A0A673ZVL8_SALTR Loading...

LIM domain only 1

AlphaFold DB , UniProt , Accession A0A673ZVL8, Species SALTR (Salmo trutta, Brown trout), Gene LMO1, Length 155 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.5	Very low	70.7	Confident	125 Å²	125	87.4 Å²	87.4	62%	0.616	46%	0.457	S	S	*	.				0	100.2	0	-67.3	173.6	-179	0	0	105.9	L3 V100	M1-L3 PolarHBondContact O-N 3.04Å; M1-V100 HydrophobicContact CE-CG2 4.45Å
2	V	46.2	Very low	72.6	Confident	132 Å²	132	88.8 Å²	88.8	80%	0.8	47%	0.465	S	S	*	.			trans	-81.9	100.2	176.9	-148.5	0	0	0	0	104.7
3	L	55.3	Low	74.1	Confident	46 Å²	46	87.8 Å²	87.8	24%	0.241	47%	0.47	C	S	.	.			trans	-75.7	117.2	161.9	-72	168.3	0	0	0	104.6	M1 K5 Y65 Y77 L78	M1-L3 PolarHBondContact O-N 3.04Å; L3-K5 PolarHBondContact O-N 3.31Å; L3-Y65 HydrophobicContact CD1-CE1 4.02Å; L3-Y65 HydrophobicContact CD2-CE1 4.3Å; L3-Y77 HydrophobicContact CD2-CD1 3.86Å; L3-Y77 HydrophobicContact CD2-CE1 3.47Å; L3-Y77 VanDerWaalsContact CD2-CE1 3.47Å; L3-L78 HydrophobicContact CD2-CD2 3.71Å
4	D	56.3	Low	75.3	Confident	84 Å²	84	84.7 Å²	84.7	45%	0.449	46%	0.455	S	S	.	.			trans	-53.5	114.8	173.3	-60.9	-76.1	0	0	0	108	E6 E7	D4-E6 PolarHBondContact O-N 3Å; D4-E7 PolarHBondContact O-N 3.25Å
5	K	58.7	Low	76.3	Confident	185 Å²	185	86.9 Å²	86.9	80%	0.804	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-56	-24.3	-175.3	-76.6	-177.5	176.2	177.9	0	111.9	L3 E7 S8	L3-K5 PolarHBondContact O-N 3.31Å; K5-E7 VanDerWaalsContact C-N 3.26Å; K5-E7 PolarHBondContact O-N 2.85Å; K5-S8 PolarHBondContact O-OG 3.46Å; K5-S8 VanDerWaalsContact O-OG 3.14Å
6	E	62.3	Low	76.6	Confident	185 Å²	185	84.7 Å²	84.7	86%	0.864	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-68	-21.4	-178.9	-57.5	-171.2	104.2	0	0	113.3	D4	D4-E6 PolarHBondContact O-N 3Å
7	E	81.6	Confident	76.6	Confident	36 Å²	36	90.5 Å²	90.5	17%	0.168	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-102	-5.9	-177.1	-60.5	-164.8	98.1	0	0	113.5	D4 K5 Y65 T66 K67 Y77	D4-E7 PolarHBondContact O-N 3.25Å; K5-E7 VanDerWaalsContact C-N 3.26Å; K5-E7 PolarHBondContact O-N 2.85Å; E7-Y65 CarbonylContact O-C 3.59Å; E7-Y65 VanDerWaalsContact O-CA 3.26Å; E7-Y65 WeakPolarHBondContact O-CA 3.25Å; E7-T66 WeakPolarHBondContact CB-O 3.38Å; E7-T66 PolarHBondContact O-N 3.06Å; E7-K67 WeakPolarHBondContact OE1-CB 3.45Å; E7-K67 WeakPolarHBondContact OE1-CD 3.15Å; E7-K67 WeakPolarHBondContact OE1-CG 3.34Å; E7-K67 IonicContact OE1-NZ 3.79Å; E7-K67 WeakPolarHBondContact OE2-CD 3.37Å; E7-K67 WeakPolarHBondContact OE2-CE 3.19Å; E7-K67 IonicContact OE2-NZ 2.75Å; E7-K67 PolarHBondContact OE2-NZ 2.91Å; E7-Y77 HydrophobicContact CB-CE2 4.3Å; E7-Y77 PolarHBondContact OE2-OH 3.06Å
8	S	90.6	Very high	76.7	Confident	44 Å²	44	89.8 Å²	89.8	31%	0.308	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.4	176.1	67.7	0	0	0	0	111.3	K5	K5-S8 PolarHBondContact O-OG 3.46Å; K5-S8 VanDerWaalsContact O-OG 3.14Å
9	V	91.9	Very high	76.8	Confident	25 Å²	25	94.9 Å²	94.9	15%	0.152	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.5	-175.4	-177.7	0	0	0	0	109.9	L39 T63 L64	V9-L39 HydrophobicContact CB-CD2 4.29Å; V9-L39 HydrophobicContact CG1-CD2 3.96Å; V9-L39 HydrophobicContact CG1-CG 4.28Å; V9-L39 HydrophobicContact CG2-CD2 3.78Å; V9-T63 WeakPolarHBondContact O-CA 3.35Å; V9-L64 HydrophobicContact CB-CD1 3.66Å; V9-L64 HydrophobicContact CB-CG 4.05Å; V9-L64 HydrophobicContact CG1-CD1 4.34Å; V9-L64 HydrophobicContact CG2-CD1 4.12Å; V9-L64 PolarHBondContact N-O 2.85Å; V9-L64 PolarHBondContact O-N 2.81Å
10	P	92.5	Very high	77.1	Confident	87 Å²	87	95.7 Å²	95.7	57%	0.565	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	143.7	175.9	29.7	-33.9	0	0	0	111
11	M	93.9	Very high	77.8	Confident	12 Å²	12	94.6 Å²	94.6	6%	0.059	50%	0.5	C	S	.	.			trans	-108.5	130.3	172.3	-60.2	-177.8	-69.4	0	0	108.6	A38 L48 L57 G61 S62 L64	M11-A38 HydrophobicContact CG-CB 3.91Å; M11-L48 HydrophobicContact CG-CD2 4.25Å; M11-L48 HydrophobicContact SD-CD2 3.54Å; M11-L48 VanDerWaalsContact SD-CD2 3.54Å; M11-L48 HydrophobicContact SD-CG 4.32Å; M11-L57 HydrophobicContact CE-CB 3.94Å; M11-L57 VanDerWaalsContact CE-O 3.3Å; M11-L57 WeakPolarHBondContact CE-O 3.34Å; M11-L57 HydrophobicContact SD-CB 3.75Å; M11-G61 WeakPolarHBondContact CE-O 3.35Å; M11-S62 PolarHBondContact N-O 3.08Å; M11-L64 HydrophobicContact CE-CB 4.38Å; M11-L64 HydrophobicContact CG-CB 4.33Å; M11-L64 HydrophobicContact CG-CD2 3.81Å; M11-L64 HydrophobicContact CG-CG 4.09Å; M11-L64 HydrophobicContact SD-CB 3.95Å; M11-L64 HydrophobicContact SD-CD2 3.78Å; M11-L64 HydrophobicContact SD-CG 4.22Å
12	L	93	Very high	80	Confident	105 Å²	105	90.9 Å²	90.9	55%	0.55	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.3	177.7	-63.2	172.8	0	0	0	109.6	V14 L36 K37	L12-V14 HydrophobicContact CB-CG1 4.14Å; L12-L36 CarbonylContact O-C 3.6Å; L12-L36 WeakPolarHBondContact O-CA 3.5Å; L12-K37 PolarHBondContact N-O 3.24Å; L12-K37 PolarHBondContact O-N 2.78Å
13	S	92.1	Very high	82.4	Confident	76 Å²	76	84.7 Å²	84.7	53%	0.531	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	122.4	165.9	-172.8	0	0	0	0	108.9
14	V	91.9	Very high	84.3	Confident	44 Å²	44	84.2 Å²	84.2	27%	0.267	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	147.1	-175.9	-58.8	0	0	0	0	110.7	L12 L35 K37	L12-V14 HydrophobicContact CB-CG1 4.14Å; V14-L35 HydrophobicContact CG2-CD1 3.29Å; V14-L35 HydrophobicContact CG2-CG 3.74Å; V14-L35 WeakPolarHBondContact CG2-O 3.46Å; V14-L35 PolarHBondContact N-O 3.26Å; V14-L35 PolarHBondContact O-N 3.22Å; V14-K37 HydrophobicContact CG2-CB 4.45Å
15	Q	89.3	Confident	86.1	Confident	117 Å²	117	82.3 Å²	82.3	55%	0.547	46%	0.459	S	S	.	.			trans	-83.9	131.8	168.9	-70.5	177.8	42.3	0	0	109.5	K17 Y34	Q15-K17 PolarHBondContact O-N 3.08Å; Q15-Y34 HydrophobicContact CG-CD1 3.62Å; Q15-Y34 HydrophobicContact CG-CE1 3.37Å
16	P	81.8	Confident	87.9	Confident	52 Å²	52	75.2 Å²	75.2	34%	0.338	43%	0.433	S	S	.	.			trans	-67	105.8	175.6	23.8	-27.1	0	0	0	110.1	D32 R33 L35	P16-D32 WeakPolarHBondContact CG-O 3.47Å; P16-R33 WeakPolarHBondContact CD-O 3.44Å; P16-L35 HydrophobicContact CB-CD2 3.78Å; P16-L35 HydrophobicContact CG-CD2 4.2Å
17	K	76.4	Confident	89.5	Confident	184 Å²	184	73.4 Å²	73.4	80%	0.8	43%	0.429	S	S	*	.			trans	-98	123.4	168.2	-65.7	-175.7	179.9	-178.6	0	109.4	Q15	Q15-K17 PolarHBondContact O-N 3.08Å
18	G	78.6	Confident	90.2	Very high	77 Å²	77	80 Å²	80	79%	0.794	45%	0.452	S	S	*	.	S	Bend	trans	90	-141.5	176.5	0	0	0	0	0	114.6
19	K	77.6	Confident	90.4	Very high	188 Å²	188	84.5 Å²	84.5	82%	0.817	47%	0.466	S	S	*	.	S	Bend	trans	-63.1	138	-175.2	-67.8	-177.9	-179.6	178.1	0	111.8	K21	K19-K21 PolarHBondContact O-N 3.16Å
20	Q	83.5	Confident	90.5	Very high	110 Å²	110	83.4 Å²	83.4	51%	0.514	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-51.5	131.3	177	-71.8	178.3	-6.1	0	0	111.4	K29	Q20-K29 HydrophobicContact CB-CB 4.47Å; Q20-K29 HydrophobicContact CB-CD 4.24Å
21	K	91.3	Very high	90.5	Very high	72 Å²	72	87.1 Å²	87.1	31%	0.313	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-90.9	147.7	179.3	-56	-58.2	-177.8	177	0	110.2	K19 K29 I30 L35 Y42	K19-K21 PolarHBondContact O-N 3.16Å; K21-K29 WeakPolarHBondContact O-CA 3.34Å; K21-I30 HydrophobicContact CB-CD1 4.44Å; K21-I30 PolarHBondContact O-N 3.44Å; K21-L35 HydrophobicContact CG-CD2 4.45Å; K21-Y42 HydrophobicContact CB-CD2 3.96Å; K21-Y42 HydrophobicContact CB-CG 4.03Å; K21-Y42 HydrophobicContact CD-CD2 4.11Å; K21-Y42 HydrophobicContact CD-CE2 3.85Å; K21-Y42 HydrophobicContact CG-CD2 4.05Å; K21-Y42 HydrophobicContact CG-CE2 4.14Å; K21-Y42 HydrophobicContact CG-CG 4.24Å
22	G	94.6	Very high	90.3	Very high	47 Å²	47	90 Å²	90	49%	0.485	48%	0.482	S	S	.	.	B	Isolated β-bridge	trans	-86.1	140.9	173.1	0	0	0	0	0	111.2
23	C	96.8	Very high	90.1	Very high	3 Å²	3	93.8 Å²	93.8	2%	0.02	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-81.6	126.6	173.3	178.7	0	0	0	0	110.6	G25 N27 R28 I30 Y42 H44 C47	C23-G25 VanDerWaalsContact C-N 3.27Å; C23-G25 PolarHBondContact O-N 2.84Å; C23-G25 PolarHBondContact SG-N 3.27Å; C23-G25 VanDerWaalsContact SG-N 3.39Å; C23-N27 WeakPolarHBondContact O-CA 3.39Å; C23-N27 PolarHBondContact O-N 3.5Å; C23-R28 WeakPolarHBondContact CB-O 3.31Å; C23-R28 PolarHBondContact N-O 3.44Å; C23-I30 HydrophobicContact CB-CD1 4.1Å; C23-I30 HydrophobicContact CB-CG1 3.78Å; C23-Y42 CarbonylContact C-O 3.59Å; C23-Y42 WeakPolarHBondContact CA-O 3.07Å; C23-H44 WeakPolarHBondContact CB-ND1 3.45Å; C23-H44 PolarHBondContact SG-N 2.85Å; C23-H44 VanDerWaalsContact SG-N 3.43Å; C23-H44 PolarHBondContact SG-ND1 3.25Å; C23-H44 VanDerWaalsContact SG-ND1 3.41Å; C23-C47 WeakPolarHBondContact SG-CB 3.26Å
24	A	95.9	Very high	90.1	Very high	36 Å²	36	94.1 Å²	94.1	30%	0.298	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-20	177.9	0	0	0	0	0	114.3	K41 Y42 W43	A24-K41 HydrophobicContact CB-CB 3.9Å; A24-K41 HydrophobicContact CB-CD 3.74Å; A24-K41 HydrophobicContact CB-CG 4.28Å; A24-Y42 PolarHBondContact N-O 2.99Å; A24-W43 HydrophobicContact CB-CD2 4.03Å; A24-W43 HydrophobicContact CB-CE3 4.04Å; A24-W43 HydrophobicContact CB-CH2 3.74Å; A24-W43 HydrophobicContact CB-CZ2 3.71Å; A24-W43 HydrophobicContact CB-CZ3 3.91Å
25	G	94.8	Very high	90.2	Very high	44 Å²	44	92.1 Å²	92.1	45%	0.454	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-36.6	-179.9	0	0	0	0	0	114.1	C23	C23-G25 VanDerWaalsContact C-N 3.27Å; C23-G25 PolarHBondContact O-N 2.84Å; C23-G25 PolarHBondContact SG-N 3.27Å; C23-G25 VanDerWaalsContact SG-N 3.39Å
26	C	96.4	Very high	90.5	Very high	36 Å²	36	87 Å²	87	24%	0.243	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123	2.7	-176	72.8	0	0	0	0	114.6	R28 H44 C47	C26-R28 PolarHBondContact O-N 3.24Å; C26-H44 PolarHBondContact SG-CE1 3.25Å; C26-H44 PolarHBondContact SG-ND1 3.32Å; C26-H44 VanDerWaalsContact SG-ND1 3.38Å; C26-C47 VanDerWaalsContact SG-SG 3.7Å
27	N	95.2	Very high	91.1	Very high	146 Å²	146	88.2 Å²	88.2	78%	0.781	44%	0.443	S	S	*	.			trans	58	9.7	-179.5	-62.8	-35.3	0	0	0	115.9	C23	C23-N27 WeakPolarHBondContact O-CA 3.39Å; C23-N27 PolarHBondContact O-N 3.5Å
28	R	95.5	Very high	92	Very high	174 Å²	174	79.6 Å²	79.6	66%	0.657	41%	0.407	S	S	*	.	S	Bend	trans	-91.8	157.4	175.7	-66	-178.4	-72.7	176.9	-1.9	111.2	C23 C26	C23-R28 WeakPolarHBondContact CB-O 3.31Å; C23-R28 PolarHBondContact N-O 3.44Å; C26-R28 PolarHBondContact O-N 3.24Å
