A0A023ILN9_RAT Loading...

Proteasome subunit beta

Component of the proteasome, a multicatalytic proteinase complex which is characterized by its ability to cleave peptides with Arg, Phe, Tyr, Leu, and Glu adjacent to the leaving group at neutral or slightly basic pH. The proteasome has an ATP-dependent proteolytic activity.

AlphaFold DB , UniProt , Accession A0A023ILN9, Species RAT (Rattus norvegicus, Rat), Gene Psmb9, Length 219 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37	Very low	35.8	Very low	243 Å²	243	128.2 Å²	128.2	100%	1.197	83%	0.829	S	S	*	*				0	103.9	0	-81.4	-177	173.2	0	0	108.5
2	L	29.8	Very low	35.6	Very low	179 Å²	179	134.3 Å²	134.3	94%	0.937	83%	0.834	S	S	*	*			trans	-146.1	101.7	166.1	-98.2	144.9	0	0	0	105
3	K	32.1	Very low	36	Very low	209 Å²	209	137.5 Å²	137.5	91%	0.909	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76.9	128	175.3	-84	-175.8	172.7	-178.6	0	108	G5	K3-G5 PolarHBondContact O-N 2.84Å
4	A	38.9	Very low	36.7	Very low	102 Å²	102	137.4 Å²	137.4	84%	0.843	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-57.7	128.3	168.2	0	0	0	0	0	109.9
5	G	34.1	Very low	37.3	Very low	75 Å²	75	132.2 Å²	132.2	77%	0.773	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-72.7	128.1	170.8	0	0	0	0	0	109.8	K3	K3-G5 PolarHBondContact O-N 2.84Å
6	A	37.4	Very low	38	Very low	88 Å²	88	132.9 Å²	132.9	73%	0.727	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-63.5	142.6	172.5	0	0	0	0	0	110.2	T8	A6-T8 PolarHBondContact O-N 3.32Å
7	P	38.4	Very low	38.9	Very low	128 Å²	128	129.3 Å²	129.3	83%	0.831	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-63.2	126.6	170.3	26	-30.2	0	0	0	108.8	A9	P7-A9 PolarHBondContact O-N 2.85Å
8	T	40.2	Very low	39.9	Very low	134 Å²	134	128.2 Å²	128.2	82%	0.822	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-57.4	130.6	171.2	37.1	0	0	0	0	108.8	A6 G10	A6-T8 PolarHBondContact O-N 3.32Å; T8-G10 VanDerWaalsContact C-N 3.32Å; T8-G10 PolarHBondContact O-N 3.02Å
9	A	36.9	Very low	41.2	Very low	105 Å²	105	122.3 Å²	122.3	87%	0.868	73%	0.728	S	S	*	*			trans	-58.8	96.7	173.3	0	0	0	0	0	108.8	P7 S11	P7-A9 PolarHBondContact O-N 2.85Å; A9-S11 PolarHBondContact O-N 3.49Å
10	G	32.4	Very low	42.8	Very low	56 Å²	56	116.3 Å²	116.3	58%	0.577	69%	0.692	S	S	*	*			trans	-60.1	130.6	170.7	0	0	0	0	0	108.7	T8 F12	T8-G10 VanDerWaalsContact C-N 3.32Å; T8-G10 PolarHBondContact O-N 3.02Å; G10-F12 PolarHBondContact O-N 2.58Å
11	S	35.9	Very low	45.1	Very low	91 Å²	91	110.9 Å²	110.9	64%	0.636	66%	0.66	S	S	*	*			trans	-42.6	122.9	166.3	172.1	0	0	0	0	110	A9 R13	A9-S11 PolarHBondContact O-N 3.49Å; S11-R13 PolarHBondContact O-N 3.14Å; S11-R13 WeakPolarHBondContact OG-CG 3.18Å
12	F	33.5	Very low	47.9	Very low	202 Å²	202	99.3 Å²	99.3	89%	0.886	60%	0.603	S	S	*	*			trans	-70	40.8	171.2	-71	-86.7	0	0	0	112.1	G10 T14	G10-F12 PolarHBondContact O-N 2.58Å; F12-T14 VanDerWaalsContact C-N 3.25Å; F12-T14 PolarHBondContact O-N 3.42Å
13	R	41.8	Very low	51.1	Low	175 Å²	175	90.9 Å²	90.9	66%	0.66	56%	0.559	S	S	*	*			trans	-75.7	89	164.4	-76.7	-176.3	-177.8	-156.9	-3.1	106.7	S11 G15 E112	S11-R13 PolarHBondContact O-N 3.14Å; S11-R13 WeakPolarHBondContact OG-CG 3.18Å; R13-G15 PolarHBondContact O-N 3.32Å; R13-E112 PolarHBondContact NH2-O 3.42Å
14	T	45.5	Very low	54.2	Low	137 Å²	137	81 Å²	81	84%	0.84	52%	0.516	S	S	*	.			trans	-41.9	122.3	155.6	7.3	0	0	0	0	107	F12	F12-T14 VanDerWaalsContact C-N 3.25Å; F12-T14 PolarHBondContact O-N 3.42Å
15	G	44.9	Very low	57	Low	59 Å²	59	76.1 Å²	76.1	61%	0.608	48%	0.476	S	S	*	.			trans	-48.2	146.7	-166.1	0	0	0	0	0	113.5	R13 V17	R13-G15 PolarHBondContact O-N 3.32Å; G15-V17 WeakPolarHBondContact O-CG2 3.41Å; G15-V17 PolarHBondContact O-N 3.35Å
16	E	49.1	Very low	60.1	Low	144 Å²	144	72.5 Å²	72.5	67%	0.673	44%	0.439	S	S	*	.			trans	-47	108.9	-178.9	-70.7	-179.4	166.3	0	0	111.2	H18	E16-H18 PolarHBondContact O-N 2.77Å; E16-H18 IonicContact OE2-CD2 2.95Å; E16-H18 IonicContact OE2-CE1 3.3Å; E16-H18 IonicContact OE2-NE2 2.75Å; E16-H18 PolarHBondContact OE2-NE2 2.78Å
17	V	52.9	Low	63	Low	71 Å²	71	70.8 Å²	70.8	43%	0.43	42%	0.416	S	S	.	.			trans	-85.6	89.4	172.4	-173.4	0	0	0	0	106.9	G15 T19 A42	G15-V17 WeakPolarHBondContact O-CG2 3.41Å; G15-V17 PolarHBondContact O-N 3.35Å; V17-T19 HydrophobicContact CG1-CG2 3.85Å; V17-T19 PolarHBondContact O-N 3.39Å; V17-T19 VanDerWaalsContact O-N 3.09Å; V17-A42 HydrophobicContact CG1-CB 4.08Å
18	H	57.7	Low	65.8	Low	110 Å²	110	65.4 Å²	65.4	51%	0.509	38%	0.379	S	S	.	.			trans	-71.4	99.7	167.4	-69.5	-72.9	0	0	0	108.3	E16 S41	E16-H18 PolarHBondContact O-N 2.77Å; E16-H18 IonicContact OE2-CD2 2.95Å; E16-H18 IonicContact OE2-CE1 3.3Å; E16-H18 IonicContact OE2-NE2 2.75Å; E16-H18 PolarHBondContact OE2-NE2 2.78Å; H18-S41 PolarHBondContact O-OG 3.16Å
19	T	63.6	Low	68.5	Low	16 Å²	16	66.5 Å²	66.5	10%	0.098	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-84	114.5	171	80.3	0	0	0	0	107.7	V17 T21 V40 G67 A69	V17-T19 HydrophobicContact CG1-CG2 3.85Å; V17-T19 PolarHBondContact O-N 3.39Å; V17-T19 VanDerWaalsContact O-N 3.09Å; T19-T21 PolarHBondContact O-N 3.07Å; T19-T21 PolarHBondContact O-OG1 3Å; T19-V40 HydrophobicContact CG2-CG1 3.55Å; T19-G67 PolarHBondContact OG1-O 2.88Å; T19-A69 HydrophobicContact CG2-CB 4.39Å
20	G	73.9	Confident	71.2	Confident	2 Å²	2	63.3 Å²	63.3	2%	0.021	36%	0.358	C	S	.	.			trans	-57.1	140.2	177.3	0	0	0	0	0	111.4	S41 K53 S149 S188	G20-S41 PolarHBondContact N-OG 3.38Å; G20-K53 PolarHBondContact O-NZ 2.91Å; G20-S149 WeakPolarHBondContact CA-OG 3.27Å; G20-S188 CarbonylContact C-O 3.58Å; G20-S188 WeakPolarHBondContact CA-O 3.41Å
21	T	90.9	Very high	74.3	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.012	33%	0.33	C	S	.	.			trans	-151.7	138	-174.7	-65	0	0	0	0	110.7	T19 I23 K53 L65 G148 S149 G150 S189	T19-T21 PolarHBondContact O-N 3.07Å; T19-T21 PolarHBondContact O-OG1 3Å; T21-I23 HydrophobicContact CG2-CB 4.47Å; T21-I23 HydrophobicContact CG2-CG1 4.38Å; T21-I23 HydrophobicContact CG2-CG2 3.65Å; T21-K53 HydrophobicContact CG2-CD 3.74Å; T21-K53 PolarHBondContact OG1-NZ 2.84Å; T21-L65 WeakPolarHBondContact CG2-O 3.42Å; T21-G148 CarbonylContact O-C 3.3Å; T21-G148 WeakPolarHBondContact O-CA 3.19Å; T21-S149 PolarHBondContact N-OG 3.45Å; T21-S149 PolarHBondContact O-N 3.22Å; T21-S149 PolarHBondContact O-OG 3.43Å; T21-G150 PolarHBondContact O-N 2.87Å; T21-S189 VanDerWaalsContact C-OG 3.31Å
22	T	95.9	Very high	77.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.3	C	S	.	.			trans	-123.3	115.6	161.1	-52.5	0	0	0	0	107.9	S36 D37 G150 I154 I179 A182 S189	T22-S36 VanDerWaalsContact O-CA 3.3Å; T22-S36 WeakPolarHBondContact O-CA 3.44Å; T22-D37 PolarHBondContact N-OD1 2.75Å; T22-D37 PolarHBondContact O-N 3.1Å; T22-G150 WeakPolarHBondContact OG1-CA 3.49Å; T22-I154 HydrophobicContact CG2-CD1 4.26Å; T22-I179 HydrophobicContact CG2-CB 4.46Å; T22-I179 HydrophobicContact CG2-CG1 4.1Å; T22-I179 HydrophobicContact CG2-CG2 4.42Å; T22-A182 HydrophobicContact CG2-CB 3.54Å; T22-A182 WeakPolarHBondContact OG1-CB 3.2Å; T22-S189 PolarHBondContact N-OG 2.8Å; T22-S189 PolarHBondContact OG1-OG 2.85Å
23	I	96.8	Very high	80.4	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.015	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	147.5	172.8	53	168.8	0	0	0	109.7	T21 G35 A64 M119 I146 G147	T21-I23 HydrophobicContact CG2-CB 4.47Å; T21-I23 HydrophobicContact CG2-CG1 4.38Å; T21-I23 HydrophobicContact CG2-CG2 3.65Å; I23-G35 WeakPolarHBondContact CA-O 3.11Å; I23-A64 HydrophobicContact CB-CB 3.87Å; I23-A64 HydrophobicContact CD1-CB 3.89Å; I23-A64 HydrophobicContact CG1-CB 4.48Å; I23-A64 HydrophobicContact CG2-CB 3.83Å; I23-M119 HydrophobicContact CD1-CB 4.21Å; I23-M119 HydrophobicContact CD1-CE 4.25Å; I23-M119 HydrophobicContact CG1-CE 4.34Å; I23-I146 WeakPolarHBondContact O-CA 3.46Å; I23-G147 WeakPolarHBondContact CG1-O 3.38Å; I23-G147 PolarHBondContact N-O 3.23Å; I23-G147 PolarHBondContact O-N 3Å
24	M	97.4	Very high	83.1	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	145.5	179	177.6	168.4	172	0	0	110.5	V34 G35 A145 I146 V158 F174 T175 A178 I179	M24-V34 CarbonylContact O-C 3.59Å; M24-V34 WeakPolarHBondContact O-CA 3.4Å; M24-G35 PolarHBondContact N-O 2.91Å; M24-G35 PolarHBondContact O-N 2.88Å; M24-A145 CarbonylContact C-O 3.59Å; M24-A145 VanDerWaalsContact CA-O 3.3Å; M24-A145 WeakPolarHBondContact CA-O 3.09Å; M24-I146 HydrophobicContact CB-CG2 4.13Å; M24-I146 HydrophobicContact CG-CG2 3.84Å; M24-I146 HydrophobicContact SD-CG2 3.98Å; M24-V158 HydrophobicContact CE-CG1 4.45Å; M24-F174 HydrophobicContact CE-CD1 3.38Å; M24-F174 HydrophobicContact CE-CD2 4.41Å; M24-F174 HydrophobicContact CE-CE1 3.08Å; M24-F174 HydrophobicContact CE-CE2 4.15Å; M24-F174 HydrophobicContact CE-CG 4.06Å; M24-F174 HydrophobicContact CE-CZ 3.51Å; M24-T175 HydrophobicContact CB-CG2 4.22Å; M24-T175 HydrophobicContact CG-CG2 4.24Å; M24-T175 HydrophobicContact SD-CG2 4.34Å; M24-A178 HydrophobicContact CE-CB 4.28Å; M24-A178 HydrophobicContact SD-CB 3.49Å; M24-A178 WeakPolarHBondContact SD-CB 3.4Å; M24-I179 HydrophobicContact CB-CD1 4.46Å; M24-I179 HydrophobicContact CB-CG1 4.43Å
25	A	98.1	Very high	85.6	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	148	166.1	0	0	0	0	0	110.6	V33 V34 M119 A121 V131 F144 A145	A25-V33 CarbonylContact C-O 3.55Å; A25-V33 WeakPolarHBondContact CA-O 3.37Å; A25-V34 HydrophobicContact CB-CG1 4.27Å; A25-V34 HydrophobicContact CB-CG2 4.28Å; A25-M119 HydrophobicContact CB-SD 3.45Å; A25-M119 WeakPolarHBondContact CB-SD 3.29Å; A25-A121 HydrophobicContact CB-CB 3.92Å; A25-V131 HydrophobicContact CB-CB 4.42Å; A25-V131 HydrophobicContact CB-CG1 3.71Å; A25-V131 HydrophobicContact CB-CG2 3.8Å; A25-F144 CarbonylContact O-C 3.57Å; A25-F144 WeakPolarHBondContact O-CA 3.45Å; A25-F144 WeakPolarHBondContact O-CB 3.39Å; A25-A145 PolarHBondContact N-O 3.1Å; A25-A145 PolarHBondContact O-N 2.79Å
26	V	98.3	Very high	88.1	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	134	178.9	58.6	0	0	0	0	110.2	V32 V33 F144 Y162 C171 F174 T175	V26-V32 CarbonylContact O-C 3.51Å; V26-V32 VanDerWaalsContact O-CA 3.29Å; V26-V32 WeakPolarHBondContact O-CA 3.42Å; V26-V33 HydrophobicContact CG1-CB 3.91Å; V26-V33 PolarHBondContact N-O 2.94Å; V26-V33 PolarHBondContact O-N 2.9Å; V26-F144 HydrophobicContact CB-CB 4.11Å; V26-F144 HydrophobicContact CG2-CB 4.12Å; V26-Y162 HydrophobicContact CG2-CE2 4.23Å; V26-C171 HydrophobicContact CG1-CB 3.66Å; V26-F174 HydrophobicContact CG2-CD1 4.29Å; V26-F174 HydrophobicContact CG2-CE1 4.41Å; V26-T175 WeakPolarHBondContact CG1-OG1 3.39Å
27	E	98.1	Very high	90.4	Very high	51 Å²	51	22.2 Å²	22.2	24%	0.238	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	139.2	175.2	-170.9	176.7	150.9	0	0	110.1	V32 G129 V131 R141 P143	E27-V32 HydrophobicContact CB-CG1 4.42Å; E27-V32 HydrophobicContact CG-CG1 4.47Å; E27-G129 WeakPolarHBondContact CG-O 3.4Å; E27-G129 VanDerWaalsContact OE1-O 3.09Å; E27-V131 HydrophobicContact CB-CG2 4.41Å; E27-R141 IonicContact OE1-NH2 3.81Å; E27-R141 PolarHBondContact OE1-NH2 3.3Å; E27-R141 VanDerWaalsContact OE1-NH2 3.1Å; E27-R141 IonicContact OE2-NE 2.75Å; E27-R141 IonicContact OE2-NH2 3.98Å; E27-P143 WeakPolarHBondContact CB-O 3.42Å; E27-P143 PolarHBondContact N-O 3.1Å
28	F	97.7	Very high	92.5	Very high	15 Å²	15	18.9 Å²	18.9	7%	0.066	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	168.9	172.9	66.8	-94.5	0	0	0	110.4	G30 G31 V32 V33 M166 P168 C171 T197 T199	F28-G30 PolarHBondContact O-N 3.08Å; F28-G31 WeakPolarHBondContact CD1-O 3.23Å; F28-G31 PolarHBondContact N-O 3.11Å; F28-G31 PolarHBondContact O-N 3.35Å; F28-G31 VanDerWaalsContact O-N 3.1Å; F28-V32 VanDerWaalsContact CE1-C 3.44Å; F28-V32 VanDerWaalsContact CE1-N 3.32Å; F28-V33 HydrophobicContact CD1-CG2 4.07Å; F28-V33 HydrophobicContact CE1-CG2 3.76Å; F28-M166 WeakPolarHBondContact CB-O 3.48Å; F28-P168 HydrophobicContact CD2-CB 4.18Å; F28-P168 HydrophobicContact CD2-CG 3.76Å; F28-P168 HydrophobicContact CE1-CB 4.32Å; F28-P168 HydrophobicContact CE2-CB 3.84Å; F28-P168 HydrophobicContact CE2-CG 3.52Å; F28-P168 HydrophobicContact CZ-CB 3.9Å; F28-P168 HydrophobicContact CZ-CG 4.1Å; F28-C171 HydrophobicContact CD1-CB 4.31Å; F28-T197 HydrophobicContact CE1-CG2 4.09Å; F28-T197 HydrophobicContact CZ-CG2 3.98Å; F28-T199 HydrophobicContact CE2-CG2 4.41Å; F28-T199 HydrophobicContact CZ-CG2 3.93Å
29	D	96.1	Very high	94.2	Very high	158 Å²	158	17 Å²	17	85%	0.845	9%	0.093	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	108.9	178.5	-171.3	18.2	0	0	0	111.1
30	G	94.7	Very high	95.5	Very high	38 Å²	38	16.7 Å²	16.7	39%	0.392	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.1	-2.2	-177.4	0	0	0	0	0	115.8	F28	F28-G30 PolarHBondContact O-N 3.08Å
31	G	97.8	Very high	96.2	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.7	-163.8	-178.4	0	0	0	0	0	117.2	F28 I198	F28-G31 WeakPolarHBondContact CD1-O 3.23Å; F28-G31 PolarHBondContact N-O 3.11Å; F28-G31 PolarHBondContact O-N 3.35Å; F28-G31 VanDerWaalsContact O-N 3.1Å; G31-I198 CarbonylContact C-O 3.58Å; G31-I198 WeakPolarHBondContact CA-O 3.5Å
32	V	98.4	Very high	95.9	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	151	174.7	-60.8	0	0	0	0	111	V26 E27 F28 V34 A121 Q130 V131 I198	V26-V32 CarbonylContact O-C 3.51Å; V26-V32 VanDerWaalsContact O-CA 3.29Å; V26-V32 WeakPolarHBondContact O-CA 3.42Å; E27-V32 HydrophobicContact CB-CG1 4.42Å; E27-V32 HydrophobicContact CG-CG1 4.47Å; F28-V32 VanDerWaalsContact CE1-C 3.44Å; F28-V32 VanDerWaalsContact CE1-N 3.32Å; V32-V34 HydrophobicContact CG2-CG2 4.37Å; V32-A121 HydrophobicContact CG2-CB 4.23Å; V32-Q130 VanDerWaalsContact CG1-N 3.31Å; V32-V131 HydrophobicContact CB-CG2 4.45Å; V32-V131 HydrophobicContact CG1-CG2 3.97Å; V32-I198 HydrophobicContact CG2-CB 3.82Å; V32-I198 HydrophobicContact CG2-CD1 3.88Å; V32-I198 HydrophobicContact CG2-CG1 4.18Å; V32-I198 PolarHBondContact N-O 3.38Å; V32-I198 PolarHBondContact O-N 3.41Å
33	V	98.6	Very high	95.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	129.3	165.9	178.5	0	0	0	0	108.1	A25 V26 F28 C171 R172 L195 V196 T197	A25-V33 CarbonylContact C-O 3.55Å; A25-V33 WeakPolarHBondContact CA-O 3.37Å; V26-V33 HydrophobicContact CG1-CB 3.91Å; V26-V33 PolarHBondContact N-O 2.94Å; V26-V33 PolarHBondContact O-N 2.9Å; F28-V33 HydrophobicContact CD1-CG2 4.07Å; F28-V33 HydrophobicContact CE1-CG2 3.76Å; V33-C171 HydrophobicContact CB-CB 4.34Å; V33-C171 HydrophobicContact CG2-CB 3.77Å; V33-R172 HydrophobicContact CG1-CG 4.02Å; V33-R172 HydrophobicContact CG2-CG 3.84Å; V33-L195 HydrophobicContact CG1-CD2 4.2Å; V33-V196 WeakPolarHBondContact CA-O 3.33Å; V33-T197 HydrophobicContact CG2-CG2 4.18Å
34	V	98.4	Very high	94.6	Very high	1 Å²	1	27 Å²	27	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.3	173.8	-163.7	0	0	0	0	108.4	M24 A25 V32 L54 A64 A121 L195 V196 I198	M24-V34 CarbonylContact O-C 3.59Å; M24-V34 WeakPolarHBondContact O-CA 3.4Å; A25-V34 HydrophobicContact CB-CG1 4.27Å; A25-V34 HydrophobicContact CB-CG2 4.28Å; V32-V34 HydrophobicContact CG2-CG2 4.37Å; V34-L54 HydrophobicContact CB-CD2 4.48Å; V34-L54 HydrophobicContact CG1-CD1 4.49Å; V34-L54 HydrophobicContact CG1-CD2 3.61Å; V34-A64 HydrophobicContact CG1-CB 4.07Å; V34-A121 HydrophobicContact CG2-CB 3.53Å; V34-L195 CarbonylContact O-C 3.59Å; V34-L195 WeakPolarHBondContact O-CA 3.4Å; V34-V196 PolarHBondContact N-O 3.32Å; V34-V196 PolarHBondContact O-N 3.18Å; V34-I198 HydrophobicContact CG2-CD1 4.19Å
35	G	98.3	Very high	94	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	149.5	-179.6	0	0	0	0	0	113.2	I23 M24 I179 Y194	I23-G35 WeakPolarHBondContact CA-O 3.11Å; M24-G35 PolarHBondContact N-O 2.91Å; M24-G35 PolarHBondContact O-N 2.88Å; G35-I179 VanDerWaalsContact C-CD1 3.42Å; G35-Y194 CarbonylContact C-O 3.57Å; G35-Y194 WeakPolarHBondContact CA-O 3.25Å
