A0A096MLM2_PAPAN Loading...

Pleckstrin homology like domain family A member 3

AlphaFold DB (Q9Y5J5), UniProt , Accession A0A096MLM2, Species PAPAN (Papio anubis, Olive baboon), Gene PHLDA3, Length 127 aa.

						>A0A096MLM2_PAPAN|A0A096MLM2|PHLDA3
MTAAATATVLKEGVLEKRSGGLLQLWKRKRCVLTERGLQLFEAKGTGGRPKELSFARIKAVECVESTGRHIYFTLVTEGGGEIDFRCPLEDPGWNAQITLGLVKFKNQQAIQTVRARQSLGTGTLVS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.9	Very low	68.2	Low	243 Å²	243	96.5 Å²	96.5	100%	1.197	61%	0.606	S	S	*	*				0	100.8	0	-66.6	175.5	83.6	0	0	107.8	A3	M1-A3 PolarHBondContact O-N 3.49Å
2	T	39.9	Very low	70.5	Confident	148 Å²	148	96.9 Å²	96.9	91%	0.908	60%	0.595	S	S	*	*			trans	-70.6	103.7	174.1	-13.3	0	0	0	0	106.5	A4	T2-A4 PolarHBondContact O-N 3.1Å
3	A	44.5	Very low	72.4	Confident	88 Å²	88	91 Å²	91	73%	0.727	57%	0.565	S	S	*	*			trans	-48.8	120.2	167	0	0	0	0	0	106.2	M1 A5	M1-A3 PolarHBondContact O-N 3.49Å; A3-A5 PolarHBondContact O-N 3.47Å
4	A	47.8	Very low	74	Confident	84 Å²	84	88.1 Å²	88.1	69%	0.694	55%	0.547	S	S	*	.			trans	-60.7	96.2	175.8	0	0	0	0	0	105.8	T2 T6	T2-A4 PolarHBondContact O-N 3.1Å; A4-T6 PolarHBondContact O-N 3.46Å
5	A	53.3	Low	75.5	Confident	69 Å²	69	82.2 Å²	82.2	57%	0.57	51%	0.51	S	S	*	.			trans	-46.8	117.5	176.3	0	0	0	0	0	106.1	A3 A7	A3-A5 PolarHBondContact O-N 3.47Å; A5-A7 PolarHBondContact O-N 3.27Å
6	T	65.6	Low	76.8	Confident	138 Å²	138	79.1 Å²	79.1	85%	0.847	49%	0.488	S	S	*	.			trans	-54.3	106.7	179.4	31.2	0	0	0	0	106.2	A4 T8	A4-T6 PolarHBondContact O-N 3.46Å; T6-T8 PolarHBondContact O-N 3.47Å
7	A	81.2	Confident	78	Confident	30 Å²	30	76.6 Å²	76.6	25%	0.248	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-59.2	129.4	-176.3	0	0	0	0	0	108	A5 V9 T34 R36	A5-A7 PolarHBondContact O-N 3.27Å; A7-V9 PolarHBondContact O-N 3.38Å; A7-T34 HydrophobicContact CB-CG2 4.28Å; A7-R36 HydrophobicContact CB-CG 4.17Å
8	T	93.2	Very high	79.1	Confident	81 Å²	81	77.3 Å²	77.3	50%	0.497	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-54	127.1	-179.2	-58.4	0	0	0	0	109.8	T6 T34 E35	T6-T8 PolarHBondContact O-N 3.47Å; T8-T34 VanDerWaalsContact O-CA 3.26Å; T8-T34 WeakPolarHBondContact O-CA 3.37Å; T8-E35 PolarHBondContact O-N 2.99Å
9	V	96.2	Very high	79.8	Confident	80 Å²	80	74.5 Å²	74.5	49%	0.485	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	124	174.4	177.1	0	0	0	0	108.2	A7 V32	A7-V9 PolarHBondContact O-N 3.38Å; V9-V32 HydrophobicContact CB-CG1 4.5Å; V9-V32 HydrophobicContact CG1-CG1 3.93Å; V9-V32 HydrophobicContact CG2-CG1 3.87Å
10	L	96.7	Very high	80	Confident	68 Å²	68	74.9 Å²	74.9	36%	0.356	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-35.9	178.2	-57.9	178.4	0	0	0	111.4	L33 E35	L10-L33 HydrophobicContact CB-CD2 4.12Å; L10-L33 HydrophobicContact CB-CG 4.09Å; L10-L33 HydrophobicContact CD1-CD2 4.47Å; L10-L33 HydrophobicContact CD1-CG 4.31Å; L10-L33 PolarHBondContact N-O 2.98Å; L10-E35 HydrophobicContact CD1-CG 4.41Å; L10-E35 HydrophobicContact CD2-CG 4.13Å; L10-E35 HydrophobicContact CG-CG 4.39Å
11	K	97.8	Very high	80.2	Confident	32 Å²	32	73.2 Å²	73.2	14%	0.139	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	145.9	173.9	170.6	174.2	179.8	77.1	0	111.2	L33 D91 W94	K11-L33 HydrophobicContact CB-CB 4.41Å; K11-L33 PolarHBondContact N-O 3.26Å; K11-L33 WeakPolarHBondContact O-CB 3.36Å; K11-L33 PolarHBondContact O-N 2.83Å; K11-D91 IonicContact NZ-OD1 2.89Å; K11-D91 PolarHBondContact NZ-OD1 2.66Å; K11-D91 IonicContact NZ-OD2 2.64Å; K11-W94 HydrophobicContact CD-CD2 3.97Å; K11-W94 HydrophobicContact CD-CE3 4.2Å; K11-W94 HydrophobicContact CD-CG 4.41Å; K11-W94 HydrophobicContact CD-CH2 4.45Å; K11-W94 HydrophobicContact CD-CZ2 4.23Å; K11-W94 HydrophobicContact CD-CZ3 4.44Å; K11-W94 HydrophobicContact CG-CH2 4.06Å; K11-W94 HydrophobicContact CG-CZ2 4.09Å; K11-W94 HydrophobicContact CG-CZ3 4.33Å
12	E	96.3	Very high	82.7	Confident	102 Å²	102	70.4 Å²	70.4	48%	0.477	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	148.2	169.5	178.5	162.5	-160.6	0	0	109.1	R30 C31 V32	E12-R30 IonicContact OE1-CZ 3.82Å; E12-R30 IonicContact OE1-NE 2.69Å; E12-R30 PolarHBondContact OE1-NE 3.46Å; E12-R30 IonicContact OE1-NH2 3.55Å; E12-C31 VanDerWaalsContact CA-O 3.3Å; E12-C31 WeakPolarHBondContact CA-O 3.4Å; E12-V32 HydrophobicContact CB-CG2 4.45Å; E12-V32 HydrophobicContact CG-CG2 3.99Å
13	G	95.1	Very high	85	Confident	20 Å²	20	69.8 Å²	69.8	21%	0.206	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.6	-149	177.9	0	0	0	0	0	111.8	C31	G13-C31 PolarHBondContact N-O 3.41Å; G13-C31 PolarHBondContact O-N 2.96Å
14	V	94.5	Very high	87.2	Confident	50 Å²	50	69.4 Å²	69.4	30%	0.303	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.8	-176.7	178.3	0	0	0	0	110.5	R28 K29	V14-R28 HydrophobicContact CG1-CB 4.25Å; V14-R28 HydrophobicContact CG1-CG 4.43Å; V14-K29 WeakPolarHBondContact CA-O 3.49Å
15	L	96.9	Very high	89.4	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	148.8	165	-69.9	173.1	0	0	0	110.1	K29 C31 L38 F73 F85 C87 W94	L15-K29 PolarHBondContact N-O 3.36Å; L15-K29 VanDerWaalsContact N-O 3.09Å; L15-K29 PolarHBondContact O-N 3.21Å; L15-C31 HydrophobicContact CD1-CB 4.33Å; L15-C31 HydrophobicContact CG-CB 4.37Å; L15-L38 HydrophobicContact CD1-CD1 4.39Å; L15-L38 HydrophobicContact CD1-CD2 3.89Å; L15-F73 HydrophobicContact CD1-CZ 4.11Å; L15-F73 HydrophobicContact CD2-CE1 4.1Å; L15-F73 HydrophobicContact CD2-CZ 3.92Å; L15-F85 HydrophobicContact CB-CD1 4.08Å; L15-F85 HydrophobicContact CD1-CD1 4.06Å; L15-F85 HydrophobicContact CD1-CE1 4.43Å; L15-C87 HydrophobicContact CD2-CB 3.65Å; L15-W94 HydrophobicContact CD1-CD2 3.81Å; L15-W94 HydrophobicContact CD1-CE3 3.59Å; L15-W94 HydrophobicContact CD1-CG 4.36Å; L15-W94 HydrophobicContact CD1-CH2 4.48Å; L15-W94 HydrophobicContact CD1-CZ3 3.94Å; L15-W94 HydrophobicContact CD2-CB 3.84Å; L15-W94 HydrophobicContact CD2-CD2 3.55Å; L15-W94 HydrophobicContact CD2-CE3 4.22Å; L15-W94 HydrophobicContact CD2-CG 3.37Å; L15-W94 HydrophobicContact CG-CD2 3.65Å; L15-W94 HydrophobicContact CG-CE3 3.93Å; L15-W94 HydrophobicContact CG-CG 4.05Å; L15-W94 HydrophobicContact CG-CH2 4.41Å; L15-W94 HydrophobicContact CG-CZ2 4.15Å; L15-W94 HydrophobicContact CG-CZ3 4.3Å
16	E	96.8	Very high	91.4	Very high	32 Å²	32	69.8 Å²	69.8	15%	0.15	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	123.4	165.2	-61.1	-164	140.3	0	0	109.4	W26 K27 R28 F85 R86	E16-W26 HydrophobicContact CB-CB 4.24Å; E16-W26 HydrophobicContact CB-CE3 4.18Å; E16-K27 WeakPolarHBondContact CA-O 3.34Å; E16-R28 HydrophobicContact CG-CG 3.81Å; E16-R28 WeakPolarHBondContact OE1-CG 3.35Å; E16-F85 CarbonylContact O-C 3.48Å; E16-F85 VanDerWaalsContact O-CA 3.27Å; E16-F85 WeakPolarHBondContact O-CA 3.42Å; E16-R86 HydrophobicContact CB-CG 3.87Å; E16-R86 PolarHBondContact N-O 2.88Å; E16-R86 PolarHBondContact O-N 3.15Å; E16-R86 IonicContact OE2-CZ 2.82Å; E16-R86 IonicContact OE2-NE 2.66Å; E16-R86 PolarHBondContact OE2-NE 2.84Å; E16-R86 IonicContact OE2-NH2 2.68Å; E16-R86 PolarHBondContact OE2-NH2 2.99Å
17	K	97.2	Very high	92.8	Very high	38 Å²	38	68.3 Å²	68.3	17%	0.165	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	133.9	176.1	176.5	177.3	165.7	164.5	0	109.9	K27 K29 L40 I83 F85	K17-K27 PolarHBondContact N-O 3.34Å; K17-K27 PolarHBondContact O-N 2.97Å; K17-K29 HydrophobicContact CB-CG 4.32Å; K17-L40 HydrophobicContact CD-CD1 3.93Å; K17-I83 HydrophobicContact CD-CG2 4.08Å; K17-I83 HydrophobicContact CG-CG2 4.26Å; K17-F85 HydrophobicContact CB-CD1 3.93Å; K17-F85 HydrophobicContact CB-CE1 3.68Å; K17-F85 HydrophobicContact CB-CZ 4.45Å; K17-F85 HydrophobicContact CD-CE1 4.14Å; K17-F85 HydrophobicContact CD-CZ 4.14Å; K17-F85 HydrophobicContact CG-CD1 4.38Å; K17-F85 HydrophobicContact CG-CE1 3.93Å; K17-F85 HydrophobicContact CG-CZ 4.21Å
18	R	96.7	Very high	93.4	Very high	88 Å²	88	74.7 Å²	74.7	33%	0.332	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	132.4	171	-156.1	170.2	76.7	-150.3	-9.3	110.8	Q24 W26 D84	R18-Q24 HydrophobicContact CG-CB 4.44Å; R18-W26 HydrophobicContact CB-CD2 4.4Å; R18-W26 HydrophobicContact CB-CE3 3.96Å; R18-W26 HydrophobicContact CB-CH2 3.98Å; R18-W26 HydrophobicContact CB-CZ2 4.4Å; R18-W26 HydrophobicContact CB-CZ3 3.73Å; R18-W26 HydrophobicContact CG-CH2 4.44Å; R18-W26 HydrophobicContact CG-CZ2 4.38Å; R18-D84 HydrophobicContact CB-CB 4.03Å; R18-D84 IonicContact CZ-OD2 2.7Å; R18-D84 PolarHBondContact N-O 3.37Å; R18-D84 IonicContact NE-OD2 2.65Å; R18-D84 IonicContact NH1-OD2 2.62Å; R18-D84 PolarHBondContact NH1-OD2 2.74Å; R18-D84 IonicContact NH2-OD2 2.76Å; R18-D84 PolarHBondContact NH2-OD2 3.26Å
