188-E190 PolarHBondContact O-N 2.96Å; D188-E190 WeakPolarHBondContact OD1-CB 3.19Å; D188-E190 PolarHBondContact OD1-N 3.49Å; D188-E190 VanDerWaalsContact OD1-N 3.13Å; E190-G192 VanDerWaalsContact C-N 3.29Å; E190-G192 PolarHBondContact O-N 3.09Å
191	A	45.1	Very low	44.7	Very low	28 Å²	28	88.2 Å²	88.2	23%	0.231	49%	0.485	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.1	-178.6	0	0	0	0	0	115.1	F170	F170-A191 HydrophobicContact CE1-CB 3.5Å; F170-A191 HydrophobicContact CE2-CB 4.46Å; F170-A191 HydrophobicContact CZ-CB 3.45Å; F170-A191 VanDerWaalsContact CZ-CB 3.45Å
192	G	43.8	Very low	44.3	Very low	13 Å²	13	91 Å²	91	13%	0.134	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	-25.6	-158.2	0	0	0	0	0	118	K182 E190 T196	K182-G192 PolarHBondContact NZ-O 3.32Å; K182-G192 VanDerWaalsContact NZ-O 3.1Å; E190-G192 VanDerWaalsContact C-N 3.29Å; E190-G192 PolarHBondContact O-N 3.09Å; G192-T196 PolarHBondContact O-OG1 3.3Å
193	A	46.2	Very low	44.2	Very low	46 Å²	46	95 Å²	95	38%	0.38	52%	0.515	S	S	.	.	H	α-helix	trans	-67.4	-44.8	-164.4	0	0	0	0	0	113.5	W195 D197	A193-W195 VanDerWaalsContact C-N 3.33Å; A193-W195 PolarHBondContact O-N 2.89Å; A193-W195 VanDerWaalsContact O-N 3.14Å; A193-D197 VanDerWaalsContact O-CB 3.28Å; A193-D197 WeakPolarHBondContact O-CB 3.32Å; A193-D197 PolarHBondContact O-N 3.48Å
194	S	46.7	Very low	44.2	Very low	59 Å²	59	96.3 Å²	96.3	41%	0.413	52%	0.524	S	S	.	.	H	α-helix	trans	-63.7	-28.4	-167.5	-168.1	0	0	0	0	115.5
195	W	42.1	Very low	44.1	Very low	101 Å²	101	99.5 Å²	99.5	38%	0.383	54%	0.542	S	S	.	.	H	α-helix	trans	-93.4	-41.2	-178.4	-172.4	58.2	0	0	0	113.4	V180 K182 A193 K198 I199	V180-W195 HydrophobicContact CB-CH2 4.49Å; K182-W195 HydrophobicContact CB-CZ3 4.36Å; K182-W195 HydrophobicContact CD-CE3 4.5Å; A193-W195 VanDerWaalsContact C-N 3.33Å; A193-W195 PolarHBondContact O-N 2.89Å; A193-W195 VanDerWaalsContact O-N 3.14Å; W195-K198 PolarHBondContact O-N 3.22Å; W195-I199 HydrophobicContact CD2-CD1 4.36Å; W195-I199 HydrophobicContact CZ2-CD1 3.91Å; W195-I199 PolarHBondContact O-N 3.46Å
196	T	45.9	Very low	44.2	Very low	58 Å²	58	94.5 Å²	94.5	36%	0.356	54%	0.536	S	S	.	.	H	α-helix	trans	-69.4	-35.5	176.6	34.5	0	0	0	0	112	G192 K198 I199 M200	G192-T196 PolarHBondContact O-OG1 3.3Å; T196-K198 VanDerWaalsContact C-N 3.31Å; T196-K198 PolarHBondContact O-N 2.7Å; T196-I199 PolarHBondContact O-N 3.39Å; T196-M200 WeakPolarHBondContact O-CB 3.46Å; T196-M200 VanDerWaalsContact O-CG 3.3Å; T196-M200 WeakPolarHBondContact O-CG 3.3Å; T196-M200 PolarHBondContact O-N 3.15Å
