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18S rRNA aminocarboxypropyltransferase

Aminocarboxypropyltransferase that catalyzes the aminocarboxypropyl transfer on pseudouridine at position 1248 (Psi1248) in 18S rRNA. It constitutes the last step in biosynthesis of the hypermodified N1-methyl-N3-(3-amino-3-carboxypropyl) pseudouridine (m1acp3-Psi) conserved in eukaryotic 18S rRNA.

AlphaFold DB , UniProt , Accession A0A087YBF8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 284 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	43.4	Very low	43.8	Very low	245 Å²	245	182.8 Å²	182.8	100%	1.207	89%	0.892	S	S	*	*				0	94.9	0	-71.4	-79.9	-104	0	0	108.3
2	G	41.4	Very low	43.6	Very low	79 Å²	79	177.5 Å²	177.5	81%	0.814	88%	0.882	S	S	*	*			trans	-82	138.3	-161.8	0	0	0	0	0	115
3	R	48	Very low	43.5	Very low	257 Å²	257	174.2 Å²	174.2	97%	0.97	87%	0.87	S	S	*	*			trans	-73.9	115.5	169.5	-76.2	174.3	161.2	178.9	-5.9	109.8
4	K	46.8	Very low	43.4	Very low	209 Å²	209	169.6 Å²	169.6	91%	0.909	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-97.1	117.5	170.2	-106.2	-179.8	-179	178.6	0	110.3
5	K	48.6	Very low	43.3	Very low	212 Å²	212	170.1 Å²	170.1	92%	0.922	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-64.1	129.8	170	-73.3	174.5	171.5	176.9	0	109.7
6	Q	48.1	Very low	43.1	Very low	197 Å²	197	163.4 Å²	163.4	92%	0.921	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-91.2	116.1	163.1	-71.6	-175.4	2.7	0	0	108.5
7	G	40.2	Very low	43.1	Very low	76 Å²	76	164.6 Å²	164.6	78%	0.784	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-75.7	131.9	177.7	0	0	0	0	0	111.4	F9	G7-F9 PolarHBondContact O-N 2.9Å
8	K	43.2	Very low	43	Very low	199 Å²	199	163.8 Å²	163.8	87%	0.865	84%	0.838	S	S	*	*			trans	-70.8	114.3	164.3	-83.3	178.8	173.5	178.6	0	108.5	V10	K8-V10 PolarHBondContact O-N 2.77Å
9	F	37.8	Very low	43	Very low	197 Å²	197	164.5 Å²	164.5	86%	0.864	84%	0.835	S	S	*	*			trans	-76.6	99.9	170.3	-151.3	-94.4	0	0	0	108.3	G7	G7-F9 PolarHBondContact O-N 2.9Å
10	V	44.5	Very low	43.2	Very low	121 Å²	121	167.7 Å²	167.7	73%	0.733	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-81.1	117.2	172.3	177.8	0	0	0	0	107.4	K8	K8-V10 PolarHBondContact O-N 2.77Å
11	R	40.2	Very low	43.2	Very low	219 Å²	219	167.9 Å²	167.9	83%	0.826	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-67.3	132.8	169.5	-69.4	-178.2	176.1	-172.2	-1.4	108.3	D13	R11-D13 PolarHBondContact O-N 2.89Å