36	S	97.9	Very high	93.7	Very high	0 Å²	0	32 Å²	32	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	154.1	170.7	76.1	0	0	0	0	112.5	T22 K53 I193 Y194	T22-S36 VanDerWaalsContact O-CA 3.3Å; T22-S36 WeakPolarHBondContact O-CA 3.44Å; S36-K53 WeakPolarHBondContact OG-CB 3.33Å; S36-I193 WeakPolarHBondContact O-CA 3.38Å; S36-Y194 PolarHBondContact N-O 3.41Å; S36-Y194 PolarHBondContact O-N 3.1Å
37	D	97.2	Very high	93.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	172.9	159.1	84.6	-61.2	0	0	0	110.8	T22 R39 K53 I179 M183 S189 G190	T22-D37 PolarHBondContact N-OD1 2.75Å; T22-D37 PolarHBondContact O-N 3.1Å; D37-R39 PolarHBondContact OD2-N 3.46Å; D37-K53 VanDerWaalsContact CG-NZ 3.28Å; D37-K53 WeakPolarHBondContact O-CD 3.45Å; D37-K53 WeakPolarHBondContact O-CE 3.49Å; D37-K53 IonicContact OD1-NZ 3.85Å; D37-K53 PolarHBondContact OD1-NZ 2.95Å; D37-K53 IonicContact OD2-NZ 3.68Å; D37-K53 PolarHBondContact OD2-NZ 2.76Å; D37-I179 HydrophobicContact CB-CG2 4.12Å; D37-M183 HydrophobicContact CB-CG 4.07Å; D37-M183 HydrophobicContact CB-SD 3.99Å; D37-S189 VanDerWaalsContact OD2-CA 3.26Å; D37-S189 WeakPolarHBondContact OD2-CA 3.4Å; D37-G190 PolarHBondContact OD2-N 3.27Å
38	S	95.9	Very high	93	Very high	0 Å²	0	37 Å²	37	0%	0	25%	0.251	C	S	.	.			trans	-118.9	-2.9	-172.5	70.1	0	0	0	0	115.4	R49 V50 F51 G190 G191 V192	S38-R49 WeakPolarHBondContact CB-O 3.5Å; S38-R49 CarbonylContact O-C 3.56Å; S38-R49 VanDerWaalsContact O-C 3.3Å; S38-R49 PolarHBondContact OG-O 2.87Å; S38-V50 PolarHBondContact O-N 2.86Å; S38-F51 VanDerWaalsContact CA-O 3.23Å; S38-F51 WeakPolarHBondContact CA-O 3.19Å; S38-F51 PolarHBondContact O-N 3.12Å; S38-G190 PolarHBondContact N-O 2.99Å; S38-G190 VanDerWaalsContact N-O 3.15Å; S38-G190 PolarHBondContact OG-O 2.92Å; S38-G191 WeakPolarHBondContact OG-CA 3.39Å; S38-V192 WeakPolarHBondContact CB-O 3.41Å; S38-V192 PolarHBondContact N-O 3.05Å; S38-V192 WeakPolarHBondContact OG-CG2 3.47Å; S38-V192 PolarHBondContact OG-N 2.94Å; S38-V192 PolarHBondContact OG-O 3.45Å
39	R	94.1	Very high	92.7	Very high	70 Å²	70	44.4 Å²	44.4	26%	0.264	28%	0.278	S	S	.	.			trans	-78.8	138.3	-178.2	-178.6	178.1	-69.9	179.7	4.8	110.7	D37 V46 N48 K53 G187 S188 S189 G190	D37-R39 PolarHBondContact OD2-N 3.46Å; R39-V46 HydrophobicContact CG-CG1 3.92Å; R39-V46 HydrophobicContact CG-CG2 4.29Å; R39-N48 WeakPolarHBondContact CA-O 3.42Å; R39-K53 WeakPolarHBondContact O-CE 3.46Å; R39-K53 PolarHBondContact O-NZ 3.17Å; R39-G187 PolarHBondContact NH1-O 2.78Å; R39-S188 WeakPolarHBondContact CD-O 3.35Å; R39-S189 PolarHBondContact NH1-O 3.37Å; R39-G190 WeakPolarHBondContact CB-O 3.25Å; R39-G190 PolarHBondContact N-O 2.84Å
40	V	91.9	Very high	92.6	Very high	11 Å²	11	41 Å²	41	7%	0.067	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	123.6	166.8	-175.7	0	0	0	0	107.2	T19 V47 N48 F51 A69	T19-V40 HydrophobicContact CG2-CG1 3.55Å; V40-V47 HydrophobicContact CB-CG2 3.91Å; V40-V47 HydrophobicContact CG1-CG2 3.59Å; V40-V47 WeakPolarHBondContact O-CG2 3.17Å; V40-V47 PolarHBondContact O-N 3.01Å; V40-N48 HydrophobicContact CB-CB 4.02Å; V40-N48 HydrophobicContact CG2-CB 4.2Å; V40-N48 PolarHBondContact N-O 2.83Å; V40-N48 PolarHBondContact O-N 2.97Å; V40-F51 HydrophobicContact CG2-CB 3.5Å; V40-F51 HydrophobicContact CG2-CD1 3.78Å; V40-F51 HydrophobicContact CG2-CD2 4.43Å; V40-F51 HydrophobicContact CG2-CG 3.66Å; V40-A69 HydrophobicContact CG1-CB 4.37Å
41	S	86.6	Confident	92.5	Very high	4 Å²	4	40.8 Å²	40.8	3%	0.028	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	147	-179.6	56.5	0	0	0	0	111.7	H18 G20 A45	H18-S41 PolarHBondContact O-OG 3.16Å; G20-S41 PolarHBondContact N-OG 3.38Å; S41-A45 CarbonylContact C-O 3.55Å; S41-A45 WeakPolarHBondContact CA-O 3.14Å
42	A	84.8	Confident	92.4	Very high	40 Å²	40	43.8 Å²	43.8	33%	0.331	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	96.5	165.6	0	0	0	0	0	108.2	V17 A44 A45 V47	V17-A42 HydrophobicContact CG1-CB 4.08Å; A42-A44 PolarHBondContact O-N 3.36Å; A42-A45 PolarHBondContact N-O 2.95Å; A42-A45 PolarHBondContact O-N 3.49Å; A42-V47 HydrophobicContact CB-CG1 3.58Å
43	G	81.7	Confident	92.3	Very high	63 Å²	63	44 Å²	44	65%	0.649	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	-131.9	-165.4	0	0	0	0	0	110.8	A45	G43-A45 VanDerWaalsContact C-N 3.27Å; G43-A45 PolarHBondContact O-N 2.69Å
44	A	83.9	Confident	92.3	Very high	116 Å²	116	44.1 Å²	44.1	96%	0.959	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-10.6	178.6	0	0	0	0	0	114.2	A42	A42-A44 PolarHBondContact O-N 3.36Å
45	A	86.3	Confident	92.2	Very high	57 Å²	57	45.1 Å²	45.1	47%	0.471	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133.9	-177.6	0	0	0	0	0	111.2	S41 A42 G43 V47	S41-A45 CarbonylContact C-O 3.55Å; S41-A45 WeakPolarHBondContact CA-O 3.14Å; A42-A45 PolarHBondContact N-O 2.95Å; A42-A45 PolarHBondContact O-N 3.49Å; G43-A45 VanDerWaalsContact C-N 3.27Å; G43-A45 PolarHBondContact O-N 2.69Å; A45-V47 PolarHBondContact O-N 2.91Å
46	V	90.4	Very high	92.1	Very high	49 Å²	49	48.5 Å²	48.5	30%	0.297	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	111.7	169.8	179.4	0	0	0	0	108.7	R39 N48 R49	R39-V46 HydrophobicContact CG-CG1 3.92Å; R39-V46 HydrophobicContact CG-CG2 4.29Å; V46-N48 WeakPolarHBondContact CG1-O 3.45Å; V46-R49 HydrophobicContact CG1-CG 3.65Å
47	V	90.3	Very high	92.1	Very high	94 Å²	94	49 Å²	49	57%	0.57	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	-31.3	-177.7	-63.5	0	0	0	0	112.3	V40 A42 A45	V40-V47 HydrophobicContact CB-CG2 3.91Å; V40-V47 HydrophobicContact CG1-CG2 3.59Å; V40-V47 WeakPolarHBondContact O-CG2 3.17Å; V40-V47 PolarHBondContact O-N 3.01Å; A42-V47 HydrophobicContact CB-CG1 3.58Å; A45-V47 PolarHBondContact O-N 2.91Å
48	N	91.4	Very high	92	Very high	60 Å²	60	51.3 Å²	51.3	32%	0.321	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	140.4	171.9	-165.4	-20.2	0	0	0	109.7	R39 V40 V46 V50 F51	R39-N48 WeakPolarHBondContact CA-O 3.42Å; V40-N48 HydrophobicContact CB-CB 4.02Å; V40-N48 HydrophobicContact CG2-CB 4.2Å; V40-N48 PolarHBondContact N-O 2.83Å; V40-N48 PolarHBondContact O-N 2.97Å; V46-N48 WeakPolarHBondContact CG1-O 3.45Å; N48-V50 PolarHBondContact OD1-N 2.98Å; N48-F51 HydrophobicContact CB-CB 4.3Å; N48-F51 PolarHBondContact OD1-N 2.88Å
49	R	91.4	Very high	92	Very high	172 Å²	172	58.7 Å²	58.7	65%	0.649	35%	0.346	S	S	*	.	S	Bend	trans	-104.4	-17.6	-179.5	-71.4	-175.9	171.1	88.9	0.5	113.7	S38 V46	S38-R49 WeakPolarHBondContact CB-O 3.5Å; S38-R49 CarbonylContact O-C 3.56Å; S38-R49 VanDerWaalsContact O-C 3.3Å; S38-R49 PolarHBondContact OG-O 2.87Å; V46-R49 HydrophobicContact CG1-CG 3.65Å
50	V	93.6	Very high	92.1	Very high	85 Å²	85	58.7 Å²	58.7	52%	0.515	35%	0.346	S	S	.	.	S	Bend	trans	-133.9	27.2	-167.5	-69.3	0	0	0	0	111.7	S38 N48 D52 Y194	S38-V50 PolarHBondContact O-N 2.86Å; N48-V50 PolarHBondContact OD1-N 2.98Å; V50-D52 PolarHBondContact O-N 3.34Å; V50-Y194 PolarHBondContact O-OH 3.15Å
51	F	94.4	Very high	92.4	Very high	34 Å²	34	58.2 Å²	58.2	15%	0.149	34%	0.343	C	S	.	.			trans	-71.3	125.1	179	-177	-98.2	0	0	0	110.5	S38 V40 N48 K53 Q73 Y194	S38-F51 VanDerWaalsContact CA-O 3.23Å; S38-F51 WeakPolarHBondContact CA-O 3.19Å; S38-F51 PolarHBondContact O-N 3.12Å; V40-F51 HydrophobicContact CG2-CB 3.5Å; V40-F51 HydrophobicContact CG2-CD1 3.78Å; V40-F51 HydrophobicContact CG2-CD2 4.43Å; V40-F51 HydrophobicContact CG2-CG 3.66Å; N48-F51 HydrophobicContact CB-CB 4.3Å; N48-F51 PolarHBondContact OD1-N 2.88Å; F51-K53 HydrophobicContact CD1-CG 3.6Å; F51-K53 HydrophobicContact CE1-CG 3.91Å; F51-K53 PolarHBondContact O-N 2.88Å; F51-Q73 VanDerWaalsContact CE2-NE2 3.28Å; F51-Q73 HydrophobicContact CZ-CG 3.99Å; F51-Q73 VanDerWaalsContact CZ-NE2 3.3Å; F51-Y194 WeakPolarHBondContact O-CE2 3.39Å
52	D	95.1	Very high	93	Very high	64 Å²	64	59 Å²	59	34%	0.342	35%	0.345	S	S	.	.			trans	-80.3	116.1	174	-167.9	-12	0	0	0	109.7	V50 L54 Y194	V50-D52 PolarHBondContact O-N 3.34Å; D52-L54 VanDerWaalsContact C-N 3.3Å; D52-L54 WeakPolarHBondContact OD1-CB 3.29Å; D52-L54 PolarHBondContact OD1-N 2.81Å; D52-Y194 HydrophobicContact CB-CD2 4.1Å; D52-Y194 HydrophobicContact CB-CE1 4.42Å; D52-Y194 HydrophobicContact CB-CE2 3.93Å; D52-Y194 HydrophobicContact CB-CG 4.38Å
53	K	96.2	Very high	93.6	Very high	3 Å²	3	57 Å²	57	1%	0.013	33%	0.329	C	S	.	.			trans	-91.2	5.8	179.6	-54.5	175.7	-171	-178.7	0	111.7	G20 T21 S36 D37 R39 F51 A64 L65	G20-K53 PolarHBondContact O-NZ 2.91Å; T21-K53 HydrophobicContact CG2-CD 3.74Å; T21-K53 PolarHBondContact OG1-NZ 2.84Å; S36-K53 WeakPolarHBondContact OG-CB 3.33Å; D37-K53 VanDerWaalsContact CG-NZ 3.28Å; D37-K53 WeakPolarHBondContact O-CD 3.45Å; D37-K53 WeakPolarHBondContact O-CE 3.49Å; D37-K53 IonicContact OD1-NZ 3.85Å; D37-K53 PolarHBondContact OD1-NZ 2.95Å; D37-K53 IonicContact OD2-NZ 3.68Å; D37-K53 PolarHBondContact OD2-NZ 2.76Å; R39-K53 WeakPolarHBondContact O-CE 3.46Å; R39-K53 PolarHBondContact O-NZ 3.17Å; F51-K53 HydrophobicContact CD1-CG 3.6Å; F51-K53 HydrophobicContact CE1-CG 3.91Å; F51-K53 PolarHBondContact O-N 2.88Å; K53-A64 CarbonylContact O-C 3.14Å; K53-A64 WeakPolarHBondContact O-CA 3.37Å; K53-L65 HydrophobicContact CB-CB 4.32Å; K53-L65 WeakPolarHBondContact O-CG 3.14Å; K53-L65 PolarHBondContact O-N 3.42Å
54	L	97.6	Very high	94.3	Very high	4 Å²	4	54 Å²	54	2%	0.021	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	89.8	179.8	-53.8	-175.9	0	0	0	109.4	V34 D52 Y62 A64 V196	V34-L54 HydrophobicContact CB-CD2 4.48Å; V34-L54 HydrophobicContact CG1-CD1 4.49Å; V34-L54 HydrophobicContact CG1-CD2 3.61Å; D52-L54 VanDerWaalsContact C-N 3.3Å; D52-L54 WeakPolarHBondContact OD1-CB 3.29Å; D52-L54 PolarHBondContact OD1-N 2.81Å; L54-Y62 HydrophobicContact CB-CD1 4.4Å; L54-A64 HydrophobicContact CD2-CB 3.74Å; L54-V196 HydrophobicContact CB-CG2 4.25Å; L54-V196 HydrophobicContact CD1-CB 4.24Å; L54-V196 HydrophobicContact CD1-CG2 3.62Å
55	S	97.1	Very high	94.8	Very high	22 Å²	22	48.9 Å²	48.9	15%	0.154	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	128.1	-178.5	-171.5	0	0	0	0	111.5	L57 Y62 C63	S55-L57 PolarHBondContact O-N 3.44Å; S55-Y62 CarbonylContact O-C 3.49Å; S55-Y62 WeakPolarHBondContact O-CA 3.49Å; S55-C63 PolarHBondContact N-O 3.39Å; S55-C63 PolarHBondContact O-N 2.97Å
56	P	97.3	Very high	95.1	Very high	71 Å²	71	46.6 Å²	46.6	46%	0.461	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	125.3	173	28.8	-32.5	0	0	0	110.6	Y62	P56-Y62 HydrophobicContact CB-CD1 4.28Å; P56-Y62 HydrophobicContact CB-CE1 3.76Å; P56-Y62 HydrophobicContact CB-CE2 4.46Å; P56-Y62 HydrophobicContact CG-CE1 4.44Å
57	L	96.8	Very high	95	Very high	9 Å²	9	44.7 Å²	44.7	5%	0.047	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-33.1	169.5	-60.6	-174.7	0	0	0	111.8	S55 I61 C63 A76 A79 A80 L83 A99 V103 V120	S55-L57 PolarHBondContact O-N 3.44Å; L57-I61 HydrophobicContact CB-CG2 4.26Å; L57-I61 HydrophobicContact CD1-CG2 4.31Å; L57-I61 PolarHBondContact N-O 2.77Å; L57-C63 HydrophobicContact CD1-CB 3.86Å; L57-C63 HydrophobicContact CD2-CB 3.88Å; L57-C63 HydrophobicContact CG-CB 3.74Å; L57-A76 HydrophobicContact CD2-CB 4.17Å; L57-A76 WeakPolarHBondContact CD2-O 3.42Å; L57-A79 HydrophobicContact CD2-CB 4.09Å; L57-A80 HydrophobicContact CD2-CB 4.37Å; L57-L83 HydrophobicContact CB-CD2 3.94Å; L57-A99 HydrophobicContact CD1-CB 4.33Å; L57-V103 HydrophobicContact CD1-CG2 3.75Å; L57-V120 HydrophobicContact CD1-CG1 4.38Å; L57-V120 HydrophobicContact CD1-CG2 4.31Å
58	H	96.3	Very high	95	Very high	50 Å²	50	41.3 Å²	41.3	23%	0.231	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	174.9	175.2	-168.9	-97.4	0	0	0	108.8	R60 I61 L83 P94	H58-R60 PolarHBondContact O-N 3.4Å; H58-I61 HydrophobicContact CB-CB 4.19Å; H58-I61 HydrophobicContact CB-CD1 4.36Å; H58-I61 HydrophobicContact CB-CG1 4.39Å; H58-I61 PolarHBondContact N-O 2.91Å; H58-I61 VanDerWaalsContact N-O 3.11Å; H58-I61 PolarHBondContact O-N 3.13Å; H58-I61 VanDerWaalsContact O-O 3.09Å; H58-L83 HydrophobicContact CB-CD2 3.85Å; H58-P94 HydrophobicContact CB-CG 4.12Å
59	Q	94.8	Very high	94.8	Very high	154 Å²	154	39.5 Å²	39.5	72%	0.72	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-29.1	-177.9	-62.5	-176.6	9.4	0	0	115.1	V203	Q59-V203 WeakPolarHBondContact O-CG2 3.34Å
60	R	97	Very high	94.7	Very high	71 Å²	71	34.4 Å²	34.4	27%	0.268	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.2	20	-177.7	-59.5	-178.3	-174.7	-168.6	-9.5	113	H58 G122 W123 I198 A200	H58-R60 PolarHBondContact O-N 3.4Å; R60-G122 CarbonylContact O-C 3.56Å; R60-G122 WeakPolarHBondContact O-CA 3.46Å; R60-W123 PolarHBondContact O-N 3.1Å; R60-I198 HydrophobicContact CB-CG2 4.02Å; R60-I198 WeakPolarHBondContact O-CG2 3.2Å; R60-A200 PolarHBondContact NH1-O 3.43Å; R60-A200 PolarHBondContact NH2-O 3.02Å
61	I	98.2	Very high	94.7	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	124.2	-178.3	-54.9	175	0	0	0	108.1	L57 H58 L83 P94 V96 A99 V120	L57-I61 HydrophobicContact CB-CG2 4.26Å; L57-I61 HydrophobicContact CD1-CG2 4.31Å; L57-I61 PolarHBondContact N-O 2.77Å; H58-I61 HydrophobicContact CB-CB 4.19Å; H58-I61 HydrophobicContact CB-CD1 4.36Å; H58-I61 HydrophobicContact CB-CG1 4.39Å; H58-I61 PolarHBondContact N-O 2.91Å; H58-I61 VanDerWaalsContact N-O 3.11Å; H58-I61 PolarHBondContact O-N 3.13Å; H58-I61 VanDerWaalsContact O-O 3.09Å; I61-L83 HydrophobicContact CD1-CD2 4.27Å; I61-P94 HydrophobicContact CD1-CG 4.32Å; I61-V96 HydrophobicContact CD1-CG2 4.45Å; I61-V96 HydrophobicContact CG1-CG2 4.28Å; I61-A99 HydrophobicContact CD1-CB 4.04Å; I61-A99 HydrophobicContact CG2-CB 3.76Å; I61-V120 HydrophobicContact CG2-CG1 3.82Å
62	Y	98.3	Very high	94.6	Very high	19 Å²	19	30.6 Å²	30.6	8%	0.075	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	152.8	-178.6	-79.7	-104.9	0	0	0	110.8	L54 S55 P56 V120 A121 V196 I198 V203 H205	L54-Y62 HydrophobicContact CB-CD1 4.4Å; S55-Y62 CarbonylContact O-C 3.49Å; S55-Y62 WeakPolarHBondContact O-CA 3.49Å; P56-Y62 HydrophobicContact CB-CD1 4.28Å; P56-Y62 HydrophobicContact CB-CE1 3.76Å; P56-Y62 HydrophobicContact CB-CE2 4.46Å; P56-Y62 HydrophobicContact CG-CE1 4.44Å; Y62-V120 WeakPolarHBondContact O-CA 3.24Å; Y62-A121 PolarHBondContact N-O 2.89Å; Y62-A121 PolarHBondContact O-N 3.14Å; Y62-A121 VanDerWaalsContact O-O 3.08Å; Y62-V196 HydrophobicContact CD1-CG1 4.24Å; Y62-V196 HydrophobicContact CD1-CG2 4.4Å; Y62-V196 HydrophobicContact CD2-CG1 4.09Å; Y62-V196 HydrophobicContact CE1-CG1 4.13Å; Y62-V196 HydrophobicContact CE1-CG2 4.3Å; Y62-V196 HydrophobicContact CE2-CG1 3.98Å; Y62-V196 HydrophobicContact CG-CG1 4.22Å; Y62-I198 HydrophobicContact CD2-CD1 3.46Å; Y62-I198 VanDerWaalsContact CD2-CD1 3.46Å; Y62-I198 HydrophobicContact CD2-CG1 4.16Å; Y62-I198 HydrophobicContact CE2-CD1 4.3Å; Y62-I198 HydrophobicContact CG-CD1 4.07Å; Y62-V203 HydrophobicContact CE2-CG1 3.95Å; Y62-V203 HydrophobicContact CE2-CG2 4.19Å; Y62-H205 AromaticContact CE1-CE1 3.8Å; Y62-H205 AromaticContact CZ-CE1 3.66Å; Y62-H205 AromaticContact CZ-NE2 3.98Å; Y62-H205 PolarHBondContact OH-CE1 2.93Å; Y62-H205 PolarHBondContact OH-NE2 3.48Å; Y62-H205 VanDerWaalsContact OH-NE2 3.08Å
63	C	96.9	Very high	94.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	118	174.4	-172.8	0	0	0	0	109.1	S55 L57 L65 M119	S55-C63 PolarHBondContact N-O 3.39Å; S55-C63 PolarHBondContact O-N 2.97Å; L57-C63 HydrophobicContact CD1-CB 3.86Å; L57-C63 HydrophobicContact CD2-CB 3.88Å; L57-C63 HydrophobicContact CG-CB 3.74Å; C63-L65 HydrophobicContact CB-CD2 4.41Å; C63-M119 CarbonylContact C-O 3.56Å; C63-M119 VanDerWaalsContact CA-O 3.31Å; C63-M119 WeakPolarHBondContact CA-O 3.09Å