19	S	92.4	Very high	93.5	Very high	24 Å²	24	71.5 Å²	71.5	17%	0.168	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-77.3	136.1	174.9	68.4	0	0	0	0	110.9	G21 Q24 L25	S19-G21 PolarHBondContact O-N 3.43Å; S19-G21 VanDerWaalsContact O-N 3.13Å; S19-Q24 PolarHBondContact O-NE2 3.48Å; S19-Q24 PolarHBondContact O-OE1 3.15Å; S19-L25 PolarHBondContact N-O 2.94Å; S19-L25 PolarHBondContact OG-N 2.79Å; S19-L25 PolarHBondContact OG-O 3.33Å
20	G	85.1	Confident	93.4	Very high	82 Å²	82	73.2 Å²	73.2	85%	0.845	38%	0.377	S	S	*	.	S	Bend	trans	-77.5	15.4	177.7	0	0	0	0	0	115.9
21	G	83.6	Confident	93.4	Very high	40 Å²	40	70 Å²	70	41%	0.412	36%	0.36	S	S	.	.	S	Bend	trans	-98.3	179.5	-180	0	0	0	0	0	113	S19 L23 Q24	S19-G21 PolarHBondContact O-N 3.43Å; S19-G21 VanDerWaalsContact O-N 3.13Å; G21-L23 PolarHBondContact O-N 3.28Å; G21-L23 VanDerWaalsContact O-N 3.08Å; G21-Q24 PolarHBondContact O-N 3.11Å; G21-Q24 PolarHBondContact O-NE2 3.33Å
22	L	86	Confident	93.3	Very high	185 Å²	185	68.8 Å²	68.8	97%	0.969	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-37.4	179.8	-74.9	156.2	0	0	0	113.9	Q24	L22-Q24 PolarHBondContact O-N 3.47Å
23	L	88	Confident	93.4	Very high	134 Å²	134	64 Å²	64	70%	0.702	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-8.4	-174.5	-59.3	177.6	0	0	0	114.5	G21 L25	G21-L23 PolarHBondContact O-N 3.28Å; G21-L23 VanDerWaalsContact O-N 3.08Å; L23-L25 HydrophobicContact CB-CD1 3.99Å; L23-L25 HydrophobicContact CB-CD2 4.28Å; L23-L25 HydrophobicContact CB-CG 3.71Å; L23-L25 HydrophobicContact CD1-CD1 4.22Å; L23-L25 WeakPolarHBondContact O-CD2 3.37Å; L23-L25 WeakPolarHBondContact O-CG 3.43Å; L23-L25 PolarHBondContact O-N 3.29Å
24	Q	90.6	Very high	93.5	Very high	80 Å²	80	63.4 Å²	63.4	37%	0.374	33%	0.326	S	S	.	.			trans	38.4	39.6	178.7	-65	-65.1	-48.3	0	0	115.1	R18 S19 G21 L22	R18-Q24 HydrophobicContact CG-CB 4.44Å; S19-Q24 PolarHBondContact O-NE2 3.48Å; S19-Q24 PolarHBondContact O-OE1 3.15Å; G21-Q24 PolarHBondContact O-N 3.11Å; G21-Q24 PolarHBondContact O-NE2 3.33Å; L22-Q24 PolarHBondContact O-N 3.47Å
25	L	94.6	Very high	93.6	Very high	92 Å²	92	63.9 Å²	63.9	48%	0.482	33%	0.325	S	S	.	.			trans	-78.2	145.4	-174	-59.9	175.9	0	0	0	111.6	S19 L23	S19-L25 PolarHBondContact N-O 2.94Å; S19-L25 PolarHBondContact OG-N 2.79Å; S19-L25 PolarHBondContact OG-O 3.33Å; L23-L25 HydrophobicContact CB-CD1 3.99Å; L23-L25 HydrophobicContact CB-CD2 4.28Å; L23-L25 HydrophobicContact CB-CG 3.71Å; L23-L25 HydrophobicContact CD1-CD1 4.22Å; L23-L25 WeakPolarHBondContact O-CD2 3.37Å; L23-L25 WeakPolarHBondContact O-CG 3.43Å; L23-L25 PolarHBondContact O-N 3.29Å
26	W	95.4	Very high	93.5	Very high	70 Å²	70	69.7 Å²	69.7	27%	0.265	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	119.2	169.2	-64.8	101.5	0	0	0	110.1	E16 R18 Y72 D84 R86	E16-W26 HydrophobicContact CB-CB 4.24Å; E16-W26 HydrophobicContact CB-CE3 4.18Å; R18-W26 HydrophobicContact CB-CD2 4.4Å; R18-W26 HydrophobicContact CB-CE3 3.96Å; R18-W26 HydrophobicContact CB-CH2 3.98Å; R18-W26 HydrophobicContact CB-CZ2 4.4Å; R18-W26 HydrophobicContact CB-CZ3 3.73Å; R18-W26 HydrophobicContact CG-CH2 4.44Å; R18-W26 HydrophobicContact CG-CZ2 4.38Å; W26-Y72 HydrophobicContact CH2-CD1 4.02Å; W26-Y72 HydrophobicContact CH2-CE1 4.22Å; W26-Y72 HydrophobicContact CZ2-CD1 4.01Å; W26-Y72 AromaticContact CZ2-CE1 3.78Å; W26-Y72 HydrophobicContact CZ2-CE1 3.78Å; W26-D84 HydrophobicContact CH2-CB 4.18Å; W26-R86 VanDerWaalsContact CD1-NH1 3.35Å; W26-R86 HydrophobicContact CD2-CG 4.02Å; W26-R86 HydrophobicContact CE3-CB 4.45Å; W26-R86 HydrophobicContact CE3-CG 3.67Å; W26-R86 HydrophobicContact CH2-CB 4.25Å; W26-R86 HydrophobicContact CH2-CG 4.23Å; W26-R86 HydrophobicContact CZ3-CB 4.07Å; W26-R86 HydrophobicContact CZ3-CG 3.8Å
27	K	94.6	Very high	93.6	Very high	107 Å²	107	68.2 Å²	68.2	47%	0.465	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	119.7	179.7	-64	-173.1	179.2	-175.2	0	109.9	E16 K17 K29	E16-K27 WeakPolarHBondContact CA-O 3.34Å; K17-K27 PolarHBondContact N-O 3.34Å; K17-K27 PolarHBondContact O-N 2.97Å; K27-K29 PolarHBondContact O-N 2.93Å
28	R	94.4	Very high	93.6	Very high	163 Å²	163	66.5 Å²	66.5	62%	0.615	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.2	132.2	171.6	-66.7	-178.5	74.2	166	4.4	110.5	V14 E16	V14-R28 HydrophobicContact CG1-CB 4.25Å; V14-R28 HydrophobicContact CG1-CG 4.43Å; E16-R28 HydrophobicContact CG-CG 3.81Å; E16-R28 WeakPolarHBondContact OE1-CG 3.35Å
29	K	94.6	Very high	93.6	Very high	14 Å²	14	64.7 Å²	64.7	6%	0.061	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	136.4	175.4	-57.4	-63.6	171	176.6	0	108.1	V14 L15 K17 K27 C31 F41 E42	V14-K29 WeakPolarHBondContact CA-O 3.49Å; L15-K29 PolarHBondContact N-O 3.36Å; L15-K29 VanDerWaalsContact N-O 3.09Å; L15-K29 PolarHBondContact O-N 3.21Å; K17-K29 HydrophobicContact CB-CG 4.32Å; K27-K29 PolarHBondContact O-N 2.93Å; K29-C31 PolarHBondContact O-SG 3.49Å; K29-F41 WeakPolarHBondContact CA-O 3.3Å; K29-E42 IonicContact NZ-OE1 3.68Å; K29-E42 PolarHBondContact NZ-OE1 3.25Å; K29-E42 IonicContact NZ-OE2 3.86Å; K29-E42 PolarHBondContact NZ-OE2 3.29Å
30	R	94.1	Very high	93.8	Very high	116 Å²	116	63.9 Å²	63.9	44%	0.438	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	130.7	159.9	174.6	179.3	136.3	-106.3	-7.1	106.8	E12 F41	E12-R30 IonicContact OE1-CZ 3.82Å; E12-R30 IonicContact OE1-NE 2.69Å; E12-R30 PolarHBondContact OE1-NE 3.46Å; E12-R30 IonicContact OE1-NH2 3.55Å; R30-F41 HydrophobicContact CB-CB 4.19Å; R30-F41 PolarHBondContact N-O 3.36Å; R30-F41 WeakPolarHBondContact O-CB 3.41Å; R30-F41 WeakPolarHBondContact O-CD2 3.4Å; R30-F41 PolarHBondContact O-N 3.3Å
31	C	96.1	Very high	94.1	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	136.1	-170.4	-69.2	0	0	0	0	110.4	E12 G13 L15 K29 L38 Q39 L40 W94	E12-C31 VanDerWaalsContact CA-O 3.3Å; E12-C31 WeakPolarHBondContact CA-O 3.4Å; G13-C31 PolarHBondContact N-O 3.41Å; G13-C31 PolarHBondContact O-N 2.96Å; L15-C31 HydrophobicContact CD1-CB 4.33Å; L15-C31 HydrophobicContact CG-CB 4.37Å; K29-C31 PolarHBondContact O-SG 3.49Å; C31-L38 HydrophobicContact CB-CD1 4.06Å; C31-Q39 VanDerWaalsContact CA-O 3.26Å; C31-Q39 WeakPolarHBondContact CA-O 3.37Å; C31-L40 WeakPolarHBondContact SG-CD2 3.34Å; C31-W94 HydrophobicContact CB-CH2 3.44Å; C31-W94 VanDerWaalsContact CB-CH2 3.44Å; C31-W94 HydrophobicContact CB-CZ2 4.1Å; C31-W94 HydrophobicContact CB-CZ3 3.96Å
32	V	96.2	Very high	94.3	Very high	8 Å²	8	65.5 Å²	65.5	5%	0.048	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	114.2	171.8	-177.9	0	0	0	0	107.8	V9 E12 T34 Q39 F41	V9-V32 HydrophobicContact CB-CG1 4.5Å; V9-V32 HydrophobicContact CG1-CG1 3.93Å; V9-V32 HydrophobicContact CG2-CG1 3.87Å; E12-V32 HydrophobicContact CB-CG2 4.45Å; E12-V32 HydrophobicContact CG-CG2 3.99Å; V32-T34 HydrophobicContact CG1-CG2 4.05Å; V32-Q39 HydrophobicContact CB-CB 4.29Å; V32-Q39 PolarHBondContact N-O 3.48Å; V32-Q39 PolarHBondContact O-N 2.81Å; V32-F41 HydrophobicContact CB-CE2 4.24Å; V32-F41 HydrophobicContact CG2-CD2 4.4Å; V32-F41 HydrophobicContact CG2-CE2 3.74Å
33	L	98.2	Very high	93.7	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	126.5	171.3	-178	62.5	0	0	0	108.9	L10 K11 L38 F55 W94 Q97 I98	L10-L33 HydrophobicContact CB-CD2 4.12Å; L10-L33 HydrophobicContact CB-CG 4.09Å; L10-L33 HydrophobicContact CD1-CD2 4.47Å; L10-L33 HydrophobicContact CD1-CG 4.31Å; L10-L33 PolarHBondContact N-O 2.98Å; K11-L33 HydrophobicContact CB-CB 4.41Å; K11-L33 PolarHBondContact N-O 3.26Å; K11-L33 WeakPolarHBondContact O-CB 3.36Å; K11-L33 PolarHBondContact O-N 2.83Å; L33-L38 HydrophobicContact CB-CD1 4.27Å; L33-L38 HydrophobicContact CD1-CB 4.42Å; L33-L38 HydrophobicContact CD1-CD1 4.41Å; L33-F55 HydrophobicContact CD1-CE1 4.42Å; L33-F55 HydrophobicContact CD1-CZ 3.8Å; L33-W94 HydrophobicContact CB-CZ3 4.13Å; L33-Q97 HydrophobicContact CD2-CB 3.78Å; L33-I98 HydrophobicContact CD1-CG1 3.9Å; L33-I98 HydrophobicContact CD2-CG1 3.97Å
34	T	97.4	Very high	92.9	Very high	8 Å²	8	64.4 Å²	64.4	5%	0.049	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	171.8	175	69	0	0	0	0	110.2	A7 T8 V32 R36 G37 F55	A7-T34 HydrophobicContact CB-CG2 4.28Å; T8-T34 VanDerWaalsContact O-CA 3.26Å; T8-T34 WeakPolarHBondContact O-CA 3.37Å; V32-T34 HydrophobicContact CG1-CG2 4.05Å; T34-R36 PolarHBondContact O-N 3.24Å; T34-R36 PolarHBondContact OG1-N 2.95Å; T34-G37 PolarHBondContact N-O 3.46Å; T34-G37 PolarHBondContact O-N 3.42Å; T34-G37 VanDerWaalsContact O-N 3.17Å; T34-G37 PolarHBondContact OG1-N 2.95Å; T34-G37 PolarHBondContact OG1-O 2.98Å; T34-G37 VanDerWaalsContact OG1-O 3.11Å; T34-F55 WeakPolarHBondContact O-CE2 3.49Å