29	K	94.9	Very high	92.7	Very high	139 Å²	139	78.8 Å²	78.8	60%	0.604	38%	0.384	S	S	*	.	B	Isolated β-bridge	trans	-69.1	134.7	173.7	-63.6	-173.3	-174.8	175.4	0	110.6	Q20 K21	Q20-K29 HydrophobicContact CB-CB 4.47Å; Q20-K29 HydrophobicContact CB-CD 4.24Å; K21-K29 WeakPolarHBondContact O-CA 3.34Å
30	I	94.7	Very high	93.4	Very high	3 Å²	3	76.9 Å²	76.9	2%	0.015	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-79.6	117.4	175.8	-54.6	168.8	0	0	0	108.7	K21 C23 D32 L35 H44	K21-I30 HydrophobicContact CB-CD1 4.44Å; K21-I30 PolarHBondContact O-N 3.44Å; C23-I30 HydrophobicContact CB-CD1 4.1Å; C23-I30 HydrophobicContact CB-CG1 3.78Å; I30-D32 HydrophobicContact CG2-CB 4.22Å; I30-L35 HydrophobicContact CB-CD2 4.47Å; I30-L35 HydrophobicContact CD1-CB 4.2Å; I30-L35 HydrophobicContact CD1-CD2 4.3Å; I30-L35 HydrophobicContact CG2-CB 3.81Å; I30-L35 HydrophobicContact CG2-CD2 4.02Å; I30-H44 WeakPolarHBondContact CA-NE2 3.46Å; I30-H44 WeakPolarHBondContact CG1-NE2 3.37Å
31	K	92.1	Very high	93.9	Very high	165 Å²	165	77.3 Å²	77.3	72%	0.717	38%	0.383	S	S	*	.			trans	-108.7	-2.6	177	-63.1	-177	-178	179.5	0	112.7
32	D	89.7	Confident	94.1	Very high	72 Å²	72	77.1 Å²	77.1	39%	0.385	38%	0.381	S	S	.	.	S	Bend	trans	-68.3	155.3	-176.5	-56.7	-24.1	0	0	0	111.6	P16 I30 Y34 H44	P16-D32 WeakPolarHBondContact CG-O 3.47Å; I30-D32 HydrophobicContact CG2-CB 4.22Å; D32-Y34 WeakPolarHBondContact CB-O 3.41Å; D32-Y34 PolarHBondContact O-N 3.07Å; D32-H44 IonicContact OD2-CD2 3.08Å; D32-H44 PolarHBondContact OD2-CD2 3.43Å; D32-H44 IonicContact OD2-CG 2.8Å
33	R	90.1	Very high	94.2	Very high	184 Å²	184	76 Å²	76	69%	0.694	36%	0.362	S	S	*	.	S	Bend	trans	-63.9	-32.8	177.9	-177.4	177.7	176.1	175.5	1.4	112.2	P16	P16-R33 WeakPolarHBondContact CD-O 3.44Å
34	Y	91.3	Very high	94.2	Very high	84 Å²	84	76.8 Å²	76.8	33%	0.329	37%	0.365	S	S	.	.	S	Bend	trans	-129.3	150.2	177.9	-60.2	-76.1	0	0	0	109.2	Q15 D32	Q15-Y34 HydrophobicContact CG-CD1 3.62Å; Q15-Y34 HydrophobicContact CG-CE1 3.37Å; D32-Y34 WeakPolarHBondContact CB-O 3.41Å; D32-Y34 PolarHBondContact O-N 3.07Å
35	L	93.5	Very high	94	Very high	1 Å²	1	79.6 Å²	79.6	1%	0.005	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	158.2	176.7	66.5	89.4	0	0	0	110.1	V14 P16 K21 I30 Y42	V14-L35 HydrophobicContact CG2-CD1 3.29Å; V14-L35 HydrophobicContact CG2-CG 3.74Å; V14-L35 WeakPolarHBondContact CG2-O 3.46Å; V14-L35 PolarHBondContact N-O 3.26Å; V14-L35 PolarHBondContact O-N 3.22Å; P16-L35 HydrophobicContact CB-CD2 3.78Å; P16-L35 HydrophobicContact CG-CD2 4.2Å; K21-L35 HydrophobicContact CG-CD2 4.45Å; I30-L35 HydrophobicContact CB-CD2 4.47Å; I30-L35 HydrophobicContact CD1-CB 4.2Å; I30-L35 HydrophobicContact CD1-CD2 4.3Å; I30-L35 HydrophobicContact CG2-CB 3.81Å; I30-L35 HydrophobicContact CG2-CD2 4.02Å; L35-Y42 HydrophobicContact CD1-CD1 3.26Å; L35-Y42 HydrophobicContact CD1-CE1 4Å; L35-Y42 HydrophobicContact CD1-CG 4.05Å
36	L	95.3	Very high	94	Very high	10 Å²	10	81.4 Å²	81.4	5%	0.052	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.8	179.4	-61.9	173.9	0	0	0	110.1	L12 Y42 W43 E45 L48	L12-L36 CarbonylContact O-C 3.6Å; L12-L36 WeakPolarHBondContact O-CA 3.5Å; L36-Y42 CarbonylContact O-C 3.58Å; L36-Y42 WeakPolarHBondContact O-CA 3.42Å; L36-W43 HydrophobicContact CB-CB 4.36Å; L36-W43 PolarHBondContact N-O 3.47Å; L36-W43 PolarHBondContact O-N 3.27Å; L36-E45 HydrophobicContact CD1-CG 4.34Å; L36-E45 HydrophobicContact CG-CG 4.24Å; L36-L48 HydrophobicContact CB-CD2 4.13Å; L36-L48 HydrophobicContact CD1-CB 4.22Å; L36-L48 HydrophobicContact CD1-CD2 3.95Å
37	K	95.2	Very high	94	Very high	77 Å²	77	81.3 Å²	81.3	34%	0.335	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	120.7	167.9	-171.1	-173	177.2	-167.1	0	109.2	L12 V14 K41 Y42	L12-K37 PolarHBondContact N-O 3.24Å; L12-K37 PolarHBondContact O-N 2.78Å; V14-K37 HydrophobicContact CG2-CB 4.45Å; K37-K41 WeakPolarHBondContact CA-O 3.39Å; K37-Y42 HydrophobicContact CB-CD1 4.17Å; K37-Y42 HydrophobicContact CB-CE1 4.18Å; K37-Y42 HydrophobicContact CD-CE1 4.12Å; K37-Y42 HydrophobicContact CG-CD1 4.19Å; K37-Y42 HydrophobicContact CG-CE1 3.97Å
38	A	94.8	Very high	94.1	Very high	4 Å²	4	74.3 Å²	74.3	3%	0.033	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	150.7	176.4	0	0	0	0	0	110	M11 D40 K41 W43 L48 L64	M11-A38 HydrophobicContact CG-CB 3.91Å; A38-D40 PolarHBondContact O-N 3.34Å; A38-K41 PolarHBondContact N-O 2.9Å; A38-K41 CarbonylContact O-C 3.6Å; A38-K41 PolarHBondContact O-N 2.92Å; A38-K41 VanDerWaalsContact O-O 3.05Å; A38-W43 PolarHBondContact O-NE1 3.05Å; A38-W43 VanDerWaalsContact O-NE1 3.11Å; A38-L48 HydrophobicContact CB-CD2 4.17Å; A38-L64 HydrophobicContact CB-CD2 3.76Å
39	L	93.2	Very high	94.1	Very high	60 Å²	60	70.2 Å²	70.2	31%	0.314	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	39.1	-178.4	-58.1	169	0	0	0	112.6	V9 K41 L64 T66 I71	V9-L39 HydrophobicContact CB-CD2 4.29Å; V9-L39 HydrophobicContact CG1-CD2 3.96Å; V9-L39 HydrophobicContact CG1-CG 4.28Å; V9-L39 HydrophobicContact CG2-CD2 3.78Å; L39-K41 WeakPolarHBondContact O-CG 3.35Å; L39-K41 PolarHBondContact O-N 3.32Å; L39-L64 HydrophobicContact CD1-CD1 4.36Å; L39-L64 HydrophobicContact CD2-CD1 4.48Å; L39-L64 HydrophobicContact CG-CD1 4.4Å; L39-T66 HydrophobicContact CD1-CG2 3.84Å; L39-T66 HydrophobicContact CD2-CG2 3.69Å; L39-T66 HydrophobicContact CG-CG2 4.33Å; L39-I71 HydrophobicContact CD1-CD1 3.74Å; L39-I71 HydrophobicContact CD1-CG1 4.05Å
40	D	92.2	Very high	94.2	Very high	148 Å²	148	63.6 Å²	63.6	79%	0.791	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	19.6	-172.9	-64.4	-49.4	0	0	0	115.7	A38	A38-D40 PolarHBondContact O-N 3.34Å
41	K	95	Very high	94.3	Very high	118 Å²	118	66.3 Å²	66.3	51%	0.513	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	166.1	-179.6	-69.4	177.9	-172.5	-173.1	0	111	A24 K37 A38 L39 W43	A24-K41 HydrophobicContact CB-CB 3.9Å; A24-K41 HydrophobicContact CB-CD 3.74Å; A24-K41 HydrophobicContact CB-CG 4.28Å; K37-K41 WeakPolarHBondContact CA-O 3.39Å; A38-K41 PolarHBondContact N-O 2.9Å; A38-K41 CarbonylContact O-C 3.6Å; A38-K41 PolarHBondContact O-N 2.92Å; A38-K41 VanDerWaalsContact O-O 3.05Å; L39-K41 WeakPolarHBondContact O-CG 3.35Å; L39-K41 PolarHBondContact O-N 3.32Å; K41-W43 HydrophobicContact CB-CZ2 4.24Å; K41-W43 HydrophobicContact CD-CZ2 4.36Å
42	Y	95.8	Very high	94.4	Very high	69 Å²	69	61 Å²	61	27%	0.271	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	143.2	178.5	-62.1	-71.2	0	0	0	110.4	K21 C23 A24 L35 L36 K37	K21-Y42 HydrophobicContact CB-CD2 3.96Å; K21-Y42 HydrophobicContact CB-CG 4.03Å; K21-Y42 HydrophobicContact CD-CD2 4.11Å; K21-Y42 HydrophobicContact CD-CE2 3.85Å; K21-Y42 HydrophobicContact CG-CD2 4.05Å; K21-Y42 HydrophobicContact CG-CE2 4.14Å; K21-Y42 HydrophobicContact CG-CG 4.24Å; C23-Y42 CarbonylContact C-O 3.59Å; C23-Y42 WeakPolarHBondContact CA-O 3.07Å; A24-Y42 PolarHBondContact N-O 2.99Å; L35-Y42 HydrophobicContact CD1-CD1 3.26Å; L35-Y42 HydrophobicContact CD1-CE1 4Å; L35-Y42 HydrophobicContact CD1-CG 4.05Å; L36-Y42 CarbonylContact O-C 3.58Å; L36-Y42 WeakPolarHBondContact O-CA 3.42Å; K37-Y42 HydrophobicContact CB-CD1 4.17Å; K37-Y42 HydrophobicContact CB-CE1 4.18Å; K37-Y42 HydrophobicContact CD-CE1 4.12Å; K37-Y42 HydrophobicContact CG-CD1 4.19Å; K37-Y42 HydrophobicContact CG-CE1 3.97Å
43	W	96.9	Very high	94.7	Very high	23 Å²	23	59.5 Å²	59.5	9%	0.087	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	145.2	-173.1	-50.5	81.3	0	0	0	110.5	A24 L36 A38 K41 L48 I71	A24-W43 HydrophobicContact CB-CD2 4.03Å; A24-W43 HydrophobicContact CB-CE3 4.04Å; A24-W43 HydrophobicContact CB-CH2 3.74Å; A24-W43 HydrophobicContact CB-CZ2 3.71Å; A24-W43 HydrophobicContact CB-CZ3 3.91Å; L36-W43 HydrophobicContact CB-CB 4.36Å; L36-W43 PolarHBondContact N-O 3.47Å; L36-W43 PolarHBondContact O-N 3.27Å; A38-W43 PolarHBondContact O-NE1 3.05Å; A38-W43 VanDerWaalsContact O-NE1 3.11Å; K41-W43 HydrophobicContact CB-CZ2 4.24Å; K41-W43 HydrophobicContact CD-CZ2 4.36Å; W43-L48 HydrophobicContact CB-CB 3.88Å; W43-L48 HydrophobicContact CB-CD2 4.39Å; W43-L48 HydrophobicContact CD2-CB 4.34Å; W43-L48 HydrophobicContact CD2-CD1 3.79Å; W43-L48 HydrophobicContact CD2-CG 4.5Å; W43-L48 HydrophobicContact CE3-CB 4.41Å; W43-L48 HydrophobicContact CE3-CD1 3.99Å; W43-L48 HydrophobicContact CG-CB 4.13Å; W43-L48 HydrophobicContact CG-CD1 4.14Å; W43-L48 HydrophobicContact CG-CD2 4.19Å; W43-L48 HydrophobicContact CG-CG 4.39Å; W43-L48 HydrophobicContact CZ2-CD1 4.38Å; W43-L48 HydrophobicContact CZ3-CD1 4.37Å; W43-I71 HydrophobicContact CH2-CD1 3.83Å; W43-I71 HydrophobicContact CZ2-CD1 4.16Å
44	H	95.8	Very high	95	Very high	20 Å²	20	56.2 Å²	56.2	9%	0.093	29%	0.288	C	S	.	.			trans	-66.2	151.6	157.9	-56.9	120.7	0	0	0	109.2	C23 C26 I30 D32 D46 C47 L48	C23-H44 WeakPolarHBondContact CB-ND1 3.45Å; C23-H44 PolarHBondContact SG-N 2.85Å; C23-H44 VanDerWaalsContact SG-N 3.43Å; C23-H44 PolarHBondContact SG-ND1 3.25Å; C23-H44 VanDerWaalsContact SG-ND1 3.41Å; C26-H44 PolarHBondContact SG-CE1 3.25Å; C26-H44 PolarHBondContact SG-ND1 3.32Å; C26-H44 VanDerWaalsContact SG-ND1 3.38Å; I30-H44 WeakPolarHBondContact CA-NE2 3.46Å; I30-H44 WeakPolarHBondContact CG1-NE2 3.37Å; D32-H44 IonicContact OD2-CD2 3.08Å; D32-H44 PolarHBondContact OD2-CD2 3.43Å; D32-H44 IonicContact OD2-CG 2.8Å; H44-D46 PolarHBondContact O-N 2.87Å; H44-C47 HydrophobicContact CB-CB 3.97Å; H44-C47 PolarHBondContact ND1-SG 2.94Å; H44-C47 VanDerWaalsContact ND1-SG 3.4Å; H44-C47 PolarHBondContact O-N 2.99Å; H44-L48 PolarHBondContact O-N 3.24Å
45	E	92.4	Very high	95.2	Very high	95 Å²	95	53.7 Å²	53.7	44%	0.444	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-37	173.1	-63.6	-175.6	132	0	0	111.3	L36 C47	L36-E45 HydrophobicContact CD1-CG 4.34Å; L36-E45 HydrophobicContact CG-CG 4.24Å; E45-C47 PolarHBondContact O-N 3.37Å
46	D	94.1	Very high	95.4	Very high	81 Å²	81	58.2 Å²	58.2	43%	0.433	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-18.1	176.7	-77.8	-45.1	0	0	0	115.9	H44 K49 R56	H44-D46 PolarHBondContact O-N 2.87Å; D46-K49 WeakPolarHBondContact O-CD 3.39Å; D46-K49 WeakPolarHBondContact O-CE 3.43Å; D46-K49 PolarHBondContact O-NZ 2.99Å; D46-R56 IonicContact OD1-CZ 2.91Å; D46-R56 IonicContact OD1-NE 2.83Å; D46-R56 PolarHBondContact OD1-NE 3.32Å; D46-R56 IonicContact OD1-NH1 3.91Å; D46-R56 IonicContact OD1-NH2 3.19Å; D46-R56 PolarHBondContact OD1-NH2 3.47Å