64	A	96.9	Very high	94.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	128.4	170.4	0	0	0	0	0	109.7	I23 V34 K53 L54 M119	I23-A64 HydrophobicContact CB-CB 3.87Å; I23-A64 HydrophobicContact CD1-CB 3.89Å; I23-A64 HydrophobicContact CG1-CB 4.48Å; I23-A64 HydrophobicContact CG2-CB 3.83Å; V34-A64 HydrophobicContact CG1-CB 4.07Å; K53-A64 CarbonylContact O-C 3.14Å; K53-A64 WeakPolarHBondContact O-CA 3.37Å; L54-A64 HydrophobicContact CD2-CB 3.74Å; A64-M119 HydrophobicContact CB-CB 4.28Å; A64-M119 PolarHBondContact N-O 3.36Å; A64-M119 PolarHBondContact O-N 3.12Å; A64-M119 VanDerWaalsContact O-N 3.15Å
65	L	94.7	Very high	94.2	Very high	7 Å²	7	33.3 Å²	33.3	4%	0.037	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	130.8	-170.7	-53.4	-172.8	0	0	0	111.1	T21 K53 C63 A72 Q73 A76 L118	T21-L65 WeakPolarHBondContact CG2-O 3.42Å; K53-L65 HydrophobicContact CB-CB 4.32Å; K53-L65 WeakPolarHBondContact O-CG 3.14Å; K53-L65 PolarHBondContact O-N 3.42Å; C63-L65 HydrophobicContact CB-CD2 4.41Å; L65-A72 HydrophobicContact CB-CB 3.91Å; L65-A72 HydrophobicContact CD1-CB 4.42Å; L65-A72 HydrophobicContact CD2-CB 4.25Å; L65-A72 HydrophobicContact CG-CB 4.41Å; L65-Q73 HydrophobicContact CD1-CG 3.82Å; L65-A76 HydrophobicContact CD2-CB 3.89Å; L65-L118 HydrophobicContact CB-CD2 4.46Å; L65-L118 HydrophobicContact CD2-CD2 3.57Å
66	S	91.8	Very high	94.1	Very high	10 Å²	10	32.2 Å²	32.2	7%	0.07	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	152.9	171.7	174.6	0	0	0	0	111	A116 H117 G148	S66-A116 WeakPolarHBondContact O-CA 3.36Å; S66-H117 VanDerWaalsContact CB-O 3.32Å; S66-H117 WeakPolarHBondContact CB-O 3.49Å; S66-H117 PolarHBondContact N-O 3.08Å; S66-H117 PolarHBondContact O-N 3.42Å; S66-G148 VanDerWaalsContact OG-CA 3.24Å; S66-G148 WeakPolarHBondContact OG-CA 3.38Å
67	G	89.6	Confident	94.1	Very high	8 Å²	8	33.7 Å²	33.7	8%	0.082	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	106	-139.4	-178.6	0	0	0	0	0	112.1	T19 A69	T19-G67 PolarHBondContact OG1-O 2.88Å; G67-A69 PolarHBondContact O-N 3.08Å
68	S	89.9	Confident	94	Very high	23 Å²	23	36.6 Å²	36.6	16%	0.161	20%	0.201	C	C	.	.	S	Bend	trans	-66.9	120	168.7	169.5	0	0	0	0	109.1	A70 D71 A72 L115	S68-A70 VanDerWaalsContact C-N 3.27Å; S68-A70 PolarHBondContact O-N 2.68Å; S68-D71 WeakPolarHBondContact CB-OD2 3.42Å; S68-D71 PolarHBondContact O-N 2.88Å; S68-D71 VanDerWaalsContact OG-CG 3.24Å; S68-D71 PolarHBondContact OG-N 2.91Å; S68-D71 PolarHBondContact OG-OD1 3.45Å; S68-D71 PolarHBondContact OG-OD2 3.49Å; S68-A72 VanDerWaalsContact O-CB 3.32Å; S68-A72 WeakPolarHBondContact O-CB 3.37Å; S68-A72 PolarHBondContact O-N 2.83Å; S68-L115 WeakPolarHBondContact CB-O 3.44Å; S68-L115 PolarHBondContact N-O 2.86Å
69	A	87.6	Confident	94	Very high	22 Å²	22	34.3 Å²	34.3	18%	0.182	19%	0.191	C	C	.	.	H	α-helix	trans	-58.4	-41.1	-178.7	0	0	0	0	0	111.9	T19 V40 G67 Q73	T19-A69 HydrophobicContact CG2-CB 4.39Å; V40-A69 HydrophobicContact CG1-CB 4.37Å; G67-A69 PolarHBondContact O-N 3.08Å; A69-Q73 WeakPolarHBondContact O-CB 3.33Å; A69-Q73 VanDerWaalsContact O-CG 3.25Å; A69-Q73 WeakPolarHBondContact O-CG 3.48Å; A69-Q73 PolarHBondContact O-N 3.43Å
70	A	89.7	Confident	94.1	Very high	65 Å²	65	28 Å²	28	54%	0.537	17%	0.165	S	C	.	.	H	α-helix	trans	-65.3	-45.2	179.1	0	0	0	0	0	111.9	S68 A74	S68-A70 VanDerWaalsContact C-N 3.27Å; S68-A70 PolarHBondContact O-N 2.68Å; A70-A74 WeakPolarHBondContact O-CB 3.19Å; A70-A74 PolarHBondContact O-N 3.11Å
71	D	91.9	Very high	94.1	Very high	38 Å²	38	31.7 Å²	31.7	20%	0.203	18%	0.18	C	C	.	.	H	α-helix	trans	-67.1	-44	-179.1	-60.1	-11.3	0	0	0	110.8	S68 A74 I75 L114 L115 A116	S68-D71 WeakPolarHBondContact CB-OD2 3.42Å; S68-D71 PolarHBondContact O-N 2.88Å; S68-D71 VanDerWaalsContact OG-CG 3.24Å; S68-D71 PolarHBondContact OG-N 2.91Å; S68-D71 PolarHBondContact OG-OD1 3.45Å; S68-D71 PolarHBondContact OG-OD2 3.49Å; D71-A74 PolarHBondContact O-N 3.17Å; D71-I75 VanDerWaalsContact O-CG1 3.31Å; D71-I75 WeakPolarHBondContact O-CG1 3.47Å; D71-I75 PolarHBondContact O-N 2.94Å; D71-L114 HydrophobicContact CB-CB 4.13Å; D71-L114 HydrophobicContact CB-CD2 3.94Å; D71-L115 PolarHBondContact OD2-N 2.85Å; D71-A116 HydrophobicContact CB-CB 4.5Å
72	A	92.3	Very high	94.1	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-63.4	-42.4	179.9	0	0	0	0	0	111.8	L65 S68 A76 A116 L118	L65-A72 HydrophobicContact CB-CB 3.91Å; L65-A72 HydrophobicContact CD1-CB 4.42Å; L65-A72 HydrophobicContact CD2-CB 4.25Å; L65-A72 HydrophobicContact CG-CB 4.41Å; S68-A72 VanDerWaalsContact O-CB 3.32Å; S68-A72 WeakPolarHBondContact O-CB 3.37Å; S68-A72 PolarHBondContact O-N 2.83Å; A72-A76 WeakPolarHBondContact O-CB 3.44Å; A72-A76 PolarHBondContact O-N 2.94Å; A72-A116 HydrophobicContact CB-CB 4.06Å; A72-L118 HydrophobicContact CB-CD2 3.93Å
73	Q	93.3	Very high	94	Very high	83 Å²	83	34.7 Å²	34.7	39%	0.388	20%	0.195	S	C	.	.	H	α-helix	trans	-63.1	-47.3	174.1	-75.7	-177.5	-51.7	0	0	111.7	F51 L65 A69 I75 A76 D77	F51-Q73 VanDerWaalsContact CE2-NE2 3.28Å; F51-Q73 HydrophobicContact CZ-CG 3.99Å; F51-Q73 VanDerWaalsContact CZ-NE2 3.3Å; L65-Q73 HydrophobicContact CD1-CG 3.82Å; A69-Q73 WeakPolarHBondContact O-CB 3.33Å; A69-Q73 VanDerWaalsContact O-CG 3.25Å; A69-Q73 WeakPolarHBondContact O-CG 3.48Å; A69-Q73 PolarHBondContact O-N 3.43Å; Q73-I75 VanDerWaalsContact C-N 3.3Å; Q73-I75 PolarHBondContact O-N 2.84Å; Q73-A76 PolarHBondContact O-N 3.26Å; Q73-A76 VanDerWaalsContact O-N 3.1Å; Q73-D77 VanDerWaalsContact O-CG 3.31Å; Q73-D77 PolarHBondContact O-N 2.99Å
74	A	94.1	Very high	93.9	Very high	43 Å²	43	40.2 Å²	40.2	36%	0.355	22%	0.221	S	C	.	.	H	α-helix	trans	-58.7	-42.3	179.5	0	0	0	0	0	112.1	A70 D71 M78	A70-A74 WeakPolarHBondContact O-CB 3.19Å; A70-A74 PolarHBondContact O-N 3.11Å; D71-A74 PolarHBondContact O-N 3.17Å; A74-M78 WeakPolarHBondContact O-CB 3.44Å; A74-M78 WeakPolarHBondContact O-CG 3.24Å; A74-M78 PolarHBondContact O-N 2.91Å
75	I	94	Very high	93.8	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-42.8	176.1	-65.3	167.2	0	0	0	111.1	D71 Q73 M78 A79 I106 L114 A116 L118	D71-I75 VanDerWaalsContact O-CG1 3.31Å; D71-I75 WeakPolarHBondContact O-CG1 3.47Å; D71-I75 PolarHBondContact O-N 2.94Å; Q73-I75 VanDerWaalsContact C-N 3.3Å; Q73-I75 PolarHBondContact O-N 2.84Å; I75-M78 PolarHBondContact O-N 3.48Å; I75-A79 VanDerWaalsContact O-CB 3.31Å; I75-A79 WeakPolarHBondContact O-CB 3.32Å; I75-A79 PolarHBondContact O-N 3Å; I75-I106 HydrophobicContact CB-CG2 4.33Å; I75-I106 HydrophobicContact CG1-CG2 4.07Å; I75-I106 HydrophobicContact CG2-CB 4.18Å; I75-I106 HydrophobicContact CG2-CG2 3.81Å; I75-L114 HydrophobicContact CD1-CB 4.25Å; I75-L114 HydrophobicContact CD1-CD1 3.72Å; I75-L114 HydrophobicContact CG1-CD1 3.64Å; I75-A116 HydrophobicContact CD1-CB 3.68Å; I75-L118 HydrophobicContact CB-CD1 3.87Å; I75-L118 HydrophobicContact CD1-CD1 4.36Å; I75-L118 HydrophobicContact CG2-CD1 3.34Å
76	A	95.4	Very high	93.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.5	-44	178.4	0	0	0	0	0	111.9	L57 L65 A72 Q73 A79 A80	L57-A76 HydrophobicContact CD2-CB 4.17Å; L57-A76 WeakPolarHBondContact CD2-O 3.42Å; L65-A76 HydrophobicContact CD2-CB 3.89Å; A72-A76 WeakPolarHBondContact O-CB 3.44Å; A72-A76 PolarHBondContact O-N 2.94Å; Q73-A76 PolarHBondContact O-N 3.26Å; Q73-A76 VanDerWaalsContact O-N 3.1Å; A76-A79 PolarHBondContact O-N 2.99Å; A76-A80 WeakPolarHBondContact O-CB 3.38Å; A76-A80 PolarHBondContact O-N 2.94Å
77	D	96.3	Very high	93.8	Very high	102 Å²	102	46.3 Å²	46.3	55%	0.545	25%	0.253	S	S	.	.	H	α-helix	trans	-64	-43.5	178	-67.2	-15.9	0	0	0	111.5	Q73 A79 A80 Y81	Q73-D77 VanDerWaalsContact O-CG 3.31Å; Q73-D77 PolarHBondContact O-N 2.99Å; D77-A79 VanDerWaalsContact C-N 3.31Å; D77-A79 PolarHBondContact O-N 2.77Å; D77-A80 PolarHBondContact O-N 3.18Å; D77-Y81 PolarHBondContact O-N 3.44Å
78	M	95.9	Very high	94	Very high	70 Å²	70	51.6 Å²	51.6	35%	0.345	28%	0.279	S	S	.	.	H	α-helix	trans	-62	-39.9	174.6	-72.3	174.6	66.9	0	0	112	A74 I75 Q82 I106 Y110	A74-M78 WeakPolarHBondContact O-CB 3.44Å; A74-M78 WeakPolarHBondContact O-CG 3.24Å; A74-M78 PolarHBondContact O-N 2.91Å; I75-M78 PolarHBondContact O-N 3.48Å; M78-Q82 WeakPolarHBondContact O-CG 3.2Å; M78-Q82 PolarHBondContact O-N 2.94Å; M78-Q82 VanDerWaalsContact O-N 3.16Å; M78-I106 HydrophobicContact CB-CD1 3.96Å; M78-I106 HydrophobicContact CE-CG2 4.14Å; M78-I106 HydrophobicContact SD-CG2 4.41Å; M78-Y110 HydrophobicContact CE-CE2 4.01Å
79	A	96.2	Very high	94.2	Very high	2 Å²	2	57.9 Å²	57.9	2%	0.017	31%	0.305	C	S	.	.	H	α-helix	trans	-68.9	-44	178.5	0	0	0	0	0	111.5	L57 I75 A76 D77 Y81 Q82 L83 I102 V103 I106	L57-A79 HydrophobicContact CD2-CB 4.09Å; I75-A79 VanDerWaalsContact O-CB 3.31Å; I75-A79 WeakPolarHBondContact O-CB 3.32Å; I75-A79 PolarHBondContact O-N 3Å; A76-A79 PolarHBondContact O-N 2.99Å; D77-A79 VanDerWaalsContact C-N 3.31Å; D77-A79 PolarHBondContact O-N 2.77Å; A79-Y81 VanDerWaalsContact C-N 3.34Å; A79-Y81 PolarHBondContact O-N 2.9Å; A79-Q82 PolarHBondContact O-N 3.09Å; A79-L83 WeakPolarHBondContact O-CB 3.28Å; A79-L83 PolarHBondContact O-N 2.83Å; A79-I102 HydrophobicContact CB-CG2 3.86Å; A79-V103 HydrophobicContact CB-CG2 3.69Å; A79-I106 HydrophobicContact CB-CD1 4Å
80	A	97.2	Very high	94.5	Very high	22 Å²	22	61.4 Å²	61.4	18%	0.182	32%	0.321	C	S	.	.	H	α-helix	trans	-57.9	-46.6	176.5	0	0	0	0	0	111.1	L57 A76 D77 Q82 L83 E84	L57-A80 HydrophobicContact CD2-CB 4.37Å; A76-A80 WeakPolarHBondContact O-CB 3.38Å; A76-A80 PolarHBondContact O-N 2.94Å; D77-A80 PolarHBondContact O-N 3.18Å; A80-Q82 PolarHBondContact O-N 3.5Å; A80-L83 PolarHBondContact O-N 2.95Å; A80-E84 WeakPolarHBondContact O-CB 3.45Å; A80-E84 PolarHBondContact O-N 2.91Å
81	Y	97	Very high	94.6	Very high	147 Å²	147	67 Å²	67	58%	0.576	34%	0.336	S	S	*	.	H	α-helix	trans	-60.3	-47.6	176.8	175	-104.1	0	0	0	113	D77 A79 L83 E84 L85	D77-Y81 PolarHBondContact O-N 3.44Å; A79-Y81 VanDerWaalsContact C-N 3.34Å; A79-Y81 PolarHBondContact O-N 2.9Å; Y81-L83 VanDerWaalsContact C-N 3.28Å; Y81-L83 PolarHBondContact O-N 3.31Å; Y81-E84 PolarHBondContact O-N 3.37Å; Y81-L85 HydrophobicContact CD1-CD1 4.18Å; Y81-L85 HydrophobicContact CE1-CD1 3.52Å; Y81-L85 HydrophobicContact CE1-CG 4.43Å; Y81-L85 HydrophobicContact CE2-CD1 4.19Å; Y81-L85 HydrophobicContact CE2-CG 4.36Å; Y81-L85 WeakPolarHBondContact O-CG 3.29Å; Y81-L85 PolarHBondContact O-N 2.88Å; Y81-L85 VanDerWaalsContact O-N 3.12Å
82	Q	96.4	Very high	94.6	Very high	82 Å²	82	71.1 Å²	71.1	38%	0.383	35%	0.354	S	S	.	.	H	α-helix	trans	-64.7	-35.8	178	-72.1	178.5	26.3	0	0	112.1	M78 A79 A80 H86 I102	M78-Q82 WeakPolarHBondContact O-CG 3.2Å; M78-Q82 PolarHBondContact O-N 2.94Å; M78-Q82 VanDerWaalsContact O-N 3.16Å; A79-Q82 PolarHBondContact O-N 3.09Å; A80-Q82 PolarHBondContact O-N 3.5Å; Q82-H86 WeakPolarHBondContact O-CB 3.49Å; Q82-H86 PolarHBondContact O-N 3.45Å; Q82-I102 HydrophobicContact CB-CD1 4.17Å; Q82-I102 HydrophobicContact CB-CG2 4.07Å
83	L	96.3	Very high	94.6	Very high	1 Å²	1	75 Å²	75	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-71.2	-37.7	179.7	-167.5	65.9	0	0	0	111.9	L57 H58 I61 A79 A80 Y81 H86 G87 P94 A99 I102	L57-L83 HydrophobicContact CB-CD2 3.94Å; H58-L83 HydrophobicContact CB-CD2 3.85Å; I61-L83 HydrophobicContact CD1-CD2 4.27Å; A79-L83 WeakPolarHBondContact O-CB 3.28Å; A79-L83 PolarHBondContact O-N 2.83Å; A80-L83 PolarHBondContact O-N 2.95Å; Y81-L83 VanDerWaalsContact C-N 3.28Å; Y81-L83 PolarHBondContact O-N 3.31Å; L83-H86 PolarHBondContact O-N 3.02Å; L83-G87 PolarHBondContact O-N 2.77Å; L83-P94 HydrophobicContact CD1-CB 3.44Å; L83-P94 VanDerWaalsContact CD1-CB 3.44Å; L83-P94 HydrophobicContact CD1-CG 3.99Å; L83-P94 HydrophobicContact CD2-CB 4.46Å; L83-P94 HydrophobicContact CD2-CG 4.16Å; L83-P94 HydrophobicContact CG-CB 3.82Å; L83-P94 HydrophobicContact CG-CG 3.77Å; L83-A99 HydrophobicContact CD1-CB 3.89Å; L83-A99 HydrophobicContact CD2-CB 3.6Å; L83-A99 HydrophobicContact CG-CB 4.42Å; L83-I102 HydrophobicContact CB-CD1 4.35Å; L83-I102 HydrophobicContact CD1-CD1 3.99Å
84	E	95.3	Very high	94.7	Very high	117 Å²	117	71.4 Å²	71.4	55%	0.547	36%	0.363	S	S	.	.	H	α-helix	trans	-63.8	-48.4	174.2	-176.5	172.9	-162.2	0	0	111.2	A80 Y81 H86 G87 L88	A80-E84 WeakPolarHBondContact O-CB 3.45Å; A80-E84 PolarHBondContact O-N 2.91Å; Y81-E84 PolarHBondContact O-N 3.37Å; E84-H86 VanDerWaalsContact C-N 3.29Å; E84-H86 PolarHBondContact O-N 3.3Å; E84-G87 PolarHBondContact O-N 2.88Å; E84-L88 HydrophobicContact CG-CD1 4.3Å; E84-L88 WeakPolarHBondContact O-CG 3.49Å; E84-L88 PolarHBondContact O-N 3.28Å
85	L	95.3	Very high	94.8	Very high	68 Å²	68	72 Å²	72	36%	0.356	36%	0.359	S	S	.	.	H	α-helix	trans	-57.2	-44.3	174	-71.4	177.8	0	0	0	111.8	Y81 G87 L88 E89	Y81-L85 HydrophobicContact CD1-CD1 4.18Å; Y81-L85 HydrophobicContact CE1-CD1 3.52Å; Y81-L85 HydrophobicContact CE1-CG 4.43Å; Y81-L85 HydrophobicContact CE2-CD1 4.19Å; Y81-L85 HydrophobicContact CE2-CG 4.36Å; Y81-L85 WeakPolarHBondContact O-CG 3.29Å; Y81-L85 PolarHBondContact O-N 2.88Å; Y81-L85 VanDerWaalsContact O-N 3.12Å; L85-G87 VanDerWaalsContact C-N 3.34Å; L85-G87 PolarHBondContact O-N 3.41Å; L85-L88 PolarHBondContact O-N 3.19Å; L85-E89 WeakPolarHBondContact O-CG 3.3Å; L85-E89 PolarHBondContact O-N 3.21Å
86	H	93.7	Very high	95	Very high	65 Å²	65	71.9 Å²	71.9	30%	0.301	36%	0.359	S	S	.	.	H	α-helix	trans	-61	-42.1	178	-175.9	61.8	0	0	0	112.6	Q82 L83 E84 E89 L90	Q82-H86 WeakPolarHBondContact O-CB 3.49Å; Q82-H86 PolarHBondContact O-N 3.45Å; L83-H86 PolarHBondContact O-N 3.02Å; E84-H86 VanDerWaalsContact C-N 3.29Å; E84-H86 PolarHBondContact O-N 3.3Å; H86-E89 PolarHBondContact O-N 3.34Å; H86-L90 WeakPolarHBondContact CE1-CD1 3.3Å; H86-L90 WeakPolarHBondContact NE2-CD1 3.46Å; H86-L90 WeakPolarHBondContact O-CG 3.31Å; H86-L90 PolarHBondContact O-N 3.08Å
87	G	92.5	Very high	95	Very high	12 Å²	12	75.5 Å²	75.5	12%	0.124	38%	0.378	C	S	.	.	H	α-helix	trans	-67	-37.1	176.4	0	0	0	0	0	113	L83 E84 L85 E91 E92	L83-G87 PolarHBondContact O-N 2.77Å; E84-G87 PolarHBondContact O-N 2.88Å; L85-G87 VanDerWaalsContact C-N 3.34Å; L85-G87 PolarHBondContact O-N 3.41Å; G87-E91 WeakPolarHBondContact O-CA 3.2Å; G87-E91 PolarHBondContact O-N 2.92Å; G87-E92 WeakPolarHBondContact CA-O 3.45Å; G87-E92 PolarHBondContact O-N 3.01Å
88	L	93.9	Very high	95	Very high	119 Å²	119	71.9 Å²	71.9	62%	0.623	36%	0.362	S	S	*	.	H	α-helix	trans	-67.1	-41.6	175.5	-70.1	173.2	0	0	0	112.3	E84 L85 L90 E91	E84-L88 HydrophobicContact CG-CD1 4.3Å; E84-L88 WeakPolarHBondContact O-CG 3.49Å; E84-L88 PolarHBondContact O-N 3.28Å; L85-L88 PolarHBondContact O-N 3.19Å; L88-L90 VanDerWaalsContact C-N 3.34Å; L88-E91 PolarHBondContact O-N 3Å
89	E	94.1	Very high	95.1	Very high	154 Å²	154	68.6 Å²	68.6	72%	0.72	35%	0.346	S	S	*	.	H	α-helix	trans	-65.8	-36.4	178.8	-75.9	177.3	175.7	0	0	112.8	L85 H86	L85-E89 WeakPolarHBondContact O-CG 3.3Å; L85-E89 PolarHBondContact O-N 3.21Å; H86-E89 PolarHBondContact O-N 3.34Å
90	L	93.3	Very high	95.1	Very high	97 Å²	97	68.5 Å²	68.5	51%	0.508	35%	0.345	S	S	.	.	H	α-helix	trans	-89.2	-10.5	-179.7	-65.6	-176.5	0	0	0	113.6	H86 L88 E92	H86-L90 WeakPolarHBondContact CE1-CD1 3.3Å; H86-L90 WeakPolarHBondContact NE2-CD1 3.46Å; H86-L90 WeakPolarHBondContact O-CG 3.31Å; H86-L90 PolarHBondContact O-N 3.08Å; L88-L90 VanDerWaalsContact C-N 3.34Å; L90-E92 HydrophobicContact CB-CB 4.43Å; L90-E92 PolarHBondContact O-N 3.22Å; L90-E92 VanDerWaalsContact O-N 3.12Å
91	E	92.8	Very high	95	Very high	182 Å²	182	70 Å²	70	85%	0.85	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	26.4	-171.2	-57.9	-175.2	170.4	0	0	113.2	G87 L88	G87-E91 WeakPolarHBondContact O-CA 3.2Å; G87-E91 PolarHBondContact O-N 2.92Å; L88-E91 PolarHBondContact O-N 3Å
92	E	91.3	Very high	94.9	Very high	125 Å²	125	64.1 Å²	64.1	58%	0.584	33%	0.328	S	S	*	.	S	Bend	trans	-132.5	145.9	-177.6	-75	-172.7	176.4	0	0	110.9	G87 L90	G87-E92 WeakPolarHBondContact CA-O 3.45Å; G87-E92 PolarHBondContact O-N 3.01Å; L90-E92 HydrophobicContact CB-CB 4.43Å; L90-E92 PolarHBondContact O-N 3.22Å; L90-E92 VanDerWaalsContact O-N 3.12Å