12	P	40.8	Very low	43.1	Very low	119 Å²	119	165.9 Å²	165.9	77%	0.773	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-68.3	128.7	174.3	27.5	-30.1	0	0	0	109.1	S14	P12-S14 PolarHBondContact O-N 3.07Å
13	D	41.8	Very low	43.5	Very low	134 Å²	134	170.3 Å²	170.3	72%	0.717	82%	0.82	S	S	*	*			trans	-67.3	96.1	174.4	-171.2	23.1	0	0	0	108.4	R11 K15	R11-D13 PolarHBondContact O-N 2.89Å; D13-K15 VanDerWaalsContact C-N 3.31Å; D13-K15 PolarHBondContact O-N 2.77Å
14	S	43.1	Very low	43.9	Very low	111 Å²	111	167.9 Å²	167.9	78%	0.776	82%	0.817	S	S	*	*			trans	-72.8	89.9	174.9	61.2	0	0	0	0	108.5	P12 G16	P12-S14 PolarHBondContact O-N 3.07Å; S14-G16 PolarHBondContact O-N 2.93Å
15	K	41.3	Very low	44.6	Very low	177 Å²	177	160.1 Å²	160.1	77%	0.77	80%	0.796	S	S	*	*			trans	-67.3	70.3	164.2	-73.6	-174.3	177.2	177	0	109.7	D13 K17	D13-K15 VanDerWaalsContact C-N 3.31Å; D13-K15 PolarHBondContact O-N 2.77Å; K15-K17 PolarHBondContact O-N 3.03Å; K15-K17 VanDerWaalsContact O-N 3.07Å
16	G	39.5	Very low	45.8	Very low	62 Å²	62	154.8 Å²	154.8	64%	0.639	77%	0.773	S	S	*	*			trans	-65.4	100.7	161.1	0	0	0	0	0	107.3	S14 D18	S14-G16 PolarHBondContact O-N 2.93Å; G16-D18 PolarHBondContact O-N 3.37Å
17	K	43.1	Very low	47.7	Very low	185 Å²	185	148.2 Å²	148.2	80%	0.804	75%	0.749	S	S	*	*			trans	-66.1	92.2	165.9	-76.7	177.6	176.6	175.1	0	106.8	K15 K19	K15-K17 PolarHBondContact O-N 3.03Å; K15-K17 VanDerWaalsContact O-N 3.07Å; K17-K19 PolarHBondContact O-N 3.21Å
18	D	41.5	Very low	50	Low	149 Å²	149	147.8 Å²	147.8	80%	0.797	73%	0.728	S	S	*	*			trans	-60.8	83.2	161.1	-86.9	-27.8	0	0	0	107.8	G16 R20	G16-D18 PolarHBondContact O-N 3.37Å; D18-R20 PolarHBondContact O-N 3.02Å
19	K	44.4	Very low	52.2	Low	177 Å²	177	145.1 Å²	145.1	77%	0.77	72%	0.719	S	S	*	*			trans	-71	73.3	162	-72.6	-174	178.6	-178.4	0	106.8	K17 H21	K17-K19 PolarHBondContact O-N 3.21Å; K19-H21 VanDerWaalsContact C-N 3.3Å; K19-H21 PolarHBondContact O-N 3.37Å
20	R	46.1	Very low	54.7	Low	228 Å²	228	138.1 Å²	138.1	86%	0.86	69%	0.692	S	S	*	*			trans	-56.3	104.3	157.4	-85.4	179.4	163	-172.6	-4.6	105.5	D18 K22	D18-R20 PolarHBondContact O-N 3.02Å; R20-K22 PolarHBondContact O-N 3.06Å
21	H	42.8	Very low	56.9	Low	173 Å²	173	132.4 Å²	132.4	80%	0.801	66%	0.658	S	S	*	*			trans	-55.5	94.9	162.9	-92	-105.1	0	0	0	106.3	K19 M23	K19-H21 VanDerWaalsContact C-N 3.3Å; K19-H21 PolarHBondContact O-N 3.37Å; H21-M23 PolarHBondContact O-N 3.04Å
22	K	41.7	Very low	59.3	Low	203 Å²	203	123.5 Å²	123.5	88%	0.883	63%	0.628	S	S	*	*			trans	-68.9	89.6	164.9	-171.3	175.6	-178.1	-179.6	0	103.9	R20 K24	R20-K22 PolarHBondContact O-N 3.06Å; K22-K24 PolarHBondContact O-N 2.95Å