197	D	48.2	Very low	44.4	Very low	99 Å²	99	95.2 Å²	95.2	53%	0.529	54%	0.536	S	S	.	.	H	α-helix	trans	-64.8	-37.4	178.1	-71.8	-22	0	0	0	111.2	A193 M200 S201	A193-D197 VanDerWaalsContact O-CB 3.28Å; A193-D197 WeakPolarHBondContact O-CB 3.32Å; A193-D197 PolarHBondContact O-N 3.48Å; D197-M200 PolarHBondContact O-N 3Å; D197-S201 WeakPolarHBondContact O-CB 3.23Å; D197-S201 PolarHBondContact O-N 2.93Å; D197-S201 PolarHBondContact O-OG 3.43Å
198	K	52.7	Low	44.7	Very low	137 Å²	137	96 Å²	96	60%	0.596	53%	0.53	S	S	*	.	H	α-helix	trans	-67.6	-37.6	176	-97	178.4	178.6	173	0	113.9	W195 T196 S201 N202	W195-K198 PolarHBondContact O-N 3.22Å; T196-K198 VanDerWaalsContact C-N 3.31Å; T196-K198 PolarHBondContact O-N 2.7Å; K198-S201 WeakPolarHBondContact CA-OG 3.41Å; K198-S201 PolarHBondContact O-OG 3.4Å; K198-N202 VanDerWaalsContact O-CB 3.23Å; K198-N202 WeakPolarHBondContact O-CB 3.44Å; K198-N202 PolarHBondContact O-N 3.48Å; K198-N202 VanDerWaalsContact O-N 3.09Å
199	I	47.5	Very low	44.6	Very low	83 Å²	83	96.3 Å²	96.3	43%	0.426	55%	0.545	S	S	.	.	H	α-helix	trans	-73.5	-36.1	178.2	-65.4	-178.4	0	0	0	110.8	W195 T196 K203	W195-I199 HydrophobicContact CD2-CD1 4.36Å; W195-I199 HydrophobicContact CZ2-CD1 3.91Å; W195-I199 PolarHBondContact O-N 3.46Å; T196-I199 PolarHBondContact O-N 3.39Å; I199-K203 PolarHBondContact O-N 3.17Å
200	M	49.7	Very low	44	Very low	133 Å²	133	92.6 Å²	92.6	66%	0.655	54%	0.54	S	S	*	.	H	α-helix	trans	-75.1	-38.3	176.9	-68.4	-78.3	-88.7	0	0	111.8	T196 D197 K203 S204	T196-M200 WeakPolarHBondContact O-CB 3.46Å; T196-M200 VanDerWaalsContact O-CG 3.3Å; T196-M200 WeakPolarHBondContact O-CG 3.3Å; T196-M200 PolarHBondContact O-N 3.15Å; D197-M200 PolarHBondContact O-N 3Å; M200-K203 PolarHBondContact O-N 3.2Å; M200-S204 PolarHBondContact O-N 3.44Å; M200-S204 PolarHBondContact O-OG 3.32Å
201	S	49.2	Very low	43.2	Very low	52 Å²	52	93.6 Å²	93.6	36%	0.364	54%	0.541	S	S	.	.	H	α-helix	trans	-67	-38.3	176.5	68.9	0	0	0	0	111.7	D197 K198 K203 S204 D205	D197-S201 WeakPolarHBondContact O-CB 3.23Å; D197-S201 PolarHBondContact O-N 2.93Å; D197-S201 PolarHBondContact O-OG 3.43Å; K198-S201 WeakPolarHBondContact CA-OG 3.41Å; K198-S201 PolarHBondContact O-OG 3.4Å; S201-K203 PolarHBondContact O-N 3.44Å; S201-S204 VanDerWaalsContact CA-OG 3.27Å; S201-S204 WeakPolarHBondContact CA-OG 3.48Å; S201-S204 PolarHBondContact O-N 3.27Å; S201-S204 PolarHBondContact O-OG 3.17Å; S201-D205 PolarHBondContact O-N 3.41Å