47	C	96.5	Very high	95.4	Very high	34 Å²	34	57.9 Å²	57.9	23%	0.23	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-22.2	-174.2	-70.8	0	0	0	0	112.6	C23 C26 H44 E45 K49	C23-C47 WeakPolarHBondContact SG-CB 3.26Å; C26-C47 VanDerWaalsContact SG-SG 3.7Å; H44-C47 HydrophobicContact CB-CB 3.97Å; H44-C47 PolarHBondContact ND1-SG 2.94Å; H44-C47 VanDerWaalsContact ND1-SG 3.4Å; H44-C47 PolarHBondContact O-N 2.99Å; E45-C47 PolarHBondContact O-N 3.37Å; C47-K49 PolarHBondContact O-N 2.73Å
48	L	96.2	Very high	95.2	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.3	C	S	.	.			trans	-89.6	90.5	178.4	-171.3	56.6	0	0	0	110.2	M11 L36 A38 W43 H44 L57 L64 I71	M11-L48 HydrophobicContact CG-CD2 4.25Å; M11-L48 HydrophobicContact SD-CD2 3.54Å; M11-L48 VanDerWaalsContact SD-CD2 3.54Å; M11-L48 HydrophobicContact SD-CG 4.32Å; L36-L48 HydrophobicContact CB-CD2 4.13Å; L36-L48 HydrophobicContact CD1-CB 4.22Å; L36-L48 HydrophobicContact CD1-CD2 3.95Å; A38-L48 HydrophobicContact CB-CD2 4.17Å; W43-L48 HydrophobicContact CB-CB 3.88Å; W43-L48 HydrophobicContact CB-CD2 4.39Å; W43-L48 HydrophobicContact CD2-CB 4.34Å; W43-L48 HydrophobicContact CD2-CD1 3.79Å; W43-L48 HydrophobicContact CD2-CG 4.5Å; W43-L48 HydrophobicContact CE3-CB 4.41Å; W43-L48 HydrophobicContact CE3-CD1 3.99Å; W43-L48 HydrophobicContact CG-CB 4.13Å; W43-L48 HydrophobicContact CG-CD1 4.14Å; W43-L48 HydrophobicContact CG-CD2 4.19Å; W43-L48 HydrophobicContact CG-CG 4.39Å; W43-L48 HydrophobicContact CZ2-CD1 4.38Å; W43-L48 HydrophobicContact CZ3-CD1 4.37Å; H44-L48 PolarHBondContact O-N 3.24Å; L48-L57 HydrophobicContact CD1-CD1 4.25Å; L48-L57 HydrophobicContact CG-CB 4.32Å; L48-L57 HydrophobicContact CG-CD1 4.15Å; L48-L57 PolarHBondContact O-N 3.09Å; L48-L64 HydrophobicContact CD1-CD2 4Å; L48-L64 HydrophobicContact CD2-CD2 4.11Å; L48-L64 HydrophobicContact CG-CD2 4.41Å; L48-I71 HydrophobicContact CD1-CD1 4.32Å; L48-I71 HydrophobicContact CD1-CG2 4.22Å
49	K	96.5	Very high	95	Very high	87 Å²	87	62.1 Å²	62.1	38%	0.378	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-121.5	154.2	-173.3	-70.8	173.6	165.7	164.3	0	112.1	D46 C47 D54 C55 R56	D46-K49 WeakPolarHBondContact O-CD 3.39Å; D46-K49 WeakPolarHBondContact O-CE 3.43Å; D46-K49 PolarHBondContact O-NZ 2.99Å; C47-K49 PolarHBondContact O-N 2.73Å; K49-D54 WeakPolarHBondContact CD-O 3.16Å; K49-D54 WeakPolarHBondContact CG-O 3.48Å; K49-C55 WeakPolarHBondContact CA-O 3.18Å; K49-R56 HydrophobicContact CG-CG 4.48Å
50	C	96.7	Very high	94.8	Very high	1 Å²	1	64 Å²	64	1%	0.007	34%	0.342	C	S	.	.			trans	-66.9	130.2	168.9	-177.3	0	0	0	0	109.9	C52 D54 C55 L57 I71 C73 D76	C50-C52 PolarHBondContact O-N 3.33Å; C50-C52 VanDerWaalsContact O-N 3.13Å; C50-C52 PolarHBondContact SG-N 2.89Å; C50-C52 VanDerWaalsContact SG-N 3.4Å; C50-D54 WeakPolarHBondContact O-CA 3.23Å; C50-D54 PolarHBondContact O-N 3.34Å; C50-C55 WeakPolarHBondContact CB-SG 3.39Å; C50-C55 PolarHBondContact N-O 2.9Å; C50-L57 HydrophobicContact CB-CD2 4.13Å; C50-I71 CarbonylContact C-O 3.6Å; C50-I71 WeakPolarHBondContact CA-O 3.47Å; C50-C73 HydrophobicContact CB-CB 4.19Å; C50-C73 PolarHBondContact SG-N 3.15Å; C50-D76 PolarHBondContact SG-OD2 3.3Å
51	A	96.6	Very high	94.7	Very high	59 Å²	59	58.7 Å²	58.7	49%	0.488	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-14.1	176.3	0	0	0	0	0	114	L70 I71 L72	A51-L70 HydrophobicContact CB-CB 4.45Å; A51-L70 HydrophobicContact CB-CD2 4.09Å; A51-I71 PolarHBondContact N-O 3.1Å; A51-L72 HydrophobicContact CB-CD2 4.22Å
52	C	95.6	Very high	94.4	Very high	55 Å²	55	57 Å²	57	37%	0.372	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-38.8	-179.6	-65.7	0	0	0	0	114.4	C50 L72 D76	C50-C52 PolarHBondContact O-N 3.33Å; C50-C52 VanDerWaalsContact O-N 3.13Å; C50-C52 PolarHBondContact SG-N 2.89Å; C50-C52 VanDerWaalsContact SG-N 3.4Å; C52-L72 HydrophobicContact CB-CD2 4.2Å; C52-L72 WeakPolarHBondContact SG-CD2 3.18Å; C52-D76 HydrophobicContact CB-CB 3.93Å
53	C	95.9	Very high	94.3	Very high	39 Å²	39	56.5 Å²	56.5	26%	0.264	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-4.9	-178.9	59.6	0	0	0	0	116	C55 C73 D76	C53-C55 HydrophobicContact CB-CB 4.18Å; C53-C55 WeakPolarHBondContact CB-SG 3.45Å; C53-C55 PolarHBondContact O-N 2.95Å; C53-C55 WeakPolarHBondContact SG-CB 3.4Å; C53-C55 CovalentContact SG-SG 2.08Å; C53-C55 PolarHBondContact SG-SG 3.02Å; C53-C73 VanDerWaalsContact SG-SG 3.66Å; C53-D76 WeakPolarHBondContact CB-OD2 3.1Å; C53-D76 PolarHBondContact SG-OD2 3.36Å
54	D	96.2	Very high	94.2	Very high	115 Å²	115	55.4 Å²	55.4	62%	0.615	33%	0.325	S	S	*	.			trans	55.6	2	-172.6	-67.8	-45.6	0	0	0	115.8	K49 C50	K49-D54 WeakPolarHBondContact CD-O 3.16Å; K49-D54 WeakPolarHBondContact CG-O 3.48Å; C50-D54 WeakPolarHBondContact O-CA 3.23Å; C50-D54 PolarHBondContact O-N 3.34Å
55	C	95.8	Very high	94.2	Very high	32 Å²	32	55.1 Å²	55.1	22%	0.216	32%	0.323	C	S	.	.			trans	-57.8	136.3	173	52.2	0	0	0	0	110.1	K49 C50 C53 L57 V60	K49-C55 WeakPolarHBondContact CA-O 3.18Å; C50-C55 WeakPolarHBondContact CB-SG 3.39Å; C50-C55 PolarHBondContact N-O 2.9Å; C53-C55 HydrophobicContact CB-CB 4.18Å; C53-C55 WeakPolarHBondContact CB-SG 3.45Å; C53-C55 PolarHBondContact O-N 2.95Å; C53-C55 WeakPolarHBondContact SG-CB 3.4Å; C53-C55 CovalentContact SG-SG 2.08Å; C53-C55 PolarHBondContact SG-SG 3.02Å; C55-L57 PolarHBondContact O-N 3.36Å; C55-V60 HydrophobicContact CB-CG2 4.37Å
56	R	95.9	Very high	94.3	Very high	96 Å²	96	52.3 Å²	52.3	36%	0.362	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-72.1	117.2	179.6	-67.2	169.2	177.5	167.4	0.2	109.6	D46 K49 G58 E59 V60	D46-R56 IonicContact OD1-CZ 2.91Å; D46-R56 IonicContact OD1-NE 2.83Å; D46-R56 PolarHBondContact OD1-NE 3.32Å; D46-R56 IonicContact OD1-NH1 3.91Å; D46-R56 IonicContact OD1-NH2 3.19Å; D46-R56 PolarHBondContact OD1-NH2 3.47Å; K49-R56 HydrophobicContact CG-CG 4.48Å; R56-G58 VanDerWaalsContact C-N 3.32Å; R56-G58 PolarHBondContact O-N 3.35Å; R56-E59 HydrophobicContact CB-CB 4.32Å; R56-E59 HydrophobicContact CB-CG 4.07Å; R56-E59 VanDerWaalsContact CD-CD 3.43Å; R56-E59 WeakPolarHBondContact CD-OE1 3.38Å; R56-E59 IonicContact CZ-OE1 2.76Å; R56-E59 IonicContact NE-OE1 2.63Å; R56-E59 IonicContact NH1-OE1 3.78Å; R56-E59 PolarHBondContact NH1-OE1 2.84Å; R56-E59 PolarHBondContact O-N 2.75Å; R56-V60 WeakPolarHBondContact O-CG2 3.4Å; R56-V60 PolarHBondContact O-N 3.4Å
57	L	95.3	Very high	94.2	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-67.7	-35.1	-170.8	-68.3	167.2	0	0	0	112.1	M11 L48 C50 C55 E59 V60 G61 L64 I71 C73	M11-L57 HydrophobicContact CE-CB 3.94Å; M11-L57 VanDerWaalsContact CE-O 3.3Å; M11-L57 WeakPolarHBondContact CE-O 3.34Å; M11-L57 HydrophobicContact SD-CB 3.75Å; L48-L57 HydrophobicContact CD1-CD1 4.25Å; L48-L57 HydrophobicContact CG-CB 4.32Å; L48-L57 HydrophobicContact CG-CD1 4.15Å; L48-L57 PolarHBondContact O-N 3.09Å; C50-L57 HydrophobicContact CB-CD2 4.13Å; C55-L57 PolarHBondContact O-N 3.36Å; L57-E59 PolarHBondContact O-N 3.48Å; L57-V60 PolarHBondContact O-N 3.4Å; L57-G61 PolarHBondContact O-N 2.87Å; L57-G61 VanDerWaalsContact O-N 3.17Å; L57-L64 HydrophobicContact CD1-CB 4.01Å; L57-L64 HydrophobicContact CD1-CD2 4.46Å; L57-I71 HydrophobicContact CD1-CG2 3.41Å; L57-I71 VanDerWaalsContact CD1-CG2 3.41Å; L57-C73 HydrophobicContact CD2-CB 3.65Å
58	G	91.4	Very high	93.9	Very high	37 Å²	37	53.4 Å²	53.4	38%	0.381	32%	0.324	S	S	.	.	H	α-helix	trans	-65.2	-21.9	176.6	0	0	0	0	0	114.7	R56	R56-G58 VanDerWaalsContact C-N 3.32Å; R56-G58 PolarHBondContact O-N 3.35Å
59	E	91.1	Very high	93.6	Very high	134 Å²	134	61.7 Å²	61.7	63%	0.626	37%	0.368	S	S	*	.	H	α-helix	trans	-86.8	-34.3	176	-66.7	177.6	-175.5	0	0	111.9	R56 L57	R56-E59 HydrophobicContact CB-CB 4.32Å; R56-E59 HydrophobicContact CB-CG 4.07Å; R56-E59 VanDerWaalsContact CD-CD 3.43Å; R56-E59 WeakPolarHBondContact CD-OE1 3.38Å; R56-E59 IonicContact CZ-OE1 2.76Å; R56-E59 IonicContact NE-OE1 2.63Å; R56-E59 IonicContact NH1-OE1 3.78Å; R56-E59 PolarHBondContact NH1-OE1 2.84Å; R56-E59 PolarHBondContact O-N 2.75Å; L57-E59 PolarHBondContact O-N 3.48Å
60	V	89.8	Confident	93.4	Very high	99 Å²	99	60.5 Å²	60.5	60%	0.6	37%	0.366	S	S	*	.	H	α-helix	trans	-79.4	-25.4	-176	178.8	0	0	0	0	112	C55 R56 L57	C55-V60 HydrophobicContact CB-CG2 4.37Å; R56-V60 WeakPolarHBondContact O-CG2 3.4Å; R56-V60 PolarHBondContact O-N 3.4Å; L57-V60 PolarHBondContact O-N 3.4Å
61	G	88.9	Confident	93.4	Very high	36 Å²	36	62.1 Å²	62.1	37%	0.371	37%	0.374	S	S	.	.			trans	176.8	-172.2	175.5	0	0	0	0	0	113.4	M11 L57	M11-G61 WeakPolarHBondContact CE-O 3.35Å; L57-G61 PolarHBondContact O-N 2.87Å; L57-G61 VanDerWaalsContact O-N 3.17Å
62	S	90.1	Very high	93.3	Very high	84 Å²	84	59.3 Å²	59.3	59%	0.587	35%	0.351	S	S	*	.	S	Bend	trans	-100	4	179.4	58.7	0	0	0	0	113.8	M11	M11-S62 PolarHBondContact N-O 3.08Å
63	T	93.1	Very high	93.3	Very high	58 Å²	58	56.9 Å²	56.9	36%	0.356	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	140	178.8	51.1	0	0	0	0	110.6	V9	V9-T63 WeakPolarHBondContact O-CA 3.35Å
64	L	94.6	Very high	93.1	Very high	0 Å²	0	62 Å²	62	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	165.6	168.5	68.2	79.2	0	0	0	109.4	V9 M11 A38 L39 L48 L57 T66 I71	V9-L64 HydrophobicContact CB-CD1 3.66Å; V9-L64 HydrophobicContact CB-CG 4.05Å; V9-L64 HydrophobicContact CG1-CD1 4.34Å; V9-L64 HydrophobicContact CG2-CD1 4.12Å; V9-L64 PolarHBondContact N-O 2.85Å; V9-L64 PolarHBondContact O-N 2.81Å; M11-L64 HydrophobicContact CE-CB 4.38Å; M11-L64 HydrophobicContact CG-CB 4.33Å; M11-L64 HydrophobicContact CG-CD2 3.81Å; M11-L64 HydrophobicContact CG-CG 4.09Å; M11-L64 HydrophobicContact SD-CB 3.95Å; M11-L64 HydrophobicContact SD-CD2 3.78Å; M11-L64 HydrophobicContact SD-CG 4.22Å; A38-L64 HydrophobicContact CB-CD2 3.76Å; L39-L64 HydrophobicContact CD1-CD1 4.36Å; L39-L64 HydrophobicContact CD2-CD1 4.48Å; L39-L64 HydrophobicContact CG-CD1 4.4Å; L48-L64 HydrophobicContact CD1-CD2 4Å; L48-L64 HydrophobicContact CD2-CD2 4.11Å; L48-L64 HydrophobicContact CG-CD2 4.41Å; L57-L64 HydrophobicContact CD1-CB 4.01Å; L57-L64 HydrophobicContact CD1-CD2 4.46Å; L64-T66 HydrophobicContact CD1-CG2 3.61Å; L64-I71 HydrophobicContact CB-CG2 4.38Å; L64-I71 HydrophobicContact CD1-CG2 4.07Å; L64-I71 HydrophobicContact CD2-CG2 3.95Å; L64-I71 HydrophobicContact CG-CG2 4.39Å