93	P	92.4	Very high	94.9	Very high	81 Å²	81	60.2 Å²	60.2	53%	0.526	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-57.6	132.3	171	-22.5	33.2	0	0	0	110.9
94	P	95.4	Very high	94.8	Very high	9 Å²	9	62.3 Å²	62.3	6%	0.058	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-65.6	148.2	-177.5	26.4	-34.2	0	0	0	111.9	H58 I61 L83	H58-P94 HydrophobicContact CB-CG 4.12Å; I61-P94 HydrophobicContact CD1-CG 4.32Å; L83-P94 HydrophobicContact CD1-CB 3.44Å; L83-P94 VanDerWaalsContact CD1-CB 3.44Å; L83-P94 HydrophobicContact CD1-CG 3.99Å; L83-P94 HydrophobicContact CD2-CB 4.46Å; L83-P94 HydrophobicContact CD2-CG 4.16Å; L83-P94 HydrophobicContact CG-CB 3.82Å; L83-P94 HydrophobicContact CG-CG 3.77Å
95	L	96.8	Very high	94.7	Very high	55 Å²	55	61 Å²	61	29%	0.288	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-77	150.6	175.2	-56.2	178.6	0	0	0	111.4	L97 A98 A99 D124 R126	L95-L97 VanDerWaalsContact C-N 3.28Å; L95-L97 PolarHBondContact O-N 3.38Å; L95-A98 HydrophobicContact CB-CB 4.3Å; L95-A98 WeakPolarHBondContact O-CB 3.27Å; L95-A98 PolarHBondContact O-N 2.86Å; L95-A98 VanDerWaalsContact O-N 3.08Å; L95-A99 PolarHBondContact O-N 2.64Å; L95-D124 HydrophobicContact CD2-CB 4.15Å; L95-R126 HydrophobicContact CD2-CB 4.36Å; L95-R126 HydrophobicContact CD2-CG 3.91Å
96	V	97.5	Very high	94.6	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.8	-40.8	177.6	-174	0	0	0	0	110.5	I61 A98 A99 A100 V120 D124 Q130 Y132	I61-V96 HydrophobicContact CD1-CG2 4.45Å; I61-V96 HydrophobicContact CG1-CG2 4.28Å; V96-A98 VanDerWaalsContact C-N 3.28Å; V96-A98 PolarHBondContact O-N 3.02Å; V96-A99 PolarHBondContact O-N 2.75Å; V96-A100 WeakPolarHBondContact O-CB 3.29Å; V96-A100 PolarHBondContact O-N 2.86Å; V96-V120 HydrophobicContact CG1-CG1 4.33Å; V96-D124 HydrophobicContact CG2-CB 4.05Å; V96-D124 WeakPolarHBondContact CG2-OD2 3.36Å; V96-D124 PolarHBondContact N-OD2 3.18Å; V96-Q130 HydrophobicContact CB-CB 4.21Å; V96-Q130 HydrophobicContact CG1-CB 3.99Å; V96-Q130 HydrophobicContact CG2-CB 4.49Å; V96-Y132 HydrophobicContact CB-CE2 4.49Å; V96-Y132 HydrophobicContact CG1-CD2 3.96Å; V96-Y132 HydrophobicContact CG1-CE2 4.03Å
97	L	96.6	Very high	94.4	Very high	76 Å²	76	56 Å²	56	40%	0.398	29%	0.293	S	S	.	.	H	α-helix	trans	-61	-34.7	176	179.8	61.5	0	0	0	112.9	L95 N101 Y132 L139	L95-L97 VanDerWaalsContact C-N 3.28Å; L95-L97 PolarHBondContact O-N 3.38Å; L97-N101 WeakPolarHBondContact CD1-ND2 3.49Å; L97-N101 WeakPolarHBondContact O-CB 3.35Å; L97-N101 PolarHBondContact O-N 2.83Å; L97-N101 PolarHBondContact O-ND2 3.43Å; L97-Y132 HydrophobicContact CD1-CE1 3.93Å; L97-L139 HydrophobicContact CD1-CD2 3.87Å
98	A	96.2	Very high	94.3	Very high	25 Å²	25	61.2 Å²	61.2	21%	0.207	31%	0.31	C	S	.	.	H	α-helix	trans	-67.2	-48	177.5	0	0	0	0	0	110.3	L95 V96 A100 N101 I102	L95-A98 HydrophobicContact CB-CB 4.3Å; L95-A98 WeakPolarHBondContact O-CB 3.27Å; L95-A98 PolarHBondContact O-N 2.86Å; L95-A98 VanDerWaalsContact O-N 3.08Å; V96-A98 VanDerWaalsContact C-N 3.28Å; V96-A98 PolarHBondContact O-N 3.02Å; A98-A100 VanDerWaalsContact C-N 3.34Å; A98-A100 PolarHBondContact O-N 2.94Å; A98-N101 PolarHBondContact O-N 2.93Å; A98-I102 WeakPolarHBondContact O-CG1 3.47Å; A98-I102 PolarHBondContact O-N 3.13Å
99	A	96.8	Very high	94.2	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-57.5	-46.2	174.8	0	0	0	0	0	112	L57 I61 L83 L95 V96 N101 I102 V103 V120	L57-A99 HydrophobicContact CD1-CB 4.33Å; I61-A99 HydrophobicContact CD1-CB 4.04Å; I61-A99 HydrophobicContact CG2-CB 3.76Å; L83-A99 HydrophobicContact CD1-CB 3.89Å; L83-A99 HydrophobicContact CD2-CB 3.6Å; L83-A99 HydrophobicContact CG-CB 4.42Å; L95-A99 PolarHBondContact O-N 2.64Å; V96-A99 PolarHBondContact O-N 2.75Å; A99-N101 VanDerWaalsContact C-N 3.3Å; A99-N101 PolarHBondContact O-N 3.29Å; A99-I102 PolarHBondContact O-N 3.04Å; A99-V103 WeakPolarHBondContact O-CG2 3.45Å; A99-V103 PolarHBondContact O-N 3Å; A99-V120 HydrophobicContact CB-CG1 4.29Å
100	A	96.3	Very high	93.9	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65	-34.1	-179.6	0	0	0	0	0	112.5	V96 A98 K104 V120 Y132 L139	V96-A100 WeakPolarHBondContact O-CB 3.29Å; V96-A100 PolarHBondContact O-N 2.86Å; A98-A100 VanDerWaalsContact C-N 3.34Å; A98-A100 PolarHBondContact O-N 2.94Å; A100-K104 VanDerWaalsContact O-CB 3.26Å; A100-K104 WeakPolarHBondContact O-CB 3.47Å; A100-K104 PolarHBondContact O-N 2.79Å; A100-V120 HydrophobicContact CB-CB 3.98Å; A100-V120 HydrophobicContact CB-CG1 4.06Å; A100-V120 HydrophobicContact CB-CG2 4.35Å; A100-Y132 HydrophobicContact CB-CD1 4.49Å; A100-Y132 HydrophobicContact CB-CD2 3.89Å; A100-Y132 HydrophobicContact CB-CG 3.82Å; A100-L139 HydrophobicContact CB-CD1 3.7Å; A100-L139 HydrophobicContact CB-CD2 4.24Å
101	N	95.8	Very high	93.6	Very high	53 Å²	53	60.6 Å²	60.6	28%	0.283	29%	0.291	S	S	.	.	H	α-helix	trans	-68.9	-39.9	172.4	-86.9	-70.2	0	0	0	113.1	L97 A98 A99 K104 N105	L97-N101 WeakPolarHBondContact CD1-ND2 3.49Å; L97-N101 WeakPolarHBondContact O-CB 3.35Å; L97-N101 PolarHBondContact O-N 2.83Å; L97-N101 PolarHBondContact O-ND2 3.43Å; A98-N101 PolarHBondContact O-N 2.93Å; A99-N101 VanDerWaalsContact C-N 3.3Å; A99-N101 PolarHBondContact O-N 3.29Å; N101-K104 PolarHBondContact O-N 3.37Å; N101-K104 PolarHBondContact OD1-NZ 3.38Å; N101-N105 VanDerWaalsContact O-CB 3.3Å; N101-N105 WeakPolarHBondContact O-CB 3.46Å; N101-N105 PolarHBondContact O-N 3.25Å; N101-N105 PolarHBondContact O-ND2 3.05Å; N101-N105 PolarHBondContact O-OD1 3.12Å
102	I	95.4	Very high	93.3	Very high	25 Å²	25	57.5 Å²	57.5	13%	0.128	28%	0.277	C	S	.	.	H	α-helix	trans	-60.8	-51	175.6	-71.3	172.9	0	0	0	110	A79 Q82 L83 A98 A99 K104 N105 I106	A79-I102 HydrophobicContact CB-CG2 3.86Å; Q82-I102 HydrophobicContact CB-CD1 4.17Å; Q82-I102 HydrophobicContact CB-CG2 4.07Å; L83-I102 HydrophobicContact CB-CD1 4.35Å; L83-I102 HydrophobicContact CD1-CD1 3.99Å; A98-I102 WeakPolarHBondContact O-CG1 3.47Å; A98-I102 PolarHBondContact O-N 3.13Å; A99-I102 PolarHBondContact O-N 3.04Å; I102-K104 PolarHBondContact O-N 3.2Å; I102-N105 PolarHBondContact O-N 3.04Å; I102-N105 VanDerWaalsContact O-N 3.16Å; I102-I106 HydrophobicContact CG2-CD1 3.72Å; I102-I106 HydrophobicContact CG2-CG1 4.48Å; I102-I106 WeakPolarHBondContact O-CG1 3.47Å; I102-I106 PolarHBondContact O-N 3.25Å
103	V	95.1	Very high	93.1	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-56.5	-51.1	177.2	173.4	0	0	0	0	110.5	L57 A79 A99 N105 I106 S107 L118 V120 T134	L57-V103 HydrophobicContact CD1-CG2 3.75Å; A79-V103 HydrophobicContact CB-CG2 3.69Å; A99-V103 WeakPolarHBondContact O-CG2 3.45Å; A99-V103 PolarHBondContact O-N 3Å; V103-N105 VanDerWaalsContact C-N 3.32Å; V103-N105 PolarHBondContact O-N 3.36Å; V103-I106 PolarHBondContact O-N 3.44Å; V103-S107 WeakPolarHBondContact O-CB 3.46Å; V103-S107 PolarHBondContact O-N 2.81Å; V103-S107 PolarHBondContact O-OG 3.45Å; V103-S107 VanDerWaalsContact O-OG 3.07Å; V103-L118 HydrophobicContact CG1-CB 3.79Å; V103-L118 HydrophobicContact CG1-CD1 3.58Å; V103-L118 HydrophobicContact CG1-CG 4.32Å; V103-V120 HydrophobicContact CB-CG2 3.97Å; V103-V120 HydrophobicContact CG1-CG2 4.12Å; V103-V120 HydrophobicContact CG2-CG2 3.77Å; V103-T134 HydrophobicContact CG1-CG2 4.3Å
104	K	94.2	Very high	92.7	Very high	44 Å²	44	55.6 Å²	55.6	19%	0.191	27%	0.265	C	S	.	.	H	α-helix	trans	-55.1	-45.2	176.7	-174	-149.2	82.7	-164.2	0	112.3	A100 N101 I102 Y108 T134 G137 L139	A100-K104 VanDerWaalsContact O-CB 3.26Å; A100-K104 WeakPolarHBondContact O-CB 3.47Å; A100-K104 PolarHBondContact O-N 2.79Å; N101-K104 PolarHBondContact O-N 3.37Å; N101-K104 PolarHBondContact OD1-NZ 3.38Å; I102-K104 PolarHBondContact O-N 3.2Å; K104-Y108 VanDerWaalsContact O-CB 3.23Å; K104-Y108 WeakPolarHBondContact O-CB 3.41Å; K104-Y108 PolarHBondContact O-N 3.4Å; K104-T134 HydrophobicContact CB-CG2 4.23Å; K104-G137 WeakPolarHBondContact CD-O 3.43Å; K104-G137 WeakPolarHBondContact CG-O 3.44Å; K104-L139 HydrophobicContact CD-CB 3.85Å; K104-L139 HydrophobicContact CG-CB 4.41Å
105	N	93.4	Very high	92.2	Very high	89 Å²	89	58 Å²	58	48%	0.476	28%	0.277	S	S	.	.	H	α-helix	trans	-67.3	-41.6	-177.4	-71.6	-17.7	0	0	0	111.7	N101 I102 V103 K109	N101-N105 VanDerWaalsContact O-CB 3.3Å; N101-N105 WeakPolarHBondContact O-CB 3.46Å; N101-N105 PolarHBondContact O-N 3.25Å; N101-N105 PolarHBondContact O-ND2 3.05Å; N101-N105 PolarHBondContact O-OD1 3.12Å; I102-N105 PolarHBondContact O-N 3.04Å; I102-N105 VanDerWaalsContact O-N 3.16Å; V103-N105 VanDerWaalsContact C-N 3.32Å; V103-N105 PolarHBondContact O-N 3.36Å; N105-K109 VanDerWaalsContact O-CB 3.25Å; N105-K109 WeakPolarHBondContact O-CB 3.37Å; N105-K109 PolarHBondContact O-N 3.07Å
106	I	92.6	Very high	91.8	Very high	7 Å²	7	56.2 Å²	56.2	4%	0.036	27%	0.271	C	S	.	.	H	α-helix	trans	-65.1	-51.7	175.7	-62.9	165.7	0	0	0	109.6	I75 M78 A79 I102 V103 Y108 K109 Y110	I75-I106 HydrophobicContact CB-CG2 4.33Å; I75-I106 HydrophobicContact CG1-CG2 4.07Å; I75-I106 HydrophobicContact CG2-CB 4.18Å; I75-I106 HydrophobicContact CG2-CG2 3.81Å; M78-I106 HydrophobicContact CB-CD1 3.96Å; M78-I106 HydrophobicContact CE-CG2 4.14Å; M78-I106 HydrophobicContact SD-CG2 4.41Å; A79-I106 HydrophobicContact CB-CD1 4Å; I102-I106 HydrophobicContact CG2-CD1 3.72Å; I102-I106 HydrophobicContact CG2-CG1 4.48Å; I102-I106 WeakPolarHBondContact O-CG1 3.47Å; I102-I106 PolarHBondContact O-N 3.25Å; V103-I106 PolarHBondContact O-N 3.44Å; I106-Y108 VanDerWaalsContact C-N 3.3Å; I106-Y108 PolarHBondContact O-N 2.86Å; I106-K109 PolarHBondContact O-N 2.9Å; I106-Y110 HydrophobicContact CG2-CD2 3.95Å; I106-Y110 HydrophobicContact CG2-CE2 4.18Å; I106-Y110 VanDerWaalsContact O-CD2 3.28Å; I106-Y110 WeakPolarHBondContact O-CD2 3.32Å; I106-Y110 PolarHBondContact O-N 3.02Å; I106-Y110 VanDerWaalsContact O-N 3.15Å
107	S	90.3	Very high	91.3	Very high	22 Å²	22	60.9 Å²	60.9	15%	0.154	29%	0.292	C	S	.	.	H	α-helix	trans	-57.4	-41.9	178.6	-62.1	0	0	0	0	112.3	V103 R111	V103-S107 WeakPolarHBondContact O-CB 3.46Å; V103-S107 PolarHBondContact O-N 2.81Å; V103-S107 PolarHBondContact O-OG 3.45Å; V103-S107 VanDerWaalsContact O-OG 3.07Å; S107-R111 WeakPolarHBondContact O-CA 3.19Å; S107-R111 PolarHBondContact O-N 3.32Å; S107-R111 VanDerWaalsContact O-N 3.1Å
108	Y	90.6	Very high	91.1	Very high	122 Å²	122	57.5 Å²	57.5	48%	0.478	28%	0.275	S	S	.	.	H	α-helix	trans	-69.8	-39.1	178.5	-172.5	-104.4	0	0	0	112.6	K104 I106 Y110 R111	K104-Y108 VanDerWaalsContact O-CB 3.23Å; K104-Y108 WeakPolarHBondContact O-CB 3.41Å; K104-Y108 PolarHBondContact O-N 3.4Å; I106-Y108 VanDerWaalsContact C-N 3.3Å; I106-Y108 PolarHBondContact O-N 2.86Å; Y108-Y110 VanDerWaalsContact C-N 3.27Å; Y108-Y110 PolarHBondContact O-N 2.89Å; Y108-R111 WeakPolarHBondContact O-CB 2.97Å; Y108-R111 VanDerWaalsContact O-CG 3.27Å; Y108-R111 WeakPolarHBondContact O-CG 3.09Å; Y108-R111 PolarHBondContact O-N 3.26Å
109	K	91.4	Very high	91	Very high	150 Å²	150	56.7 Å²	56.7	65%	0.652	27%	0.267	S	S	*	.	H	α-helix	trans	-60.6	-38.5	178.5	-179	-178.4	177.4	-165.2	0	112	N105 I106	N105-K109 VanDerWaalsContact O-CB 3.25Å; N105-K109 WeakPolarHBondContact O-CB 3.37Å; N105-K109 PolarHBondContact O-N 3.07Å; I106-K109 PolarHBondContact O-N 2.9Å
110	Y	89.1	Confident	91.1	Very high	69 Å²	69	56.6 Å²	56.6	27%	0.271	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	19.9	-176.7	-61.2	-74.3	0	0	0	113.5	M78 I106 Y108 E112 D113 L114	M78-Y110 HydrophobicContact CE-CE2 4.01Å; I106-Y110 HydrophobicContact CG2-CD2 3.95Å; I106-Y110 HydrophobicContact CG2-CE2 4.18Å; I106-Y110 VanDerWaalsContact O-CD2 3.28Å; I106-Y110 WeakPolarHBondContact O-CD2 3.32Å; I106-Y110 PolarHBondContact O-N 3.02Å; I106-Y110 VanDerWaalsContact O-N 3.15Å; Y108-Y110 VanDerWaalsContact C-N 3.27Å; Y108-Y110 PolarHBondContact O-N 2.89Å; Y110-E112 PolarHBondContact O-N 2.87Å; Y110-D113 PolarHBondContact O-N 3.42Å; Y110-L114 HydrophobicContact CD2-CD1 4.27Å; Y110-L114 HydrophobicContact CG-CD1 3.99Å; Y110-L114 PolarHBondContact O-N 3.39Å
111	R	86	Confident	91.2	Very high	138 Å²	138	56.7 Å²	56.7	52%	0.521	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.4	-173.2	69	-179.8	-137.5	163.8	12.2	115.5	S107 Y108	S107-R111 WeakPolarHBondContact O-CA 3.19Å; S107-R111 PolarHBondContact O-N 3.32Å; S107-R111 VanDerWaalsContact O-N 3.1Å; Y108-R111 WeakPolarHBondContact O-CB 2.97Å; Y108-R111 VanDerWaalsContact O-CG 3.27Å; Y108-R111 WeakPolarHBondContact O-CG 3.09Å; Y108-R111 PolarHBondContact O-N 3.26Å
112	E	86.7	Confident	91.3	Very high	117 Å²	117	54.1 Å²	54.1	55%	0.547	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-15.7	179.2	-55.1	-60.4	151	0	0	112.2	R13 Y110	R13-E112 PolarHBondContact NH2-O 3.42Å; Y110-E112 PolarHBondContact O-N 2.87Å
113	D	86.6	Confident	91.4	Very high	120 Å²	120	54.8 Å²	54.8	64%	0.642	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-33.3	-171.9	-62.7	-43.2	0	0	0	113.2	Y110	Y110-D113 PolarHBondContact O-N 3.42Å
114	L	84.4	Confident	91.5	Very high	45 Å²	45	55.2 Å²	55.2	24%	0.236	26%	0.256	C	S	.	.			trans	-112.2	135.8	-176.1	-61.1	-178.3	0	0	0	111.1	D71 I75 Y110	D71-L114 HydrophobicContact CB-CB 4.13Å; D71-L114 HydrophobicContact CB-CD2 3.94Å; I75-L114 HydrophobicContact CD1-CB 4.25Å; I75-L114 HydrophobicContact CD1-CD1 3.72Å; I75-L114 HydrophobicContact CG1-CD1 3.64Å; Y110-L114 HydrophobicContact CD2-CD1 4.27Å; Y110-L114 HydrophobicContact CG-CD1 3.99Å; Y110-L114 PolarHBondContact O-N 3.39Å
115	L	85.4	Confident	91.5	Very high	59 Å²	59	60.3 Å²	60.3	31%	0.309	28%	0.281	S	S	.	.			trans	-108.6	84.3	177.7	-164.5	154.2	0	0	0	109.3	S68 D71	S68-L115 WeakPolarHBondContact CB-O 3.44Å; S68-L115 PolarHBondContact N-O 2.86Å; D71-L115 PolarHBondContact OD2-N 2.85Å
116	A	86.9	Confident	91.6	Very high	18 Å²	18	65.1 Å²	65.1	15%	0.149	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	139	178.9	0	0	0	0	0	111.6	S66 D71 A72 I75 L118	S66-A116 WeakPolarHBondContact O-CA 3.36Å; D71-A116 HydrophobicContact CB-CB 4.5Å; A72-A116 HydrophobicContact CB-CB 4.06Å; I75-A116 HydrophobicContact CD1-CB 3.68Å; A116-L118 HydrophobicContact CB-CD2 4.41Å; A116-L118 HydrophobicContact CB-CG 4.34Å
117	H	86.9	Confident	91.8	Very high	98 Å²	98	70.3 Å²	70.3	45%	0.454	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	118.2	169.5	-67.5	85.7	0	0	0	107.3	S66	S66-H117 VanDerWaalsContact CB-O 3.32Å; S66-H117 WeakPolarHBondContact CB-O 3.49Å; S66-H117 PolarHBondContact N-O 3.08Å; S66-H117 PolarHBondContact O-N 3.42Å
118	L	92.4	Very high	92.1	Very high	5 Å²	5	70.2 Å²	70.2	3%	0.026	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	142.5	-170.3	-59.8	-179.4	0	0	0	110.1	L65 A72 I75 V103 A116 T134	L65-L118 HydrophobicContact CB-CD2 4.46Å; L65-L118 HydrophobicContact CD2-CD2 3.57Å; A72-L118 HydrophobicContact CB-CD2 3.93Å; I75-L118 HydrophobicContact CB-CD1 3.87Å; I75-L118 HydrophobicContact CD1-CD1 4.36Å; I75-L118 HydrophobicContact CG2-CD1 3.34Å; V103-L118 HydrophobicContact CG1-CB 3.79Å; V103-L118 HydrophobicContact CG1-CD1 3.58Å; V103-L118 HydrophobicContact CG1-CG 4.32Å; A116-L118 HydrophobicContact CB-CD2 4.41Å; A116-L118 HydrophobicContact CB-CG 4.34Å; L118-T134 PolarHBondContact O-N 3.02Å; L118-T134 VanDerWaalsContact O-N 3.14Å; L118-T134 PolarHBondContact O-OG1 3.5Å
119	M	95.6	Very high	92.4	Very high	8 Å²	8	64.6 Å²	64.6	4%	0.039	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	124.9	174.7	-178.1	-168.9	-57.1	0	0	108.1	I23 A25 C63 A64 V131 Y132 A145	I23-M119 HydrophobicContact CD1-CB 4.21Å; I23-M119 HydrophobicContact CD1-CE 4.25Å; I23-M119 HydrophobicContact CG1-CE 4.34Å; A25-M119 HydrophobicContact CB-SD 3.45Å; A25-M119 WeakPolarHBondContact CB-SD 3.29Å; C63-M119 CarbonylContact C-O 3.56Å; C63-M119 VanDerWaalsContact CA-O 3.31Å; C63-M119 WeakPolarHBondContact CA-O 3.09Å; A64-M119 HydrophobicContact CB-CB 4.28Å; A64-M119 PolarHBondContact N-O 3.36Å; A64-M119 PolarHBondContact O-N 3.12Å; A64-M119 VanDerWaalsContact O-N 3.15Å; M119-V131 HydrophobicContact CG-CG1 4.29Å; M119-V131 HydrophobicContact SD-CG1 4.24Å; M119-Y132 WeakPolarHBondContact CA-O 3.2Å; M119-A145 VanDerWaalsContact CE-C 3.44Å; M119-A145 HydrophobicContact CE-CB 3.57Å; M119-A145 WeakPolarHBondContact CE-O 3.31Å; M119-A145 HydrophobicContact CG-CB 4.34Å; M119-A145 HydrophobicContact SD-CB 3.78Å