35	E	96.2	Very high	91.5	Very high	60 Å²	60	62.4 Å²	62.4	28%	0.28	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-14.6	172	-61.5	-170.5	135.7	0	0	114.2	T8 L10 F55 K104	T8-E35 PolarHBondContact O-N 2.99Å; L10-E35 HydrophobicContact CD1-CG 4.41Å; L10-E35 HydrophobicContact CD2-CG 4.13Å; L10-E35 HydrophobicContact CG-CG 4.39Å; E35-F55 WeakPolarHBondContact O-CD2 3.46Å; E35-K104 IonicContact OE1-NZ 2.81Å; E35-K104 PolarHBondContact OE1-NZ 2.8Å
36	R	96.1	Very high	89.8	Confident	123 Å²	123	66 Å²	66	46%	0.464	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-15	179.8	-63.4	-174.2	179.9	176.6	2.5	113.9	A7 T34 S54 F55	A7-R36 HydrophobicContact CB-CG 4.17Å; T34-R36 PolarHBondContact O-N 3.24Å; T34-R36 PolarHBondContact OG1-N 2.95Å; R36-S54 WeakPolarHBondContact O-CA 3.29Å; R36-F55 VanDerWaalsContact C-CD2 3.49Å; R36-F55 PolarHBondContact O-N 3.44Å
37	G	97.7	Very high	88.4	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	143.8	-168	-176.5	0	0	0	0	0	113.7	T34 L53	T34-G37 PolarHBondContact N-O 3.46Å; T34-G37 PolarHBondContact O-N 3.42Å; T34-G37 VanDerWaalsContact O-N 3.17Å; T34-G37 PolarHBondContact OG1-N 2.95Å; T34-G37 PolarHBondContact OG1-O 2.98Å; T34-G37 VanDerWaalsContact OG1-O 3.11Å; G37-L53 WeakPolarHBondContact CA-O 3.25Å
38	L	98.1	Very high	87.4	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.01	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	123.4	-173.9	-177.6	66.9	0	0	0	111.2	L15 C31 L33 L40 L53 L75 F85 W94 I98	L15-L38 HydrophobicContact CD1-CD1 4.39Å; L15-L38 HydrophobicContact CD1-CD2 3.89Å; C31-L38 HydrophobicContact CB-CD1 4.06Å; L33-L38 HydrophobicContact CB-CD1 4.27Å; L33-L38 HydrophobicContact CD1-CB 4.42Å; L33-L38 HydrophobicContact CD1-CD1 4.41Å; L38-L40 HydrophobicContact CD2-CD2 3.78Å; L38-L40 HydrophobicContact CG-CD2 3.84Å; L38-L53 HydrophobicContact CB-CB 4.3Å; L38-L53 HydrophobicContact CD2-CD1 4.46Å; L38-L53 PolarHBondContact N-O 3.36Å; L38-L53 PolarHBondContact O-N 2.93Å; L38-L75 HydrophobicContact CD2-CD1 4.44Å; L38-F85 HydrophobicContact CD2-CE1 4.33Å; L38-F85 HydrophobicContact CD2-CZ 4.21Å; L38-W94 HydrophobicContact CD1-CE3 4.47Å; L38-W94 HydrophobicContact CD1-CZ3 3.75Å; L38-I98 HydrophobicContact CD2-CD1 4.25Å
39	Q	96.3	Very high	87	Confident	51 Å²	51	66.8 Å²	66.8	24%	0.238	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.5	174.4	-63.1	178.3	-25.6	0	0	109.8	C31 V32 F41 P50	C31-Q39 VanDerWaalsContact CA-O 3.26Å; C31-Q39 WeakPolarHBondContact CA-O 3.37Å; V32-Q39 HydrophobicContact CB-CB 4.29Å; V32-Q39 PolarHBondContact N-O 3.48Å; V32-Q39 PolarHBondContact O-N 2.81Å; Q39-F41 HydrophobicContact CB-CE2 3.85Å; Q39-F41 HydrophobicContact CB-CZ 4.47Å; Q39-P50 HydrophobicContact CB-CB 4.01Å; Q39-P50 HydrophobicContact CB-CG 4.33Å; Q39-P50 HydrophobicContact CG-CG 4.47Å
40	L	95.6	Very high	86.8	Confident	6 Å²	6	67.7 Å²	67.7	3%	0.031	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	115.4	-180	-53.2	177.3	0	0	0	109.6	K17 C31 L38 P50 K51 L53 F85	K17-L40 HydrophobicContact CD-CD1 3.93Å; C31-L40 WeakPolarHBondContact SG-CD2 3.34Å; L38-L40 HydrophobicContact CD2-CD2 3.78Å; L38-L40 HydrophobicContact CG-CD2 3.84Å; L40-P50 WeakPolarHBondContact O-CA 3.46Å; L40-K51 HydrophobicContact CB-CB 4.36Å; L40-K51 PolarHBondContact N-O 2.89Å; L40-K51 PolarHBondContact O-N 3.48Å; L40-L53 HydrophobicContact CD1-CD1 3.96Å; L40-L53 HydrophobicContact CD1-CG 4.25Å; L40-F85 HydrophobicContact CD1-CE1 4.23Å; L40-F85 HydrophobicContact CD1-CZ 4.11Å; L40-F85 HydrophobicContact CD2-CE1 4.01Å; L40-F85 HydrophobicContact CD2-CZ 4.4Å
41	F	93.4	Very high	86.8	Confident	34 Å²	34	68.1 Å²	68.1	15%	0.149	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	137	175.5	-61.9	-97.5	0	0	0	110	K29 R30 V32 Q39 P50	K29-F41 WeakPolarHBondContact CA-O 3.3Å; R30-F41 HydrophobicContact CB-CB 4.19Å; R30-F41 PolarHBondContact N-O 3.36Å; R30-F41 WeakPolarHBondContact O-CB 3.41Å; R30-F41 WeakPolarHBondContact O-CD2 3.4Å; R30-F41 PolarHBondContact O-N 3.3Å; V32-F41 HydrophobicContact CB-CE2 4.24Å; V32-F41 HydrophobicContact CG2-CD2 4.4Å; V32-F41 HydrophobicContact CG2-CE2 3.74Å; Q39-F41 HydrophobicContact CB-CE2 3.85Å; Q39-F41 HydrophobicContact CB-CZ 4.47Å; F41-P50 HydrophobicContact CD1-CB 3.85Å; F41-P50 HydrophobicContact CD1-CG 4.41Å; F41-P50 HydrophobicContact CD2-CB 4.12Å; F41-P50 HydrophobicContact CE1-CB 3.61Å; F41-P50 HydrophobicContact CE1-CG 3.7Å; F41-P50 HydrophobicContact CE2-CB 3.87Å; F41-P50 HydrophobicContact CE2-CG 4.3Å; F41-P50 HydrophobicContact CG-CB 4.11Å; F41-P50 HydrophobicContact CZ-CB 3.62Å; F41-P50 HydrophobicContact CZ-CG 3.63Å
42	E	86	Confident	86.7	Confident	123 Å²	123	72.3 Å²	72.3	58%	0.575	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.8	140.2	171.6	-68.1	-60.5	150.1	0	0	110.4	K29 K44	K29-E42 IonicContact NZ-OE1 3.68Å; K29-E42 PolarHBondContact NZ-OE1 3.25Å; K29-E42 IonicContact NZ-OE2 3.86Å; K29-E42 PolarHBondContact NZ-OE2 3.29Å; E42-K44 PolarHBondContact O-N 3.49Å
43	A	74.6	Confident	86.7	Confident	79 Å²	79	72.8 Å²	72.8	65%	0.653	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-24.9	-178.7	0	0	0	0	0	113.4
44	K	71.3	Confident	86.7	Confident	216 Å²	216	74.1 Å²	74.1	94%	0.939	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	35.1	-174.9	-65.7	-168.9	177.9	-174.2	0	114.1	E42	E42-K44 PolarHBondContact O-N 3.49Å
45	G	61.4	Low	86.7	Confident	39 Å²	39	73.9 Å²	73.9	40%	0.402	40%	0.401	S	S	.	.			trans	-142.6	108.4	174.2	0	0	0	0	0	111.3	G47	G45-G47 PolarHBondContact O-N 3Å
46	T	59.1	Low	86.8	Confident	167 Å²	167	73.5 Å²	73.5	100%	1.025	41%	0.408	S	S	*	.	S	Bend	trans	-73	-0.3	179.3	45	0	0	0	0	114
47	G	64.2	Low	86.9	Confident	76 Å²	76	76.2 Å²	76.2	78%	0.784	42%	0.418	S	S	*	.	S	Bend	trans	-156.7	15.4	-175.1	0	0	0	0	0	116.8	G45	G45-G47 PolarHBondContact O-N 3Å
48	G	74.9	Confident	86.9	Confident	52 Å²	52	76.4 Å²	76.4	54%	0.536	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-75	143.8	176.2	0	0	0	0	0	112.2
49	R	85.7	Confident	86.9	Confident	229 Å²	229	81.9 Å²	81.9	86%	0.864	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-56.8	126.6	168.8	-177.4	178.8	179	177.6	0.8	108.7
50	P	91.1	Very high	87	Confident	33 Å²	33	80.5 Å²	80.5	21%	0.214	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-63.4	149.7	179.1	24.9	-33.2	0	0	0	111	Q39 L40 F41 E52	Q39-P50 HydrophobicContact CB-CB 4.01Å; Q39-P50 HydrophobicContact CB-CG 4.33Å; Q39-P50 HydrophobicContact CG-CG 4.47Å; L40-P50 WeakPolarHBondContact O-CA 3.46Å; F41-P50 HydrophobicContact CD1-CB 3.85Å; F41-P50 HydrophobicContact CD1-CG 4.41Å; F41-P50 HydrophobicContact CD2-CB 4.12Å; F41-P50 HydrophobicContact CE1-CB 3.61Å; F41-P50 HydrophobicContact CE1-CG 3.7Å; F41-P50 HydrophobicContact CE2-CB 3.87Å; F41-P50 HydrophobicContact CE2-CG 4.3Å; F41-P50 HydrophobicContact CG-CB 4.11Å; F41-P50 HydrophobicContact CZ-CB 3.62Å; F41-P50 HydrophobicContact CZ-CG 3.63Å; P50-E52 PolarHBondContact O-N 3.41Å
51	K	92.7	Very high	87.2	Confident	125 Å²	125	81.4 Å²	81.4	54%	0.543	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	119.1	165.2	176.7	166.2	-178.7	157.6	0	108.4	L40	L40-K51 HydrophobicContact CB-CB 4.36Å; L40-K51 PolarHBondContact N-O 2.89Å; L40-K51 PolarHBondContact O-N 3.48Å
52	E	94.1	Very high	87.4	Confident	88 Å²	88	84 Å²	84	41%	0.411	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	125	-178.5	-170.5	175	172.1	0	0	111.4	P50	P50-E52 PolarHBondContact O-N 3.41Å
53	L	96.7	Very high	87.9	Confident	17 Å²	17	82.5 Å²	82.5	9%	0.089	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	84.8	165.4	-59.3	-176.1	0	0	0	108	G37 L38 L40 L75 I83 F85	G37-L53 WeakPolarHBondContact CA-O 3.25Å; L38-L53 HydrophobicContact CB-CB 4.3Å; L38-L53 HydrophobicContact CD2-CD1 4.46Å; L38-L53 PolarHBondContact N-O 3.36Å; L38-L53 PolarHBondContact O-N 2.93Å; L40-L53 HydrophobicContact CD1-CD1 3.96Å; L40-L53 HydrophobicContact CD1-CG 4.25Å; L53-L75 HydrophobicContact CD1-CD1 3.95Å; L53-I83 HydrophobicContact CD1-CD1 4.04Å; L53-I83 HydrophobicContact CD2-CD1 3.77Å; L53-F85 HydrophobicContact CD1-CE2 4.11Å; L53-F85 HydrophobicContact CD1-CZ 3.71Å
54	S	97.6	Very high	89	Confident	28 Å²	28	82.5 Å²	82.5	20%	0.196	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	138.5	178.9	177.6	0	0	0	0	111.1	R36 A56 R57 I58	R36-S54 WeakPolarHBondContact O-CA 3.29Å; S54-A56 PolarHBondContact O-N 3.39Å; S54-A56 VanDerWaalsContact O-N 3.15Å; S54-A56 PolarHBondContact OG-N 3.45Å; S54-R57 PolarHBondContact O-N 2.99Å; S54-I58 PolarHBondContact O-N 3.36Å