202	N	43.6	Very low	42.4	Very low	124 Å²	124	96.9 Å²	96.9	66%	0.663	56%	0.562	S	S	*	*	H	α-helix	trans	-70.9	-18.3	176.2	-149.9	59.7	0	0	0	112.8	K198	K198-N202 VanDerWaalsContact O-CB 3.23Å; K198-N202 WeakPolarHBondContact O-CB 3.44Å; K198-N202 PolarHBondContact O-N 3.48Å; K198-N202 VanDerWaalsContact O-N 3.09Å
203	K	44.9	Very low	41.8	Very low	153 Å²	153	105.6 Å²	105.6	67%	0.665	60%	0.6	S	S	*	*	H	α-helix	trans	-86.8	-31.6	169.6	-89	-179.1	175.3	177.3	0	112.9	I199 M200 S201 A206 S207	I199-K203 PolarHBondContact O-N 3.17Å; M200-K203 PolarHBondContact O-N 3.2Å; S201-K203 PolarHBondContact O-N 3.44Å; K203-A206 PolarHBondContact O-N 3.06Å; K203-S207 PolarHBondContact O-OG 3.42Å
204	S	44.2	Very low	41	Very low	64 Å²	64	106.8 Å²	106.8	45%	0.448	62%	0.616	S	S	.	*	H	α-helix	trans	-72.7	-28.7	174.5	54.8	0	0	0	0	112.9	M200 S201 A206 S207	M200-S204 PolarHBondContact O-N 3.44Å; M200-S204 PolarHBondContact O-OG 3.32Å; S201-S204 VanDerWaalsContact CA-OG 3.27Å; S201-S204 WeakPolarHBondContact CA-OG 3.48Å; S201-S204 PolarHBondContact O-N 3.27Å; S201-S204 PolarHBondContact O-OG 3.17Å; S204-A206 VanDerWaalsContact C-N 3.31Å; S204-A206 PolarHBondContact O-N 3.49Å; S204-S207 PolarHBondContact O-N 3.31Å; S204-S207 PolarHBondContact O-OG 2.72Å
205	D	43.1	Very low	40.2	Very low	119 Å²	119	113.3 Å²	113.3	64%	0.636	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-20.2	175.6	-73.5	-18.8	0	0	0	113.1	S201 S207	S201-D205 PolarHBondContact O-N 3.41Å; D205-S207 VanDerWaalsContact C-N 3.32Å; D205-S207 PolarHBondContact O-N 2.79Å
206	A	42.7	Very low	39.7	Very low	89 Å²	89	112.2 Å²	112.2	74%	0.736	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-1.3	176.9	0	0	0	0	0	114.1	K203 S204	K203-A206 PolarHBondContact O-N 3.06Å; S204-A206 VanDerWaalsContact C-N 3.31Å; S204-A206 PolarHBondContact O-N 3.49Å
207	S	37.9	Very low	39.1	Very low	92 Å²	92	118.6 Å²	118.6	64%	0.643	69%	0.686	S	S	*	*	S	Bend	trans	-125.6	10.2	-174	49.5	0	0	0	0	115.3	K203 S204 D205	K203-S207 PolarHBondContact O-OG 3.42Å; S204-S207 PolarHBondContact O-N 3.31Å; S204-S207 PolarHBondContact O-OG 2.72Å; D205-S207 VanDerWaalsContact C-N 3.32Å; D205-S207 PolarHBondContact O-N 2.79Å
208	S	39.1	Very low	38.2	Very low	95 Å²	95	117.4 Å²	117.4	66%	0.664	70%	0.697	S	S	*	*	S	Bend	trans	-120.9	16.8	-177.8	61.5	0	0	0	0	116.5
209	A	33	Very low	37.4	Very low	100 Å²	100	116 Å²	116	83%	0.826	71%	0.711	S	S	*	*			trans	-118.1	81.3	170.7	0	0	0	0	0	111.4
210	T	31	Very low	36.8	Very low	123 Å²	123	120 Å²	120	76%	0.755	73%	0.733	S	S	*	*			trans	-111.1	128.7	159.6	-39.6	0	0	0	0	109.1
211	K	31.3	Very low	36.4	Very low	197 Å²	197	122.9 Å²	122.9	86%	0.857	75%	0.745	S	S	*	*			trans	81.5	133.2	173.6	-54.7	-168.3	178.3	-179.1	0	115