120	V	97.8	Very high	92.8	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.7	179.7	179.5	0	0	0	0	108.5	L57 I61 Y62 V96 A99 A100 V103 Y132	L57-V120 HydrophobicContact CD1-CG1 4.38Å; L57-V120 HydrophobicContact CD1-CG2 4.31Å; I61-V120 HydrophobicContact CG2-CG1 3.82Å; Y62-V120 WeakPolarHBondContact O-CA 3.24Å; V96-V120 HydrophobicContact CG1-CG1 4.33Å; A99-V120 HydrophobicContact CB-CG1 4.29Å; A100-V120 HydrophobicContact CB-CB 3.98Å; A100-V120 HydrophobicContact CB-CG1 4.06Å; A100-V120 HydrophobicContact CB-CG2 4.35Å; V103-V120 HydrophobicContact CB-CG2 3.97Å; V103-V120 HydrophobicContact CG1-CG2 4.12Å; V103-V120 HydrophobicContact CG2-CG2 3.77Å; V120-Y132 PolarHBondContact N-O 3.27Å; V120-Y132 PolarHBondContact O-N 3.23Å
121	A	98.3	Very high	93.2	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.008	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	142.2	176.5	0	0	0	0	0	109.7	A25 V32 V34 Y62 Q130 V131	A25-A121 HydrophobicContact CB-CB 3.92Å; V32-A121 HydrophobicContact CG2-CB 4.23Å; V34-A121 HydrophobicContact CG2-CB 3.53Å; Y62-A121 PolarHBondContact N-O 2.89Å; Y62-A121 PolarHBondContact O-N 3.14Å; Y62-A121 VanDerWaalsContact O-O 3.08Å; A121-Q130 VanDerWaalsContact CA-O 3.27Å; A121-Q130 WeakPolarHBondContact CA-O 3.36Å; A121-V131 HydrophobicContact CB-CG2 4.07Å
122	G	98.2	Very high	93.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	-173.1	-177.9	0	0	0	0	0	112.7	R60 G129 Q130	R60-G122 CarbonylContact O-C 3.56Å; R60-G122 WeakPolarHBondContact O-CA 3.46Å; G122-G129 WeakPolarHBondContact O-CA 3.38Å; G122-Q130 PolarHBondContact N-O 3.15Å; G122-Q130 VanDerWaalsContact N-O 3.09Å; G122-Q130 PolarHBondContact O-N 2.87Å
123	W	98.4	Very high	94	Very high	39 Å²	39	43.5 Å²	43.5	15%	0.148	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135.6	174.3	-177.9	96.7	0	0	0	109.7	R60 Q125 G128 I198 A200	R60-W123 PolarHBondContact O-N 3.1Å; W123-Q125 HydrophobicContact CH2-CB 4.37Å; W123-Q125 HydrophobicContact CH2-CG 3.8Å; W123-Q125 HydrophobicContact CZ3-CG 3.8Å; W123-G128 WeakPolarHBondContact CA-O 3.27Å; W123-I198 HydrophobicContact CB-CG2 3.81Å; W123-A200 HydrophobicContact CD2-CB 4.31Å; W123-A200 HydrophobicContact CH2-CB 3.79Å; W123-A200 HydrophobicContact CZ2-CB 3.29Å; W123-A200 HydrophobicContact CZ3-CB 4.48Å
124	D	97	Very high	93.7	Very high	8 Å²	8	38.3 Å²	38.3	4%	0.043	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	168.9	167.3	69.3	48.8	0	0	0	112.4	L95 V96 R126 E127 G128 Q130	L95-D124 HydrophobicContact CD2-CB 4.15Å; V96-D124 HydrophobicContact CG2-CB 4.05Å; V96-D124 WeakPolarHBondContact CG2-OD2 3.36Å; V96-D124 PolarHBondContact N-OD2 3.18Å; D124-R126 VanDerWaalsContact C-N 3.25Å; D124-R126 PolarHBondContact O-N 2.66Å; D124-R126 WeakPolarHBondContact OD1-CA 3.49Å; D124-R126 PolarHBondContact OD1-N 3.37Å; D124-E127 PolarHBondContact OD1-N 3.14Å; D124-G128 PolarHBondContact N-O 3.43Å; D124-G128 VanDerWaalsContact N-O 3.1Å; D124-G128 VanDerWaalsContact O-CA 3.23Å; D124-G128 WeakPolarHBondContact O-CA 3.38Å; D124-G128 PolarHBondContact O-N 2.98Å; D124-G128 VanDerWaalsContact O-N 3.08Å; D124-Q130 PolarHBondContact OD1-NE2 2.98Å; D124-Q130 PolarHBondContact OD2-NE2 3.16Å
125	Q	94.6	Very high	93.1	Very high	151 Å²	151	42.4 Å²	42.4	71%	0.706	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-12.9	-175	-60.3	178.2	8.8	0	0	113.8	W123	W123-Q125 HydrophobicContact CH2-CB 4.37Å; W123-Q125 HydrophobicContact CH2-CG 3.8Å; W123-Q125 HydrophobicContact CZ3-CG 3.8Å
126	R	94.9	Very high	92.2	Very high	190 Å²	190	43.2 Å²	43.2	72%	0.717	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-49.6	-174.1	-72.6	-169.2	170.7	-166.1	-2.1	112.3	L95 D124	L95-R126 HydrophobicContact CD2-CB 4.36Å; L95-R126 HydrophobicContact CD2-CG 3.91Å; D124-R126 VanDerWaalsContact C-N 3.25Å; D124-R126 PolarHBondContact O-N 2.66Å; D124-R126 WeakPolarHBondContact OD1-CA 3.49Å; D124-R126 PolarHBondContact OD1-N 3.37Å
127	E	96.1	Very high	91.3	Very high	117 Å²	117	43.6 Å²	43.6	55%	0.547	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-1.9	-171	-71.6	-88.1	168.8	0	0	111.7	D124 Q130 R141	D124-E127 PolarHBondContact OD1-N 3.14Å; E127-Q130 VanDerWaalsContact CB-CD 3.49Å; E127-Q130 HydrophobicContact CB-CG 4.08Å; E127-R141 IonicContact OE2-CZ 3.67Å; E127-R141 IonicContact OE2-NH1 3.7Å; E127-R141 PolarHBondContact OE2-NH1 3.17Å
128	G	97.1	Very high	91.2	Very high	20 Å²	20	44.7 Å²	44.7	21%	0.206	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	71.3	-141.9	-178.9	0	0	0	0	0	112	W123 D124 Q130	W123-G128 WeakPolarHBondContact CA-O 3.27Å; D124-G128 PolarHBondContact N-O 3.43Å; D124-G128 VanDerWaalsContact N-O 3.1Å; D124-G128 VanDerWaalsContact O-CA 3.23Å; D124-G128 WeakPolarHBondContact O-CA 3.38Å; D124-G128 PolarHBondContact O-N 2.98Å; D124-G128 VanDerWaalsContact O-N 3.08Å; G128-Q130 PolarHBondContact O-NE2 3.45Å; G128-Q130 VanDerWaalsContact O-NE2 3.11Å
129	G	97.4	Very high	91.2	Very high	4 Å²	4	46.7 Å²	46.7	4%	0.041	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	132.3	176.7	0	0	0	0	0	111.5	E27 G122	E27-G129 WeakPolarHBondContact CG-O 3.4Å; E27-G129 VanDerWaalsContact OE1-O 3.09Å; G122-G129 WeakPolarHBondContact O-CA 3.38Å
130	Q	98.3	Very high	91.1	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.009	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	142.4	-179.1	-69.7	157.3	81	0	0	111	V32 V96 A121 G122 D124 E127 G128 Y132	V32-Q130 VanDerWaalsContact CG1-N 3.31Å; V96-Q130 HydrophobicContact CB-CB 4.21Å; V96-Q130 HydrophobicContact CG1-CB 3.99Å; V96-Q130 HydrophobicContact CG2-CB 4.49Å; A121-Q130 VanDerWaalsContact CA-O 3.27Å; A121-Q130 WeakPolarHBondContact CA-O 3.36Å; G122-Q130 PolarHBondContact N-O 3.15Å; G122-Q130 VanDerWaalsContact N-O 3.09Å; G122-Q130 PolarHBondContact O-N 2.87Å; D124-Q130 PolarHBondContact OD1-NE2 2.98Å; D124-Q130 PolarHBondContact OD2-NE2 3.16Å; E127-Q130 VanDerWaalsContact CB-CD 3.49Å; E127-Q130 HydrophobicContact CB-CG 4.08Å; G128-Q130 PolarHBondContact O-NE2 3.45Å; G128-Q130 VanDerWaalsContact O-NE2 3.11Å; Q130-Y132 HydrophobicContact CB-CD2 4.29Å; Q130-Y132 HydrophobicContact CB-CE2 3.75Å; Q130-Y132 HydrophobicContact CG-CE2 4.32Å; Q130-Y132 PolarHBondContact OE1-OH 3.32Å; Q130-Y132 VanDerWaalsContact OE1-OH 3.13Å
131	V	97.9	Very high	91	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	128.7	173.1	178.5	0	0	0	0	110.2	A25 E27 V32 M119 A121 R141 Q142 A145	A25-V131 HydrophobicContact CB-CB 4.42Å; A25-V131 HydrophobicContact CB-CG1 3.71Å; A25-V131 HydrophobicContact CB-CG2 3.8Å; E27-V131 HydrophobicContact CB-CG2 4.41Å; V32-V131 HydrophobicContact CB-CG2 4.45Å; V32-V131 HydrophobicContact CG1-CG2 3.97Å; M119-V131 HydrophobicContact CG-CG1 4.29Å; M119-V131 HydrophobicContact SD-CG1 4.24Å; A121-V131 HydrophobicContact CB-CG2 4.07Å; V131-R141 WeakPolarHBondContact O-CA 3.3Å; V131-Q142 WeakPolarHBondContact CB-O 3.45Å; V131-Q142 PolarHBondContact O-N 3.47Å; V131-Q142 VanDerWaalsContact O-N 3.1Å; V131-A145 HydrophobicContact CG1-CB 3.76Å
132	Y	97.3	Very high	90.8	Very high	18 Å²	18	58.1 Å²	58.1	7%	0.071	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	121.4	179.5	-70.8	-81.6	0	0	0	111.8	V96 L97 A100 M119 V120 Q130 L139 I140 R141	V96-Y132 HydrophobicContact CB-CE2 4.49Å; V96-Y132 HydrophobicContact CG1-CD2 3.96Å; V96-Y132 HydrophobicContact CG1-CE2 4.03Å; L97-Y132 HydrophobicContact CD1-CE1 3.93Å; A100-Y132 HydrophobicContact CB-CD1 4.49Å; A100-Y132 HydrophobicContact CB-CD2 3.89Å; A100-Y132 HydrophobicContact CB-CG 3.82Å; M119-Y132 WeakPolarHBondContact CA-O 3.2Å; V120-Y132 PolarHBondContact N-O 3.27Å; V120-Y132 PolarHBondContact O-N 3.23Å; Q130-Y132 HydrophobicContact CB-CD2 4.29Å; Q130-Y132 HydrophobicContact CB-CE2 3.75Å; Q130-Y132 HydrophobicContact CG-CE2 4.32Å; Q130-Y132 PolarHBondContact OE1-OH 3.32Å; Q130-Y132 VanDerWaalsContact OE1-OH 3.13Å; Y132-L139 HydrophobicContact CD1-CD1 3.94Å; Y132-L139 HydrophobicContact CD1-CD2 4.32Å; Y132-L139 HydrophobicContact CD1-CG 3.89Å; Y132-L139 HydrophobicContact CG-CD1 4.17Å; Y132-I140 WeakPolarHBondContact CA-O 3.48Å; Y132-R141 HydrophobicContact CD1-CB 4.03Å; Y132-R141 HydrophobicContact CE1-CB 3.65Å; Y132-R141 HydrophobicContact CE1-CG 4.23Å
133	G	91.9	Very high	90.7	Very high	11 Å²	11	61 Å²	61	11%	0.113	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	133.8	167.8	0	0	0	0	0	111.2	I140	G133-I140 PolarHBondContact N-O 2.61Å; G133-I140 PolarHBondContact O-N 3.09Å
134	T	81.8	Confident	90.6	Very high	11 Å²	11	60.9 Å²	60.9	7%	0.067	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	101.8	169.9	69.1	0	0	0	0	109.6	V103 K104 L118 M138 L139	V103-T134 HydrophobicContact CG1-CG2 4.3Å; K104-T134 HydrophobicContact CB-CG2 4.23Å; L118-T134 PolarHBondContact O-N 3.02Å; L118-T134 VanDerWaalsContact O-N 3.14Å; L118-T134 PolarHBondContact O-OG1 3.5Å; T134-M138 WeakPolarHBondContact CA-O 3.36Å; T134-L139 HydrophobicContact CG2-CD1 3.89Å
135	M	70.1	Confident	90.6	Very high	130 Å²	130	60.7 Å²	60.7	64%	0.64	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	119.8	-179.4	-69.7	-169.8	74.6	0	0	109.9	G137 M138	M135-G137 PolarHBondContact O-N 2.89Å; M135-G137 VanDerWaalsContact O-N 3.09Å; M135-M138 PolarHBondContact N-O 2.86Å; M135-M138 WeakPolarHBondContact O-CB 3.34Å; M135-M138 PolarHBondContact O-N 3.15Å
136	G	66.4	Low	90.7	Very high	76 Å²	76	54.7 Å²	54.7	78%	0.784	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	27	173.5	0	0	0	0	0	115.1	M138	G136-M138 VanDerWaalsContact C-N 3.32Å
137	G	69.8	Low	90.6	Very high	27 Å²	27	46.4 Å²	46.4	28%	0.278	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-0.1	-175.3	0	0	0	0	0	115.1	K104 M135	K104-G137 WeakPolarHBondContact CD-O 3.43Å; K104-G137 WeakPolarHBondContact CG-O 3.44Å; M135-G137 PolarHBondContact O-N 2.89Å; M135-G137 VanDerWaalsContact O-N 3.09Å
138	M	84.1	Confident	90.4	Very high	120 Å²	120	41.7 Å²	41.7	59%	0.591	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	152.1	169.4	-58.6	-179.5	67.9	0	0	110.4	T134 M135 G136 I140	T134-M138 WeakPolarHBondContact CA-O 3.36Å; M135-M138 PolarHBondContact N-O 2.86Å; M135-M138 WeakPolarHBondContact O-CB 3.34Å; M135-M138 PolarHBondContact O-N 3.15Å; G136-M138 VanDerWaalsContact C-N 3.32Å; M138-I140 HydrophobicContact CB-CG1 4.45Å; M138-I140 HydrophobicContact CE-CD1 4.31Å
139	L	91.8	Very high	90.1	Very high	47 Å²	47	43.1 Å²	43.1	25%	0.246	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	119.5	173.1	-175.4	69.1	0	0	0	108.4	L97 A100 K104 Y132 T134	L97-L139 HydrophobicContact CD1-CD2 3.87Å; A100-L139 HydrophobicContact CB-CD1 3.7Å; A100-L139 HydrophobicContact CB-CD2 4.24Å; K104-L139 HydrophobicContact CD-CB 3.85Å; K104-L139 HydrophobicContact CG-CB 4.41Å; Y132-L139 HydrophobicContact CD1-CD1 3.94Å; Y132-L139 HydrophobicContact CD1-CD2 4.32Å; Y132-L139 HydrophobicContact CD1-CG 3.89Å; Y132-L139 HydrophobicContact CG-CD1 4.17Å; T134-L139 HydrophobicContact CG2-CD1 3.89Å
140	I	93.5	Very high	89.9	Confident	73 Å²	73	43 Å²	43	37%	0.374	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	124.3	-174.4	-54.6	177.1	0	0	0	108.7	Y132 G133 M138 Q142	Y132-I140 WeakPolarHBondContact CA-O 3.48Å; G133-I140 PolarHBondContact N-O 2.61Å; G133-I140 PolarHBondContact O-N 3.09Å; M138-I140 HydrophobicContact CB-CG1 4.45Å; M138-I140 HydrophobicContact CE-CD1 4.31Å; I140-Q142 HydrophobicContact CG2-CG 3.85Å
141	R	95.5	Very high	89.7	Confident	95 Å²	95	43.3 Å²	43.3	36%	0.358	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	133.1	169.2	-173.5	175.2	176.1	174.1	0.8	109.1	E27 E127 V131 Y132	E27-R141 IonicContact OE1-NH2 3.81Å; E27-R141 PolarHBondContact OE1-NH2 3.3Å; E27-R141 VanDerWaalsContact OE1-NH2 3.1Å; E27-R141 IonicContact OE2-NE 2.75Å; E27-R141 IonicContact OE2-NH2 3.98Å; E127-R141 IonicContact OE2-CZ 3.67Å; E127-R141 IonicContact OE2-NH1 3.7Å; E127-R141 PolarHBondContact OE2-NH1 3.17Å; V131-R141 WeakPolarHBondContact O-CA 3.3Å; Y132-R141 HydrophobicContact CD1-CB 4.03Å; Y132-R141 HydrophobicContact CE1-CB 3.65Å; Y132-R141 HydrophobicContact CE1-CG 4.23Å
142	Q	95.2	Very high	89.4	Confident	81 Å²	81	48 Å²	48	38%	0.379	29%	0.286	S	S	.	.			trans	-139.1	150.3	178.2	-58.6	-174.6	-73.8	0	0	110	V131 I140 F144	V131-Q142 WeakPolarHBondContact CB-O 3.45Å; V131-Q142 PolarHBondContact O-N 3.47Å; V131-Q142 VanDerWaalsContact O-N 3.1Å; I140-Q142 HydrophobicContact CG2-CG 3.85Å; Q142-F144 WeakPolarHBondContact CB-O 3.36Å; Q142-F144 PolarHBondContact O-N 3.44Å
143	P	95.9	Very high	89.4	Confident	62 Å²	62	53.5 Å²	53.5	40%	0.403	31%	0.307	S	S	.	.	S	Bend	trans	-66.6	-28.3	175.1	26.8	-34.3	0	0	0	112.4	E27 Y162	E27-P143 WeakPolarHBondContact CB-O 3.42Å; E27-P143 PolarHBondContact N-O 3.1Å; P143-Y162 WeakPolarHBondContact CB-OH 3.39Å
144	F	96.7	Very high	89.6	Confident	36 Å²	36	53 Å²	53	16%	0.158	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	154.4	166.4	68.4	-88.7	0	0	0	108.5	A25 V26 Q142 V158 Y162	A25-F144 CarbonylContact O-C 3.57Å; A25-F144 WeakPolarHBondContact O-CA 3.45Å; A25-F144 WeakPolarHBondContact O-CB 3.39Å; V26-F144 HydrophobicContact CB-CB 4.11Å; V26-F144 HydrophobicContact CG2-CB 4.12Å; Q142-F144 WeakPolarHBondContact CB-O 3.36Å; Q142-F144 PolarHBondContact O-N 3.44Å; F144-V158 HydrophobicContact CE2-CB 4.01Å; F144-V158 HydrophobicContact CE2-CG2 3.78Å; F144-V158 HydrophobicContact CZ-CG2 4.37Å; F144-Y162 AromaticContact CD1-CD1 3.85Å; F144-Y162 HydrophobicContact CD1-CD1 3.85Å; F144-Y162 AromaticContact CD1-CD2 3.57Å; F144-Y162 HydrophobicContact CD1-CD2 3.57Å; F144-Y162 HydrophobicContact CD1-CE1 4.09Å; F144-Y162 AromaticContact CD1-CE2 3.83Å; F144-Y162 HydrophobicContact CD1-CE2 3.83Å; F144-Y162 AromaticContact CD1-CG 3.59Å; F144-Y162 HydrophobicContact CD1-CG 3.59Å; F144-Y162 AromaticContact CE1-CD1 3.59Å; F144-Y162 HydrophobicContact CE1-CD1 3.59Å; F144-Y162 HydrophobicContact CE1-CD2 4.06Å; F144-Y162 HydrophobicContact CE1-CE1 4.12Å; F144-Y162 AromaticContact CE1-CG 3.56Å; F144-Y162 HydrophobicContact CE1-CG 3.56Å; F144-Y162 HydrophobicContact CG-CD2 4.33Å
145	A	96.2	Very high	90.2	Very high	4 Å²	4	58.4 Å²	58.4	3%	0.033	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	145.3	174.2	0	0	0	0	0	109.5	M24 A25 M119 V131	M24-A145 CarbonylContact C-O 3.59Å; M24-A145 VanDerWaalsContact CA-O 3.3Å; M24-A145 WeakPolarHBondContact CA-O 3.09Å; A25-A145 PolarHBondContact N-O 3.1Å; A25-A145 PolarHBondContact O-N 2.79Å; M119-A145 VanDerWaalsContact CE-C 3.44Å; M119-A145 HydrophobicContact CE-CB 3.57Å; M119-A145 WeakPolarHBondContact CE-O 3.31Å; M119-A145 HydrophobicContact CG-CB 4.34Å; M119-A145 HydrophobicContact SD-CB 3.78Å; V131-A145 HydrophobicContact CG1-CB 3.76Å
146	I	96.1	Very high	91.5	Very high	25 Å²	25	55 Å²	55	13%	0.128	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.4	174.3	56.5	171.5	0	0	0	109.2	I23 M24 I154 Y155 V158	I23-I146 WeakPolarHBondContact O-CA 3.46Å; M24-I146 HydrophobicContact CB-CG2 4.13Å; M24-I146 HydrophobicContact CG-CG2 3.84Å; M24-I146 HydrophobicContact SD-CG2 3.98Å; I146-I154 HydrophobicContact CD1-CD1 4.46Å; I146-I154 HydrophobicContact CD1-CG1 4.16Å; I146-I154 HydrophobicContact CG2-CD1 4.22Å; I146-Y155 HydrophobicContact CD1-CD1 3.84Å; I146-Y155 HydrophobicContact CD1-CD2 4.38Å; I146-Y155 HydrophobicContact CD1-CE1 3.79Å; I146-Y155 HydrophobicContact CD1-CE2 4.32Å; I146-Y155 HydrophobicContact CD1-CG 4.14Å; I146-Y155 HydrophobicContact CG1-CE1 4.26Å; I146-V158 HydrophobicContact CD1-CG2 3.98Å; I146-V158 HydrophobicContact CG2-CG1 4.23Å