23	M	50	Low	61.6	Low	172 Å²	172	123.8 Å²	123.8	85%	0.847	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-51.7	117.2	170.2	-69.7	-165.8	77.1	0	0	105.6	H21 G25	H21-M23 PolarHBondContact O-N 3.04Å; M23-G25 PolarHBondContact O-N 3.14Å; M23-G25 VanDerWaalsContact O-N 3.1Å
24	K	56.5	Low	64	Low	205 Å²	205	121 Å²	121	89%	0.891	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-58.4	118	174.2	-149.9	175.3	-179.1	-173.5	0	104.5	K22 K26	K22-K24 PolarHBondContact O-N 2.95Å; K24-K26 PolarHBondContact O-N 3.19Å
25	G	61.9	Low	66.3	Low	46 Å²	46	116.1 Å²	116.1	47%	0.474	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-53.2	141.3	-178	0	0	0	0	0	109.8	M23	M23-G25 PolarHBondContact O-N 3.14Å; M23-G25 VanDerWaalsContact O-N 3.1Å
26	K	74.2	Confident	68.6	Low	101 Å²	101	112.1 Å²	112.1	44%	0.439	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-55.2	141	172.8	-64.6	-175.8	176.3	-167.4	0	108.9	K24 E34	K24-K26 PolarHBondContact O-N 3.19Å; K26-E34 IonicContact NZ-OE1 2.9Å; K26-E34 PolarHBondContact NZ-OE1 3.02Å; K26-E34 IonicContact NZ-OE2 2.79Å; K26-E34 PolarHBondContact NZ-OE2 3.48Å
27	S	87.9	Confident	70.9	Confident	58 Å²	58	112.8 Å²	112.8	41%	0.406	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-69.1	152.8	174.6	68.4	0	0	0	0	109.4	E29 T30 F31	S27-E29 PolarHBondContact O-N 2.99Å; S27-T30 PolarHBondContact N-OG1 2.98Å; S27-T30 PolarHBondContact O-N 2.83Å; S27-T30 PolarHBondContact O-OG1 3.12Å; S27-T30 WeakPolarHBondContact OG-CG2 3.12Å; S27-T30 PolarHBondContact OG-N 3.21Å; S27-T30 PolarHBondContact OG-OG1 3.48Å; S27-T30 VanDerWaalsContact OG-OG1 3.12Å; S27-F31 PolarHBondContact O-N 3.48Å; S27-F31 VanDerWaalsContact O-N 3.12Å
28	L	88.4	Confident	73.1	Confident	67 Å²	67	104.3 Å²	104.3	35%	0.351	51%	0.509	S	S	.	.	H	α-helix	trans	-61	-33.5	178.8	-173.4	62.8	0	0	0	112	F31 T32 R111 A115 F177	L28-F31 WeakPolarHBondContact O-CB 3.49Å; L28-F31 PolarHBondContact O-N 3.01Å; L28-T32 PolarHBondContact O-N 2.97Å; L28-T32 PolarHBondContact O-OG1 3.4Å; L28-R111 HydrophobicContact CD1-CG 4.26Å; L28-A115 HydrophobicContact CD1-CB 3.98Å; L28-F177 HydrophobicContact CD1-CE1 4.17Å; L28-F177 HydrophobicContact CD1-CZ 3.83Å
29	E	88.1	Confident	75.2	Confident	143 Å²	143	98.7 Å²	98.7	67%	0.668	48%	0.479	S	S	*	.	H	α-helix	trans	-62.8	-50	176	-65.4	173.3	170.4	0	0	111.7	S27 F31 T32 E33	S27-E29 PolarHBondContact O-N 2.99Å; E29-F31 PolarHBondContact O-N 3.46Å; E29-T32 WeakPolarHBondContact CA-OG1 3.36Å; E29-T32 PolarHBondContact O-N 2.88Å; E29-T32 VanDerWaalsContact O-N 3.1Å; E29-T32 PolarHBondContact O-OG1 2.77Å; E29-E33 WeakPolarHBondContact O-CG 3.44Å; E29-E33 PolarHBondContact O-N 2.94Å