65	Y	95	Very high	93	Very high	13 Å²	13	63.9 Å²	63.9	5%	0.051	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.5	178.1	-63.9	-100.3	0	0	0	109.9	L3 E7 L72 R74 Y77	L3-Y65 HydrophobicContact CD1-CE1 4.02Å; L3-Y65 HydrophobicContact CD2-CE1 4.3Å; E7-Y65 CarbonylContact O-C 3.59Å; E7-Y65 VanDerWaalsContact O-CA 3.26Å; E7-Y65 WeakPolarHBondContact O-CA 3.25Å; Y65-L72 PolarHBondContact N-O 3.03Å; Y65-L72 PolarHBondContact O-N 3.32Å; Y65-R74 HydrophobicContact CD2-CB 4.23Å; Y65-R74 HydrophobicContact CE2-CB 3.64Å; Y65-R74 HydrophobicContact CE2-CG 4.02Å; Y65-Y77 VanDerWaalsContact CB-CD2 3.44Å; Y65-Y77 AromaticContact CD1-CD1 3.85Å; Y65-Y77 HydrophobicContact CD1-CD1 3.85Å; Y65-Y77 HydrophobicContact CD1-CD2 4.23Å; Y65-Y77 HydrophobicContact CD1-CE1 4.15Å; Y65-Y77 HydrophobicContact CD1-CE2 4.45Å; Y65-Y77 AromaticContact CD1-CG 3.91Å; Y65-Y77 HydrophobicContact CD1-CG 3.91Å; Y65-Y77 HydrophobicContact CE1-CD1 4.46Å; Y65-Y77 HydrophobicContact CG-CD1 4.2Å; Y65-Y77 HydrophobicContact CG-CD2 4.12Å; Y65-Y77 AromaticContact CG-CG 3.82Å; Y65-Y77 HydrophobicContact CG-CG 3.82Å
66	T	94.4	Very high	92.9	Very high	36 Å²	36	62.6 Å²	62.6	22%	0.221	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	126.6	176.7	54.6	0	0	0	0	111.9	E7 L39 L64 L70 I71	E7-T66 WeakPolarHBondContact CB-O 3.38Å; E7-T66 PolarHBondContact O-N 3.06Å; L39-T66 HydrophobicContact CD1-CG2 3.84Å; L39-T66 HydrophobicContact CD2-CG2 3.69Å; L39-T66 HydrophobicContact CG-CG2 4.33Å; L64-T66 HydrophobicContact CD1-CG2 3.61Å; T66-L70 VanDerWaalsContact CA-O 3.27Å; T66-L70 WeakPolarHBondContact CA-O 3.43Å; T66-I71 HydrophobicContact CG2-CG1 4.36Å
67	K	92.6	Very high	92.8	Very high	61 Å²	61	58.3 Å²	58.3	27%	0.265	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	144	174.5	-170.4	157.6	-160.6	151.2	0	110.4	E7 N69 L70 Y77 F81	E7-K67 WeakPolarHBondContact OE1-CB 3.45Å; E7-K67 WeakPolarHBondContact OE1-CD 3.15Å; E7-K67 WeakPolarHBondContact OE1-CG 3.34Å; E7-K67 IonicContact OE1-NZ 3.79Å; E7-K67 WeakPolarHBondContact OE2-CD 3.37Å; E7-K67 WeakPolarHBondContact OE2-CE 3.19Å; E7-K67 IonicContact OE2-NZ 2.75Å; E7-K67 PolarHBondContact OE2-NZ 2.91Å; K67-N69 PolarHBondContact O-N 2.95Å; K67-N69 VanDerWaalsContact O-N 3.16Å; K67-L70 PolarHBondContact N-O 2.9Å; K67-L70 WeakPolarHBondContact O-CB 3.18Å; K67-L70 PolarHBondContact O-N 3.4Å; K67-Y77 HydrophobicContact CB-CD2 4.44Å; K67-Y77 HydrophobicContact CB-CE2 3.93Å; K67-Y77 HydrophobicContact CD-CE2 3.94Å; K67-F81 HydrophobicContact CB-CD2 4.05Å; K67-F81 HydrophobicContact CB-CE2 3.79Å; K67-F81 HydrophobicContact CB-CZ 4.23Å; K67-F81 HydrophobicContact CD-CB 3.87Å; K67-F81 HydrophobicContact CD-CD1 3.77Å; K67-F81 HydrophobicContact CD-CD2 3.72Å; K67-F81 HydrophobicContact CD-CE1 4.15Å; K67-F81 HydrophobicContact CD-CE2 4.09Å; K67-F81 HydrophobicContact CD-CG 3.53Å; K67-F81 HydrophobicContact CD-CZ 4.3Å; K67-F81 HydrophobicContact CG-CD1 4.33Å; K67-F81 HydrophobicContact CG-CD2 4.15Å; K67-F81 HydrophobicContact CG-CE1 4.21Å; K67-F81 HydrophobicContact CG-CE2 4Å; K67-F81 HydrophobicContact CG-CG 4.3Å; K67-F81 HydrophobicContact CG-CZ 4.04Å
68	A	89.9	Confident	92.6	Very high	77 Å²	77	59 Å²	59	64%	0.636	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	40.2	-179.5	0	0	0	0	0	113.4	L70 F81	A68-L70 PolarHBondContact O-N 2.98Å; A68-F81 HydrophobicContact CB-CZ 4.4Å
69	N	89.6	Confident	92.6	Very high	174 Å²	174	63.3 Å²	63.3	93%	0.93	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	16.3	-175.6	-58.1	-41.2	0	0	0	115.7	K67	K67-N69 PolarHBondContact O-N 2.95Å; K67-N69 VanDerWaalsContact O-N 3.16Å
70	L	93.9	Very high	92.6	Very high	63 Å²	63	60.6 Å²	60.6	33%	0.33	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	143	174.3	-58.3	175.8	0	0	0	110.8	A51 T66 K67 A68 L72	A51-L70 HydrophobicContact CB-CB 4.45Å; A51-L70 HydrophobicContact CB-CD2 4.09Å; T66-L70 VanDerWaalsContact CA-O 3.27Å; T66-L70 WeakPolarHBondContact CA-O 3.43Å; K67-L70 PolarHBondContact N-O 2.9Å; K67-L70 WeakPolarHBondContact O-CB 3.18Å; K67-L70 PolarHBondContact O-N 3.4Å; A68-L70 PolarHBondContact O-N 2.98Å; L70-L72 HydrophobicContact CB-CD1 4.24Å; L70-L72 HydrophobicContact CB-CD2 4.09Å; L70-L72 HydrophobicContact CB-CG 3.96Å
71	I	95.4	Very high	92.7	Very high	34 Å²	34	59.3 Å²	59.3	17%	0.174	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.9	167.9	-55.3	179.3	0	0	0	107.3	L39 W43 L48 C50 A51 L57 L64 T66	L39-I71 HydrophobicContact CD1-CD1 3.74Å; L39-I71 HydrophobicContact CD1-CG1 4.05Å; W43-I71 HydrophobicContact CH2-CD1 3.83Å; W43-I71 HydrophobicContact CZ2-CD1 4.16Å; L48-I71 HydrophobicContact CD1-CD1 4.32Å; L48-I71 HydrophobicContact CD1-CG2 4.22Å; C50-I71 CarbonylContact C-O 3.6Å; C50-I71 WeakPolarHBondContact CA-O 3.47Å; A51-I71 PolarHBondContact N-O 3.1Å; L57-I71 HydrophobicContact CD1-CG2 3.41Å; L57-I71 VanDerWaalsContact CD1-CG2 3.41Å; L64-I71 HydrophobicContact CB-CG2 4.38Å; L64-I71 HydrophobicContact CD1-CG2 4.07Å; L64-I71 HydrophobicContact CD2-CG2 3.95Å; L64-I71 HydrophobicContact CG-CG2 4.39Å; T66-I71 HydrophobicContact CG2-CG1 4.36Å
72	L	95.8	Very high	92.6	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	151.4	-169.2	-61.1	175.9	0	0	0	112.5	A51 C52 Y65 L70 D76 Y77 L80 F81	A51-L72 HydrophobicContact CB-CD2 4.22Å; C52-L72 HydrophobicContact CB-CD2 4.2Å; C52-L72 WeakPolarHBondContact SG-CD2 3.18Å; Y65-L72 PolarHBondContact N-O 3.03Å; Y65-L72 PolarHBondContact O-N 3.32Å; L70-L72 HydrophobicContact CB-CD1 4.24Å; L70-L72 HydrophobicContact CB-CD2 4.09Å; L70-L72 HydrophobicContact CB-CG 3.96Å; L72-D76 HydrophobicContact CD2-CB 4.44Å; L72-Y77 HydrophobicContact CD1-CD2 4.45Å; L72-L80 HydrophobicContact CD1-CD1 4.07Å; L72-F81 HydrophobicContact CD1-CD2 4.13Å; L72-F81 HydrophobicContact CD1-CE2 3.58Å
73	C	95.1	Very high	92.5	Very high	4 Å²	4	60.1 Å²	60.1	3%	0.027	31%	0.305	C	S	.	.			trans	-74.6	160.7	165	78.6	0	0	0	0	110	C50 C53 L57 R75 D76 Y77	C50-C73 HydrophobicContact CB-CB 4.19Å; C50-C73 PolarHBondContact SG-N 3.15Å; C53-C73 VanDerWaalsContact SG-SG 3.66Å; L57-C73 HydrophobicContact CD2-CB 3.65Å; C73-R75 PolarHBondContact O-N 3.33Å; C73-D76 PolarHBondContact O-N 3.05Å; C73-D76 PolarHBondContact SG-N 3.18Å; C73-D76 PolarHBondContact SG-OD2 2.9Å; C73-D76 VanDerWaalsContact SG-OD2 3.33Å; C73-Y77 WeakPolarHBondContact O-CB 3.04Å; C73-Y77 PolarHBondContact O-N 3.14Å
74	R	92	Very high	92.3	Very high	148 Å²	148	61 Å²	61	56%	0.558	31%	0.31	S	S	*	.	H	α-helix	trans	-52.4	-42	178.4	-176.3	175.5	175.7	164.8	-0.2	112.8	Y65 L78	Y65-R74 HydrophobicContact CD2-CB 4.23Å; Y65-R74 HydrophobicContact CE2-CB 3.64Å; Y65-R74 HydrophobicContact CE2-CG 4.02Å; R74-L78 HydrophobicContact CG-CD1 4.06Å; R74-L78 WeakPolarHBondContact O-CB 3.38Å; R74-L78 VanDerWaalsContact O-CG 3.32Å; R74-L78 WeakPolarHBondContact O-CG 3.32Å; R74-L78 PolarHBondContact O-N 3Å
75	R	92.4	Very high	92.1	Very high	153 Å²	153	62.2 Å²	62.2	58%	0.577	32%	0.322	S	S	*	.	H	α-helix	trans	-65	-49.6	-177.5	-175	179.8	67.3	-178.3	0.2	111.8	C73 L78 R79 F97	C73-R75 PolarHBondContact O-N 3.33Å; R75-L78 PolarHBondContact O-N 3.23Å; R75-R79 WeakPolarHBondContact O-CB 3.42Å; R75-R79 PolarHBondContact O-N 3.2Å; R75-F97 HydrophobicContact CG-CB 4.46Å
76	D	94.4	Very high	92.2	Very high	6 Å²	6	66.4 Å²	66.4	3%	0.032	35%	0.345	C	S	.	.	H	α-helix	trans	-71.3	-35.3	-179.9	-75.3	-49.1	0	0	0	112.3	C50 C52 C53 L72 C73 R79 L80	C50-D76 PolarHBondContact SG-OD2 3.3Å; C52-D76 HydrophobicContact CB-CB 3.93Å; C53-D76 WeakPolarHBondContact CB-OD2 3.1Å; C53-D76 PolarHBondContact SG-OD2 3.36Å; L72-D76 HydrophobicContact CD2-CB 4.44Å; C73-D76 PolarHBondContact O-N 3.05Å; C73-D76 PolarHBondContact SG-N 3.18Å; C73-D76 PolarHBondContact SG-OD2 2.9Å; C73-D76 VanDerWaalsContact SG-OD2 3.33Å; D76-R79 PolarHBondContact O-N 3.41Å; D76-R79 IonicContact OD1-CZ 3.95Å; D76-R79 IonicContact OD1-NE 2.87Å; D76-R79 PolarHBondContact OD1-NE 2.89Å; D76-R79 VanDerWaalsContact OD1-NE 3.09Å; D76-R79 IonicContact OD1-NH2 3.43Å; D76-R79 PolarHBondContact OD1-NH2 3.16Å; D76-L80 WeakPolarHBondContact O-CB 3.39Å; D76-L80 WeakPolarHBondContact O-CG 3.36Å; D76-L80 PolarHBondContact O-N 3.23Å
77	Y	94	Very high	92.2	Very high	5 Å²	5	64.8 Å²	64.8	2%	0.02	34%	0.335	C	S	.	.	H	α-helix	trans	-57.9	-51.4	171.7	178.7	-89.8	0	0	0	111.2	L3 E7 Y65 K67 L72 C73 R79 L80 F81	L3-Y77 HydrophobicContact CD2-CD1 3.86Å; L3-Y77 HydrophobicContact CD2-CE1 3.47Å; L3-Y77 VanDerWaalsContact CD2-CE1 3.47Å; E7-Y77 HydrophobicContact CB-CE2 4.3Å; E7-Y77 PolarHBondContact OE2-OH 3.06Å; Y65-Y77 VanDerWaalsContact CB-CD2 3.44Å; Y65-Y77 AromaticContact CD1-CD1 3.85Å; Y65-Y77 HydrophobicContact CD1-CD1 3.85Å; Y65-Y77 HydrophobicContact CD1-CD2 4.23Å; Y65-Y77 HydrophobicContact CD1-CE1 4.15Å; Y65-Y77 HydrophobicContact CD1-CE2 4.45Å; Y65-Y77 AromaticContact CD1-CG 3.91Å; Y65-Y77 HydrophobicContact CD1-CG 3.91Å; Y65-Y77 HydrophobicContact CE1-CD1 4.46Å; Y65-Y77 HydrophobicContact CG-CD1 4.2Å; Y65-Y77 HydrophobicContact CG-CD2 4.12Å; Y65-Y77 AromaticContact CG-CG 3.82Å; Y65-Y77 HydrophobicContact CG-CG 3.82Å; K67-Y77 HydrophobicContact CB-CD2 4.44Å; K67-Y77 HydrophobicContact CB-CE2 3.93Å; K67-Y77 HydrophobicContact CD-CE2 3.94Å; L72-Y77 HydrophobicContact CD1-CD2 4.45Å; C73-Y77 WeakPolarHBondContact O-CB 3.04Å; C73-Y77 PolarHBondContact O-N 3.14Å; Y77-R79 VanDerWaalsContact C-N 3.32Å; Y77-R79 PolarHBondContact O-N 3.04Å; Y77-L80 PolarHBondContact O-N 3.39Å; Y77-F81 AromaticContact CD2-CD2 3.92Å; Y77-F81 HydrophobicContact CD2-CD2 3.92Å; Y77-F81 HydrophobicContact CE2-CB 4.43Å; Y77-F81 HydrophobicContact CE2-CD2 4.09Å; Y77-F81 WeakPolarHBondContact O-CB 3.32Å; Y77-F81 PolarHBondContact O-N 2.99Å
78	L	92.1	Very high	92.2	Very high	16 Å²	16	63.7 Å²	63.7	8%	0.084	34%	0.338	C	S	.	.	H	α-helix	trans	-62.2	-40.6	176.5	-74.4	173	0	0	0	111.6	L3 R74 R75 L80 G82 A96 F97	L3-L78 HydrophobicContact CD2-CD2 3.71Å; R74-L78 HydrophobicContact CG-CD1 4.06Å; R74-L78 WeakPolarHBondContact O-CB 3.38Å; R74-L78 VanDerWaalsContact O-CG 3.32Å; R74-L78 WeakPolarHBondContact O-CG 3.32Å; R74-L78 PolarHBondContact O-N 3Å; R75-L78 PolarHBondContact O-N 3.23Å; L78-L80 VanDerWaalsContact C-N 3.33Å; L78-L80 PolarHBondContact O-N 2.85Å; L78-G82 VanDerWaalsContact O-CA 3.23Å; L78-G82 WeakPolarHBondContact O-CA 3.26Å; L78-G82 PolarHBondContact O-N 3.34Å; L78-A96 WeakPolarHBondContact O-CB 3.34Å; L78-F97 HydrophobicContact CB-CB 3.93Å