55	F	98.5	Very high	90.2	Very high	4 Å²	4	77.5 Å²	77.5	2%	0.018	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-58.7	-23.5	172.5	-71.1	-34.9	0	0	0	113.4	L33 T34 E35 R36 R57 I58 I98 L102 F105	L33-F55 HydrophobicContact CD1-CE1 4.42Å; L33-F55 HydrophobicContact CD1-CZ 3.8Å; T34-F55 WeakPolarHBondContact O-CE2 3.49Å; E35-F55 WeakPolarHBondContact O-CD2 3.46Å; R36-F55 VanDerWaalsContact C-CD2 3.49Å; R36-F55 PolarHBondContact O-N 3.44Å; F55-R57 PolarHBondContact O-N 2.92Å; F55-R57 VanDerWaalsContact O-N 3.12Å; F55-I58 PolarHBondContact O-N 3.06Å; F55-I98 HydrophobicContact CE1-CG2 4.07Å; F55-L102 HydrophobicContact CB-CD1 3.93Å; F55-L102 HydrophobicContact CD1-CB 4.08Å; F55-L102 HydrophobicContact CD1-CD1 3.86Å; F55-L102 HydrophobicContact CE1-CB 4.1Å; F55-L102 HydrophobicContact CG-CD1 4.1Å; F55-F105 HydrophobicContact CB-CB 3.99Å; F55-F105 HydrophobicContact CB-CD1 3.54Å; F55-F105 HydrophobicContact CB-CD2 4.12Å; F55-F105 HydrophobicContact CB-CE1 4Å; F55-F105 HydrophobicContact CB-CG 3.61Å; F55-F105 HydrophobicContact CB-CZ 4.48Å; F55-F105 HydrophobicContact CD2-CB 3.86Å; F55-F105 HydrophobicContact CD2-CD2 4.4Å; F55-F105 HydrophobicContact CD2-CG 4.15Å; F55-F105 HydrophobicContact CG-CB 4.3Å; F55-F105 HydrophobicContact CG-CG 4.36Å
56	A	97.4	Very high	92	Very high	52 Å²	52	79.3 Å²	79.3	43%	0.43	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-62.7	-15.5	171.4	0	0	0	0	0	113.7	S54 F105	S54-A56 PolarHBondContact O-N 3.39Å; S54-A56 VanDerWaalsContact O-N 3.15Å; S54-A56 PolarHBondContact OG-N 3.45Å; A56-F105 HydrophobicContact CB-CE1 4.02Å; A56-F105 HydrophobicContact CB-CZ 3.95Å
57	R	98	Very high	93.7	Very high	180 Å²	180	74.7 Å²	74.7	68%	0.679	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-114.4	-2.9	-179.2	-58.5	-179.3	69.9	172.7	4.8	113.1	S54 F55 T77 E78	S54-R57 PolarHBondContact O-N 2.99Å; F55-R57 PolarHBondContact O-N 2.92Å; F55-R57 VanDerWaalsContact O-N 3.12Å; R57-T77 CarbonylContact O-C 3.55Å; R57-T77 VanDerWaalsContact O-CA 3.23Å; R57-T77 WeakPolarHBondContact O-CA 3.3Å; R57-T77 WeakPolarHBondContact O-CB 3.24Å; R57-E78 PolarHBondContact O-N 3.33Å
58	I	98.6	Very high	95.1	Very high	4 Å²	4	74.2 Å²	74.2	2%	0.021	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	125.9	-180	-58	-52.7	0	0	0	108.7	S54 F55 L75 T77 L102 K106	S54-I58 PolarHBondContact O-N 3.36Å; F55-I58 PolarHBondContact O-N 3.06Å; I58-L75 HydrophobicContact CD1-CB 4.26Å; I58-L75 HydrophobicContact CD1-CD1 4.45Å; I58-T77 HydrophobicContact CD1-CG2 4.21Å; I58-L102 HydrophobicContact CB-CD1 4.14Å; I58-L102 HydrophobicContact CG2-CD1 4.29Å; I58-L102 HydrophobicContact CG2-CD2 3.81Å; I58-L102 WeakPolarHBondContact O-CD1 3.47Å; I58-K106 VanDerWaalsContact O-CE 3.24Å; I58-K106 WeakPolarHBondContact O-CE 3.42Å; I58-K106 PolarHBondContact O-NZ 2.99Å
59	K	98.3	Very high	96.2	Very high	116 Å²	116	81.3 Å²	81.3	50%	0.504	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-54.4	176.1	-174.2	-179.8	176	-172.8	0	111.1	V76 E78 K106	K59-V76 WeakPolarHBondContact CA-O 3.23Å; K59-V76 HydrophobicContact CB-CB 4.49Å; K59-V76 HydrophobicContact CB-CG1 4.3Å; K59-V76 WeakPolarHBondContact CB-O 3.4Å; K59-V76 HydrophobicContact CD-CG1 4.32Å; K59-V76 PolarHBondContact N-O 2.95Å; K59-E78 WeakPolarHBondContact CA-OE1 3.3Å; K59-K106 PolarHBondContact O-NZ 2.86Å
60	A	98.3	Very high	96.8	Very high	22 Å²	22	72.1 Å²	72.1	18%	0.182	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	164.7	-172.3	0	0	0	0	0	112.1	E62 V76	A60-E62 HydrophobicContact CB-CG 3.96Å; A60-V76 PolarHBondContact N-O 3.19Å; A60-V76 PolarHBondContact O-N 3.26Å
61	V	98.7	Very high	97.1	Very high	25 Å²	25	71.5 Å²	71.5	15%	0.152	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.5	163.4	-174.9	0	0	0	0	106.6	V64 F73 T74 L75 N95 I98	V61-V64 HydrophobicContact CG1-CG2 4.37Å; V61-F73 HydrophobicContact CG1-CB 4.26Å; V61-F73 HydrophobicContact CG1-CD2 4.15Å; V61-T74 WeakPolarHBondContact CA-O 3.34Å; V61-L75 HydrophobicContact CB-CD2 4.39Å; V61-L75 HydrophobicContact CG1-CD2 4.27Å; V61-L75 HydrophobicContact CG2-CD2 3.74Å; V61-N95 HydrophobicContact CG1-CB 4.31Å; V61-I98 HydrophobicContact CG2-CB 4.38Å; V61-I98 HydrophobicContact CG2-CG2 3.68Å
62	E	98.2	Very high	97.4	Very high	89 Å²	89	68.7 Å²	68.7	42%	0.416	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	179.3	-173.4	-66.1	-176.5	-172.9	0	0	111.1	A60 V64 T74 V76	A60-E62 HydrophobicContact CB-CG 3.96Å; E62-V64 PolarHBondContact O-N 3.12Å; E62-V64 VanDerWaalsContact O-N 3.15Å; E62-T74 PolarHBondContact N-O 3.25Å; E62-T74 PolarHBondContact O-N 2.7Å; E62-V76 HydrophobicContact CB-CG2 4.27Å; E62-V76 HydrophobicContact CG-CG2 4.13Å
63	C	96.4	Very high	97.6	Very high	92 Å²	92	64.6 Å²	64.6	62%	0.622	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51	41.2	175.6	-58.6	0	0	0	0	113.2	E65	C63-E65 PolarHBondContact O-N 2.95Å
64	V	97.5	Very high	97.7	Very high	78 Å²	78	64.3 Å²	64.3	47%	0.473	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	112.5	177.7	-179.8	0	0	0	0	108.8	V61 E62 Y72 F73 N95	V61-V64 HydrophobicContact CG1-CG2 4.37Å; E62-V64 PolarHBondContact O-N 3.12Å; E62-V64 VanDerWaalsContact O-N 3.15Å; V64-Y72 VanDerWaalsContact CA-O 3.3Å; V64-Y72 WeakPolarHBondContact CA-O 3.48Å; V64-F73 HydrophobicContact CG2-CB 4.08Å; V64-N95 HydrophobicContact CG1-CB 4.5Å; V64-N95 VanDerWaalsContact CG1-ND2 3.28Å; V64-N95 WeakPolarHBondContact CG1-ND2 3.48Å; V64-N95 HydrophobicContact CG2-CB 4.12Å
65	E	97.9	Very high	97.7	Very high	112 Å²	112	63.1 Å²	63.1	52%	0.523	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	139.6	-179.3	-167.6	-171.1	152	0	0	110.4	C63 T67 I71 Y72	C63-E65 PolarHBondContact O-N 2.95Å; E65-T67 PolarHBondContact OE1-OG1 2.78Å; E65-I71 CarbonylContact O-C 3.57Å; E65-I71 WeakPolarHBondContact O-CA 3.3Å; E65-Y72 PolarHBondContact N-O 3.12Å; E65-Y72 PolarHBondContact O-N 2.89Å
66	S	97.6	Very high	97.7	Very high	77 Å²	77	63.5 Å²	63.5	54%	0.538	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	112.2	172	-173.7	0	0	0	0	109.3	L89	S66-L89 WeakPolarHBondContact OG-CD2 3.41Å
67	T	95.3	Very high	97.8	Very high	70 Å²	70	62.4 Å²	62.4	43%	0.429	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	133.5	-178.1	-80.8	0	0	0	0	110.4	E65 R69 H70	E65-T67 PolarHBondContact OE1-OG1 2.78Å; T67-R69 PolarHBondContact O-N 2.99Å; T67-H70 PolarHBondContact N-O 2.73Å; T67-H70 PolarHBondContact O-N 3.48Å; T67-H70 VanDerWaalsContact O-O 3.09Å
68	G	94.8	Very high	97.7	Very high	66 Å²	66	58.8 Å²	58.8	68%	0.68	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	-122.8	-178.7	0	0	0	0	0	111.8	L89	G68-L89 WeakPolarHBondContact O-CD1 3.44Å
69	R	96.5	Very high	97.6	Very high	200 Å²	200	62.2 Å²	62.2	76%	0.755	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	10.4	179.9	-63.7	-167	-65.5	173.7	-1.4	114.2	T67 L89	T67-R69 PolarHBondContact O-N 2.99Å; R69-L89 PolarHBondContact O-N 2.88Å; R69-L89 VanDerWaalsContact O-N 3.07Å
70	H	98.2	Very high	97.5	Very high	36 Å²	36	59.3 Å²	59.3	17%	0.167	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	153.9	-172.2	-58.7	92.1	0	0	0	112.9	T67 Y72 R86 C87	T67-H70 PolarHBondContact N-O 2.73Å; T67-H70 PolarHBondContact O-N 3.48Å; T67-H70 VanDerWaalsContact O-O 3.09Å; H70-Y72 HydrophobicContact CB-CD2 4.2Å; H70-Y72 HydrophobicContact CB-CE2 3.57Å; H70-R86 HydrophobicContact CB-CB 4.26Å; H70-C87 CarbonylContact C-O 3.58Å; H70-C87 VanDerWaalsContact CA-O 3.22Å; H70-C87 WeakPolarHBondContact CA-O 3.28Å; H70-C87 WeakPolarHBondContact CB-O 3.39Å
71	I	98.2	Very high	97.4	Very high	20 Å²	20	59.9 Å²	59.9	10%	0.103	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	125.2	163.4	-56	171.1	0	0	0	106.8	E65 R86 C87 L89 P92	E65-I71 CarbonylContact O-C 3.57Å; E65-I71 WeakPolarHBondContact O-CA 3.3Å; I71-R86 CarbonylContact O-C 3.54Å; I71-R86 WeakPolarHBondContact O-CA 3.34Å; I71-R86 WeakPolarHBondContact O-CB 3.3Å; I71-C87 PolarHBondContact N-O 2.86Å; I71-C87 PolarHBondContact O-N 2.89Å; I71-L89 HydrophobicContact CD1-CD2 4.12Å; I71-L89 HydrophobicContact CG1-CD2 3.68Å; I71-P92 HydrophobicContact CD1-CB 3.65Å
72	Y	98.5	Very high	97.3	Very high	66 Å²	66	65.1 Å²	65.1	26%	0.259	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	146	178.7	-62.5	-98.7	0	0	0	109.5	W26 V64 E65 H70 F85 R86	W26-Y72 HydrophobicContact CH2-CD1 4.02Å; W26-Y72 HydrophobicContact CH2-CE1 4.22Å; W26-Y72 HydrophobicContact CZ2-CD1 4.01Å; W26-Y72 AromaticContact CZ2-CE1 3.78Å; W26-Y72 HydrophobicContact CZ2-CE1 3.78Å; V64-Y72 VanDerWaalsContact CA-O 3.3Å; V64-Y72 WeakPolarHBondContact CA-O 3.48Å; E65-Y72 PolarHBondContact N-O 3.12Å; E65-Y72 PolarHBondContact O-N 2.89Å; H70-Y72 HydrophobicContact CB-CD2 4.2Å; H70-Y72 HydrophobicContact CB-CE2 3.57Å; Y72-F85 WeakPolarHBondContact CA-O 3.37Å; Y72-R86 HydrophobicContact CD1-CB 3.72Å; Y72-R86 HydrophobicContact CE1-CB 3.93Å; Y72-R86 HydrophobicContact CE1-CG 4.34Å; Y72-R86 HydrophobicContact CG-CB 4.17Å