212	S	28.6	Very low	36.2	Very low	97 Å²	97	129 Å²	129	68%	0.678	77%	0.768	S	S	*	*			cis	-165.7	156.9	22.9	41.1	0	0	0	0	111.5
213	E	30.6	Very low	36.1	Very low	197 Å²	197	130.8 Å²	130.8	92%	0.921	77%	0.772	S	S	*	*			trans	64.5	132	156.2	-67.3	168.3	166.3	0	0	118.2
214	G	28.5	Very low	36.6	Very low	70 Å²	70	135.5 Å²	135.5	72%	0.722	79%	0.786	S	S	*	*			cis	164.3	118.7	1.2	0	0	0	0	0	108
215	H	30.9	Very low	36.5	Very low	196 Å²	196	138.9 Å²	138.9	91%	0.907	80%	0.799	S	S	*	*			trans	-174.4	122.9	153.1	-135.8	55.5	0	0	0	109.4
216	G	30.3	Very low	36.4	Very low	79 Å²	79	146.2 Å²	146.2	81%	0.814	83%	0.829	S	S	*	*			trans	171.2	68.7	-178.5	0	0	0	0	0	110.2
217	E	33.8	Very low	36.1	Very low	191 Å²	191	149.1 Å²	149.1	89%	0.893	83%	0.834	S	S	*	*			trans	-75.1	127.3	173.2	-165.4	173.4	-162.6	0	0	109.6
218	G	30.8	Very low	36	Very low	74 Å²	74	152.1 Å²	152.1	76%	0.763	84%	0.844	S	S	*	*			trans	90	104.1	151.9	0	0	0	0	0	118.8
219	A	34.8	Very low	35.8	Very low	108 Å²	108	155.2 Å²	155.2	89%	0.893	85%	0.854	S	S	*	*				-174.1	138.2	112	0	0	0	0	0	110.4
220	D	35.8	Very low	36	Very low	166 Å²	166	158.5 Å²	158.5	89%	0.888	86%	0.856	S	S	*	*			trans	-53.1	152.1	-157.9	-75.4	-52.6	0	0	0	119.5	E222	D220-E222 PolarHBondContact O-N 2.81Å
221	E	39.8	Very low	36.3	Very low	194 Å²	194	160.7 Å²	160.7	91%	0.907	86%	0.862	S	S	*	*			trans	-75.2	108.9	169.9	-51.4	-173.1	-178.2	0	0	109.6	E223	E221-E223 PolarHBondContact O-N 2.7Å
222	E	45.1	Very low	36.6	Very low	182 Å²	182	158.3 Å²	158.3	85%	0.85	86%	0.862	S	S	*	*			trans	-89.9	97.5	166.1	-158.6	161	-153.9	0	0	108.8	D220 W224	D220-E222 PolarHBondContact O-N 2.81Å; E222-W224 PolarHBondContact O-N 3.16Å
223	E	41.5	Very low	37.2	Very low	160 Å²	160	162.6 Å²	162.6	75%	0.748	88%	0.876	S	S	*	*			trans	-28.4	114.6	163.4	-147.8	164.1	-157.8	0	0	113.2	E221 D225	E221-E223 PolarHBondContact O-N 2.7Å; E223-D225 PolarHBondContact O-N 3.01Å
224	W	55.7	Low	37.7	Very low	252 Å²	252	160 Å²	160	96%	0.955	87%	0.872	S	S	*	*			trans	-87.8	96.4	165.7	-72.4	93.6	0	0	0	108.5	E222	E222-W224 PolarHBondContact O-N 3.16Å
225	D	41.7	Very low	38.5	Very low	136 Å²	136	167.5 Å²	167.5	73%	0.727	89%	0.885	S	S	*	*			trans	-72.2	151.1	164.6	-83.5	-29.8	0	0	0	111.3	E223	E223-D225 PolarHBondContact O-N 3.01Å
226	E	41.7	Very low	39.2	Very low	272 Å²	272	164.9 Å²	164.9	100%	1.271	88%	0.883	S	S	*	*			trans	-43.8	0	-173	-64.4	-179.9	149.9	0	0	118.2

Retrieved 226 of 226 residues in 87.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).