147	G	93.5	Very high	93	Very high	15 Å²	15	54.4 Å²	54.4	16%	0.155	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	170.3	-176.7	0	0	0	0	0	113.6	I23	I23-G147 WeakPolarHBondContact CG1-O 3.38Å; I23-G147 PolarHBondContact N-O 3.23Å; I23-G147 PolarHBondContact O-N 3Å
148	G	91.7	Very high	94.3	Very high	19 Å²	19	53.1 Å²	53.1	20%	0.196	28%	0.282	C	S	.	.	S	Bend	trans	82.8	177.9	-174.7	0	0	0	0	0	113.9	T21 S66 G150 S151	T21-G148 CarbonylContact O-C 3.3Å; T21-G148 WeakPolarHBondContact O-CA 3.19Å; S66-G148 VanDerWaalsContact OG-CA 3.24Å; S66-G148 WeakPolarHBondContact OG-CA 3.38Å; G148-G150 VanDerWaalsContact C-N 3.3Å; G148-G150 PolarHBondContact O-N 2.86Å; G148-S151 WeakPolarHBondContact O-CB 3.43Å; G148-S151 PolarHBondContact O-N 3.03Å; G148-S151 PolarHBondContact O-OG 3.15Å
149	S	92.1	Very high	94.9	Very high	50 Å²	50	52.9 Å²	52.9	35%	0.35	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-59.2	-39.4	-177.3	52.1	0	0	0	0	113	G20 T21 S151 T152 D186	G20-S149 WeakPolarHBondContact CA-OG 3.27Å; T21-S149 PolarHBondContact N-OG 3.45Å; T21-S149 PolarHBondContact O-N 3.22Å; T21-S149 PolarHBondContact O-OG 3.43Å; S149-S151 VanDerWaalsContact C-N 3.26Å; S149-S151 PolarHBondContact O-N 3.24Å; S149-T152 PolarHBondContact O-OG1 3.05Å; S149-D186 PolarHBondContact OG-OD2 3.03Å
150	G	93.1	Very high	95.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-73.8	-17.9	-175.6	0	0	0	0	0	113.9	T21 T22 G148 T152 Y153 D186	T21-G150 PolarHBondContact O-N 2.87Å; T22-G150 WeakPolarHBondContact OG1-CA 3.49Å; G148-G150 VanDerWaalsContact C-N 3.3Å; G148-G150 PolarHBondContact O-N 2.86Å; G150-T152 PolarHBondContact O-N 2.82Å; G150-T152 VanDerWaalsContact O-N 3.16Å; G150-Y153 PolarHBondContact O-N 3.44Å; G150-Y153 VanDerWaalsContact O-N 3.15Å; G150-D186 WeakPolarHBondContact CA-OD2 3.41Å; G150-D186 PolarHBondContact N-OD2 3.39Å; G150-D186 VanDerWaalsContact N-OD2 3.13Å
151	S	92.8	Very high	95.3	Very high	9 Å²	9	52.4 Å²	52.4	6%	0.063	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-57.8	-31.2	177.4	68.9	0	0	0	0	112.9	G148 S149 Y153 I154 Y155	G148-S151 WeakPolarHBondContact O-CB 3.43Å; G148-S151 PolarHBondContact O-N 3.03Å; G148-S151 PolarHBondContact O-OG 3.15Å; S149-S151 VanDerWaalsContact C-N 3.26Å; S149-S151 PolarHBondContact O-N 3.24Å; S151-Y153 PolarHBondContact O-N 2.78Å; S151-Y153 VanDerWaalsContact O-N 3.17Å; S151-I154 VanDerWaalsContact O-CG1 3.27Å; S151-I154 WeakPolarHBondContact O-CG1 3.42Å; S151-I154 PolarHBondContact O-N 2.92Å; S151-I154 VanDerWaalsContact O-N 3.14Å; S151-Y155 WeakPolarHBondContact O-CD2 3.45Å
152	T	93.1	Very high	95.3	Very high	100 Å²	100	50.4 Å²	50.4	61%	0.613	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-58	-31.1	179.2	-50.3	0	0	0	0	113.1	S149 G150	S149-T152 PolarHBondContact O-OG1 3.05Å; G150-T152 PolarHBondContact O-N 2.82Å; G150-T152 VanDerWaalsContact O-N 3.16Å
153	Y	95.2	Very high	95.4	Very high	132 Å²	132	53 Å²	53	52%	0.518	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-83	-13.9	-176.8	-60.7	-76	0	0	0	113.8	G150 S151 R185 D186	G150-Y153 PolarHBondContact O-N 3.44Å; G150-Y153 VanDerWaalsContact O-N 3.15Å; S151-Y153 PolarHBondContact O-N 2.78Å; S151-Y153 VanDerWaalsContact O-N 3.17Å; Y153-R185 HydrophobicContact CD1-CB 3.75Å; Y153-R185 HydrophobicContact CD2-CB 4.22Å; Y153-R185 HydrophobicContact CE1-CB 4.2Å; Y153-R185 HydrophobicContact CG-CB 3.76Å; Y153-D186 HydrophobicContact CD2-CB 3.87Å; Y153-D186 HydrophobicContact CE2-CB 3.64Å
154	I	96.5	Very high	95.4	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-0.1	-167.4	57.9	165.5	0	0	0	114.4	T22 I146 S151 G156 Y157 V158 A178 L181 A182	T22-I154 HydrophobicContact CG2-CD1 4.26Å; I146-I154 HydrophobicContact CD1-CD1 4.46Å; I146-I154 HydrophobicContact CD1-CG1 4.16Å; I146-I154 HydrophobicContact CG2-CD1 4.22Å; S151-I154 VanDerWaalsContact O-CG1 3.27Å; S151-I154 WeakPolarHBondContact O-CG1 3.42Å; S151-I154 PolarHBondContact O-N 2.92Å; S151-I154 VanDerWaalsContact O-N 3.14Å; I154-G156 VanDerWaalsContact C-N 3.33Å; I154-G156 PolarHBondContact O-N 2.64Å; I154-Y157 WeakPolarHBondContact O-CB 3.34Å; I154-Y157 PolarHBondContact O-N 3.41Å; I154-V158 HydrophobicContact CD1-CG1 4.41Å; I154-V158 WeakPolarHBondContact O-CG2 3.26Å; I154-V158 PolarHBondContact O-N 2.81Å; I154-A178 HydrophobicContact CD1-CB 4.13Å; I154-A178 WeakPolarHBondContact CG2-O 3.39Å; I154-L181 HydrophobicContact CG2-CB 3.94Å; I154-A182 HydrophobicContact CD1-CB 4.35Å; I154-A182 HydrophobicContact CG2-CB 3.79Å
155	Y	96.1	Very high	95.2	Very high	124 Å²	124	57 Å²	57	49%	0.486	34%	0.342	S	S	.	.	H	α-helix	trans	-48.8	-51.3	175	-83.6	-74.5	0	0	0	112.7	I146 S151 Y157 V158 D159	I146-Y155 HydrophobicContact CD1-CD1 3.84Å; I146-Y155 HydrophobicContact CD1-CD2 4.38Å; I146-Y155 HydrophobicContact CD1-CE1 3.79Å; I146-Y155 HydrophobicContact CD1-CE2 4.32Å; I146-Y155 HydrophobicContact CD1-CG 4.14Å; I146-Y155 HydrophobicContact CG1-CE1 4.26Å; S151-Y155 WeakPolarHBondContact O-CD2 3.45Å; Y155-Y157 VanDerWaalsContact C-N 3.28Å; Y155-Y157 PolarHBondContact O-N 3.22Å; Y155-V158 VanDerWaalsContact O-CG2 3.29Å; Y155-V158 WeakPolarHBondContact O-CG2 3.3Å; Y155-V158 PolarHBondContact O-N 3.1Å; Y155-D159 WeakPolarHBondContact O-CB 3.33Å; Y155-D159 PolarHBondContact O-N 3.42Å; Y155-D159 VanDerWaalsContact O-N 3.08Å
156	G	97.1	Very high	95.3	Very high	59 Å²	59	57.9 Å²	57.9	61%	0.608	35%	0.346	S	S	*	.	H	α-helix	trans	-64.6	-30.9	179.8	0	0	0	0	0	113.9	I154 A160	I154-G156 VanDerWaalsContact C-N 3.33Å; I154-G156 PolarHBondContact O-N 2.64Å; G156-A160 WeakPolarHBondContact O-CB 3.37Å; G156-A160 PolarHBondContact O-N 2.83Å
157	Y	96.8	Very high	95.3	Very high	63 Å²	63	59.9 Å²	59.9	25%	0.247	36%	0.359	C	S	.	.	H	α-helix	trans	-72.3	-50.2	175.8	172.8	-102.7	0	0	0	111.1	I154 Y155 D159 A160 A161 F174 D177 A178 L181	I154-Y157 WeakPolarHBondContact O-CB 3.34Å; I154-Y157 PolarHBondContact O-N 3.41Å; Y155-Y157 VanDerWaalsContact C-N 3.28Å; Y155-Y157 PolarHBondContact O-N 3.22Å; Y157-D159 VanDerWaalsContact C-N 3.31Å; Y157-D159 PolarHBondContact O-N 2.82Å; Y157-A160 PolarHBondContact O-N 2.72Å; Y157-A160 VanDerWaalsContact O-N 3.17Å; Y157-A161 HydrophobicContact CD2-CB 4.27Å; Y157-A161 HydrophobicContact CE1-CB 4.13Å; Y157-A161 HydrophobicContact CE2-CB 3.83Å; Y157-A161 VanDerWaalsContact O-CB 3.24Å; Y157-A161 WeakPolarHBondContact O-CB 3.48Å; Y157-A161 PolarHBondContact O-N 3.45Å; Y157-F174 HydrophobicContact CD1-CE2 4.45Å; Y157-F174 HydrophobicContact CE1-CD2 4.03Å; Y157-F174 AromaticContact CE1-CE2 3.97Å; Y157-F174 HydrophobicContact CE1-CE2 3.97Å; Y157-D177 HydrophobicContact CE1-CB 4.18Å; Y157-D177 WeakPolarHBondContact OH-CB 3.45Å; Y157-D177 PolarHBondContact OH-OD2 3.03Å; Y157-A178 HydrophobicContact CD1-CB 4.01Å; Y157-A178 HydrophobicContact CE1-CB 3.88Å; Y157-L181 HydrophobicContact CD1-CD1 3.8Å; Y157-L181 HydrophobicContact CD2-CD1 3.53Å; Y157-L181 HydrophobicContact CE1-CD1 4.08Å; Y157-L181 HydrophobicContact CE2-CD1 3.83Å; Y157-L181 HydrophobicContact CG-CD1 3.51Å
158	V	97	Very high	95.5	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.006	36%	0.364	C	S	.	.	H	α-helix	trans	-64.3	-37.9	-176.1	-61.7	0	0	0	0	111.9	M24 F144 I146 I154 Y155 A160 Y162 F174 A178	M24-V158 HydrophobicContact CE-CG1 4.45Å; F144-V158 HydrophobicContact CE2-CB 4.01Å; F144-V158 HydrophobicContact CE2-CG2 3.78Å; F144-V158 HydrophobicContact CZ-CG2 4.37Å; I146-V158 HydrophobicContact CD1-CG2 3.98Å; I146-V158 HydrophobicContact CG2-CG1 4.23Å; I154-V158 HydrophobicContact CD1-CG1 4.41Å; I154-V158 WeakPolarHBondContact O-CG2 3.26Å; I154-V158 PolarHBondContact O-N 2.81Å; Y155-V158 VanDerWaalsContact O-CG2 3.29Å; Y155-V158 WeakPolarHBondContact O-CG2 3.3Å; Y155-V158 PolarHBondContact O-N 3.1Å; V158-A160 VanDerWaalsContact C-N 3.32Å; V158-A160 PolarHBondContact O-N 3.03Å; V158-Y162 WeakPolarHBondContact O-CB 3.43Å; V158-Y162 PolarHBondContact O-N 3.22Å; V158-F174 HydrophobicContact CB-CE2 4.28Å; V158-F174 HydrophobicContact CB-CZ 3.89Å; V158-F174 HydrophobicContact CG1-CE2 4.18Å; V158-F174 HydrophobicContact CG1-CZ 3.99Å; V158-A178 HydrophobicContact CG1-CB 4.14Å
159	D	96.1	Very high	95.7	Very high	115 Å²	115	65.4 Å²	65.4	62%	0.615	38%	0.379	S	S	*	.	H	α-helix	trans	-65.8	-34.5	176.5	-74.5	-13.8	0	0	0	112.5	Y155 Y157	Y155-D159 WeakPolarHBondContact O-CB 3.33Å; Y155-D159 PolarHBondContact O-N 3.42Å; Y155-D159 VanDerWaalsContact O-N 3.08Å; Y157-D159 VanDerWaalsContact C-N 3.31Å; Y157-D159 PolarHBondContact O-N 2.82Å
160	A	97.1	Very high	96	Very high	84 Å²	84	66.4 Å²	66.4	69%	0.694	38%	0.378	S	S	*	.	H	α-helix	trans	-83.5	-34.2	-179.8	0	0	0	0	0	113.3	G156 Y157 V158	G156-A160 WeakPolarHBondContact O-CB 3.37Å; G156-A160 PolarHBondContact O-N 2.83Å; Y157-A160 PolarHBondContact O-N 2.72Å; Y157-A160 VanDerWaalsContact O-N 3.17Å; V158-A160 VanDerWaalsContact C-N 3.32Å; V158-A160 PolarHBondContact O-N 3.03Å
161	A	96.6	Very high	96.3	Very high	25 Å²	25	66.4 Å²	66.4	21%	0.207	38%	0.378	C	S	.	.	H	α-helix	trans	-91.4	-29.1	-173.2	0	0	0	0	0	113.2	Y157 M166 F174	Y157-A161 HydrophobicContact CD2-CB 4.27Å; Y157-A161 HydrophobicContact CE1-CB 4.13Å; Y157-A161 HydrophobicContact CE2-CB 3.83Å; Y157-A161 VanDerWaalsContact O-CB 3.24Å; Y157-A161 WeakPolarHBondContact O-CB 3.48Å; Y157-A161 PolarHBondContact O-N 3.45Å; A161-M166 WeakPolarHBondContact O-CE 3.33Å; A161-F174 HydrophobicContact CB-CD2 4.05Å; A161-F174 HydrophobicContact CB-CE2 3.78Å
162	Y	97.5	Very high	96.5	Very high	53 Å²	53	67.2 Å²	67.2	21%	0.208	38%	0.38	C	S	.	.			trans	-61.7	137.2	179.6	175.6	-104.5	0	0	0	111.7	V26 P143 F144 V158 P164 M166 F174	V26-Y162 HydrophobicContact CG2-CE2 4.23Å; P143-Y162 WeakPolarHBondContact CB-OH 3.39Å; F144-Y162 AromaticContact CD1-CD1 3.85Å; F144-Y162 HydrophobicContact CD1-CD1 3.85Å; F144-Y162 AromaticContact CD1-CD2 3.57Å; F144-Y162 HydrophobicContact CD1-CD2 3.57Å; F144-Y162 HydrophobicContact CD1-CE1 4.09Å; F144-Y162 AromaticContact CD1-CE2 3.83Å; F144-Y162 HydrophobicContact CD1-CE2 3.83Å; F144-Y162 AromaticContact CD1-CG 3.59Å; F144-Y162 HydrophobicContact CD1-CG 3.59Å; F144-Y162 AromaticContact CE1-CD1 3.59Å; F144-Y162 HydrophobicContact CE1-CD1 3.59Å; F144-Y162 HydrophobicContact CE1-CD2 4.06Å; F144-Y162 HydrophobicContact CE1-CE1 4.12Å; F144-Y162 AromaticContact CE1-CG 3.56Å; F144-Y162 HydrophobicContact CE1-CG 3.56Å; F144-Y162 HydrophobicContact CG-CD2 4.33Å; V158-Y162 WeakPolarHBondContact O-CB 3.43Å; V158-Y162 PolarHBondContact O-N 3.22Å; Y162-P164 HydrophobicContact CE1-CG 4.3Å; Y162-M166 HydrophobicContact CD2-SD 4.39Å; Y162-F174 AromaticContact CD2-CE1 3.99Å; Y162-F174 HydrophobicContact CD2-CE1 3.99Å; Y162-F174 HydrophobicContact CD2-CZ 4.49Å
163	K	96.1	Very high	96.7	Very high	136 Å²	136	69.3 Å²	69.3	59%	0.591	38%	0.377	S	S	*	.			trans	-136.6	132.1	176.2	-63.4	175.8	-173.4	172.9	0	108.7	G165 M166	K163-G165 PolarHBondContact O-N 2.91Å; K163-M166 HydrophobicContact CB-CE 3.96Å; K163-M166 HydrophobicContact CB-CG 4.23Å; K163-M166 HydrophobicContact CG-CE 4.21Å; K163-M166 VanDerWaalsContact N-CE 3.34Å; K163-M166 VanDerWaalsContact O-CG 3.29Å; K163-M166 WeakPolarHBondContact O-CG 3.47Å
164	P	95.1	Very high	96.9	Very high	112 Å²	112	63.3 Å²	63.3	73%	0.727	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	139.2	171.5	-23.5	33.8	0	0	0	111.4	Y162	Y162-P164 HydrophobicContact CE1-CG 4.3Å
165	G	93.9	Very high	96.9	Very high	71 Å²	71	63.3 Å²	63.3	73%	0.732	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	26.8	176.9	0	0	0	0	0	114.7	K163	K163-G165 PolarHBondContact O-N 2.91Å
166	M	96.9	Very high	97	Very high	22 Å²	22	57.9 Å²	57.9	11%	0.108	33%	0.333	C	S	.	.			trans	-56.7	143.1	168.8	-82.6	170.4	167.5	0	0	111.2	F28 A161 Y162 K163 E170 C171 F174	F28-M166 WeakPolarHBondContact CB-O 3.48Å; A161-M166 WeakPolarHBondContact O-CE 3.33Å; Y162-M166 HydrophobicContact CD2-SD 4.39Å; K163-M166 HydrophobicContact CB-CE 3.96Å; K163-M166 HydrophobicContact CB-CG 4.23Å; K163-M166 HydrophobicContact CG-CE 4.21Å; K163-M166 VanDerWaalsContact N-CE 3.34Å; K163-M166 VanDerWaalsContact O-CG 3.29Å; K163-M166 WeakPolarHBondContact O-CG 3.47Å; M166-E170 HydrophobicContact CB-CB 4.03Å; M166-E170 HydrophobicContact CG-CB 4.1Å; M166-C171 VanDerWaalsContact CB-SG 3.51Å; M166-F174 HydrophobicContact CE-CB 4.49Å; M166-F174 HydrophobicContact CE-CG 4.36Å; M166-F174 HydrophobicContact SD-CB 4.39Å; M166-F174 HydrophobicContact SD-CD1 4.16Å; M166-F174 HydrophobicContact SD-CG 4.35Å
167	T	97.8	Very high	97.1	Very high	66 Å²	66	56.4 Å²	56.4	41%	0.405	31%	0.311	S	S	.	.			trans	-70.7	161.6	170.8	58.7	0	0	0	0	111.3	E169 E170 C171	T167-E169 PolarHBondContact O-N 3.16Å; T167-E170 PolarHBondContact N-OE2 3.16Å; T167-E170 PolarHBondContact O-N 3.15Å; T167-E170 VanDerWaalsContact O-N 3.07Å; T167-E170 WeakPolarHBondContact OG1-CB 3.23Å; T167-E170 VanDerWaalsContact OG1-CD 3.29Å; T167-E170 WeakPolarHBondContact OG1-CG 3.49Å; T167-E170 PolarHBondContact OG1-N 3.04Å; T167-E170 PolarHBondContact OG1-OE2 3.13Å; T167-C171 PolarHBondContact O-N 3.37Å
168	P	96.6	Very high	97.1	Very high	41 Å²	41	53.4 Å²	53.4	27%	0.266	30%	0.299	S	S	.	.	H	α-helix	trans	-55.8	-39.9	178.6	-18.2	26.5	0	0	0	112.5	F28 C171 R172	F28-P168 HydrophobicContact CD2-CB 4.18Å; F28-P168 HydrophobicContact CD2-CG 3.76Å; F28-P168 HydrophobicContact CE1-CB 4.32Å; F28-P168 HydrophobicContact CE2-CB 3.84Å; F28-P168 HydrophobicContact CE2-CG 3.52Å; F28-P168 HydrophobicContact CZ-CB 3.9Å; F28-P168 HydrophobicContact CZ-CG 4.1Å; P168-C171 PolarHBondContact O-N 2.99Å; P168-R172 WeakPolarHBondContact O-CG 3.46Å; P168-R172 PolarHBondContact O-N 2.87Å
169	E	97.1	Very high	97.1	Very high	109 Å²	109	53.3 Å²	53.3	51%	0.509	30%	0.299	S	S	.	.	H	α-helix	trans	-65.4	-42	176.9	-82.4	61.8	-159.2	0	0	112	T167 R172 R173	T167-E169 PolarHBondContact O-N 3.16Å; E169-R172 VanDerWaalsContact CG-NH2 3.28Å; E169-R172 PolarHBondContact O-N 3.36Å; E169-R172 IonicContact OE1-CZ 2.76Å; E169-R172 IonicContact OE1-NH1 2.64Å; E169-R172 IonicContact OE1-NH2 2.58Å; E169-R172 PolarHBondContact OE1-NH2 3.06Å; E169-R172 IonicContact OE2-NH2 3.65Å; E169-R173 PolarHBondContact O-N 3.31Å
170	E	97.8	Very high	97.2	Very high	71 Å²	71	48 Å²	48	33%	0.332	27%	0.27	S	S	.	.	H	α-helix	trans	-65.7	-40.6	174.4	-74.8	170.7	137.8	0	0	111.6	M166 T167 R173 F174	M166-E170 HydrophobicContact CB-CB 4.03Å; M166-E170 HydrophobicContact CG-CB 4.1Å; T167-E170 PolarHBondContact N-OE2 3.16Å; T167-E170 PolarHBondContact O-N 3.15Å; T167-E170 VanDerWaalsContact O-N 3.07Å; T167-E170 WeakPolarHBondContact OG1-CB 3.23Å; T167-E170 VanDerWaalsContact OG1-CD 3.29Å; T167-E170 WeakPolarHBondContact OG1-CG 3.49Å; T167-E170 PolarHBondContact OG1-N 3.04Å; T167-E170 PolarHBondContact OG1-OE2 3.13Å; E170-R173 PolarHBondContact O-N 3.07Å; E170-F174 WeakPolarHBondContact O-CB 3.23Å; E170-F174 PolarHBondContact O-N 2.98Å
171	C	98.1	Very high	97.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-43.9	174.1	-76.6	0	0	0	0	112	V26 F28 V33 M166 T167 P168 R173 F174 T175	V26-C171 HydrophobicContact CG1-CB 3.66Å; F28-C171 HydrophobicContact CD1-CB 4.31Å; V33-C171 HydrophobicContact CB-CB 4.34Å; V33-C171 HydrophobicContact CG2-CB 3.77Å; M166-C171 VanDerWaalsContact CB-SG 3.51Å; T167-C171 PolarHBondContact O-N 3.37Å; P168-C171 PolarHBondContact O-N 2.99Å; C171-R173 PolarHBondContact O-N 2.88Å; C171-F174 PolarHBondContact O-N 3.38Å; C171-T175 WeakPolarHBondContact O-CB 3.35Å; C171-T175 PolarHBondContact O-N 3.33Å; C171-T175 PolarHBondContact O-OG1 2.9Å