73	F	98.7	Very high	97.3	Very high	2 Å²	2	62.2 Å²	62.2	1%	0.009	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	155.3	172.2	60.8	-84.9	0	0	0	110.6	L15 V61 V64 L75 F85 W94 N95 I98	L15-F73 HydrophobicContact CD1-CZ 4.11Å; L15-F73 HydrophobicContact CD2-CE1 4.1Å; L15-F73 HydrophobicContact CD2-CZ 3.92Å; V61-F73 HydrophobicContact CG1-CB 4.26Å; V61-F73 HydrophobicContact CG1-CD2 4.15Å; V64-F73 HydrophobicContact CG2-CB 4.08Å; F73-L75 HydrophobicContact CD2-CD2 4.22Å; F73-L75 HydrophobicContact CE2-CD2 4.26Å; F73-F85 HydrophobicContact CD1-CB 4.27Å; F73-F85 HydrophobicContact CD2-CB 4.05Å; F73-F85 HydrophobicContact CE1-CB 3.8Å; F73-F85 HydrophobicContact CE2-CB 3.55Å; F73-F85 HydrophobicContact CE2-CD2 4.01Å; F73-F85 AromaticContact CE2-CG 3.95Å; F73-F85 HydrophobicContact CE2-CG 3.95Å; F73-F85 HydrophobicContact CG-CB 4.39Å; F73-F85 HydrophobicContact CZ-CB 3.41Å; F73-F85 VanDerWaalsContact CZ-CB 3.41Å; F73-F85 HydrophobicContact CZ-CG 4.06Å; F73-F85 PolarHBondContact N-O 2.94Å; F73-F85 PolarHBondContact O-N 3.02Å; F73-F85 VanDerWaalsContact O-O 3.13Å; F73-W94 HydrophobicContact CE1-CB 4.03Å; F73-W94 HydrophobicContact CZ-CB 4.04Å; F73-N95 HydrophobicContact CB-CB 4.02Å; F73-N95 HydrophobicContact CD1-CB 3.96Å; F73-N95 HydrophobicContact CD2-CB 4.39Å; F73-N95 HydrophobicContact CG-CB 3.88Å; F73-I98 HydrophobicContact CE2-CD1 3.77Å; F73-I98 HydrophobicContact CZ-CD1 4.04Å
74	T	98.5	Very high	97.3	Very high	11 Å²	11	58.9 Å²	58.9	7%	0.067	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131	-178.4	-62	0	0	0	0	110	V61 E62 V76 E82 D84	V61-T74 WeakPolarHBondContact CA-O 3.34Å; E62-T74 PolarHBondContact N-O 3.25Å; E62-T74 PolarHBondContact O-N 2.7Å; T74-V76 HydrophobicContact CG2-CG2 4.25Å; T74-E82 HydrophobicContact CG2-CB 3.83Å; T74-E82 HydrophobicContact CG2-CG 4.03Å; T74-D84 WeakPolarHBondContact CB-OD1 3.33Å; T74-D84 WeakPolarHBondContact CG2-OD1 3.31Å; T74-D84 PolarHBondContact OG1-OD1 2.95Å
75	L	98.6	Very high	97.4	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.016	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	113.7	165.7	-57.1	-171.6	0	0	0	109	L38 L53 I58 V61 F73 I83 F85 I98	L38-L75 HydrophobicContact CD2-CD1 4.44Å; L53-L75 HydrophobicContact CD1-CD1 3.95Å; I58-L75 HydrophobicContact CD1-CB 4.26Å; I58-L75 HydrophobicContact CD1-CD1 4.45Å; V61-L75 HydrophobicContact CB-CD2 4.39Å; V61-L75 HydrophobicContact CG1-CD2 4.27Å; V61-L75 HydrophobicContact CG2-CD2 3.74Å; F73-L75 HydrophobicContact CD2-CD2 4.22Å; F73-L75 HydrophobicContact CE2-CD2 4.26Å; L75-I83 HydrophobicContact CB-CB 4.42Å; L75-I83 PolarHBondContact N-O 3.47Å; L75-I83 PolarHBondContact O-N 2.95Å; L75-F85 HydrophobicContact CB-CE2 4.43Å; L75-F85 HydrophobicContact CD1-CD2 4.22Å; L75-F85 HydrophobicContact CD1-CE2 3.63Å; L75-F85 HydrophobicContact CD1-CZ 4.37Å; L75-F85 HydrophobicContact CG-CD2 3.98Å; L75-F85 HydrophobicContact CG-CE2 3.81Å; L75-I98 HydrophobicContact CD2-CG2 3.9Å
76	V	98.4	Very high	97.4	Very high	12 Å²	12	51.9 Å²	51.9	7%	0.073	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	128.6	173.5	-175.9	0	0	0	0	108.1	K59 A60 E62 T74	K59-V76 WeakPolarHBondContact CA-O 3.23Å; K59-V76 HydrophobicContact CB-CB 4.49Å; K59-V76 HydrophobicContact CB-CG1 4.3Å; K59-V76 WeakPolarHBondContact CB-O 3.4Å; K59-V76 HydrophobicContact CD-CG1 4.32Å; K59-V76 PolarHBondContact N-O 2.95Å; A60-V76 PolarHBondContact N-O 3.19Å; A60-V76 PolarHBondContact O-N 3.26Å; E62-V76 HydrophobicContact CB-CG2 4.27Å; E62-V76 HydrophobicContact CG-CG2 4.13Å; T74-V76 HydrophobicContact CG2-CG2 4.25Å
77	T	98	Very high	97.4	Very high	30 Å²	30	48.2 Å²	48.2	18%	0.184	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	158.5	177.7	64.9	0	0	0	0	111.2	R57 I58 G79 G80 G81 I83	R57-T77 CarbonylContact O-C 3.55Å; R57-T77 VanDerWaalsContact O-CA 3.23Å; R57-T77 WeakPolarHBondContact O-CA 3.3Å; R57-T77 WeakPolarHBondContact O-CB 3.24Å; I58-T77 HydrophobicContact CD1-CG2 4.21Å; T77-G79 PolarHBondContact O-N 3.43Å; T77-G79 VanDerWaalsContact O-N 3.12Å; T77-G80 PolarHBondContact O-N 2.92Å; T77-G81 WeakPolarHBondContact CB-O 3.39Å; T77-G81 WeakPolarHBondContact CG2-O 3.45Å; T77-G81 PolarHBondContact N-O 3.47Å; T77-G81 VanDerWaalsContact OG1-CA 3.3Å; T77-G81 WeakPolarHBondContact OG1-CA 3.4Å; T77-G81 PolarHBondContact OG1-N 3.43Å; T77-G81 PolarHBondContact OG1-O 2.93Å; T77-I83 HydrophobicContact CG2-CD1 4.22Å
78	E	97.1	Very high	97.4	Very high	103 Å²	103	46.4 Å²	46.4	48%	0.481	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-25	176.1	-65.9	-65.1	166.6	0	0	112.7	R57 K59 G80 K106	R57-E78 PolarHBondContact O-N 3.33Å; K59-E78 WeakPolarHBondContact CA-OE1 3.3Å; E78-G80 VanDerWaalsContact C-N 3.31Å; E78-G80 PolarHBondContact O-N 3.49Å; E78-K106 IonicContact OE1-NZ 3.15Å; E78-K106 PolarHBondContact OE1-NZ 3.28Å
79	G	96	Very high	97.5	Very high	76 Å²	76	46.8 Å²	46.8	78%	0.784	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	9.2	174.9	0	0	0	0	0	115.1	T77 G81	T77-G79 PolarHBondContact O-N 3.43Å; T77-G79 VanDerWaalsContact O-N 3.12Å; G79-G81 VanDerWaalsContact C-N 3.27Å; G79-G81 PolarHBondContact O-N 2.87Å
80	G	95.8	Very high	97.4	Very high	56 Å²	56	44.8 Å²	44.8	58%	0.577	26%	0.26	S	S	*	.	S	Bend	trans	77.9	2.5	-178.4	0	0	0	0	0	115.3	T77 E78	T77-G80 PolarHBondContact O-N 2.92Å; E78-G80 VanDerWaalsContact C-N 3.31Å; E78-G80 PolarHBondContact O-N 3.49Å
81	G	96.4	Very high	97.2	Very high	34 Å²	34	45.1 Å²	45.1	35%	0.351	26%	0.263	S	S	.	.			trans	-74.8	146.1	172.3	0	0	0	0	0	112	T77 G79	T77-G81 WeakPolarHBondContact CB-O 3.39Å; T77-G81 WeakPolarHBondContact CG2-O 3.45Å; T77-G81 PolarHBondContact N-O 3.47Å; T77-G81 VanDerWaalsContact OG1-CA 3.3Å; T77-G81 WeakPolarHBondContact OG1-CA 3.4Å; T77-G81 PolarHBondContact OG1-N 3.43Å; T77-G81 PolarHBondContact OG1-O 2.93Å; G79-G81 VanDerWaalsContact C-N 3.27Å; G79-G81 PolarHBondContact O-N 2.87Å
82	E	97.2	Very high	97.1	Very high	135 Å²	135	47.5 Å²	47.5	63%	0.631	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	140.9	-178.3	-68.1	175	-176	0	0	111.5	T74	T74-E82 HydrophobicContact CG2-CB 3.83Å; T74-E82 HydrophobicContact CG2-CG 4.03Å
83	I	97.2	Very high	97	Very high	27 Å²	27	45.4 Å²	45.4	14%	0.138	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	110.2	177.3	-47.2	175	0	0	0	109.1	K17 L53 L75 T77 F85	K17-I83 HydrophobicContact CD-CG2 4.08Å; K17-I83 HydrophobicContact CG-CG2 4.26Å; L53-I83 HydrophobicContact CD1-CD1 4.04Å; L53-I83 HydrophobicContact CD2-CD1 3.77Å; L75-I83 HydrophobicContact CB-CB 4.42Å; L75-I83 PolarHBondContact N-O 3.47Å; L75-I83 PolarHBondContact O-N 2.95Å; T77-I83 HydrophobicContact CG2-CD1 4.22Å; I83-F85 HydrophobicContact CB-CE2 3.97Å; I83-F85 HydrophobicContact CG2-CD2 4.22Å; I83-F85 HydrophobicContact CG2-CE2 3.41Å; I83-F85 VanDerWaalsContact CG2-CE2 3.41Å; I83-F85 HydrophobicContact CG2-CZ 3.78Å; I83-F85 VanDerWaalsContact O-CD2 3.31Å; I83-F85 WeakPolarHBondContact O-CD2 3.14Å
84	D	98	Very high	97	Very high	22 Å²	22	45.3 Å²	45.3	12%	0.118	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	135.3	-176.1	-67.5	-4.3	0	0	0	112	R18 W26 T74	R18-D84 HydrophobicContact CB-CB 4.03Å; R18-D84 IonicContact CZ-OD2 2.7Å; R18-D84 PolarHBondContact N-O 3.37Å; R18-D84 IonicContact NE-OD2 2.65Å; R18-D84 IonicContact NH1-OD2 2.62Å; R18-D84 PolarHBondContact NH1-OD2 2.74Å; R18-D84 IonicContact NH2-OD2 2.76Å; R18-D84 PolarHBondContact NH2-OD2 3.26Å; W26-D84 HydrophobicContact CH2-CB 4.18Å; T74-D84 WeakPolarHBondContact CB-OD1 3.33Å; T74-D84 WeakPolarHBondContact CG2-OD1 3.31Å; T74-D84 PolarHBondContact OG1-OD1 2.95Å