79	R	91.2	Very high	92.4	Very high	128 Å²	128	61.5 Å²	61.5	48%	0.483	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-38.8	178.2	-176.4	172.8	67.5	96.5	-1.3	113.5	R75 D76 Y77 F97	R75-R79 WeakPolarHBondContact O-CB 3.42Å; R75-R79 PolarHBondContact O-N 3.2Å; D76-R79 PolarHBondContact O-N 3.41Å; D76-R79 IonicContact OD1-CZ 3.95Å; D76-R79 IonicContact OD1-NE 2.87Å; D76-R79 PolarHBondContact OD1-NE 2.89Å; D76-R79 VanDerWaalsContact OD1-NE 3.09Å; D76-R79 IonicContact OD1-NH2 3.43Å; D76-R79 PolarHBondContact OD1-NH2 3.16Å; Y77-R79 VanDerWaalsContact C-N 3.32Å; Y77-R79 PolarHBondContact O-N 3.04Å; R79-F97 HydrophobicContact CB-CD1 3.66Å; R79-F97 HydrophobicContact CB-CE1 4.11Å; R79-F97 HydrophobicContact CB-CG 4.44Å; R79-F97 HydrophobicContact CG-CD1 3.89Å; R79-F97 HydrophobicContact CG-CE1 3.79Å
80	L	91	Very high	92.6	Very high	78 Å²	78	55.4 Å²	55.4	41%	0.408	29%	0.29	S	S	.	.	H	α-helix	trans	-89.1	-35.2	-176.8	-67.4	173.9	0	0	0	113.1	L72 D76 Y77 L78	L72-L80 HydrophobicContact CD1-CD1 4.07Å; D76-L80 WeakPolarHBondContact O-CB 3.39Å; D76-L80 WeakPolarHBondContact O-CG 3.36Å; D76-L80 PolarHBondContact O-N 3.23Å; Y77-L80 PolarHBondContact O-N 3.39Å; L78-L80 VanDerWaalsContact C-N 3.33Å; L78-L80 PolarHBondContact O-N 2.85Å
81	F	90.6	Very high	92.6	Very high	71 Å²	71	56.9 Å²	56.9	31%	0.311	31%	0.306	S	S	.	.	H	α-helix	trans	-132.4	-4.2	-166	-52.1	-65.5	0	0	0	114.3	K67 A68 L72 Y77	K67-F81 HydrophobicContact CB-CD2 4.05Å; K67-F81 HydrophobicContact CB-CE2 3.79Å; K67-F81 HydrophobicContact CB-CZ 4.23Å; K67-F81 HydrophobicContact CD-CB 3.87Å; K67-F81 HydrophobicContact CD-CD1 3.77Å; K67-F81 HydrophobicContact CD-CD2 3.72Å; K67-F81 HydrophobicContact CD-CE1 4.15Å; K67-F81 HydrophobicContact CD-CE2 4.09Å; K67-F81 HydrophobicContact CD-CG 3.53Å; K67-F81 HydrophobicContact CD-CZ 4.3Å; K67-F81 HydrophobicContact CG-CD1 4.33Å; K67-F81 HydrophobicContact CG-CD2 4.15Å; K67-F81 HydrophobicContact CG-CE1 4.21Å; K67-F81 HydrophobicContact CG-CE2 4Å; K67-F81 HydrophobicContact CG-CG 4.3Å; K67-F81 HydrophobicContact CG-CZ 4.04Å; A68-F81 HydrophobicContact CB-CZ 4.4Å; L72-F81 HydrophobicContact CD1-CD2 4.13Å; L72-F81 HydrophobicContact CD1-CE2 3.58Å; Y77-F81 AromaticContact CD2-CD2 3.92Å; Y77-F81 HydrophobicContact CD2-CD2 3.92Å; Y77-F81 HydrophobicContact CE2-CB 4.43Å; Y77-F81 HydrophobicContact CE2-CD2 4.09Å; Y77-F81 WeakPolarHBondContact O-CB 3.32Å; Y77-F81 PolarHBondContact O-N 2.99Å
82	G	87.9	Confident	92.6	Very high	20 Å²	20	62.3 Å²	62.3	21%	0.206	33%	0.328	C	S	.	.	S	Bend	trans	-73.5	149.5	176.5	0	0	0	0	0	111.7	L78 T84 A96	L78-G82 VanDerWaalsContact O-CA 3.23Å; L78-G82 WeakPolarHBondContact O-CA 3.26Å; L78-G82 PolarHBondContact O-N 3.34Å; G82-T84 PolarHBondContact O-N 3.44Å; G82-A96 WeakPolarHBondContact O-CB 3.27Å
83	T	87.1	Confident	92.6	Very high	118 Å²	118	67.3 Å²	67.3	72%	0.724	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-68.6	120.6	173.2	-42.9	0	0	0	0	110.6	A96	T83-A96 WeakPolarHBondContact O-CB 3.43Å
84	T	89.6	Confident	92.6	Very high	77 Å²	77	67.4 Å²	67.4	47%	0.472	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-77.9	162.2	170.3	54.8	0	0	0	0	110.6	G82 I94 A96	G82-T84 PolarHBondContact O-N 3.44Å; T84-I94 WeakPolarHBondContact CA-O 3.45Å; T84-I94 WeakPolarHBondContact CB-O 3.44Å; T84-A96 HydrophobicContact CG2-CB 4.46Å
85	G	90.8	Very high	92.6	Very high	24 Å²	24	62.1 Å²	62.1	25%	0.247	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	178.4	174.6	0	0	0	0	0	111.4	L93 I94	G85-L93 CarbonylContact O-C 3.59Å; G85-I94 PolarHBondContact N-O 2.99Å; G85-I94 VanDerWaalsContact N-O 3.09Å; G85-I94 PolarHBondContact O-N 2.87Å
86	N	95.6	Very high	92.5	Very high	102 Å²	102	55.1 Å²	55.1	55%	0.545	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132.8	173.1	-71.3	82.5	0	0	0	109.6	A88 S91 K92 V107	N86-A88 PolarHBondContact O-N 3.45Å; N86-S91 PolarHBondContact ND2-O 3.08Å; N86-K92 WeakPolarHBondContact CA-O 3.42Å; N86-V107 WeakPolarHBondContact O-CG2 3.36Å
87	C	95.1	Very high	92.1	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.007	33%	0.332	C	S	.	.			trans	-67	123	175.9	177.2	0	0	0	0	110	A89 C90 S91 K92 I94 V107 C112	C87-A89 PolarHBondContact O-N 3.28Å; C87-C90 VanDerWaalsContact CB-SG 3.55Å; C87-S91 WeakPolarHBondContact O-CA 3.38Å; C87-S91 PolarHBondContact O-N 2.9Å; C87-K92 PolarHBondContact N-O 2.9Å; C87-I94 HydrophobicContact CB-CD1 3.98Å; C87-I94 HydrophobicContact CB-CG1 4.01Å; C87-V107 CarbonylContact C-O 3.58Å; C87-V107 WeakPolarHBondContact CA-O 3.2Å; C87-C112 VanDerWaalsContact SG-CB 3.58Å
88	A	93.4	Very high	92	Very high	38 Å²	38	62.1 Å²	62.1	31%	0.314	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-21.1	-178.5	0	0	0	0	0	113.6	N86 N106 V107 Y108	N86-A88 PolarHBondContact O-N 3.45Å; A88-N106 HydrophobicContact CB-CB 3.83Å; A88-V107 PolarHBondContact N-O 2.99Å; A88-Y108 HydrophobicContact CB-CD1 4.18Å; A88-Y108 HydrophobicContact CB-CE1 3.57Å; A88-Y108 HydrophobicContact CB-CE2 4.46Å
89	A	92.9	Very high	91.9	Very high	32 Å²	32	68.4 Å²	68.4	26%	0.264	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-39.8	178	0	0	0	0	0	113.7	C87 Y108 C112	C87-A89 PolarHBondContact O-N 3.28Å; A89-Y108 HydrophobicContact CB-CD1 3.76Å; A89-Y108 HydrophobicContact CB-CE1 4.03Å; A89-C112 HydrophobicContact CB-CB 4.06Å
90	C	93.9	Very high	92	Very high	45 Å²	45	63.9 Å²	63.9	30%	0.304	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-1.3	-175.6	73.3	0	0	0	0	114.5	C87 K92 H109 C112	C87-C90 VanDerWaalsContact CB-SG 3.55Å; C90-K92 PolarHBondContact O-N 2.77Å; C90-H109 PolarHBondContact SG-CE1 3.24Å; C90-H109 PolarHBondContact SG-ND1 3.4Å; C90-H109 VanDerWaalsContact SG-ND1 3.4Å; C90-C112 VanDerWaalsContact SG-SG 3.65Å
91	S	94.2	Very high	92.1	Very high	94 Å²	94	63.6 Å²	63.6	66%	0.657	36%	0.36	S	S	*	.			trans	59	0.4	-177.5	-57.8	0	0	0	0	116.1	N86 C87	N86-S91 PolarHBondContact ND2-O 3.08Å; C87-S91 WeakPolarHBondContact O-CA 3.38Å; C87-S91 PolarHBondContact O-N 2.9Å
92	K	95.6	Very high	92.2	Very high	148 Å²	148	67.3 Å²	67.3	64%	0.643	37%	0.372	S	S	*	.			trans	-74.4	154.3	177.9	-62.2	178	-176.5	178.3	0	111.4	N86 C87 C90	N86-K92 WeakPolarHBondContact CA-O 3.42Å; C87-K92 PolarHBondContact N-O 2.9Å; C90-K92 PolarHBondContact O-N 2.77Å
93	L	95.3	Very high	92.3	Very high	105 Å²	105	66.7 Å²	66.7	55%	0.55	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	131.9	176.8	-170.2	77.2	0	0	0	110.7	G85	G85-L93 CarbonylContact O-C 3.59Å
94	I	95.1	Very high	92.4	Very high	6 Å²	6	70.8 Å²	70.8	3%	0.031	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	115.1	168.8	-53.4	178.3	0	0	0	107.9	T84 G85 C87 E98 V100 V107 H109	T84-I94 WeakPolarHBondContact CA-O 3.45Å; T84-I94 WeakPolarHBondContact CB-O 3.44Å; G85-I94 PolarHBondContact N-O 2.99Å; G85-I94 VanDerWaalsContact N-O 3.09Å; G85-I94 PolarHBondContact O-N 2.87Å; C87-I94 HydrophobicContact CB-CD1 3.98Å; C87-I94 HydrophobicContact CB-CG1 4.01Å; I94-E98 HydrophobicContact CG2-CB 4.09Å; I94-V100 HydrophobicContact CB-CG1 4.49Å; I94-V100 HydrophobicContact CD1-CG1 3.93Å; I94-V100 HydrophobicContact CG2-CG1 3.31Å; I94-V107 HydrophobicContact CD1-CB 4.07Å; I94-V107 HydrophobicContact CD1-CG2 3.77Å; I94-H109 WeakPolarHBondContact CG1-NE2 3.36Å
95	P	92.2	Very high	92.3	Very high	37 Å²	37	74.7 Å²	74.7	24%	0.24	39%	0.386	C	S	.	.			trans	-58.1	143.7	169.7	-19	31.3	0	0	0	111.9	F97 E98	P95-F97 HydrophobicContact CB-CD1 3.76Å; P95-F97 HydrophobicContact CB-CE1 3.34Å; P95-F97 HydrophobicContact CB-CE2 4.42Å; P95-F97 HydrophobicContact CB-CG 4.48Å; P95-F97 HydrophobicContact CB-CZ 3.72Å; P95-F97 HydrophobicContact CG-CE1 4.24Å; P95-F97 HydrophobicContact CG-CZ 4.21Å; P95-F97 PolarHBondContact O-N 3.09Å; P95-F97 VanDerWaalsContact O-N 3.1Å; P95-E98 HydrophobicContact CB-CB 4.43Å; P95-E98 WeakPolarHBondContact CD-OE2 3.35Å; P95-E98 WeakPolarHBondContact O-CB 3.18Å; P95-E98 PolarHBondContact O-N 3.08Å
96	A	90.1	Very high	92.3	Very high	6 Å²	6	75 Å²	75	5%	0.05	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-17.2	-173.9	0	0	0	0	0	114.9	L78 G82 T83 T84	L78-A96 WeakPolarHBondContact O-CB 3.34Å; G82-A96 WeakPolarHBondContact O-CB 3.27Å; T83-A96 WeakPolarHBondContact O-CB 3.43Å; T84-A96 HydrophobicContact CG2-CB 4.46Å
97	F	86.7	Confident	92.2	Very high	94 Å²	94	71.1 Å²	71.1	41%	0.412	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-8.8	175.3	65.2	-92.2	0	0	0	113.2	R75 L78 R79 P95	R75-F97 HydrophobicContact CG-CB 4.46Å; L78-F97 HydrophobicContact CB-CB 3.93Å; R79-F97 HydrophobicContact CB-CD1 3.66Å; R79-F97 HydrophobicContact CB-CE1 4.11Å; R79-F97 HydrophobicContact CB-CG 4.44Å; R79-F97 HydrophobicContact CG-CD1 3.89Å; R79-F97 HydrophobicContact CG-CE1 3.79Å; P95-F97 HydrophobicContact CB-CD1 3.76Å; P95-F97 HydrophobicContact CB-CE1 3.34Å; P95-F97 HydrophobicContact CB-CE2 4.42Å; P95-F97 HydrophobicContact CB-CG 4.48Å; P95-F97 HydrophobicContact CB-CZ 3.72Å; P95-F97 HydrophobicContact CG-CE1 4.24Å; P95-F97 HydrophobicContact CG-CZ 4.21Å; P95-F97 PolarHBondContact O-N 3.09Å; P95-F97 VanDerWaalsContact O-N 3.1Å
98	E	91.6	Very high	92.2	Very high	64 Å²	64	71.1 Å²	71.1	30%	0.299	36%	0.361	S	S	.	.	S	Bend	trans	-76.4	142.8	-178.3	-164.4	176.6	145.6	0	0	110.9	I94 P95 H109	I94-E98 HydrophobicContact CG2-CB 4.09Å; P95-E98 HydrophobicContact CB-CB 4.43Å; P95-E98 WeakPolarHBondContact CD-OE2 3.35Å; P95-E98 WeakPolarHBondContact O-CB 3.18Å; P95-E98 PolarHBondContact O-N 3.08Å; E98-H109 IonicContact OE1-CD2 3.18Å; E98-H109 PolarHBondContact OE1-CD2 3.31Å; E98-H109 IonicContact OE1-CG 3.98Å; E98-H109 IonicContact OE2-CD2 3.98Å
99	M	90.4	Very high	92.3	Very high	149 Å²	149	70.4 Å²	70.4	73%	0.734	35%	0.352	S	S	*	.			trans	-74.8	135.8	172.4	-63.3	-177.9	82.4	0	0	109.5	L110	M99-L110 HydrophobicContact CB-CD1 4.09Å; M99-L110 HydrophobicContact CB-CG 4.48Å
100	V	93.6	Very high	92.3	Very high	32 Å²	32	73.2 Å²	73.2	19%	0.194	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	152.2	-173.6	-64.6	0	0	0	0	111.7	M1 I94 R102 Y108	M1-V100 HydrophobicContact CE-CG2 4.45Å; I94-V100 HydrophobicContact CB-CG1 4.49Å; I94-V100 HydrophobicContact CD1-CG1 3.93Å; I94-V100 HydrophobicContact CG2-CG1 3.31Å; V100-R102 HydrophobicContact CG2-CG 4.38Å; V100-Y108 WeakPolarHBondContact CA-O 3.3Å; V100-Y108 WeakPolarHBondContact CB-O 3.43Å