172	R	98	Very high	97.1	Very high	27 Å²	27	44.7 Å²	44.7	10%	0.102	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-44.7	175.2	-74.4	-167.6	-60.9	-94	7.3	112	V33 P168 E169 T176 T197	V33-R172 HydrophobicContact CG1-CG 4.02Å; V33-R172 HydrophobicContact CG2-CG 3.84Å; P168-R172 WeakPolarHBondContact O-CG 3.46Å; P168-R172 PolarHBondContact O-N 2.87Å; E169-R172 VanDerWaalsContact CG-NH2 3.28Å; E169-R172 PolarHBondContact O-N 3.36Å; E169-R172 IonicContact OE1-CZ 2.76Å; E169-R172 IonicContact OE1-NH1 2.64Å; E169-R172 IonicContact OE1-NH2 2.58Å; E169-R172 PolarHBondContact OE1-NH2 3.06Å; E169-R172 IonicContact OE2-NH2 3.65Å; R172-T176 WeakPolarHBondContact O-CB 3.34Å; R172-T176 PolarHBondContact O-N 2.64Å; R172-T176 PolarHBondContact O-OG1 3.41Å; R172-T197 WeakPolarHBondContact CD-OG1 3.48Å
173	R	97.6	Very high	96.9	Very high	144 Å²	144	43.4 Å²	43.4	54%	0.543	23%	0.234	S	C	.	.	H	α-helix	trans	-63.6	-47.1	176.1	-175.9	172.7	63.8	-133.3	-3.7	111.2	E169 E170 C171 T175 T176 D177	E169-R173 PolarHBondContact O-N 3.31Å; E170-R173 PolarHBondContact O-N 3.07Å; C171-R173 PolarHBondContact O-N 2.88Å; R173-T175 VanDerWaalsContact C-N 3.35Å; R173-T175 PolarHBondContact O-N 2.86Å; R173-T176 WeakPolarHBondContact O-CB 3.4Å; R173-T176 PolarHBondContact O-N 3.27Å; R173-T176 VanDerWaalsContact O-N 3.16Å; R173-D177 WeakPolarHBondContact CG-OD2 3.44Å; R173-D177 WeakPolarHBondContact O-CB 3.47Å; R173-D177 PolarHBondContact O-N 2.95Å
174	F	98.2	Very high	96.8	Very high	6 Å²	6	40.9 Å²	40.9	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-55.8	-47.5	177.9	174.8	-130.8	0	0	0	112.2	M24 V26 Y157 V158 A161 Y162 M166 E170 C171 A178	M24-F174 HydrophobicContact CE-CD1 3.38Å; M24-F174 HydrophobicContact CE-CD2 4.41Å; M24-F174 HydrophobicContact CE-CE1 3.08Å; M24-F174 HydrophobicContact CE-CE2 4.15Å; M24-F174 HydrophobicContact CE-CG 4.06Å; M24-F174 HydrophobicContact CE-CZ 3.51Å; V26-F174 HydrophobicContact CG2-CD1 4.29Å; V26-F174 HydrophobicContact CG2-CE1 4.41Å; Y157-F174 HydrophobicContact CD1-CE2 4.45Å; Y157-F174 HydrophobicContact CE1-CD2 4.03Å; Y157-F174 AromaticContact CE1-CE2 3.97Å; Y157-F174 HydrophobicContact CE1-CE2 3.97Å; V158-F174 HydrophobicContact CB-CE2 4.28Å; V158-F174 HydrophobicContact CB-CZ 3.89Å; V158-F174 HydrophobicContact CG1-CE2 4.18Å; V158-F174 HydrophobicContact CG1-CZ 3.99Å; A161-F174 HydrophobicContact CB-CD2 4.05Å; A161-F174 HydrophobicContact CB-CE2 3.78Å; Y162-F174 AromaticContact CD2-CE1 3.99Å; Y162-F174 HydrophobicContact CD2-CE1 3.99Å; Y162-F174 HydrophobicContact CD2-CZ 4.49Å; M166-F174 HydrophobicContact CE-CB 4.49Å; M166-F174 HydrophobicContact CE-CG 4.36Å; M166-F174 HydrophobicContact SD-CB 4.39Å; M166-F174 HydrophobicContact SD-CD1 4.16Å; M166-F174 HydrophobicContact SD-CG 4.35Å; E170-F174 WeakPolarHBondContact O-CB 3.23Å; E170-F174 PolarHBondContact O-N 2.98Å; C171-F174 PolarHBondContact O-N 3.38Å; F174-A178 VanDerWaalsContact O-CB 3.3Å; F174-A178 WeakPolarHBondContact O-CB 3.48Å; F174-A178 PolarHBondContact O-N 2.82Å
175	T	98.3	Very high	96.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.3	-43.3	176.1	-59.6	0	0	0	0	112	M24 V26 C171 R173 A178 I179 L195	M24-T175 HydrophobicContact CB-CG2 4.22Å; M24-T175 HydrophobicContact CG-CG2 4.24Å; M24-T175 HydrophobicContact SD-CG2 4.34Å; V26-T175 WeakPolarHBondContact CG1-OG1 3.39Å; C171-T175 WeakPolarHBondContact O-CB 3.35Å; C171-T175 PolarHBondContact O-N 3.33Å; C171-T175 PolarHBondContact O-OG1 2.9Å; R173-T175 VanDerWaalsContact C-N 3.35Å; R173-T175 PolarHBondContact O-N 2.86Å; T175-A178 PolarHBondContact O-N 3.32Å; T175-I179 HydrophobicContact CG2-CD1 3.71Å; T175-I179 HydrophobicContact CG2-CG1 4.46Å; T175-I179 WeakPolarHBondContact O-CB 3.4Å; T175-I179 VanDerWaalsContact O-CG1 3.31Å; T175-I179 WeakPolarHBondContact O-CG1 3.26Å; T175-I179 PolarHBondContact O-N 2.98Å; T175-L195 HydrophobicContact CG2-CD2 3.61Å
176	T	98	Very high	96.6	Very high	11 Å²	11	38.8 Å²	38.8	7%	0.067	18%	0.183	C	C	.	.	H	α-helix	trans	-60.8	-49.3	177.6	-56.1	0	0	0	0	111.2	R172 R173 A178 I179 T180 I193 I208 P214	R172-T176 WeakPolarHBondContact O-CB 3.34Å; R172-T176 PolarHBondContact O-N 2.64Å; R172-T176 PolarHBondContact O-OG1 3.41Å; R173-T176 WeakPolarHBondContact O-CB 3.4Å; R173-T176 PolarHBondContact O-N 3.27Å; R173-T176 VanDerWaalsContact O-N 3.16Å; T176-A178 PolarHBondContact O-N 3.48Å; T176-I179 PolarHBondContact O-N 2.9Å; T176-T180 VanDerWaalsContact O-CB 3.28Å; T176-T180 WeakPolarHBondContact O-CB 3.49Å; T176-T180 PolarHBondContact O-N 3.44Å; T176-T180 PolarHBondContact O-OG1 2.92Å; T176-I193 HydrophobicContact CG2-CD1 4.07Å; T176-I208 HydrophobicContact CG2-CD1 3.43Å; T176-I208 VanDerWaalsContact CG2-CD1 3.43Å; T176-I208 VanDerWaalsContact OG1-CD1 3.24Å; T176-I208 WeakPolarHBondContact OG1-CD1 3.28Å; T176-P214 HydrophobicContact CG2-CG 3.82Å
177	D	97.4	Very high	96.2	Very high	27 Å²	27	40.6 Å²	40.6	14%	0.144	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-45.1	-178.9	-68.1	-16.6	0	0	0	110.7	Y157 R173 T180 L181 P214 F216	Y157-D177 HydrophobicContact CE1-CB 4.18Å; Y157-D177 WeakPolarHBondContact OH-CB 3.45Å; Y157-D177 PolarHBondContact OH-OD2 3.03Å; R173-D177 WeakPolarHBondContact CG-OD2 3.44Å; R173-D177 WeakPolarHBondContact O-CB 3.47Å; R173-D177 PolarHBondContact O-N 2.95Å; D177-T180 PolarHBondContact O-N 3.03Å; D177-L181 WeakPolarHBondContact O-CB 3.38Å; D177-L181 VanDerWaalsContact O-CG 3.29Å; D177-L181 WeakPolarHBondContact O-CG 3.35Å; D177-L181 PolarHBondContact O-N 3.3Å; D177-P214 VanDerWaalsContact OD1-CG 3.32Å; D177-P214 WeakPolarHBondContact OD1-CG 3.2Å; D177-F216 HydrophobicContact CB-CZ 3.88Å
178	A	97.8	Very high	95.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.6	-49.5	178.3	0	0	0	0	0	112	M24 I154 Y157 V158 F174 T175 T176 T180 L181 A182	M24-A178 HydrophobicContact CE-CB 4.28Å; M24-A178 HydrophobicContact SD-CB 3.49Å; M24-A178 WeakPolarHBondContact SD-CB 3.4Å; I154-A178 HydrophobicContact CD1-CB 4.13Å; I154-A178 WeakPolarHBondContact CG2-O 3.39Å; Y157-A178 HydrophobicContact CD1-CB 4.01Å; Y157-A178 HydrophobicContact CE1-CB 3.88Å; V158-A178 HydrophobicContact CG1-CB 4.14Å; F174-A178 VanDerWaalsContact O-CB 3.3Å; F174-A178 WeakPolarHBondContact O-CB 3.48Å; F174-A178 PolarHBondContact O-N 2.82Å; T175-A178 PolarHBondContact O-N 3.32Å; T176-A178 PolarHBondContact O-N 3.48Å; A178-T180 VanDerWaalsContact C-N 3.31Å; A178-T180 PolarHBondContact O-N 3.04Å; A178-L181 PolarHBondContact O-N 3.21Å; A178-A182 PolarHBondContact O-N 2.9Å
179	I	97.6	Very high	95.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-38.6	179.7	-65.6	170.2	0	0	0	110.6	T22 M24 G35 D37 T175 T176 A182 M183 I193	T22-I179 HydrophobicContact CG2-CB 4.46Å; T22-I179 HydrophobicContact CG2-CG1 4.1Å; T22-I179 HydrophobicContact CG2-CG2 4.42Å; M24-I179 HydrophobicContact CB-CD1 4.46Å; M24-I179 HydrophobicContact CB-CG1 4.43Å; G35-I179 VanDerWaalsContact C-CD1 3.42Å; D37-I179 HydrophobicContact CB-CG2 4.12Å; T175-I179 HydrophobicContact CG2-CD1 3.71Å; T175-I179 HydrophobicContact CG2-CG1 4.46Å; T175-I179 WeakPolarHBondContact O-CB 3.4Å; T175-I179 VanDerWaalsContact O-CG1 3.31Å; T175-I179 WeakPolarHBondContact O-CG1 3.26Å; T175-I179 PolarHBondContact O-N 2.98Å; T176-I179 PolarHBondContact O-N 2.9Å; I179-A182 WeakPolarHBondContact O-CB 3.24Å; I179-A182 PolarHBondContact O-N 3.29Å; I179-M183 HydrophobicContact CG2-CG 4.22Å; I179-M183 HydrophobicContact CG2-SD 3.69Å; I179-M183 WeakPolarHBondContact O-CB 3.36Å; I179-M183 VanDerWaalsContact O-CG 3.23Å; I179-M183 WeakPolarHBondContact O-CG 3.31Å; I179-M183 PolarHBondContact O-N 3.47Å; I179-I193 HydrophobicContact CB-CD1 3.91Å; I179-I193 HydrophobicContact CB-CG1 4.39Å; I179-I193 HydrophobicContact CD1-CG2 4.05Å; I179-I193 HydrophobicContact CG2-CD1 3.76Å; I179-I193 HydrophobicContact CG2-CG1 3.75Å; I179-I193 HydrophobicContact CG2-CG2 4.47Å
180	T	96.8	Very high	95.4	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.012	17%	0.167	C	C	.	.	H	α-helix	trans	-64.1	-44.2	177.4	-55.7	0	0	0	0	111.8	T176 D177 A178 A182 M183 N184 I193 L213 P214 F216	T176-T180 VanDerWaalsContact O-CB 3.28Å; T176-T180 WeakPolarHBondContact O-CB 3.49Å; T176-T180 PolarHBondContact O-N 3.44Å; T176-T180 PolarHBondContact O-OG1 2.92Å; D177-T180 PolarHBondContact O-N 3.03Å; A178-T180 VanDerWaalsContact C-N 3.31Å; A178-T180 PolarHBondContact O-N 3.04Å; T180-A182 VanDerWaalsContact C-N 3.29Å; T180-A182 PolarHBondContact O-N 2.6Å; T180-M183 PolarHBondContact O-N 3.25Å; T180-N184 PolarHBondContact O-N 2.76Å; T180-N184 VanDerWaalsContact O-N 3.07Å; T180-I193 WeakPolarHBondContact OG1-CD1 3.21Å; T180-L213 HydrophobicContact CG2-CB 4.13Å; T180-P214 VanDerWaalsContact CG2-O 3.27Å; T180-P214 WeakPolarHBondContact CG2-O 3.39Å; T180-F216 HydrophobicContact CG2-CD2 4.33Å; T180-F216 HydrophobicContact CG2-CE2 3.87Å
181	L	96.3	Very high	95.2	Very high	41 Å²	41	30.5 Å²	30.5	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-59.9	-40	174.4	-74.7	169.8	0	0	0	112	I154 Y157 D177 A178 F216	I154-L181 HydrophobicContact CG2-CB 3.94Å; Y157-L181 HydrophobicContact CD1-CD1 3.8Å; Y157-L181 HydrophobicContact CD2-CD1 3.53Å; Y157-L181 HydrophobicContact CE1-CD1 4.08Å; Y157-L181 HydrophobicContact CE2-CD1 3.83Å; Y157-L181 HydrophobicContact CG-CD1 3.51Å; D177-L181 WeakPolarHBondContact O-CB 3.38Å; D177-L181 VanDerWaalsContact O-CG 3.29Å; D177-L181 WeakPolarHBondContact O-CG 3.35Å; D177-L181 PolarHBondContact O-N 3.3Å; A178-L181 PolarHBondContact O-N 3.21Å; L181-F216 HydrophobicContact CD1-CE1 4.24Å; L181-F216 HydrophobicContact CD1-CZ 4.17Å; L181-F216 HydrophobicContact CD2-CB 4.24Å; L181-F216 HydrophobicContact CD2-CD1 3.84Å; L181-F216 HydrophobicContact CD2-CD2 3.61Å; L181-F216 HydrophobicContact CD2-CE1 4.03Å; L181-F216 HydrophobicContact CD2-CE2 3.83Å; L181-F216 HydrophobicContact CD2-CG 3.62Å; L181-F216 HydrophobicContact CD2-CZ 4.03Å; L181-F216 HydrophobicContact CG-CD1 4.42Å; L181-F216 HydrophobicContact CG-CD2 4.06Å; L181-F216 HydrophobicContact CG-CE1 4.11Å; L181-F216 HydrophobicContact CG-CE2 3.73Å; L181-F216 HydrophobicContact CG-CG 4.4Å; L181-F216 HydrophobicContact CG-CZ 3.75Å
182	A	95.9	Very high	95.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-45.8	175	0	0	0	0	0	111.7	T22 I154 A178 I179 T180 N184 R185 D186	T22-A182 HydrophobicContact CG2-CB 3.54Å; T22-A182 WeakPolarHBondContact OG1-CB 3.2Å; I154-A182 HydrophobicContact CD1-CB 4.35Å; I154-A182 HydrophobicContact CG2-CB 3.79Å; A178-A182 PolarHBondContact O-N 2.9Å; I179-A182 WeakPolarHBondContact O-CB 3.24Å; I179-A182 PolarHBondContact O-N 3.29Å; T180-A182 VanDerWaalsContact C-N 3.29Å; T180-A182 PolarHBondContact O-N 2.6Å; A182-N184 PolarHBondContact O-N 2.99Å; A182-R185 PolarHBondContact O-N 3.33Å; A182-D186 WeakPolarHBondContact O-CB 3.32Å; A182-D186 PolarHBondContact O-N 3.02Å
183	M	94.4	Very high	95.1	Very high	25 Å²	25	30.1 Å²	30.1	12%	0.123	17%	0.166	C	C	.	.	H	α-helix	trans	-59.1	-31.5	178.3	-72.9	166.6	51.9	0	0	112.9	D37 I179 T180 R185 G191 I193 L213	D37-M183 HydrophobicContact CB-CG 4.07Å; D37-M183 HydrophobicContact CB-SD 3.99Å; I179-M183 HydrophobicContact CG2-CG 4.22Å; I179-M183 HydrophobicContact CG2-SD 3.69Å; I179-M183 WeakPolarHBondContact O-CB 3.36Å; I179-M183 VanDerWaalsContact O-CG 3.23Å; I179-M183 WeakPolarHBondContact O-CG 3.31Å; I179-M183 PolarHBondContact O-N 3.47Å; T180-M183 PolarHBondContact O-N 3.25Å; M183-R185 VanDerWaalsContact C-N 3.28Å; M183-R185 PolarHBondContact O-N 3.32Å; M183-G191 WeakPolarHBondContact CE-O 3.5Å; M183-I193 HydrophobicContact SD-CD1 4.21Å; M183-I193 HydrophobicContact SD-CG1 3.84Å; M183-L213 HydrophobicContact CE-CD1 3.5Å; M183-L213 VanDerWaalsContact CE-CD1 3.5Å
184	N	92.9	Very high	95.2	Very high	84 Å²	84	25.1 Å²	25.1	45%	0.449	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-20.2	177.5	-72.5	-16.5	0	0	0	113.5	T180 A182	T180-N184 PolarHBondContact O-N 2.76Å; T180-N184 VanDerWaalsContact O-N 3.07Å; A182-N184 PolarHBondContact O-N 2.99Å
185	R	92.4	Very high	95.1	Very high	128 Å²	128	25 Å²	25	48%	0.483	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-34.3	-175.1	-61.2	-55.3	-164.3	-175	6.1	113.8	Y153 A182 M183 G187 Y217 D218	Y153-R185 HydrophobicContact CD1-CB 3.75Å; Y153-R185 HydrophobicContact CD2-CB 4.22Å; Y153-R185 HydrophobicContact CE1-CB 4.2Å; Y153-R185 HydrophobicContact CG-CB 3.76Å; A182-R185 PolarHBondContact O-N 3.33Å; M183-R185 VanDerWaalsContact C-N 3.28Å; M183-R185 PolarHBondContact O-N 3.32Å; R185-G187 PolarHBondContact O-N 3.43Å; R185-Y217 PolarHBondContact NH1-OH 3.43Å; R185-Y217 VanDerWaalsContact NH2-CZ 3.29Å; R185-Y217 PolarHBondContact NH2-OH 2.81Å; R185-D218 IonicContact CZ-OD2 3.22Å; R185-D218 IonicContact NH1-OD2 2.72Å; R185-D218 IonicContact NH2-OD2 2.84Å
186	D	92.9	Very high	95.2	Very high	10 Å²	10	25.1 Å²	25.1	5%	0.053	15%	0.148	C	C	.	.			trans	-86.5	105.9	177.3	-176.5	18.6	0	0	0	110.8	S149 G150 Y153 A182 S188 S189	S149-D186 PolarHBondContact OG-OD2 3.03Å; G150-D186 WeakPolarHBondContact CA-OD2 3.41Å; G150-D186 PolarHBondContact N-OD2 3.39Å; G150-D186 VanDerWaalsContact N-OD2 3.13Å; Y153-D186 HydrophobicContact CD2-CB 3.87Å; Y153-D186 HydrophobicContact CE2-CB 3.64Å; A182-D186 WeakPolarHBondContact O-CB 3.32Å; A182-D186 PolarHBondContact O-N 3.02Å; D186-S188 PolarHBondContact O-N 2.7Å; D186-S188 PolarHBondContact OD1-N 3.01Å; D186-S189 PolarHBondContact O-N 3.44Å; D186-S189 WeakPolarHBondContact OD2-CB 3.23Å; D186-S189 PolarHBondContact OD2-OG 2.93Å
187	G	88.1	Confident	95.2	Very high	61 Å²	61	25 Å²	25	63%	0.629	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.8	-179.9	0	0	0	0	0	114.2	R39 R185	R39-G187 PolarHBondContact NH1-O 2.78Å; R185-G187 PolarHBondContact O-N 3.43Å
188	S	88.4	Confident	95.2	Very high	42 Å²	42	23.7 Å²	23.7	29%	0.294	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-13.5	-179.1	-50.8	0	0	0	0	112.6	G20 R39 D186	G20-S188 CarbonylContact C-O 3.58Å; G20-S188 WeakPolarHBondContact CA-O 3.41Å; R39-S188 WeakPolarHBondContact CD-O 3.35Å; D186-S188 PolarHBondContact O-N 2.7Å; D186-S188 PolarHBondContact OD1-N 3.01Å
189	S	92.4	Very high	95.2	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.007	15%	0.151	C	C	.	.			trans	-96.6	155.2	172.3	-63.5	0	0	0	0	111.2	T21 T22 D37 R39 D186	T21-S189 VanDerWaalsContact C-OG 3.31Å; T22-S189 PolarHBondContact N-OG 2.8Å; T22-S189 PolarHBondContact OG1-OG 2.85Å; D37-S189 VanDerWaalsContact OD2-CA 3.26Å; D37-S189 WeakPolarHBondContact OD2-CA 3.4Å; R39-S189 PolarHBondContact NH1-O 3.37Å; D186-S189 PolarHBondContact O-N 3.44Å; D186-S189 WeakPolarHBondContact OD2-CB 3.23Å; D186-S189 PolarHBondContact OD2-OG 2.93Å
190	G	93.1	Very high	95.2	Very high	3 Å²	3	27.3 Å²	27.3	3%	0.031	17%	0.167	C	C	.	.			trans	157.6	-166.4	175.1	0	0	0	0	0	114.9	D37 S38 R39	D37-G190 PolarHBondContact OD2-N 3.27Å; S38-G190 PolarHBondContact N-O 2.99Å; S38-G190 VanDerWaalsContact N-O 3.15Å; S38-G190 PolarHBondContact OG-O 2.92Å; R39-G190 WeakPolarHBondContact CB-O 3.25Å; R39-G190 PolarHBondContact N-O 2.84Å
191	G	94.2	Very high	95.1	Very high	29 Å²	29	34.8 Å²	34.8	30%	0.299	21%	0.206	S	C	.	.	S	Bend	trans	90.8	-126.8	179.3	0	0	0	0	0	111.7	S38 M183	S38-G191 WeakPolarHBondContact OG-CA 3.39Å; M183-G191 WeakPolarHBondContact CE-O 3.5Å
192	V	96.8	Very high	95.1	Very high	19 Å²	19	33.9 Å²	33.9	12%	0.115	21%	0.207	C	C	.	.			trans	-106.2	165.1	176.5	-59.2	0	0	0	0	109.7	S38 Y194 V207 I208 L209	S38-V192 WeakPolarHBondContact CB-O 3.41Å; S38-V192 PolarHBondContact N-O 3.05Å; S38-V192 WeakPolarHBondContact OG-CG2 3.47Å; S38-V192 PolarHBondContact OG-N 2.94Å; S38-V192 PolarHBondContact OG-O 3.45Å; V192-Y194 HydrophobicContact CG2-CD2 4.41Å; V192-Y194 HydrophobicContact CG2-CE2 3.94Å; V192-V207 HydrophobicContact CB-CG1 4Å; V192-V207 HydrophobicContact CG2-CG1 3.85Å; V192-I208 WeakPolarHBondContact CA-O 3.31Å; V192-I208 WeakPolarHBondContact CB-O 3.42Å; V192-L209 HydrophobicContact CG1-CD2 4.05Å