85	F	98.5	Very high	96.9	Very high	1 Å²	1	46 Å²	46	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	155.5	177.5	-68.9	-88.9	0	0	0	110.4	L15 E16 K17 L38 L40 L53 Y72 F73 L75 I83	L15-F85 HydrophobicContact CB-CD1 4.08Å; L15-F85 HydrophobicContact CD1-CD1 4.06Å; L15-F85 HydrophobicContact CD1-CE1 4.43Å; E16-F85 CarbonylContact O-C 3.48Å; E16-F85 VanDerWaalsContact O-CA 3.27Å; E16-F85 WeakPolarHBondContact O-CA 3.42Å; K17-F85 HydrophobicContact CB-CD1 3.93Å; K17-F85 HydrophobicContact CB-CE1 3.68Å; K17-F85 HydrophobicContact CB-CZ 4.45Å; K17-F85 HydrophobicContact CD-CE1 4.14Å; K17-F85 HydrophobicContact CD-CZ 4.14Å; K17-F85 HydrophobicContact CG-CD1 4.38Å; K17-F85 HydrophobicContact CG-CE1 3.93Å; K17-F85 HydrophobicContact CG-CZ 4.21Å; L38-F85 HydrophobicContact CD2-CE1 4.33Å; L38-F85 HydrophobicContact CD2-CZ 4.21Å; L40-F85 HydrophobicContact CD1-CE1 4.23Å; L40-F85 HydrophobicContact CD1-CZ 4.11Å; L40-F85 HydrophobicContact CD2-CE1 4.01Å; L40-F85 HydrophobicContact CD2-CZ 4.4Å; L53-F85 HydrophobicContact CD1-CE2 4.11Å; L53-F85 HydrophobicContact CD1-CZ 3.71Å; Y72-F85 WeakPolarHBondContact CA-O 3.37Å; F73-F85 HydrophobicContact CD1-CB 4.27Å; F73-F85 HydrophobicContact CD2-CB 4.05Å; F73-F85 HydrophobicContact CE1-CB 3.8Å; F73-F85 HydrophobicContact CE2-CB 3.55Å; F73-F85 HydrophobicContact CE2-CD2 4.01Å; F73-F85 AromaticContact CE2-CG 3.95Å; F73-F85 HydrophobicContact CE2-CG 3.95Å; F73-F85 HydrophobicContact CG-CB 4.39Å; F73-F85 HydrophobicContact CZ-CB 3.41Å; F73-F85 VanDerWaalsContact CZ-CB 3.41Å; F73-F85 HydrophobicContact CZ-CG 4.06Å; F73-F85 PolarHBondContact N-O 2.94Å; F73-F85 PolarHBondContact O-N 3.02Å; F73-F85 VanDerWaalsContact O-O 3.13Å; L75-F85 HydrophobicContact CB-CE2 4.43Å; L75-F85 HydrophobicContact CD1-CD2 4.22Å; L75-F85 HydrophobicContact CD1-CE2 3.63Å; L75-F85 HydrophobicContact CD1-CZ 4.37Å; L75-F85 HydrophobicContact CG-CD2 3.98Å; L75-F85 HydrophobicContact CG-CE2 3.81Å; I83-F85 HydrophobicContact CB-CE2 3.97Å; I83-F85 HydrophobicContact CG2-CD2 4.22Å; I83-F85 HydrophobicContact CG2-CE2 3.41Å; I83-F85 VanDerWaalsContact CG2-CE2 3.41Å; I83-F85 HydrophobicContact CG2-CZ 3.78Å; I83-F85 VanDerWaalsContact O-CD2 3.31Å; I83-F85 WeakPolarHBondContact O-CD2 3.14Å
86	R	98	Very high	96.9	Very high	43 Å²	43	48 Å²	48	16%	0.162	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	152	160.7	70.9	-175.8	-174.2	-178.7	0.3	110.9	E16 W26 H70 I71 Y72	E16-R86 HydrophobicContact CB-CG 3.87Å; E16-R86 PolarHBondContact N-O 2.88Å; E16-R86 PolarHBondContact O-N 3.15Å; E16-R86 IonicContact OE2-CZ 2.82Å; E16-R86 IonicContact OE2-NE 2.66Å; E16-R86 PolarHBondContact OE2-NE 2.84Å; E16-R86 IonicContact OE2-NH2 2.68Å; E16-R86 PolarHBondContact OE2-NH2 2.99Å; W26-R86 VanDerWaalsContact CD1-NH1 3.35Å; W26-R86 HydrophobicContact CD2-CG 4.02Å; W26-R86 HydrophobicContact CE3-CB 4.45Å; W26-R86 HydrophobicContact CE3-CG 3.67Å; W26-R86 HydrophobicContact CH2-CB 4.25Å; W26-R86 HydrophobicContact CH2-CG 4.23Å; W26-R86 HydrophobicContact CZ3-CB 4.07Å; W26-R86 HydrophobicContact CZ3-CG 3.8Å; H70-R86 HydrophobicContact CB-CB 4.26Å; I71-R86 CarbonylContact O-C 3.54Å; I71-R86 WeakPolarHBondContact O-CA 3.34Å; I71-R86 WeakPolarHBondContact O-CB 3.3Å; Y72-R86 HydrophobicContact CD1-CB 3.72Å; Y72-R86 HydrophobicContact CE1-CB 3.93Å; Y72-R86 HydrophobicContact CE1-CG 4.34Å; Y72-R86 HydrophobicContact CG-CB 4.17Å
87	C	97.8	Very high	96.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	155.1	170.3	67.5	0	0	0	0	110.4	L15 H70 I71 D91 W94	L15-C87 HydrophobicContact CD2-CB 3.65Å; H70-C87 CarbonylContact C-O 3.58Å; H70-C87 VanDerWaalsContact CA-O 3.22Å; H70-C87 WeakPolarHBondContact CA-O 3.28Å; H70-C87 WeakPolarHBondContact CB-O 3.39Å; I71-C87 PolarHBondContact N-O 2.86Å; I71-C87 PolarHBondContact O-N 2.89Å; C87-D91 PolarHBondContact SG-O 2.64Å; C87-W94 HydrophobicContact CB-CG 4.43Å
88	P	96	Very high	96.9	Very high	31 Å²	31	49.2 Å²	49.2	20%	0.201	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	151.7	171.3	-17.4	31.1	0	0	0	111.5	E90 D91	P88-E90 HydrophobicContact CB-CG 3.86Å; P88-E90 VanDerWaalsContact CB-OE1 3.26Å; P88-E90 WeakPolarHBondContact CB-OE1 3.13Å; P88-E90 WeakPolarHBondContact CB-OE2 3.38Å; P88-E90 PolarHBondContact O-N 3.15Å; P88-D91 CarbonylContact O-C 3.45Å; P88-D91 PolarHBondContact O-N 3.24Å; P88-D91 VanDerWaalsContact O-N 3.11Å
89	L	94.9	Very high	97	Very high	74 Å²	74	46.9 Å²	46.9	39%	0.387	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.5	175.2	-79.3	174.9	0	0	0	112.9	S66 G68 R69 I71 D91 P92	S66-L89 WeakPolarHBondContact OG-CD2 3.41Å; G68-L89 WeakPolarHBondContact O-CD1 3.44Å; R69-L89 PolarHBondContact O-N 2.88Å; R69-L89 VanDerWaalsContact O-N 3.07Å; I71-L89 HydrophobicContact CD1-CD2 4.12Å; I71-L89 HydrophobicContact CG1-CD2 3.68Å; L89-D91 VanDerWaalsContact C-N 3.29Å; L89-D91 PolarHBondContact O-N 2.93Å; L89-P92 WeakPolarHBondContact O-CD 3.35Å
90	E	95.2	Very high	97.1	Very high	158 Å²	158	49.2 Å²	49.2	74%	0.738	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-13.4	175.2	62.4	-92.7	-158.4	0	0	114.5	P88 P92	P88-E90 HydrophobicContact CB-CG 3.86Å; P88-E90 VanDerWaalsContact CB-OE1 3.26Å; P88-E90 WeakPolarHBondContact CB-OE1 3.13Å; P88-E90 WeakPolarHBondContact CB-OE2 3.38Å; P88-E90 PolarHBondContact O-N 3.15Å; E90-P92 VanDerWaalsContact C-CD 3.44Å
91	D	94.7	Very high	97.3	Very high	44 Å²	44	46.8 Å²	46.8	24%	0.235	26%	0.262	C	S	.	.	S	Bend	trans	-126.7	65.4	172.8	-175.2	30.8	0	0	0	111.1	K11 C87 P88 L89 W94	K11-D91 IonicContact NZ-OD1 2.89Å; K11-D91 PolarHBondContact NZ-OD1 2.66Å; K11-D91 IonicContact NZ-OD2 2.64Å; C87-D91 PolarHBondContact SG-O 2.64Å; P88-D91 CarbonylContact O-C 3.45Å; P88-D91 PolarHBondContact O-N 3.24Å; P88-D91 VanDerWaalsContact O-N 3.11Å; L89-D91 VanDerWaalsContact C-N 3.29Å; L89-D91 PolarHBondContact O-N 2.93Å; D91-W94 PolarHBondContact OD2-NE1 3.28Å
92	P	95.2	Very high	97.4	Very high	69 Å²	69	45.5 Å²	45.5	45%	0.448	25%	0.247	S	C	.	.			trans	-78.9	177.8	-174.3	35.3	-36.2	0	0	0	112.4	I71 L89 E90 W94	I71-P92 HydrophobicContact CD1-CB 3.65Å; L89-P92 WeakPolarHBondContact O-CD 3.35Å; E90-P92 VanDerWaalsContact C-CD 3.44Å; P92-W94 PolarHBondContact O-N 2.64Å
93	G	96.3	Very high	97.4	Very high	22 Å²	22	43.5 Å²	43.5	23%	0.227	24%	0.244	C	C	.	.			trans	88.6	-2.1	169.2	0	0	0	0	0	115.5	N95 A96 Q97	G93-N95 PolarHBondContact O-N 3.23Å; G93-A96 PolarHBondContact O-N 2.83Å; G93-Q97 WeakPolarHBondContact O-CG 3.34Å; G93-Q97 PolarHBondContact O-N 2.69Å
94	W	98.4	Very high	97.5	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-53.8	-50.9	174.3	-83.5	102.5	0	0	0	112.7	K11 L15 C31 L33 L38 F73 C87 D91 P92 A96 Q97 I98	K11-W94 HydrophobicContact CD-CD2 3.97Å; K11-W94 HydrophobicContact CD-CE3 4.2Å; K11-W94 HydrophobicContact CD-CG 4.41Å; K11-W94 HydrophobicContact CD-CH2 4.45Å; K11-W94 HydrophobicContact CD-CZ2 4.23Å; K11-W94 HydrophobicContact CD-CZ3 4.44Å; K11-W94 HydrophobicContact CG-CH2 4.06Å; K11-W94 HydrophobicContact CG-CZ2 4.09Å; K11-W94 HydrophobicContact CG-CZ3 4.33Å; L15-W94 HydrophobicContact CD1-CD2 3.81Å; L15-W94 HydrophobicContact CD1-CE3 3.59Å; L15-W94 HydrophobicContact CD1-CG 4.36Å; L15-W94 HydrophobicContact CD1-CH2 4.48Å; L15-W94 HydrophobicContact CD1-CZ3 3.94Å; L15-W94 HydrophobicContact CD2-CB 3.84Å; L15-W94 HydrophobicContact CD2-CD2 3.55Å; L15-W94 HydrophobicContact CD2-CE3 4.22Å; L15-W94 HydrophobicContact CD2-CG 3.37Å; L15-W94 HydrophobicContact CG-CD2 3.65Å; L15-W94 HydrophobicContact CG-CE3 3.93Å; L15-W94 HydrophobicContact CG-CG 4.05Å; L15-W94 HydrophobicContact CG-CH2 4.41Å; L15-W94 HydrophobicContact CG-CZ2 4.15Å; L15-W94 HydrophobicContact CG-CZ3 4.3Å; C31-W94 HydrophobicContact CB-CH2 3.44Å; C31-W94 VanDerWaalsContact CB-CH2 3.44Å; C31-W94 HydrophobicContact CB-CZ2 4.1Å; C31-W94 HydrophobicContact CB-CZ3 3.96Å; L33-W94 HydrophobicContact CB-CZ3 4.13Å; L38-W94 HydrophobicContact CD1-CE3 4.47Å; L38-W94 HydrophobicContact CD1-CZ3 3.75Å; F73-W94 HydrophobicContact CE1-CB 4.03Å; F73-W94 HydrophobicContact CZ-CB 4.04Å; C87-W94 HydrophobicContact CB-CG 4.43Å; D91-W94 PolarHBondContact OD2-NE1 3.28Å; P92-W94 PolarHBondContact O-N 2.64Å; W94-A96 VanDerWaalsContact C-N 3.34Å; W94-A96 PolarHBondContact O-N 3.08Å; W94-Q97 PolarHBondContact O-N 3.44Å; W94-I98 HydrophobicContact CE3-CD1 4.29Å; W94-I98 WeakPolarHBondContact O-CB 3.44Å; W94-I98 WeakPolarHBondContact O-CD1 3.27Å; W94-I98 WeakPolarHBondContact O-CG1 3.33Å; W94-I98 PolarHBondContact O-N 2.95Å
95	N	98	Very high	97.5	Very high	26 Å²	26	47.4 Å²	47.4	14%	0.139	26%	0.259	C	S	.	.	H	α-helix	trans	-57.7	-44.6	177.3	63.8	-57.7	0	0	0	111.9	V61 V64 F73 G93 T99	V61-N95 HydrophobicContact CG1-CB 4.31Å; V64-N95 HydrophobicContact CG1-CB 4.5Å; V64-N95 VanDerWaalsContact CG1-ND2 3.28Å; V64-N95 WeakPolarHBondContact CG1-ND2 3.48Å; V64-N95 HydrophobicContact CG2-CB 4.12Å; F73-N95 HydrophobicContact CB-CB 4.02Å; F73-N95 HydrophobicContact CD1-CB 3.96Å; F73-N95 HydrophobicContact CD2-CB 4.39Å; F73-N95 HydrophobicContact CG-CB 3.88Å; G93-N95 PolarHBondContact O-N 3.23Å; N95-T99 WeakPolarHBondContact O-CB 3.35Å; N95-T99 PolarHBondContact O-N 2.93Å; N95-T99 PolarHBondContact O-OG1 2.91Å