101	M	93.3	Very high	92.2	Very high	72 Å²	72	76.2 Å²	76.2	36%	0.355	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	143.1	164	-67.9	-62.7	-81.7	0	0	109.7	V107 Y108 L110 F113	M101-V107 WeakPolarHBondContact O-CA 3.38Å; M101-Y108 PolarHBondContact N-O 2.8Å; M101-Y108 PolarHBondContact O-N 3.2Å; M101-L110 HydrophobicContact CG-CD2 3.8Å; M101-L110 HydrophobicContact SD-CD2 4.21Å; M101-F113 HydrophobicContact CB-CB 3.87Å; M101-F113 HydrophobicContact CB-CD1 4.34Å; M101-F113 HydrophobicContact CB-CD2 3.54Å; M101-F113 HydrophobicContact CB-CE2 4.17Å; M101-F113 HydrophobicContact CB-CG 3.64Å; M101-F113 HydrophobicContact CE-CD1 3.54Å; M101-F113 HydrophobicContact CE-CE1 3.55Å; M101-F113 HydrophobicContact CE-CG 4.08Å; M101-F113 HydrophobicContact CE-CZ 4.1Å; M101-F113 HydrophobicContact CG-CB 3.67Å; M101-F113 HydrophobicContact CG-CD1 4.03Å; M101-F113 HydrophobicContact CG-CD2 4.11Å; M101-F113 HydrophobicContact CG-CG 3.66Å
102	R	92	Very high	92.2	Very high	149 Å²	149	73.2 Å²	73.2	56%	0.562	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.9	176.3	-63.1	-170.2	173.1	-95.8	-7.8	109.6	V100 N106 V107	V100-R102 HydrophobicContact CG2-CG 4.38Å; R102-N106 WeakPolarHBondContact CA-O 3.38Å; R102-V107 HydrophobicContact CG-CG1 4.2Å
103	A	90	Very high	92.2	Very high	8 Å²	8	66.9 Å²	66.9	7%	0.066	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	116	173.1	0	0	0	0	0	108.8	D105 N106 Y108 F113 F128	A103-D105 PolarHBondContact O-N 2.82Å; A103-N106 PolarHBondContact N-O 3.14Å; A103-N106 VanDerWaalsContact N-O 3.08Å; A103-N106 PolarHBondContact O-N 2.98Å; A103-Y108 HydrophobicContact CB-CE2 4.17Å; A103-F113 HydrophobicContact CB-CE2 4.19Å; A103-F128 HydrophobicContact CB-CE2 4.01Å; A103-F128 HydrophobicContact CB-CZ 4.3Å
104	R	88.3	Confident	92.2	Very high	203 Å²	203	62.5 Å²	62.5	77%	0.766	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	-125	-167	-55.7	-170.1	-176.1	162.3	-2.4	110.4	N106 L130	R104-N106 VanDerWaalsContact C-N 3.35Å; R104-L130 HydrophobicContact CB-CD2 4.29Å; R104-L130 HydrophobicContact CG-CD2 4Å
105	D	88.9	Confident	92.2	Very high	160 Å²	160	62.2 Å²	62.2	86%	0.856	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-4.1	-179.5	-55.7	-53.7	0	0	0	113.5	A103	A103-D105 PolarHBondContact O-N 2.82Å
106	N	91	Very high	92.2	Very high	29 Å²	29	63.8 Å²	63.8	16%	0.155	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	146.7	-176	-66.9	-33.7	0	0	0	112.4	A88 R102 A103 R104 Y108 N133	A88-N106 HydrophobicContact CB-CB 3.83Å; R102-N106 WeakPolarHBondContact CA-O 3.38Å; A103-N106 PolarHBondContact N-O 3.14Å; A103-N106 VanDerWaalsContact N-O 3.08Å; A103-N106 PolarHBondContact O-N 2.98Å; R104-N106 VanDerWaalsContact C-N 3.35Å; N106-Y108 HydrophobicContact CB-CD2 4.35Å; N106-Y108 HydrophobicContact CB-CE2 3.36Å; N106-Y108 WeakPolarHBondContact CB-OH 3.25Å; N106-Y108 PolarHBondContact ND2-OH 2.82Å; N106-N133 PolarHBondContact ND2-ND2 3.39Å
107	V	93.5	Very high	92.3	Very high	22 Å²	22	68 Å²	68	13%	0.133	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	143.2	173.6	-65	0	0	0	0	110	N86 C87 A88 I94 M101 R102	N86-V107 WeakPolarHBondContact O-CG2 3.36Å; C87-V107 CarbonylContact C-O 3.58Å; C87-V107 WeakPolarHBondContact CA-O 3.2Å; A88-V107 PolarHBondContact N-O 2.99Å; I94-V107 HydrophobicContact CD1-CB 4.07Å; I94-V107 HydrophobicContact CD1-CG2 3.77Å; M101-V107 WeakPolarHBondContact O-CA 3.38Å; R102-V107 HydrophobicContact CG-CG1 4.2Å
108	Y	93.8	Very high	92.6	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	145.2	-177.1	-55.7	-96	0	0	0	110	A88 A89 V100 M101 A103 N106 F113 N133 I135	A88-Y108 HydrophobicContact CB-CD1 4.18Å; A88-Y108 HydrophobicContact CB-CE1 3.57Å; A88-Y108 HydrophobicContact CB-CE2 4.46Å; A89-Y108 HydrophobicContact CB-CD1 3.76Å; A89-Y108 HydrophobicContact CB-CE1 4.03Å; V100-Y108 WeakPolarHBondContact CA-O 3.3Å; V100-Y108 WeakPolarHBondContact CB-O 3.43Å; M101-Y108 PolarHBondContact N-O 2.8Å; M101-Y108 PolarHBondContact O-N 3.2Å; A103-Y108 HydrophobicContact CB-CE2 4.17Å; N106-Y108 HydrophobicContact CB-CD2 4.35Å; N106-Y108 HydrophobicContact CB-CE2 3.36Å; N106-Y108 WeakPolarHBondContact CB-OH 3.25Å; N106-Y108 PolarHBondContact ND2-OH 2.82Å; Y108-F113 HydrophobicContact CD2-CD2 4.03Å; Y108-F113 HydrophobicContact CD2-CE2 4.36Å; Y108-F113 HydrophobicContact CG-CD2 4.12Å; Y108-N133 PolarHBondContact OH-O 3.38Å; Y108-I135 HydrophobicContact CD1-CD1 3.68Å; Y108-I135 HydrophobicContact CD2-CD1 4.06Å; Y108-I135 HydrophobicContact CE1-CD1 3.38Å; Y108-I135 HydrophobicContact CE1-CG1 4.1Å; Y108-I135 HydrophobicContact CE2-CD1 3.81Å; Y108-I135 HydrophobicContact CG-CD1 4.01Å; Y108-I135 VanDerWaalsContact CZ-CD1 3.46Å
109	H	95.4	Very high	92.8	Very high	24 Å²	24	69.3 Å²	69.3	11%	0.111	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	153.3	162.5	-55.3	118.1	0	0	0	109.5	C90 I94 E98 D111 C112 F113	C90-H109 PolarHBondContact SG-CE1 3.24Å; C90-H109 PolarHBondContact SG-ND1 3.4Å; C90-H109 VanDerWaalsContact SG-ND1 3.4Å; I94-H109 WeakPolarHBondContact CG1-NE2 3.36Å; E98-H109 IonicContact OE1-CD2 3.18Å; E98-H109 PolarHBondContact OE1-CD2 3.31Å; E98-H109 IonicContact OE1-CG 3.98Å; E98-H109 IonicContact OE2-CD2 3.98Å; H109-D111 VanDerWaalsContact C-N 3.26Å; H109-D111 PolarHBondContact O-N 2.85Å; H109-C112 HydrophobicContact CB-CB 3.99Å; H109-C112 PolarHBondContact ND1-SG 3.13Å; H109-C112 VanDerWaalsContact ND1-SG 3.41Å; H109-C112 PolarHBondContact O-N 3.27Å; H109-F113 PolarHBondContact O-N 3.19Å; H109-F113 VanDerWaalsContact O-N 3.15Å
110	L	93.3	Very high	92.9	Very high	91 Å²	91	66.7 Å²	66.7	48%	0.476	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-56.2	-43.6	175.8	-60.4	-174.9	0	0	0	111.5	M99 M101 C112 F113	M99-L110 HydrophobicContact CB-CD1 4.09Å; M99-L110 HydrophobicContact CB-CG 4.48Å; M101-L110 HydrophobicContact CG-CD2 3.8Å; M101-L110 HydrophobicContact SD-CD2 4.21Å; L110-C112 VanDerWaalsContact C-N 3.28Å; L110-C112 PolarHBondContact O-N 3.4Å; L110-F113 PolarHBondContact O-N 3.16Å
111	D	92.8	Very high	92.9	Very high	107 Å²	107	72.9 Å²	72.9	57%	0.572	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-72.2	-19.7	178.2	-71.8	-52.7	0	0	0	114	H109 R121	H109-D111 VanDerWaalsContact C-N 3.26Å; H109-D111 PolarHBondContact O-N 2.85Å; D111-R121 IonicContact OD1-CZ 3.09Å; D111-R121 IonicContact OD1-NH1 3.34Å; D111-R121 PolarHBondContact OD1-NH1 3.34Å; D111-R121 VanDerWaalsContact OD1-NH1 3.08Å; D111-R121 IonicContact OD1-NH2 3.66Å; D111-R121 PolarHBondContact OD1-NH2 3.34Å
112	C	94.2	Very high	92.9	Very high	32 Å²	32	71.1 Å²	71.1	22%	0.216	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-89.5	-8.9	177.4	-66.3	0	0	0	0	112.8	C87 A89 C90 H109 L110 A114	C87-C112 VanDerWaalsContact SG-CB 3.58Å; A89-C112 HydrophobicContact CB-CB 4.06Å; C90-C112 VanDerWaalsContact SG-SG 3.65Å; H109-C112 HydrophobicContact CB-CB 3.99Å; H109-C112 PolarHBondContact ND1-SG 3.13Å; H109-C112 VanDerWaalsContact ND1-SG 3.41Å; H109-C112 PolarHBondContact O-N 3.27Å; L110-C112 VanDerWaalsContact C-N 3.28Å; L110-C112 PolarHBondContact O-N 3.4Å; C112-A114 VanDerWaalsContact C-N 3.28Å; C112-A114 PolarHBondContact O-N 3.33Å
113	F	95.1	Very high	92.9	Very high	15 Å²	15	68.5 Å²	68.5	7%	0.066	35%	0.346	C	S	.	.			trans	-84.2	75.3	178	-163.1	-98.5	0	0	0	110.2	M101 A103 Y108 H109 L110 F122 F128 I135	M101-F113 HydrophobicContact CB-CB 3.87Å; M101-F113 HydrophobicContact CB-CD1 4.34Å; M101-F113 HydrophobicContact CB-CD2 3.54Å; M101-F113 HydrophobicContact CB-CE2 4.17Å; M101-F113 HydrophobicContact CB-CG 3.64Å; M101-F113 HydrophobicContact CE-CD1 3.54Å; M101-F113 HydrophobicContact CE-CE1 3.55Å; M101-F113 HydrophobicContact CE-CG 4.08Å; M101-F113 HydrophobicContact CE-CZ 4.1Å; M101-F113 HydrophobicContact CG-CB 3.67Å; M101-F113 HydrophobicContact CG-CD1 4.03Å; M101-F113 HydrophobicContact CG-CD2 4.11Å; M101-F113 HydrophobicContact CG-CG 3.66Å; A103-F113 HydrophobicContact CB-CE2 4.19Å; Y108-F113 HydrophobicContact CD2-CD2 4.03Å; Y108-F113 HydrophobicContact CD2-CE2 4.36Å; Y108-F113 HydrophobicContact CG-CD2 4.12Å; H109-F113 PolarHBondContact O-N 3.19Å; H109-F113 VanDerWaalsContact O-N 3.15Å; L110-F113 PolarHBondContact O-N 3.16Å; F113-F122 AromaticContact CD1-CD2 3.8Å; F113-F122 HydrophobicContact CD1-CD2 3.8Å; F113-F122 AromaticContact CE1-CD2 3.78Å; F113-F122 HydrophobicContact CE1-CD2 3.78Å; F113-F122 HydrophobicContact CE1-CE2 4.48Å; F113-F122 HydrophobicContact CE1-CG 4.42Å; F113-F128 HydrophobicContact CE1-CD1 4.37Å; F113-F128 HydrophobicContact CE1-CE1 4.43Å; F113-F128 HydrophobicContact CE2-CE2 4.49Å; F113-F128 HydrophobicContact CZ-CD1 4.11Å; F113-F128 HydrophobicContact CZ-CD2 4.09Å; F113-F128 AromaticContact CZ-CE1 3.93Å; F113-F128 HydrophobicContact CZ-CE1 3.93Å; F113-F128 AromaticContact CZ-CE2 3.91Å; F113-F128 HydrophobicContact CZ-CE2 3.91Å; F113-F128 HydrophobicContact CZ-CG 4.19Å; F113-F128 AromaticContact CZ-CZ 3.83Å; F113-F128 HydrophobicContact CZ-CZ 3.83Å; F113-I135 HydrophobicContact CD2-CD1 3.46Å; F113-I135 VanDerWaalsContact CD2-CD1 3.46Å; F113-I135 HydrophobicContact CE2-CD1 3.53Å; F113-I135 HydrophobicContact CE2-CG1 4.42Å; F113-I135 HydrophobicContact CG-CD1 4.38Å; F113-I135 HydrophobicContact CZ-CD1 4.49Å
114	A	95.5	Very high	92.9	Very high	12 Å²	12	75.6 Å²	75.6	10%	0.099	39%	0.388	C	S	.	.	B	Isolated β-bridge	trans	-141.8	162.5	-179	0	0	0	0	0	109.8	C112 Q116 Q120 R121 F122	C112-A114 VanDerWaalsContact C-N 3.28Å; C112-A114 PolarHBondContact O-N 3.33Å; A114-Q116 PolarHBondContact O-N 2.87Å; A114-Q120 CarbonylContact C-O 3.56Å; A114-Q120 WeakPolarHBondContact CA-O 3.13Å; A114-Q120 WeakPolarHBondContact CB-O 3.45Å; A114-R121 HydrophobicContact CB-CG 4.45Å; A114-F122 VanDerWaalsContact C-CE2 3.48Å
115	C	94.9	Very high	93	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	39%	0.388	C	S	.	.			trans	-60	127.6	173	-176.8	0	0	0	0	110	L117 C118 N119 Q120 F122 I135 C137 D140	C115-L117 PolarHBondContact O-N 2.96Å; C115-C118 VanDerWaalsContact CB-SG 3.51Å; C115-C118 VanDerWaalsContact SG-SG 3.67Å; C115-N119 WeakPolarHBondContact O-CA 3.42Å; C115-N119 PolarHBondContact O-N 3.11Å; C115-Q120 HydrophobicContact CB-CB 4.48Å; C115-Q120 PolarHBondContact N-O 3.26Å; C115-F122 HydrophobicContact CB-CZ 4.14Å; C115-I135 CarbonylContact C-O 3.59Å; C115-I135 WeakPolarHBondContact CA-O 3.46Å; C115-C137 HydrophobicContact CB-CB 4.05Å; C115-C137 PolarHBondContact SG-N 3.31Å; C115-D140 PolarHBondContact SG-OD2 2.93Å
116	Q	92.3	Very high	93.2	Very high	70 Å²	70	65.2 Å²	65.2	33%	0.327	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-5.2	-177.3	-68.4	-173.9	-99.6	0	0	114.2	A114 I135	A114-Q116 PolarHBondContact O-N 2.87Å; Q116-I135 PolarHBondContact N-O 3.37Å; Q116-I135 VanDerWaalsContact OE1-N 3.15Å