193	I	98.1	Very high	95.2	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.4	171.1	-60.7	175.7	0	0	0	108.8	S36 T176 I179 T180 M183 L195 V207 I208 L213	S36-I193 WeakPolarHBondContact O-CA 3.38Å; T176-I193 HydrophobicContact CG2-CD1 4.07Å; I179-I193 HydrophobicContact CB-CD1 3.91Å; I179-I193 HydrophobicContact CB-CG1 4.39Å; I179-I193 HydrophobicContact CD1-CG2 4.05Å; I179-I193 HydrophobicContact CG2-CD1 3.76Å; I179-I193 HydrophobicContact CG2-CG1 3.75Å; I179-I193 HydrophobicContact CG2-CG2 4.47Å; T180-I193 WeakPolarHBondContact OG1-CD1 3.21Å; M183-I193 HydrophobicContact SD-CD1 4.21Å; M183-I193 HydrophobicContact SD-CG1 3.84Å; I193-L195 HydrophobicContact CG2-CD2 4.06Å; I193-L195 HydrophobicContact CG2-CG 3.99Å; I193-V207 CarbonylContact O-C 3.52Å; I193-V207 WeakPolarHBondContact O-CA 3.32Å; I193-I208 HydrophobicContact CB-CB 4.26Å; I193-I208 PolarHBondContact N-O 3.44Å; I193-I208 PolarHBondContact O-N 3.22Å; I193-L213 HydrophobicContact CD1-CD2 3.4Å; I193-L213 HydrophobicContact CG1-CD2 3.72Å
194	Y	98.3	Very high	95.3	Very high	39 Å²	39	38 Å²	38	15%	0.153	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	131.9	165	-68.3	-73.8	0	0	0	108.8	G35 S36 V50 F51 D52 V192 V207	G35-Y194 CarbonylContact C-O 3.57Å; G35-Y194 WeakPolarHBondContact CA-O 3.25Å; S36-Y194 PolarHBondContact N-O 3.41Å; S36-Y194 PolarHBondContact O-N 3.1Å; V50-Y194 PolarHBondContact O-OH 3.15Å; F51-Y194 WeakPolarHBondContact O-CE2 3.39Å; D52-Y194 HydrophobicContact CB-CD2 4.1Å; D52-Y194 HydrophobicContact CB-CE1 4.42Å; D52-Y194 HydrophobicContact CB-CE2 3.93Å; D52-Y194 HydrophobicContact CB-CG 4.38Å; V192-Y194 HydrophobicContact CG2-CD2 4.41Å; V192-Y194 HydrophobicContact CG2-CE2 3.94Å; Y194-V207 HydrophobicContact CD1-CG1 4.34Å; Y194-V207 HydrophobicContact CD1-CG2 3.73Å; Y194-V207 HydrophobicContact CE1-CG1 4.11Å; Y194-V207 HydrophobicContact CE1-CG2 3.66Å
195	L	98.1	Very high	95.6	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.021	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	136.8	174.3	-70.7	177.4	0	0	0	109.9	V33 V34 T175 I193 R206 I208	V33-L195 HydrophobicContact CG1-CD2 4.2Å; V34-L195 CarbonylContact O-C 3.59Å; V34-L195 WeakPolarHBondContact O-CA 3.4Å; T175-L195 HydrophobicContact CG2-CD2 3.61Å; I193-L195 HydrophobicContact CG2-CD2 4.06Å; I193-L195 HydrophobicContact CG2-CG 3.99Å; L195-R206 HydrophobicContact CB-CB 4.32Å; L195-R206 PolarHBondContact N-O 2.84Å; L195-R206 PolarHBondContact O-N 3.44Å; L195-I208 HydrophobicContact CD1-CD1 3.61Å; L195-I208 HydrophobicContact CD1-CG1 4.31Å; L195-I208 HydrophobicContact CG-CD1 4.47Å
196	V	98.5	Very high	95.8	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	116	174.6	-178	0	0	0	0	107.9	V33 V34 L54 Y62 I198 V203 D204	V33-V196 WeakPolarHBondContact CA-O 3.33Å; V34-V196 PolarHBondContact N-O 3.32Å; V34-V196 PolarHBondContact O-N 3.18Å; L54-V196 HydrophobicContact CB-CG2 4.25Å; L54-V196 HydrophobicContact CD1-CB 4.24Å; L54-V196 HydrophobicContact CD1-CG2 3.62Å; Y62-V196 HydrophobicContact CD1-CG1 4.24Å; Y62-V196 HydrophobicContact CD1-CG2 4.4Å; Y62-V196 HydrophobicContact CD2-CG1 4.09Å; Y62-V196 HydrophobicContact CE1-CG1 4.13Å; Y62-V196 HydrophobicContact CE1-CG2 4.3Å; Y62-V196 HydrophobicContact CE2-CG1 3.98Å; Y62-V196 HydrophobicContact CG-CG1 4.22Å; V196-I198 HydrophobicContact CG1-CD1 4.25Å; V196-I198 HydrophobicContact CG1-CG1 3.78Å; V196-V203 HydrophobicContact CG1-CG1 3.31Å; V196-D204 WeakPolarHBondContact CA-O 3.41Å
197	T	98.6	Very high	96	Very high	8 Å²	8	41.1 Å²	41.1	5%	0.049	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123.9	172.1	-53.6	0	0	0	0	108.7	F28 V33 R172 T199 V203 D204	F28-T197 HydrophobicContact CE1-CG2 4.09Å; F28-T197 HydrophobicContact CZ-CG2 3.98Å; V33-T197 HydrophobicContact CG2-CG2 4.18Å; R172-T197 WeakPolarHBondContact CD-OG1 3.48Å; T197-T199 HydrophobicContact CG2-CG2 4.3Å; T197-V203 CarbonylContact O-C 3.56Å; T197-V203 WeakPolarHBondContact O-CA 3.44Å; T197-D204 PolarHBondContact N-O 3.26Å; T197-D204 PolarHBondContact O-N 3.17Å
198	I	98.5	Very high	96.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.8	-174.3	-51.5	170.4	0	0	0	108.2	G31 V32 V34 R60 Y62 W123 V196 V203	G31-I198 CarbonylContact C-O 3.58Å; G31-I198 WeakPolarHBondContact CA-O 3.5Å; V32-I198 HydrophobicContact CG2-CB 3.82Å; V32-I198 HydrophobicContact CG2-CD1 3.88Å; V32-I198 HydrophobicContact CG2-CG1 4.18Å; V32-I198 PolarHBondContact N-O 3.38Å; V32-I198 PolarHBondContact O-N 3.41Å; V34-I198 HydrophobicContact CG2-CD1 4.19Å; R60-I198 HydrophobicContact CB-CG2 4.02Å; R60-I198 WeakPolarHBondContact O-CG2 3.2Å; Y62-I198 HydrophobicContact CD2-CD1 3.46Å; Y62-I198 VanDerWaalsContact CD2-CD1 3.46Å; Y62-I198 HydrophobicContact CD2-CG1 4.16Å; Y62-I198 HydrophobicContact CE2-CD1 4.3Å; Y62-I198 HydrophobicContact CG-CD1 4.07Å; W123-I198 HydrophobicContact CB-CG2 3.81Å; V196-I198 HydrophobicContact CG1-CD1 4.25Å; V196-I198 HydrophobicContact CG1-CG1 3.78Å; I198-V203 HydrophobicContact CG1-CG1 4.38Å; I198-V203 HydrophobicContact CG1-CG2 4.45Å; I198-V203 HydrophobicContact CG2-CG2 4.28Å
199	T	98	Very high	96.8	Very high	36 Å²	36	41.3 Å²	41.3	22%	0.221	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	178.9	-178.3	63.4	0	0	0	0	111.4	F28 T197 D201 G202	F28-T199 HydrophobicContact CE2-CG2 4.41Å; F28-T199 HydrophobicContact CZ-CG2 3.93Å; T197-T199 HydrophobicContact CG2-CG2 4.3Å; T199-D201 PolarHBondContact O-N 3.33Å; T199-D201 PolarHBondContact OG1-N 3.2Å; T199-G202 PolarHBondContact N-O 3.09Å; T199-G202 PolarHBondContact O-N 3.35Å; T199-G202 PolarHBondContact OG1-N 2.89Å; T199-G202 PolarHBondContact OG1-O 3.49Å; T199-G202 VanDerWaalsContact OG1-O 3.14Å
200	A	96.6	Very high	96.6	Very high	40 Å²	40	43.4 Å²	43.4	33%	0.331	25%	0.252	S	S	.	.	S	Bend	trans	-60.2	-28.6	170.6	0	0	0	0	0	113.7	R60 W123	R60-A200 PolarHBondContact NH1-O 3.43Å; R60-A200 PolarHBondContact NH2-O 3.02Å; W123-A200 HydrophobicContact CD2-CB 4.31Å; W123-A200 HydrophobicContact CH2-CB 3.79Å; W123-A200 HydrophobicContact CZ2-CB 3.29Å; W123-A200 HydrophobicContact CZ3-CB 4.48Å
201	D	95.6	Very high	96.5	Very high	158 Å²	158	49.7 Å²	49.7	85%	0.845	29%	0.285	S	S	*	.	S	Bend	trans	-85.3	-27.5	-176.4	-64	-39.2	0	0	0	112	T199	T199-D201 PolarHBondContact O-N 3.33Å; T199-D201 PolarHBondContact OG1-N 3.2Å
202	G	95.1	Very high	96.4	Very high	23 Å²	23	53.8 Å²	53.8	24%	0.237	30%	0.296	C	S	.	.			trans	155.6	-156.5	-179.8	0	0	0	0	0	112.9	T199	T199-G202 PolarHBondContact N-O 3.09Å; T199-G202 PolarHBondContact O-N 3.35Å; T199-G202 PolarHBondContact OG1-N 2.89Å; T199-G202 PolarHBondContact OG1-O 3.49Å; T199-G202 VanDerWaalsContact OG1-O 3.14Å
203	V	97.7	Very high	96.2	Very high	45 Å²	45	54.1 Å²	54.1	27%	0.273	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	129.2	-175.5	-174.8	0	0	0	0	109.8	Q59 Y62 V196 T197 I198 H205	Q59-V203 WeakPolarHBondContact O-CG2 3.34Å; Y62-V203 HydrophobicContact CE2-CG1 3.95Å; Y62-V203 HydrophobicContact CE2-CG2 4.19Å; V196-V203 HydrophobicContact CG1-CG1 3.31Å; T197-V203 CarbonylContact O-C 3.56Å; T197-V203 WeakPolarHBondContact O-CA 3.44Å; I198-V203 HydrophobicContact CG1-CG1 4.38Å; I198-V203 HydrophobicContact CG1-CG2 4.45Å; I198-V203 HydrophobicContact CG2-CG2 4.28Å; V203-H205 WeakPolarHBondContact CG1-NE2 3.45Å
204	D	97.8	Very high	95.8	Very high	65 Å²	65	56 Å²	56	35%	0.348	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.6	174.9	-179.2	39.1	0	0	0	109.6	V196 T197 R206	V196-D204 WeakPolarHBondContact CA-O 3.41Å; T197-D204 PolarHBondContact N-O 3.26Å; T197-D204 PolarHBondContact O-N 3.17Å; D204-R206 IonicContact OD2-CZ 3.72Å; D204-R206 VanDerWaalsContact OD2-CZ 3.3Å; D204-R206 IonicContact OD2-NE 3.76Å; D204-R206 PolarHBondContact OD2-NE 2.84Å; D204-R206 IonicContact OD2-NH2 3.1Å; D204-R206 PolarHBondContact OD2-NH2 3.42Å
205	H	97.6	Very high	95.4	Very high	103 Å²	103	60.6 Å²	60.6	48%	0.477	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.1	178.1	-67.6	-96.8	0	0	0	110	Y62 V203	Y62-H205 AromaticContact CE1-CE1 3.8Å; Y62-H205 AromaticContact CZ-CE1 3.66Å; Y62-H205 AromaticContact CZ-NE2 3.98Å; Y62-H205 PolarHBondContact OH-CE1 2.93Å; Y62-H205 PolarHBondContact OH-NE2 3.48Å; Y62-H205 VanDerWaalsContact OH-NE2 3.08Å; V203-H205 WeakPolarHBondContact CG1-NE2 3.45Å
206	R	97.2	Very high	94.9	Very high	114 Å²	114	63.7 Å²	63.7	43%	0.43	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145.4	174.2	-59.8	-171.7	-171.8	-162.9	0.2	110.7	L195 D204	L195-R206 HydrophobicContact CB-CB 4.32Å; L195-R206 PolarHBondContact N-O 2.84Å; L195-R206 PolarHBondContact O-N 3.44Å; D204-R206 IonicContact OD2-CZ 3.72Å; D204-R206 VanDerWaalsContact OD2-CZ 3.3Å; D204-R206 IonicContact OD2-NE 3.76Å; D204-R206 PolarHBondContact OD2-NE 2.84Å; D204-R206 IonicContact OD2-NH2 3.1Å; D204-R206 PolarHBondContact OD2-NH2 3.42Å
207	V	97.9	Very high	94	Very high	71 Å²	71	71.1 Å²	71.1	43%	0.43	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.2	170.8	-171.2	0	0	0	0	106.6	V192 I193 Y194 L209	V192-V207 HydrophobicContact CB-CG1 4Å; V192-V207 HydrophobicContact CG2-CG1 3.85Å; I193-V207 CarbonylContact O-C 3.52Å; I193-V207 WeakPolarHBondContact O-CA 3.32Å; Y194-V207 HydrophobicContact CD1-CG1 4.34Å; Y194-V207 HydrophobicContact CD1-CG2 3.73Å; Y194-V207 HydrophobicContact CE1-CG1 4.11Å; Y194-V207 HydrophobicContact CE1-CG2 3.66Å; V207-L209 HydrophobicContact CG1-CD2 4.15Å
208	I	96.9	Very high	92.3	Very high	27 Å²	27	74.8 Å²	74.8	14%	0.138	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	115.3	172.9	-55.6	177	0	0	0	106.9	T176 V192 I193 L195 E212 L213	T176-I208 HydrophobicContact CG2-CD1 3.43Å; T176-I208 VanDerWaalsContact CG2-CD1 3.43Å; T176-I208 VanDerWaalsContact OG1-CD1 3.24Å; T176-I208 WeakPolarHBondContact OG1-CD1 3.28Å; V192-I208 WeakPolarHBondContact CA-O 3.31Å; V192-I208 WeakPolarHBondContact CB-O 3.42Å; I193-I208 HydrophobicContact CB-CB 4.26Å; I193-I208 PolarHBondContact N-O 3.44Å; I193-I208 PolarHBondContact O-N 3.22Å; L195-I208 HydrophobicContact CD1-CD1 3.61Å; L195-I208 HydrophobicContact CD1-CG1 4.31Å; L195-I208 HydrophobicContact CG-CD1 4.47Å; I208-E212 HydrophobicContact CG2-CB 3.82Å; I208-L213 HydrophobicContact CB-CD2 4.45Å; I208-L213 HydrophobicContact CG2-CD2 3.84Å
209	L	95.8	Very high	90.1	Very high	81 Å²	81	83.5 Å²	83.5	42%	0.424	43%	0.433	S	S	.	.			trans	-74.1	158.6	-177.7	-59.5	-179	0	0	0	110.8	V192 V207 D211 E212 L213	V192-L209 HydrophobicContact CG1-CD2 4.05Å; V207-L209 HydrophobicContact CG1-CD2 4.15Å; L209-D211 WeakPolarHBondContact CB-OD1 3.27Å; L209-D211 PolarHBondContact O-N 2.83Å; L209-D211 VanDerWaalsContact O-N 3.15Å; L209-E212 HydrophobicContact CB-CG 4.29Å; L209-E212 PolarHBondContact N-OE2 3.18Å; L209-E212 VanDerWaalsContact N-OE2 3.13Å; L209-E212 WeakPolarHBondContact O-CB 3.43Å; L209-E212 PolarHBondContact O-N 2.95Å; L209-L213 PolarHBondContact O-N 2.99Å
210	G	89.1	Confident	89.7	Confident	45 Å²	45	85.9 Å²	85.9	46%	0.464	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-30.3	-174.1	0	0	0	0	0	114.4
211	D	89.7	Confident	89.4	Confident	134 Å²	134	88.3 Å²	88.3	72%	0.717	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-17.7	176.2	58.1	-42	0	0	0	113.9	L209	L209-D211 WeakPolarHBondContact CB-OD1 3.27Å; L209-D211 PolarHBondContact O-N 2.83Å; L209-D211 VanDerWaalsContact O-N 3.15Å
212	E	92.5	Very high	89	Confident	115 Å²	115	84.4 Å²	84.4	54%	0.537	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-6.2	177.3	-59.1	175.8	154.9	0	0	112.5	I208 L209	I208-E212 HydrophobicContact CG2-CB 3.82Å; L209-E212 HydrophobicContact CB-CG 4.29Å; L209-E212 PolarHBondContact N-OE2 3.18Å; L209-E212 VanDerWaalsContact N-OE2 3.13Å; L209-E212 WeakPolarHBondContact O-CB 3.43Å; L209-E212 PolarHBondContact O-N 2.95Å
213	L	92.1	Very high	88.7	Confident	26 Å²	26	88 Å²	88	14%	0.136	44%	0.438	C	S	.	.	S	Bend	trans	-64.5	139.5	-178.9	-66.3	175	0	0	0	111.5	T180 M183 I193 I208 L209 K215	T180-L213 HydrophobicContact CG2-CB 4.13Å; M183-L213 HydrophobicContact CE-CD1 3.5Å; M183-L213 VanDerWaalsContact CE-CD1 3.5Å; I193-L213 HydrophobicContact CD1-CD2 3.4Å; I193-L213 HydrophobicContact CG1-CD2 3.72Å; I208-L213 HydrophobicContact CB-CD2 4.45Å; I208-L213 HydrophobicContact CG2-CD2 3.84Å; L209-L213 PolarHBondContact O-N 2.99Å; L213-K215 PolarHBondContact O-N 2.85Å
214	P	90.6	Very high	88.1	Confident	40 Å²	40	90.7 Å²	90.7	26%	0.26	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-54.5	135	173.6	-25.1	33	0	0	0	112.5	T176 D177 T180 F216	T176-P214 HydrophobicContact CG2-CG 3.82Å; D177-P214 VanDerWaalsContact OD1-CG 3.32Å; D177-P214 WeakPolarHBondContact OD1-CG 3.2Å; T180-P214 VanDerWaalsContact CG2-O 3.27Å; T180-P214 WeakPolarHBondContact CG2-O 3.39Å; P214-F216 HydrophobicContact CB-CE2 3.94Å; P214-F216 HydrophobicContact CB-CZ 4.09Å
215	K	88.9	Confident	87.5	Confident	136 Å²	136	92.4 Å²	92.4	59%	0.591	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-97.9	132.7	176	-67.8	152.2	166.4	-95.3	0	108.8	L213 E219	L213-K215 PolarHBondContact O-N 2.85Å; K215-E219 WeakPolarHBondContact CB-OE2 3.33Å; K215-E219 WeakPolarHBondContact CD-OE2 3.47Å; K215-E219 WeakPolarHBondContact CE-OE2 3.46Å; K215-E219 WeakPolarHBondContact CG-OE2 3.2Å; K215-E219 IonicContact NZ-OE1 3.84Å; K215-E219 PolarHBondContact NZ-OE1 3.29Å; K215-E219 IonicContact NZ-OE2 3.6Å; K215-E219 PolarHBondContact NZ-OE2 3.45Å
216	F	87.6	Confident	86.7	Confident	68 Å²	68	91.6 Å²	91.6	30%	0.298	45%	0.454	S	S	.	.			trans	-111.8	-143.3	-179.1	-65.1	-83.6	0	0	0	110.2	D177 T180 L181 P214 D218	D177-F216 HydrophobicContact CB-CZ 3.88Å; T180-F216 HydrophobicContact CG2-CD2 4.33Å; T180-F216 HydrophobicContact CG2-CE2 3.87Å; L181-F216 HydrophobicContact CD1-CE1 4.24Å; L181-F216 HydrophobicContact CD1-CZ 4.17Å; L181-F216 HydrophobicContact CD2-CB 4.24Å; L181-F216 HydrophobicContact CD2-CD1 3.84Å; L181-F216 HydrophobicContact CD2-CD2 3.61Å; L181-F216 HydrophobicContact CD2-CE1 4.03Å; L181-F216 HydrophobicContact CD2-CE2 3.83Å; L181-F216 HydrophobicContact CD2-CG 3.62Å; L181-F216 HydrophobicContact CD2-CZ 4.03Å; L181-F216 HydrophobicContact CG-CD1 4.42Å; L181-F216 HydrophobicContact CG-CD2 4.06Å; L181-F216 HydrophobicContact CG-CE1 4.11Å; L181-F216 HydrophobicContact CG-CE2 3.73Å; L181-F216 HydrophobicContact CG-CG 4.4Å; L181-F216 HydrophobicContact CG-CZ 3.75Å; P214-F216 HydrophobicContact CB-CE2 3.94Å; P214-F216 HydrophobicContact CB-CZ 4.09Å; F216-D218 VanDerWaalsContact C-N 3.34Å; F216-D218 PolarHBondContact O-N 3.22Å
217	Y	79.9	Confident	85.9	Confident	158 Å²	158	89.9 Å²	89.9	62%	0.62	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-20.2	-172.8	96.2	-80.7	0	0	0	114.8	R185 E219	R185-Y217 PolarHBondContact NH1-OH 3.43Å; R185-Y217 VanDerWaalsContact NH2-CZ 3.29Å; R185-Y217 PolarHBondContact NH2-OH 2.81Å; Y217-E219 PolarHBondContact O-N 3.42Å; Y217-E219 VanDerWaalsContact O-N 3.12Å
218	D	63.8	Low	84.9	Confident	85 Å²	85	91.5 Å²	91.5	46%	0.455	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	12.4	-176.2	-82.1	-47.7	0	0	0	113.1	R185 F216	R185-D218 IonicContact CZ-OD2 3.22Å; R185-D218 IonicContact NH1-OD2 2.72Å; R185-D218 IonicContact NH2-OD2 2.84Å; F216-D218 VanDerWaalsContact C-N 3.34Å; F216-D218 PolarHBondContact O-N 3.22Å
219	E	52.3	Low	83.8	Confident	183 Å²	183	97.4 Å²	97.4	86%	0.855	49%	0.487	S	S	*	.			trans	-128.8	0	171.7	-70	-165.1	170.3	0	0	113	K215 Y217	K215-E219 WeakPolarHBondContact CB-OE2 3.33Å; K215-E219 WeakPolarHBondContact CD-OE2 3.47Å; K215-E219 WeakPolarHBondContact CE-OE2 3.46Å; K215-E219 WeakPolarHBondContact CG-OE2 3.2Å; K215-E219 IonicContact NZ-OE1 3.84Å; K215-E219 PolarHBondContact NZ-OE1 3.29Å; K215-E219 IonicContact NZ-OE2 3.6Å; K215-E219 PolarHBondContact NZ-OE2 3.45Å; Y217-E219 PolarHBondContact O-N 3.42Å; Y217-E219 VanDerWaalsContact O-N 3.12Å

Retrieved 219 of 219 residues in 430.2 ms (Link to these results)

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