96	A	98.1	Very high	97.4	Very high	45 Å²	45	50.5 Å²	50.5	37%	0.372	27%	0.272	S	S	.	.	H	α-helix	trans	-66.5	-46.1	-178.3	0	0	0	0	0	111.8	G93 W94 T99 L100	G93-A96 PolarHBondContact O-N 2.83Å; W94-A96 VanDerWaalsContact C-N 3.34Å; W94-A96 PolarHBondContact O-N 3.08Å; A96-T99 WeakPolarHBondContact O-CB 3.46Å; A96-T99 PolarHBondContact O-N 3.4Å; A96-L100 WeakPolarHBondContact O-CG 3.26Å; A96-L100 PolarHBondContact O-N 3.06Å
97	Q	98.4	Very high	97.4	Very high	67 Å²	67	53 Å²	53	31%	0.313	29%	0.289	S	S	.	.	H	α-helix	trans	-70	-37.2	-180	-66.6	-175	13.9	0	0	112.7	L33 G93 W94 T99 L100 G101	L33-Q97 HydrophobicContact CD2-CB 3.78Å; G93-Q97 WeakPolarHBondContact O-CG 3.34Å; G93-Q97 PolarHBondContact O-N 2.69Å; W94-Q97 PolarHBondContact O-N 3.44Å; Q97-T99 VanDerWaalsContact C-N 3.3Å; Q97-L100 PolarHBondContact O-N 3Å; Q97-G101 PolarHBondContact O-N 2.77Å
98	I	98.7	Very high	97.4	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-61.7	-43.1	171.9	-67.6	167.2	0	0	0	109.7	L33 L38 F55 V61 F73 L75 W94 G101 L102	L33-I98 HydrophobicContact CD1-CG1 3.9Å; L33-I98 HydrophobicContact CD2-CG1 3.97Å; L38-I98 HydrophobicContact CD2-CD1 4.25Å; F55-I98 HydrophobicContact CE1-CG2 4.07Å; V61-I98 HydrophobicContact CG2-CB 4.38Å; V61-I98 HydrophobicContact CG2-CG2 3.68Å; F73-I98 HydrophobicContact CE2-CD1 3.77Å; F73-I98 HydrophobicContact CZ-CD1 4.04Å; L75-I98 HydrophobicContact CD2-CG2 3.9Å; W94-I98 HydrophobicContact CE3-CD1 4.29Å; W94-I98 WeakPolarHBondContact O-CB 3.44Å; W94-I98 WeakPolarHBondContact O-CD1 3.27Å; W94-I98 WeakPolarHBondContact O-CG1 3.33Å; W94-I98 PolarHBondContact O-N 2.95Å; I98-G101 PolarHBondContact O-N 3.44Å; I98-L102 VanDerWaalsContact O-CB 3.3Å; I98-L102 WeakPolarHBondContact O-CB 3.5Å; I98-L102 PolarHBondContact O-N 2.89Å
99	T	98.7	Very high	97.4	Very high	54 Å²	54	59.1 Å²	59.1	33%	0.331	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-49.2	177.3	-59.3	0	0	0	0	111.4	N95 A96 Q97 G101 L102 V103	N95-T99 WeakPolarHBondContact O-CB 3.35Å; N95-T99 PolarHBondContact O-N 2.93Å; N95-T99 PolarHBondContact O-OG1 2.91Å; A96-T99 WeakPolarHBondContact O-CB 3.46Å; A96-T99 PolarHBondContact O-N 3.4Å; Q97-T99 VanDerWaalsContact C-N 3.3Å; T99-G101 PolarHBondContact O-N 3.22Å; T99-L102 PolarHBondContact O-N 3.11Å; T99-V103 HydrophobicContact CG2-CG2 4.5Å; T99-V103 WeakPolarHBondContact O-CG2 3.22Å; T99-V103 PolarHBondContact O-N 3.24Å
100	L	98.5	Very high	97.5	Very high	124 Å²	124	58.1 Å²	58.1	65%	0.649	32%	0.317	S	S	*	.	H	α-helix	trans	-61.6	-43.8	177.7	-71.2	171.9	0	0	0	112.1	A96 Q97 L102 V103 K104	A96-L100 WeakPolarHBondContact O-CG 3.26Å; A96-L100 PolarHBondContact O-N 3.06Å; Q97-L100 PolarHBondContact O-N 3Å; L100-L102 VanDerWaalsContact C-N 3.35Å; L100-L102 PolarHBondContact O-N 3.46Å; L100-V103 PolarHBondContact O-N 3.04Å; L100-K104 WeakPolarHBondContact O-CB 3.41Å; L100-K104 PolarHBondContact O-N 2.86Å
101	G	98.2	Very high	97.6	Very high	5 Å²	5	53.9 Å²	53.9	5%	0.052	30%	0.299	C	S	.	.	H	α-helix	trans	-60.1	-44.1	175.5	0	0	0	0	0	112.2	Q97 I98 T99 K104 F105	Q97-G101 PolarHBondContact O-N 2.77Å; I98-G101 PolarHBondContact O-N 3.44Å; T99-G101 PolarHBondContact O-N 3.22Å; G101-K104 PolarHBondContact O-N 2.95Å; G101-F105 WeakPolarHBondContact O-CB 3.1Å; G101-F105 PolarHBondContact O-N 3.04Å
102	L	98.6	Very high	97.7	Very high	8 Å²	8	57.9 Å²	57.9	4%	0.042	32%	0.316	C	S	.	.	H	α-helix	trans	-63.7	-46.6	177.8	-179.3	61.2	0	0	0	112.1	F55 I58 I98 T99 L100 F105 K106	F55-L102 HydrophobicContact CB-CD1 3.93Å; F55-L102 HydrophobicContact CD1-CB 4.08Å; F55-L102 HydrophobicContact CD1-CD1 3.86Å; F55-L102 HydrophobicContact CE1-CB 4.1Å; F55-L102 HydrophobicContact CG-CD1 4.1Å; I58-L102 HydrophobicContact CB-CD1 4.14Å; I58-L102 HydrophobicContact CG2-CD1 4.29Å; I58-L102 HydrophobicContact CG2-CD2 3.81Å; I58-L102 WeakPolarHBondContact O-CD1 3.47Å; I98-L102 VanDerWaalsContact O-CB 3.3Å; I98-L102 WeakPolarHBondContact O-CB 3.5Å; I98-L102 PolarHBondContact O-N 2.89Å; T99-L102 PolarHBondContact O-N 3.11Å; L100-L102 VanDerWaalsContact C-N 3.35Å; L100-L102 PolarHBondContact O-N 3.46Å; L102-F105 PolarHBondContact O-N 3.17Å; L102-K106 HydrophobicContact CD1-CD 4.21Å; L102-K106 HydrophobicContact CD1-CG 4.26Å; L102-K106 HydrophobicContact CG-CD 4.38Å; L102-K106 WeakPolarHBondContact O-CG 3.49Å; L102-K106 PolarHBondContact O-N 3.38Å
103	V	98.5	Very high	97.7	Very high	92 Å²	92	57.6 Å²	57.6	56%	0.558	31%	0.313	S	S	*	.	H	α-helix	trans	-61.7	-46.3	178	170	0	0	0	0	110.6	T99 L100 F105 K106 N107	T99-V103 HydrophobicContact CG2-CG2 4.5Å; T99-V103 WeakPolarHBondContact O-CG2 3.22Å; T99-V103 PolarHBondContact O-N 3.24Å; L100-V103 PolarHBondContact O-N 3.04Å; V103-F105 VanDerWaalsContact C-N 3.34Å; V103-F105 PolarHBondContact O-N 2.89Å; V103-K106 PolarHBondContact O-N 2.83Å; V103-N107 VanDerWaalsContact O-CB 3.25Å; V103-N107 WeakPolarHBondContact O-CB 3.37Å; V103-N107 PolarHBondContact O-N 3.07Å
104	K	98.1	Very high	97.7	Very high	101 Å²	101	59.9 Å²	59.9	44%	0.439	32%	0.323	S	S	.	.	H	α-helix	trans	-57.7	-48	176.3	-175.6	-178	-178.5	-175.6	0	111	E35 L100 G101 N107 Q108	E35-K104 IonicContact OE1-NZ 2.81Å; E35-K104 PolarHBondContact OE1-NZ 2.8Å; L100-K104 WeakPolarHBondContact O-CB 3.41Å; L100-K104 PolarHBondContact O-N 2.86Å; G101-K104 PolarHBondContact O-N 2.95Å; K104-N107 PolarHBondContact O-N 3.49Å; K104-Q108 VanDerWaalsContact O-CG 3.3Å; K104-Q108 WeakPolarHBondContact O-CG 3.41Å; K104-Q108 PolarHBondContact O-N 3.49Å
105	F	97.8	Very high	97.5	Very high	31 Å²	31	67.8 Å²	67.8	14%	0.136	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-48.6	179.6	-179.3	-90.2	0	0	0	112.1	F55 A56 G101 L102 V103 N107 Q108 Q109	F55-F105 HydrophobicContact CB-CB 3.99Å; F55-F105 HydrophobicContact CB-CD1 3.54Å; F55-F105 HydrophobicContact CB-CD2 4.12Å; F55-F105 HydrophobicContact CB-CE1 4Å; F55-F105 HydrophobicContact CB-CG 3.61Å; F55-F105 HydrophobicContact CB-CZ 4.48Å; F55-F105 HydrophobicContact CD2-CB 3.86Å; F55-F105 HydrophobicContact CD2-CD2 4.4Å; F55-F105 HydrophobicContact CD2-CG 4.15Å; F55-F105 HydrophobicContact CG-CB 4.3Å; F55-F105 HydrophobicContact CG-CG 4.36Å; A56-F105 HydrophobicContact CB-CE1 4.02Å; A56-F105 HydrophobicContact CB-CZ 3.95Å; G101-F105 WeakPolarHBondContact O-CB 3.1Å; G101-F105 PolarHBondContact O-N 3.04Å; L102-F105 PolarHBondContact O-N 3.17Å; V103-F105 VanDerWaalsContact C-N 3.34Å; V103-F105 PolarHBondContact O-N 2.89Å; F105-N107 PolarHBondContact O-N 3.42Å; F105-Q108 PolarHBondContact O-N 3.43Å; F105-Q109 HydrophobicContact CD1-CG 4.4Å; F105-Q109 HydrophobicContact CE1-CG 4.02Å; F105-Q109 HydrophobicContact CZ-CG 4.32Å; F105-Q109 PolarHBondContact O-N 2.88Å
106	K	97.6	Very high	97.3	Very high	66 Å²	66	68.9 Å²	68.9	29%	0.287	37%	0.365	S	S	.	.	H	α-helix	trans	-65.2	-39	179	-73.2	-170.6	167.3	-167.5	0	112.3	I58 K59 E78 L102 V103 Q109 A110	I58-K106 VanDerWaalsContact O-CE 3.24Å; I58-K106 WeakPolarHBondContact O-CE 3.42Å; I58-K106 PolarHBondContact O-NZ 2.99Å; K59-K106 PolarHBondContact O-NZ 2.86Å; E78-K106 IonicContact OE1-NZ 3.15Å; E78-K106 PolarHBondContact OE1-NZ 3.28Å; L102-K106 HydrophobicContact CD1-CD 4.21Å; L102-K106 HydrophobicContact CD1-CG 4.26Å; L102-K106 HydrophobicContact CG-CD 4.38Å; L102-K106 WeakPolarHBondContact O-CG 3.49Å; L102-K106 PolarHBondContact O-N 3.38Å; V103-K106 PolarHBondContact O-N 2.83Å; K106-Q109 PolarHBondContact O-N 2.87Å; K106-A110 PolarHBondContact O-N 2.79Å
107	N	98.2	Very high	97	Very high	94 Å²	94	75 Å²	75	50%	0.503	38%	0.379	S	S	.	.	H	α-helix	trans	-62	-43.4	174.9	-178.7	-96.1	0	0	0	111.8	V103 K104 F105 Q109 A110 I111	V103-N107 VanDerWaalsContact O-CB 3.25Å; V103-N107 WeakPolarHBondContact O-CB 3.37Å; V103-N107 PolarHBondContact O-N 3.07Å; K104-N107 PolarHBondContact O-N 3.49Å; F105-N107 PolarHBondContact O-N 3.42Å; N107-Q109 PolarHBondContact O-N 3.13Å; N107-A110 PolarHBondContact O-N 2.86Å; N107-I111 WeakPolarHBondContact O-CG1 3.2Å; N107-I111 PolarHBondContact O-N 3.26Å; N107-I111 VanDerWaalsContact OD1-CD1 3.29Å; N107-I111 WeakPolarHBondContact OD1-CD1 3.26Å
108	Q	97.5	Very high	96.7	Very high	81 Å²	81	77.4 Å²	77.4	38%	0.379	39%	0.39	S	S	.	.	H	α-helix	trans	-61.2	-44.3	175.6	-73.4	172.4	-21.4	0	0	112.2	K104 F105 A110 I111 Q112	K104-Q108 VanDerWaalsContact O-CG 3.3Å; K104-Q108 WeakPolarHBondContact O-CG 3.41Å; K104-Q108 PolarHBondContact O-N 3.49Å; F105-Q108 PolarHBondContact O-N 3.43Å; Q108-A110 VanDerWaalsContact C-N 3.33Å; Q108-A110 PolarHBondContact O-N 3.22Å; Q108-I111 PolarHBondContact O-N 3.22Å; Q108-Q112 VanDerWaalsContact O-CG 3.3Å; Q108-Q112 WeakPolarHBondContact O-CG 3.49Å; Q108-Q112 PolarHBondContact O-N 2.91Å