117	L	92.1	Very high	93.2	Very high	94 Å²	94	70.5 Å²	70.5	49%	0.492	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-57.4	174	-64.6	-176.9	0	0	0	111.4	C115 L136 D140 F150	C115-L117 PolarHBondContact O-N 2.96Å; L117-L136 HydrophobicContact CB-CD2 4.45Å; L117-L136 HydrophobicContact CD1-CD2 3.71Å; L117-L136 HydrophobicContact CG-CD2 3.66Å; L117-D140 HydrophobicContact CB-CB 4.42Å; L117-D140 HydrophobicContact CD1-CB 4.11Å; L117-F150 HydrophobicContact CD1-CZ 4.44Å
118	C	93.8	Very high	93.3	Very high	59 Å²	59	73.3 Å²	73.3	40%	0.399	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-3.7	-178.2	67	0	0	0	0	115.3	C115 Q120 D140	C115-C118 VanDerWaalsContact CB-SG 3.51Å; C115-C118 VanDerWaalsContact SG-SG 3.67Å; C118-Q120 PolarHBondContact O-N 3.3Å; C118-Q120 VanDerWaalsContact O-N 3.14Å; C118-Q120 WeakPolarHBondContact SG-CB 2.98Å; C118-D140 WeakPolarHBondContact CB-OD2 3.15Å; C118-D140 PolarHBondContact N-OD2 3.48Å; C118-D140 PolarHBondContact SG-OD2 3.28Å
119	N	93.9	Very high	93.2	Very high	127 Å²	127	76.2 Å²	76.2	68%	0.679	41%	0.41	S	S	*	.			trans	59.6	15.4	-174.3	-62	-52.1	0	0	0	115	C115 R121	C115-N119 WeakPolarHBondContact O-CA 3.42Å; C115-N119 PolarHBondContact O-N 3.11Å; N119-R121 PolarHBondContact O-N 3.01Å
120	Q	93.6	Very high	93.1	Very high	94 Å²	94	76.2 Å²	76.2	44%	0.439	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-65.2	127	175.9	-177.9	177	-11.8	0	0	110.7	A114 C115 C118	A114-Q120 CarbonylContact C-O 3.56Å; A114-Q120 WeakPolarHBondContact CA-O 3.13Å; A114-Q120 WeakPolarHBondContact CB-O 3.45Å; C115-Q120 HydrophobicContact CB-CB 4.48Å; C115-Q120 PolarHBondContact N-O 3.26Å; C118-Q120 PolarHBondContact O-N 3.3Å; C118-Q120 VanDerWaalsContact O-N 3.14Å; C118-Q120 WeakPolarHBondContact SG-CB 2.98Å
121	R	93.6	Very high	92.8	Very high	163 Å²	163	73 Å²	73	62%	0.615	39%	0.393	S	S	*	.	B	Isolated β-bridge	trans	-77	142.4	172.2	-66.1	-179.5	174	-138.4	-10.1	110.2	D111 A114 N119	D111-R121 IonicContact OD1-CZ 3.09Å; D111-R121 IonicContact OD1-NH1 3.34Å; D111-R121 PolarHBondContact OD1-NH1 3.34Å; D111-R121 VanDerWaalsContact OD1-NH1 3.08Å; D111-R121 IonicContact OD1-NH2 3.66Å; D111-R121 PolarHBondContact OD1-NH2 3.34Å; A114-R121 HydrophobicContact CB-CG 4.45Å; N119-R121 PolarHBondContact O-N 3.01Å
122	F	93.1	Very high	92.3	Very high	35 Å²	35	73.1 Å²	73.1	15%	0.154	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-88.7	136.6	177.8	-58.1	-71.6	0	0	0	111.5	F113 A114 C115 D126 F128 I135 C137	F113-F122 AromaticContact CD1-CD2 3.8Å; F113-F122 HydrophobicContact CD1-CD2 3.8Å; F113-F122 AromaticContact CE1-CD2 3.78Å; F113-F122 HydrophobicContact CE1-CD2 3.78Å; F113-F122 HydrophobicContact CE1-CE2 4.48Å; F113-F122 HydrophobicContact CE1-CG 4.42Å; A114-F122 VanDerWaalsContact C-CE2 3.48Å; C115-F122 HydrophobicContact CB-CZ 4.14Å; F122-D126 HydrophobicContact CB-CB 4.29Å; F122-D126 HydrophobicContact CD1-CB 4.13Å; F122-F128 HydrophobicContact CD1-CB 4.17Å; F122-F128 HydrophobicContact CE1-CB 3.75Å; F122-F128 HydrophobicContact CE2-CB 4.2Å; F122-F128 HydrophobicContact CZ-CB 3.76Å; F122-I135 HydrophobicContact CE2-CG2 3.44Å; F122-I135 VanDerWaalsContact CE2-CG2 3.44Å; F122-I135 HydrophobicContact CZ-CG2 3.79Å; F122-C137 HydrophobicContact CE1-CB 3.83Å; F122-C137 HydrophobicContact CZ-CB 4.28Å
123	C	91.4	Very high	91.7	Very high	94 Å²	94	76.1 Å²	76.1	64%	0.635	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-91.7	163.8	167.3	-72.5	0	0	0	0	110.9	G125 D126	C123-G125 PolarHBondContact O-N 2.08Å; C123-D126 PolarHBondContact N-OD2 2.95Å; C123-D126 WeakPolarHBondContact O-CB 3.47Å; C123-D126 PolarHBondContact O-N 2.8Å; C123-D126 VanDerWaalsContact O-N 3.08Å
124	V	90.4	Very high	91.4	Very high	157 Å²	157	78.1 Å²	78.1	95%	0.952	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	123.4	173.8	179.3	0	0	0	0	109.1
125	G	90.7	Very high	91.2	Very high	75 Å²	75	77.6 Å²	77.6	77%	0.773	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.2	-12.7	-177.6	0	0	0	0	0	114.4	C123	C123-G125 PolarHBondContact O-N 2.08Å
126	D	92	Very high	91.2	Very high	69 Å²	69	77.6 Å²	77.6	37%	0.369	41%	0.413	S	S	.	.			trans	-68.3	142	176.9	-70.4	-9.2	0	0	0	111.5	F122 C123	F122-D126 HydrophobicContact CB-CB 4.29Å; F122-D126 HydrophobicContact CD1-CB 4.13Å; C123-D126 PolarHBondContact N-OD2 2.95Å; C123-D126 WeakPolarHBondContact O-CB 3.47Å; C123-D126 PolarHBondContact O-N 2.8Å; C123-D126 VanDerWaalsContact O-N 3.08Å
127	K	92.3	Very high	91.3	Very high	141 Å²	141	74.5 Å²	74.5	61%	0.613	40%	0.399	S	S	*	.			trans	-82.3	134.9	170.7	-65.2	-179.8	-174.6	172.8	0	109.7
128	F	94.3	Very high	91.4	Very high	81 Å²	81	73.6 Å²	73.6	36%	0.355	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	157.1	171	70.9	-87.6	0	0	0	109.7	A103 F113 F122 I135 L136	A103-F128 HydrophobicContact CB-CE2 4.01Å; A103-F128 HydrophobicContact CB-CZ 4.3Å; F113-F128 HydrophobicContact CE1-CD1 4.37Å; F113-F128 HydrophobicContact CE1-CE1 4.43Å; F113-F128 HydrophobicContact CE2-CE2 4.49Å; F113-F128 HydrophobicContact CZ-CD1 4.11Å; F113-F128 HydrophobicContact CZ-CD2 4.09Å; F113-F128 AromaticContact CZ-CE1 3.93Å; F113-F128 HydrophobicContact CZ-CE1 3.93Å; F113-F128 AromaticContact CZ-CE2 3.91Å; F113-F128 HydrophobicContact CZ-CE2 3.91Å; F113-F128 HydrophobicContact CZ-CG 4.19Å; F113-F128 AromaticContact CZ-CZ 3.83Å; F113-F128 HydrophobicContact CZ-CZ 3.83Å; F122-F128 HydrophobicContact CD1-CB 4.17Å; F122-F128 HydrophobicContact CE1-CB 3.75Å; F122-F128 HydrophobicContact CE2-CB 4.2Å; F122-F128 HydrophobicContact CZ-CB 3.76Å; F128-I135 HydrophobicContact CB-CG2 4.29Å; F128-I135 HydrophobicContact CD2-CG2 4.15Å; F128-L136 WeakPolarHBondContact CA-O 3.49Å
129	F	93.3	Very high	91.4	Very high	60 Å²	60	77.3 Å²	77.3	26%	0.263	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	145.8	179.7	-63.5	-92	0	0	0	109.8	I135 L136 Q138 Y141	F129-I135 WeakPolarHBondContact O-CA 3.43Å; F129-L136 PolarHBondContact N-O 3.3Å; F129-L136 PolarHBondContact O-N 3.04Å; F129-Q138 HydrophobicContact CE2-CB 3.93Å; F129-Q138 HydrophobicContact CE2-CG 4.01Å; F129-Y141 HydrophobicContact CB-CD1 4.26Å; F129-Y141 HydrophobicContact CB-CD2 3.46Å; F129-Y141 VanDerWaalsContact CB-CD2 3.46Å; F129-Y141 HydrophobicContact CB-CE2 3.9Å; F129-Y141 HydrophobicContact CB-CG 3.65Å; F129-Y141 AromaticContact CD1-CD1 3.72Å; F129-Y141 HydrophobicContact CD1-CD1 3.72Å; F129-Y141 HydrophobicContact CD1-CD2 4.28Å; F129-Y141 AromaticContact CD1-CE1 3.69Å; F129-Y141 HydrophobicContact CD1-CE1 3.69Å; F129-Y141 HydrophobicContact CD1-CE2 4.23Å; F129-Y141 HydrophobicContact CD1-CG 4.02Å; F129-Y141 AromaticContact CD1-CZ 3.94Å; F129-Y141 AromaticContact CD2-CD1 3.88Å; F129-Y141 HydrophobicContact CD2-CD1 3.88Å; F129-Y141 HydrophobicContact CD2-CD2 4.46Å; F129-Y141 AromaticContact CD2-CG 3.76Å; F129-Y141 HydrophobicContact CD2-CG 3.76Å; F129-Y141 AromaticContact CE1-CD1 3.98Å; F129-Y141 HydrophobicContact CE1-CD1 3.98Å; F129-Y141 AromaticContact CE1-CE1 3.92Å; F129-Y141 HydrophobicContact CE1-CE1 3.92Å; F129-Y141 HydrophobicContact CE2-CD1 4.14Å; F129-Y141 HydrophobicContact CE2-CG 4.45Å; F129-Y141 AromaticContact CG-CD1 3.67Å; F129-Y141 HydrophobicContact CG-CD1 3.67Å; F129-Y141 AromaticContact CG-CD2 3.83Å; F129-Y141 HydrophobicContact CG-CD2 3.83Å; F129-Y141 HydrophobicContact CG-CE1 4.08Å; F129-Y141 HydrophobicContact CG-CE2 4.22Å; F129-Y141 AromaticContact CG-CG 3.52Å; F129-Y141 HydrophobicContact CG-CG 3.52Å; F129-Y141 HydrophobicContact CZ-CD1 4.18Å
130	L	91.8	Very high	91.3	Very high	25 Å²	25	72.6 Å²	72.6	13%	0.131	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	111.7	177	-168.5	75.4	0	0	0	109.2	R104 M134 I135	R104-L130 HydrophobicContact CB-CD2 4.29Å; R104-L130 HydrophobicContact CG-CD2 4Å; L130-M134 WeakPolarHBondContact CA-O 3.4Å; L130-I135 HydrophobicContact CD1-CG1 3.73Å
131	K	87.3	Confident	91.3	Very high	24 Å²	24	71.1 Å²	71.1	10%	0.104	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	124.7	179.1	-167.1	170.6	-166.4	174.8	0	109.9	N133 M134 Y141 F150	K131-N133 VanDerWaalsContact C-N 3.26Å; K131-N133 PolarHBondContact O-N 2.78Å; K131-M134 PolarHBondContact N-O 2.89Å; K131-M134 WeakPolarHBondContact O-CA 3.5Å; K131-M134 WeakPolarHBondContact O-CB 3.45Å; K131-M134 PolarHBondContact O-N 2.89Å; K131-Y141 HydrophobicContact CB-CE2 4.49Å; K131-Y141 HydrophobicContact CD-CE2 4.19Å; K131-F150 HydrophobicContact CD-CB 3.82Å; K131-F150 HydrophobicContact CD-CD1 3.92Å; K131-F150 HydrophobicContact CD-CG 4.01Å; K131-F150 VanDerWaalsContact CE-CB 3.42Å; K131-F150 PolarHBondContact NZ-O 3.42Å
132	N	83.8	Confident	91.2	Very high	109 Å²	109	67.9 Å²	67.9	58%	0.583	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	45	-176.6	-58.7	-14.2	0	0	0	112.9	M134	N132-M134 PolarHBondContact O-N 3.02Å
133	N	81.2	Confident	91	Very high	94 Å²	94	71.5 Å²	71.5	50%	0.503	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	4.8	-173	-71	20.8	0	0	0	116.2	N106 Y108 K131	N106-N133 PolarHBondContact ND2-ND2 3.39Å; Y108-N133 PolarHBondContact OH-O 3.38Å; K131-N133 VanDerWaalsContact C-N 3.26Å; K131-N133 PolarHBondContact O-N 2.78Å
134	M	87.8	Confident	90.6	Very high	58 Å²	58	67.3 Å²	67.3	29%	0.286	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	130.7	173.8	-59.4	-156.9	-57.6	0	0	112.2	L130 K131 N132 F150	L130-M134 WeakPolarHBondContact CA-O 3.4Å; K131-M134 PolarHBondContact N-O 2.89Å; K131-M134 WeakPolarHBondContact O-CA 3.5Å; K131-M134 WeakPolarHBondContact O-CB 3.45Å; K131-M134 PolarHBondContact O-N 2.89Å; N132-M134 PolarHBondContact O-N 3.02Å; M134-F150 HydrophobicContact CE-CE1 3.66Å; M134-F150 HydrophobicContact CE-CZ 4.1Å
135	I	92.8	Very high	89.9	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	125.8	172.4	-58.7	164.5	0	0	0	108.6	Y108 F113 C115 Q116 F122 F128 F129 L130	Y108-I135 HydrophobicContact CD1-CD1 3.68Å; Y108-I135 HydrophobicContact CD2-CD1 4.06Å; Y108-I135 HydrophobicContact CE1-CD1 3.38Å; Y108-I135 HydrophobicContact CE1-CG1 4.1Å; Y108-I135 HydrophobicContact CE2-CD1 3.81Å; Y108-I135 HydrophobicContact CG-CD1 4.01Å; Y108-I135 VanDerWaalsContact CZ-CD1 3.46Å; F113-I135 HydrophobicContact CD2-CD1 3.46Å; F113-I135 VanDerWaalsContact CD2-CD1 3.46Å; F113-I135 HydrophobicContact CE2-CD1 3.53Å; F113-I135 HydrophobicContact CE2-CG1 4.42Å; F113-I135 HydrophobicContact CG-CD1 4.38Å; F113-I135 HydrophobicContact CZ-CD1 4.49Å; C115-I135 CarbonylContact C-O 3.59Å; C115-I135 WeakPolarHBondContact CA-O 3.46Å; Q116-I135 PolarHBondContact N-O 3.37Å; Q116-I135 VanDerWaalsContact OE1-N 3.15Å; F122-I135 HydrophobicContact CE2-CG2 3.44Å; F122-I135 VanDerWaalsContact CE2-CG2 3.44Å; F122-I135 HydrophobicContact CZ-CG2 3.79Å; F128-I135 HydrophobicContact CB-CG2 4.29Å; F128-I135 HydrophobicContact CD2-CG2 4.15Å; F129-I135 WeakPolarHBondContact O-CA 3.43Å; L130-I135 HydrophobicContact CD1-CG1 3.73Å
136	L	94	Very high	89	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143.3	-177.9	-60	176.2	0	0	0	110.6	L117 F128 F129 Y141 F150	L117-L136 HydrophobicContact CB-CD2 4.45Å; L117-L136 HydrophobicContact CD1-CD2 3.71Å; L117-L136 HydrophobicContact CG-CD2 3.66Å; F128-L136 WeakPolarHBondContact CA-O 3.49Å; F129-L136 PolarHBondContact N-O 3.3Å; F129-L136 PolarHBondContact O-N 3.04Å; L136-Y141 HydrophobicContact CD1-CD2 4.17Å; L136-F150 HydrophobicContact CD1-CZ 4.14Å
137	C	95.1	Very high	87.9	Confident	6 Å²	6	69 Å²	69	4%	0.041	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	166.3	167.3	73.3	0	0	0	0	110.3	C115 F122 M139 D140 Y141	C115-C137 HydrophobicContact CB-CB 4.05Å; C115-C137 PolarHBondContact SG-N 3.31Å; F122-C137 HydrophobicContact CE1-CB 3.83Å; F122-C137 HydrophobicContact CZ-CB 4.28Å; C137-M139 VanDerWaalsContact C-N 3.3Å; C137-M139 PolarHBondContact O-N 3.17Å; C137-D140 VanDerWaalsContact SG-CG 3.56Å; C137-D140 PolarHBondContact SG-N 2.97Å; C137-D140 PolarHBondContact SG-OD2 3.18Å; C137-D140 VanDerWaalsContact SG-OD2 3.36Å; C137-Y141 VanDerWaalsContact O-CB 3.26Å; C137-Y141 WeakPolarHBondContact O-CB 3.48Å; C137-Y141 PolarHBondContact O-N 3.32Å
138	Q	93.5	Very high	86.3	Confident	74 Å²	74	65 Å²	65	35%	0.346	34%	0.335	S	S	.	.	H	α-helix	trans	-57.5	-43.8	-179	-178	175.1	-16.7	0	0	112.6	F129 Y141 E142	F129-Q138 HydrophobicContact CE2-CB 3.93Å; F129-Q138 HydrophobicContact CE2-CG 4.01Å; Q138-Y141 PolarHBondContact O-N 2.84Å; Q138-E142 HydrophobicContact CG-CG 4.4Å; Q138-E142 WeakPolarHBondContact CG-OE1 3.35Å; Q138-E142 PolarHBondContact NE2-OE1 2.97Å; Q138-E142 WeakPolarHBondContact O-CB 3.48Å; Q138-E142 VanDerWaalsContact O-CG 3.31Å; Q138-E142 WeakPolarHBondContact O-CG 3.48Å; Q138-E142 PolarHBondContact O-N 2.99Å
139	M	93.3	Very high	84.5	Confident	137 Å²	137	65 Å²	65	68%	0.675	35%	0.345	S	S	*	.	H	α-helix	trans	-62	-54.3	-178.6	-64.8	179	62	0	0	111.7	C137 Y141 E142 E143	C137-M139 VanDerWaalsContact C-N 3.3Å; C137-M139 PolarHBondContact O-N 3.17Å; M139-Y141 VanDerWaalsContact C-N 3.26Å; M139-Y141 PolarHBondContact O-N 2.88Å; M139-E142 PolarHBondContact O-N 2.88Å; M139-E143 WeakPolarHBondContact O-CB 3.03Å; M139-E143 PolarHBondContact O-N 2.83Å
140	D	93.2	Very high	82.8	Confident	29 Å²	29	63.8 Å²	63.8	16%	0.155	34%	0.34	C	S	.	.	H	α-helix	trans	-64.5	-32.3	-178.8	-72.2	-23.8	0	0	0	112.4	C115 L117 C118 C137 G144	C115-D140 PolarHBondContact SG-OD2 2.93Å; L117-D140 HydrophobicContact CB-CB 4.42Å; L117-D140 HydrophobicContact CD1-CB 4.11Å; C118-D140 WeakPolarHBondContact CB-OD2 3.15Å; C118-D140 PolarHBondContact N-OD2 3.48Å; C118-D140 PolarHBondContact SG-OD2 3.28Å; C137-D140 VanDerWaalsContact SG-CG 3.56Å; C137-D140 PolarHBondContact SG-N 2.97Å; C137-D140 PolarHBondContact SG-OD2 3.18Å; C137-D140 VanDerWaalsContact SG-OD2 3.36Å; D140-G144 PolarHBondContact O-N 3.43Å
141	Y	92	Very high	80.6	Confident	62 Å²	62	71 Å²	71	24%	0.243	37%	0.373	C	S	.	.	H	α-helix	trans	-67.3	-48.2	175	-179.5	-98.9	0	0	0	111.7	F129 K131 L136 C137 Q138 M139 G144 Q145	F129-Y141 HydrophobicContact CB-CD1 4.26Å; F129-Y141 HydrophobicContact CB-CD2 3.46Å; F129-Y141 VanDerWaalsContact CB-CD2 3.46Å; F129-Y141 HydrophobicContact CB-CE2 3.9Å; F129-Y141 HydrophobicContact CB-CG 3.65Å; F129-Y141 AromaticContact CD1-CD1 3.72Å; F129-Y141 HydrophobicContact CD1-CD1 3.72Å; F129-Y141 HydrophobicContact CD1-CD2 4.28Å; F129-Y141 AromaticContact CD1-CE1 3.69Å; F129-Y141 HydrophobicContact CD1-CE1 3.69Å; F129-Y141 HydrophobicContact CD1-CE2 4.23Å; F129-Y141 HydrophobicContact CD1-CG 4.02Å; F129-Y141 AromaticContact CD1-CZ 3.94Å; F129-Y141 AromaticContact CD2-CD1 3.88Å; F129-Y141 HydrophobicContact CD2-CD1 3.88Å; F129-Y141 HydrophobicContact CD2-CD2 4.46Å; F129-Y141 AromaticContact CD2-CG 3.76Å; F129-Y141 HydrophobicContact CD2-CG 3.76Å; F129-Y141 AromaticContact CE1-CD1 3.98Å; F129-Y141 HydrophobicContact CE1-CD1 3.98Å; F129-Y141 AromaticContact CE1-CE1 3.92Å; F129-Y141 HydrophobicContact CE1-CE1 3.92Å; F129-Y141 HydrophobicContact CE2-CD1 4.14Å; F129-Y141 HydrophobicContact CE2-CG 4.45Å; F129-Y141 AromaticContact CG-CD1 3.67Å; F129-Y141 HydrophobicContact CG-CD1 3.67Å; F129-Y141 AromaticContact CG-CD2 3.83Å; F129-Y141 HydrophobicContact CG-CD2 3.83Å; F129-Y141 HydrophobicContact CG-CE1 4.08Å; F129-Y141 HydrophobicContact CG-CE2 4.22Å; F129-Y141 AromaticContact CG-CG 3.52Å; F129-Y141 HydrophobicContact CG-CG 3.52Å; F129-Y141 HydrophobicContact CZ-CD1 4.18Å; K131-Y141 HydrophobicContact CB-CE2 4.49Å; K131-Y141 HydrophobicContact CD-CE2 4.19Å; L136-Y141 HydrophobicContact CD1-CD2 4.17Å; C137-Y141 VanDerWaalsContact O-CB 3.26Å; C137-Y141 WeakPolarHBondContact O-CB 3.48Å; C137-Y141 PolarHBondContact O-N 3.32Å; Q138-Y141 PolarHBondContact O-N 2.84Å; M139-Y141 VanDerWaalsContact C-N 3.26Å; M139-Y141 PolarHBondContact O-N 2.88Å; Y141-G144 PolarHBondContact O-N 3.41Å; Y141-Q145 HydrophobicContact CE1-CG 4.22Å; Y141-Q145 VanDerWaalsContact CZ-NE2 3.33Å; Y141-Q145 VanDerWaalsContact O-CG 3.25Å; Y141-Q145 WeakPolarHBondContact O-CG 3.33Å; Y141-Q145 PolarHBondContact O-N 3.25Å; Y141-Q145 PolarHBondContact OH-NE2 3.44Å; Y141-Q145 VanDerWaalsContact OH-NE2 3.16Å
142	E	91.8	Very high	78.4	Confident	95 Å²	95	74.8 Å²	74.8	44%	0.444	40%	0.398	S	S	.	.	H	α-helix	trans	-65.5	-41.4	179.8	-71.9	171.2	-176.7	0	0	111.6	Q138 M139 Q145 L146	Q138-E142 HydrophobicContact CG-CG 4.4Å; Q138-E142 WeakPolarHBondContact CG-OE1 3.35Å; Q138-E142 PolarHBondContact NE2-OE1 2.97Å; Q138-E142 WeakPolarHBondContact O-CB 3.48Å; Q138-E142 VanDerWaalsContact O-CG 3.31Å; Q138-E142 WeakPolarHBondContact O-CG 3.48Å; Q138-E142 PolarHBondContact O-N 2.99Å; M139-E142 PolarHBondContact O-N 2.88Å; E142-Q145 PolarHBondContact O-N 3.28Å; E142-L146 PolarHBondContact O-N 3.38Å
143	E	88.9	Confident	76.1	Confident	112 Å²	112	77.9 Å²	77.9	52%	0.523	41%	0.409	S	S	.	.	H	α-helix	trans	-63.5	-42.1	176.5	-171.8	176.4	164.7	0	0	112	M139 Q145 L146 N147	M139-E143 WeakPolarHBondContact O-CB 3.03Å; M139-E143 PolarHBondContact O-N 2.83Å; E143-Q145 VanDerWaalsContact C-N 3.27Å; E143-Q145 PolarHBondContact O-N 3.01Å; E143-L146 PolarHBondContact O-N 3.4Å; E143-N147 PolarHBondContact O-N 3.19Å; E143-N147 VanDerWaalsContact O-N 3.08Å; E143-N147 PolarHBondContact O-ND2 2.79Å
144	G	82.7	Confident	73.9	Confident	6 Å²	6	78.5 Å²	78.5	6%	0.062	42%	0.416	C	S	.	.	H	α-helix	trans	-63.1	-29.6	175.9	0	0	0	0	0	114.2	D140 Y141	D140-G144 PolarHBondContact O-N 3.43Å; Y141-G144 PolarHBondContact O-N 3.41Å
145	Q	76.8	Confident	71.4	Confident	76 Å²	76	88 Å²	88	36%	0.355	46%	0.46	S	S	.	.	H	α-helix	trans	-73.5	-37.3	176.1	-64.9	-77	-17.4	0	0	111.6	Y141 E142 E143	Y141-Q145 HydrophobicContact CE1-CG 4.22Å; Y141-Q145 VanDerWaalsContact CZ-NE2 3.33Å; Y141-Q145 VanDerWaalsContact O-CG 3.25Å; Y141-Q145 WeakPolarHBondContact O-CG 3.33Å; Y141-Q145 PolarHBondContact O-N 3.25Å; Y141-Q145 PolarHBondContact OH-NE2 3.44Å; Y141-Q145 VanDerWaalsContact OH-NE2 3.16Å; E142-Q145 PolarHBondContact O-N 3.28Å; E143-Q145 VanDerWaalsContact C-N 3.27Å; E143-Q145 PolarHBondContact O-N 3.01Å
146	L	71.9	Confident	70.3	Confident	151 Å²	151	92.4 Å²	92.4	79%	0.791	48%	0.483	S	S	*	.	H	α-helix	trans	-70	-35.5	177.9	-70.6	165.2	0	0	0	112.2	E142 E143 G148	E142-L146 PolarHBondContact O-N 3.38Å; E143-L146 PolarHBondContact O-N 3.4Å; L146-G148 VanDerWaalsContact C-N 3.32Å; L146-G148 PolarHBondContact O-N 2.76Å
147	N	67.6	Low	69	Low	108 Å²	108	97.3 Å²	97.3	58%	0.578	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	1.1	-176.5	-68.1	-20.8	0	0	0	114.3	E143 S149	E143-N147 PolarHBondContact O-N 3.19Å; E143-N147 VanDerWaalsContact O-N 3.08Å; E143-N147 PolarHBondContact O-ND2 2.79Å; N147-S149 PolarHBondContact O-N 2.83Å
148	G	59.3	Low	67.6	Low	58 Å²	58	102.3 Å²	102.3	60%	0.598	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	7.3	176.2	0	0	0	0	0	115.5	L146 F150	L146-G148 VanDerWaalsContact C-N 3.32Å; L146-G148 PolarHBondContact O-N 2.76Å; G148-F150 PolarHBondContact O-N 2.63Å
149	S	57.2	Low	66.1	Low	82 Å²	82	104 Å²	104	57%	0.573	55%	0.545	S	S	*	.			trans	-78.7	-2	-177	43.4	0	0	0	0	114	N147	N147-S149 PolarHBondContact O-N 2.83Å
150	F	56.7	Low	64.4	Low	33 Å²	33	101.9 Å²	101.9	15%	0.145	54%	0.537	C	S	.	.	S	Bend	trans	-129.9	88.4	175.6	-63.1	-85.1	0	0	0	111.2	L117 K131 M134 L136 G148 T152	L117-F150 HydrophobicContact CD1-CZ 4.44Å; K131-F150 HydrophobicContact CD-CB 3.82Å; K131-F150 HydrophobicContact CD-CD1 3.92Å; K131-F150 HydrophobicContact CD-CG 4.01Å; K131-F150 VanDerWaalsContact CE-CB 3.42Å; K131-F150 PolarHBondContact NZ-O 3.42Å; M134-F150 HydrophobicContact CE-CE1 3.66Å; M134-F150 HydrophobicContact CE-CZ 4.1Å; L136-F150 HydrophobicContact CD1-CZ 4.14Å; G148-F150 PolarHBondContact O-N 2.63Å; F150-T152 PolarHBondContact O-N 3.03Å
151	E	45.2	Very low	62.4	Low	178 Å²	178	106.8 Å²	106.8	83%	0.832	56%	0.563	S	S	*	*			trans	-48.9	127.5	171.6	-77.8	178.7	91.1	0	0	110.8	Q153	E151-Q153 PolarHBondContact O-N 3.39Å
152	T	41.1	Very low	60.3	Low	103 Å²	103	110 Å²	110	63%	0.632	59%	0.585	S	S	*	*			trans	-65.6	96.5	177.3	-43.2	0	0	0	0	108.6	F150 V154	F150-T152 PolarHBondContact O-N 3.03Å; T152-V154 VanDerWaalsContact C-N 3.28Å; T152-V154 HydrophobicContact CG2-CG2 3.64Å; T152-V154 PolarHBondContact O-N 2.99Å
153	Q	36.8	Very low	57.9	Low	173 Å²	173	111.2 Å²	111.2	81%	0.808	60%	0.596	S	S	*	*			trans	-77	92.4	160.9	-121.3	171	11.9	0	0	107.7	E151	E151-Q153 PolarHBondContact O-N 3.39Å
154	V	34.7	Very low	55.3	Low	107 Å²	107	111.1 Å²	111.1	65%	0.648	60%	0.602	S	S	*	*			trans	-72.5	130.8	162.3	170.6	0	0	0	0	107.6	T152	T152-V154 VanDerWaalsContact C-N 3.28Å; T152-V154 HydrophobicContact CG2-CG2 3.64Å; T152-V154 PolarHBondContact O-N 2.99Å
155	Q	34.1	Very low	52.8	Low	258 Å²	258	120.6 Å²	120.6	100%	1.206	65%	0.651	S	S	*	*			trans	90.3	0	171.9	-72.1	169.1	-3.7	0	0	117.6

Retrieved 155 of 155 residues in 89.5 ms (Link to these results)

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