109	Q	96.1	Very high	96.3	Very high	80 Å²	80	81.3 Å²	81.3	37%	0.374	42%	0.417	S	S	.	.	H	α-helix	trans	-61.4	-40.5	175.5	-72.4	-169.6	-27.5	0	0	112.3	F105 K106 N107 Q112 T113	F105-Q109 HydrophobicContact CD1-CG 4.4Å; F105-Q109 HydrophobicContact CE1-CG 4.02Å; F105-Q109 HydrophobicContact CZ-CG 4.32Å; F105-Q109 PolarHBondContact O-N 2.88Å; K106-Q109 PolarHBondContact O-N 2.87Å; N107-Q109 PolarHBondContact O-N 3.13Å; Q109-Q112 PolarHBondContact O-N 3.46Å; Q109-T113 WeakPolarHBondContact O-CB 3.38Å; Q109-T113 PolarHBondContact O-N 2.77Å; Q109-T113 PolarHBondContact O-OG1 2.94Å
110	A	96.8	Very high	95.7	Very high	53 Å²	53	84.7 Å²	84.7	44%	0.438	43%	0.433	S	S	.	.	H	α-helix	trans	-63.2	-46.8	176.7	0	0	0	0	0	111.4	K106 N107 Q108 Q112 T113 V114	K106-A110 PolarHBondContact O-N 2.79Å; N107-A110 PolarHBondContact O-N 2.86Å; Q108-A110 VanDerWaalsContact C-N 3.33Å; Q108-A110 PolarHBondContact O-N 3.22Å; A110-Q112 PolarHBondContact O-N 2.9Å; A110-T113 WeakPolarHBondContact O-CB 3.34Å; A110-T113 PolarHBondContact O-N 3.24Å; A110-V114 WeakPolarHBondContact O-CG2 3.26Å; A110-V114 PolarHBondContact O-N 2.72Å
111	I	97.6	Very high	94.5	Very high	69 Å²	69	80.8 Å²	80.8	35%	0.354	42%	0.422	S	S	.	.	H	α-helix	trans	-60.1	-45	176.7	-68.9	167.7	0	0	0	111.1	N107 Q108 T113 V114 R115	N107-I111 WeakPolarHBondContact O-CG1 3.2Å; N107-I111 PolarHBondContact O-N 3.26Å; N107-I111 VanDerWaalsContact OD1-CD1 3.29Å; N107-I111 WeakPolarHBondContact OD1-CD1 3.26Å; Q108-I111 PolarHBondContact O-N 3.22Å; I111-T113 VanDerWaalsContact C-N 3.33Å; I111-T113 PolarHBondContact O-N 3.29Å; I111-V114 PolarHBondContact O-N 2.91Å; I111-R115 HydrophobicContact CG2-CG 4.44Å; I111-R115 WeakPolarHBondContact O-CG 3.3Å; I111-R115 PolarHBondContact O-N 2.79Å
112	Q	96.1	Very high	92.7	Very high	127 Å²	127	85.5 Å²	85.5	59%	0.593	45%	0.45	S	S	*	.	H	α-helix	trans	-61.3	-42.6	177.7	-74.2	172.5	-8.3	0	0	111.7	Q108 Q109 A110 V114 R115 A116	Q108-Q112 VanDerWaalsContact O-CG 3.3Å; Q108-Q112 WeakPolarHBondContact O-CG 3.49Å; Q108-Q112 PolarHBondContact O-N 2.91Å; Q109-Q112 PolarHBondContact O-N 3.46Å; A110-Q112 PolarHBondContact O-N 2.9Å; Q112-V114 PolarHBondContact O-N 2.7Å; Q112-R115 PolarHBondContact O-N 3.47Å; Q112-A116 WeakPolarHBondContact O-CB 3.33Å; Q112-A116 PolarHBondContact O-N 3Å
113	T	95.7	Very high	90.7	Very high	64 Å²	64	88 Å²	88	39%	0.393	48%	0.477	S	S	.	.	H	α-helix	trans	-62.1	-43.1	177	-60.3	0	0	0	0	111.5	Q109 A110 I111 A116 R117	Q109-T113 WeakPolarHBondContact O-CB 3.38Å; Q109-T113 PolarHBondContact O-N 2.77Å; Q109-T113 PolarHBondContact O-OG1 2.94Å; A110-T113 WeakPolarHBondContact O-CB 3.34Å; A110-T113 PolarHBondContact O-N 3.24Å; I111-T113 VanDerWaalsContact C-N 3.33Å; I111-T113 PolarHBondContact O-N 3.29Å; T113-A116 PolarHBondContact O-N 2.87Å; T113-R117 WeakPolarHBondContact O-CG 3.48Å; T113-R117 PolarHBondContact O-N 2.82Å; T113-R117 VanDerWaalsContact O-N 3.11Å
114	V	95.5	Very high	88.6	Confident	69 Å²	69	89 Å²	89	42%	0.418	48%	0.484	S	S	.	.	H	α-helix	trans	-63.3	-47.6	176.4	171	0	0	0	0	111	A110 I111 Q112 A116 R117 Q118	A110-V114 WeakPolarHBondContact O-CG2 3.26Å; A110-V114 PolarHBondContact O-N 2.72Å; I111-V114 PolarHBondContact O-N 2.91Å; Q112-V114 PolarHBondContact O-N 2.7Å; V114-A116 VanDerWaalsContact C-N 3.33Å; V114-A116 PolarHBondContact O-N 2.76Å; V114-R117 PolarHBondContact O-N 2.9Å; V114-Q118 WeakPolarHBondContact O-CG 3.47Å; V114-Q118 PolarHBondContact O-N 2.93Å
115	R	95.1	Very high	86.5	Confident	167 Å²	167	91.5 Å²	91.5	63%	0.63	50%	0.501	S	S	*	.	H	α-helix	trans	-59.7	-42.8	178.1	-73.4	177.4	178.2	-179.7	-0.2	112.1	I111 Q112 R117 Q118 S119	I111-R115 HydrophobicContact CG2-CG 4.44Å; I111-R115 WeakPolarHBondContact O-CG 3.3Å; I111-R115 PolarHBondContact O-N 2.79Å; Q112-R115 PolarHBondContact O-N 3.47Å; R115-R117 VanDerWaalsContact C-N 3.35Å; R115-R117 PolarHBondContact O-N 3.04Å; R115-Q118 PolarHBondContact O-N 3.47Å; R115-S119 PolarHBondContact O-N 2.62Å; R115-S119 PolarHBondContact O-OG 3.3Å
116	A	93.2	Very high	84.1	Confident	49 Å²	49	96.3 Å²	96.3	41%	0.405	53%	0.533	S	S	.	.	H	α-helix	trans	-62.1	-41.4	177.4	0	0	0	0	0	112.1	Q112 T113 V114 S119 L120	Q112-A116 WeakPolarHBondContact O-CB 3.33Å; Q112-A116 PolarHBondContact O-N 3Å; T113-A116 PolarHBondContact O-N 2.87Å; V114-A116 VanDerWaalsContact C-N 3.33Å; V114-A116 PolarHBondContact O-N 2.76Å; A116-S119 WeakPolarHBondContact CA-OG 3.18Å; A116-S119 PolarHBondContact O-N 2.65Å; A116-S119 PolarHBondContact O-OG 3.48Å; A116-L120 WeakPolarHBondContact O-CG 3.49Å; A116-L120 PolarHBondContact O-N 2.68Å; A116-L120 VanDerWaalsContact O-N 3.15Å
117	R	92.4	Very high	81.5	Confident	173 Å²	173	101.8 Å²	101.8	65%	0.653	58%	0.579	S	S	*	*	H	α-helix	trans	-64.2	-41.4	175.1	-71.2	171.5	-178.1	168.2	1	112.1	T113 V114 R115 L120 G121	T113-R117 WeakPolarHBondContact O-CG 3.48Å; T113-R117 PolarHBondContact O-N 2.82Å; T113-R117 VanDerWaalsContact O-N 3.11Å; V114-R117 PolarHBondContact O-N 2.9Å; R115-R117 VanDerWaalsContact C-N 3.35Å; R115-R117 PolarHBondContact O-N 3.04Å; R117-L120 PolarHBondContact O-N 3.11Å; R117-G121 PolarHBondContact O-N 3.04Å
118	Q	92	Very high	80.7	Confident	118 Å²	118	102.2 Å²	102.2	55%	0.551	58%	0.583	S	S	*	*	H	α-helix	trans	-63.8	-43.6	176.8	-71.8	171.8	-22.2	0	0	111.6	V114 R115 L120 G121 T122	V114-Q118 WeakPolarHBondContact O-CG 3.47Å; V114-Q118 PolarHBondContact O-N 2.93Å; R115-Q118 PolarHBondContact O-N 3.47Å; Q118-L120 VanDerWaalsContact C-N 3.27Å; Q118-L120 PolarHBondContact O-N 2.87Å; Q118-G121 PolarHBondContact O-N 2.93Å; Q118-T122 PolarHBondContact O-N 2.89Å; Q118-T122 VanDerWaalsContact O-N 3.1Å; Q118-T122 PolarHBondContact O-OG1 3.22Å
119	S	89.7	Confident	79.8	Confident	82 Å²	82	103.3 Å²	103.3	57%	0.573	59%	0.594	S	S	*	*	H	α-helix	trans	-63.3	-32.1	176.9	54.4	0	0	0	0	113.5	R115 A116	R115-S119 PolarHBondContact O-N 2.62Å; R115-S119 PolarHBondContact O-OG 3.3Å; A116-S119 WeakPolarHBondContact CA-OG 3.18Å; A116-S119 PolarHBondContact O-N 2.65Å; A116-S119 PolarHBondContact O-OG 3.48Å
120	L	85.8	Confident	78.9	Confident	126 Å²	126	104.6 Å²	104.6	66%	0.66	61%	0.606	S	S	*	*	H	α-helix	trans	-73.7	-42.5	175.5	-70.4	166.4	0	0	0	111.6	A116 R117 Q118 T122 G123 T124	A116-L120 WeakPolarHBondContact O-CG 3.49Å; A116-L120 PolarHBondContact O-N 2.68Å; A116-L120 VanDerWaalsContact O-N 3.15Å; R117-L120 PolarHBondContact O-N 3.11Å; Q118-L120 VanDerWaalsContact C-N 3.27Å; Q118-L120 PolarHBondContact O-N 2.87Å; L120-T122 PolarHBondContact O-N 2.82Å; L120-G123 PolarHBondContact O-N 3.21Å; L120-T124 PolarHBondContact O-OG1 3.07Å
121	G	73.1	Confident	77.9	Confident	42 Å²	42	107.6 Å²	107.6	43%	0.433	62%	0.616	S	S	.	*	H	α-helix	trans	-65.4	-36	-179.8	0	0	0	0	0	114	R117 Q118 G123 T124	R117-G121 PolarHBondContact O-N 3.04Å; Q118-G121 PolarHBondContact O-N 2.93Å; G121-G123 VanDerWaalsContact C-N 3.29Å; G121-G123 PolarHBondContact O-N 2.81Å; G121-T124 PolarHBondContact O-N 3.09Å
122	T	62.3	Low	76.6	Confident	104 Å²	104	110 Å²	110	64%	0.638	63%	0.633	S	S	*	*	H	α-helix	trans	-70.9	-26	177	-43.4	0	0	0	0	112.4	Q118 L120 T124	Q118-T122 PolarHBondContact O-N 2.89Å; Q118-T122 VanDerWaalsContact O-N 3.1Å; Q118-T122 PolarHBondContact O-OG1 3.22Å; L120-T122 PolarHBondContact O-N 2.82Å; T122-T124 VanDerWaalsContact C-N 3.32Å; T122-T124 PolarHBondContact O-N 3.31Å
123	G	56.4	Low	75.3	Confident	59 Å²	59	108.9 Å²	108.9	61%	0.608	64%	0.635	S	S	*	*	H	α-helix	trans	-73.9	-18.4	178.7	0	0	0	0	0	114.5	L120 G121	L120-G123 PolarHBondContact O-N 3.21Å; G121-G123 VanDerWaalsContact C-N 3.29Å; G121-G123 PolarHBondContact O-N 2.81Å
124	T	54.3	Low	73.9	Confident	113 Å²	113	112.1 Å²	112.1	69%	0.693	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-12.7	-176.7	-45.7	0	0	0	0	113.6	L120 G121 T122	L120-T124 PolarHBondContact O-OG1 3.07Å; G121-T124 PolarHBondContact O-N 3.09Å; T122-T124 VanDerWaalsContact C-N 3.32Å; T122-T124 PolarHBondContact O-N 3.31Å
125	L	54.4	Low	72.2	Confident	154 Å²	154	115.4 Å²	115.4	81%	0.806	67%	0.67	S	S	*	*	S	Bend	trans	-94.4	14.7	-178.3	-70.7	174.2	0	0	0	114.5
126	V	46.5	Very low	70.3	Confident	133 Å²	133	111.1 Å²	111.1	81%	0.806	67%	0.674	S	S	*	*			trans	-116.7	80.3	169.6	-167.3	0	0	0	0	108.8
127	S	43.7	Very low	68.2	Low	180 Å²	180	116.7 Å²	116.7	100%	1.259	70%	0.698	S	S	*	*			trans	-134.2	0	156.2	74.9	0	0	0	0	108

Retrieved 127 of 127 residues in 23.1 ms (Link to these results)

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