30	T	89.7	Confident	77.2	Confident	51 Å²	51	96.4 Å²	96.4	31%	0.313	47%	0.471	S	S	.	.	H	α-helix	trans	-61.2	-33.3	176.3	55.3	0	0	0	0	112	S27 E34	S27-T30 PolarHBondContact N-OG1 2.98Å; S27-T30 PolarHBondContact O-N 2.83Å; S27-T30 PolarHBondContact O-OG1 3.12Å; S27-T30 WeakPolarHBondContact OG-CG2 3.12Å; S27-T30 PolarHBondContact OG-N 3.21Å; S27-T30 PolarHBondContact OG-OG1 3.48Å; S27-T30 VanDerWaalsContact OG-OG1 3.12Å; T30-E34 WeakPolarHBondContact O-CB 3.36Å; T30-E34 VanDerWaalsContact O-CG 3.32Å; T30-E34 WeakPolarHBondContact O-CG 3.38Å; T30-E34 PolarHBondContact O-N 2.99Å
31	F	91.6	Very high	79.1	Confident	1 Å²	1	88 Å²	88	0%	0.004	45%	0.451	C	S	.	.	H	α-helix	trans	-66.8	-41.9	175.7	178.6	-90.5	0	0	0	112.1	S27 L28 E29 E34 M35 P57 C58 A115 F177 L180	S27-F31 PolarHBondContact O-N 3.48Å; S27-F31 VanDerWaalsContact O-N 3.12Å; L28-F31 WeakPolarHBondContact O-CB 3.49Å; L28-F31 PolarHBondContact O-N 3.01Å; E29-F31 PolarHBondContact O-N 3.46Å; F31-E34 PolarHBondContact O-N 3.17Å; F31-M35 WeakPolarHBondContact O-CB 3.46Å; F31-M35 PolarHBondContact O-N 3.32Å; F31-P57 HydrophobicContact CD2-CB 3.69Å; F31-P57 HydrophobicContact CD2-CG 4.07Å; F31-P57 HydrophobicContact CE1-CG 4.33Å; F31-P57 HydrophobicContact CE2-CB 3.5Å; F31-P57 HydrophobicContact CE2-CG 3.45Å; F31-P57 VanDerWaalsContact CE2-CG 3.45Å; F31-P57 HydrophobicContact CG-CB 4.48Å; F31-P57 HydrophobicContact CZ-CB 4.19Å; F31-P57 HydrophobicContact CZ-CG 3.63Å; F31-C58 HydrophobicContact CE2-CB 3.66Å; F31-C58 HydrophobicContact CZ-CB 4.23Å; F31-A115 HydrophobicContact CB-CB 4.28Å; F31-A115 HydrophobicContact CD1-CB 3.92Å; F31-A115 HydrophobicContact CD2-CB 3.89Å; F31-A115 HydrophobicContact CE1-CB 4.23Å; F31-A115 HydrophobicContact CE2-CB 4.21Å; F31-A115 HydrophobicContact CG-CB 3.74Å; F31-A115 HydrophobicContact CZ-CB 4.36Å; F31-F177 HydrophobicContact CD1-CD1 4.4Å; F31-F177 AromaticContact CD1-CE1 3.77Å; F31-F177 HydrophobicContact CD1-CE1 3.77Å; F31-F177 HydrophobicContact CD1-CE2 4.23Å; F31-F177 AromaticContact CD1-CZ 3.67Å; F31-F177 HydrophobicContact CD1-CZ 3.67Å; F31-F177 AromaticContact CE1-CD1 3.84Å; F31-F177 HydrophobicContact CE1-CD1 3.84Å; F31-F177 AromaticContact CE1-CD2 3.75Å; F31-F177 HydrophobicContact CE1-CD2 3.75Å; F31-F177 AromaticContact CE1-CE1 3.55Å; F31-F177 HydrophobicContact CE1-CE1 3.55Å; F31-F177 AromaticContact CE1-CE2 3.48Å; F31-F177 HydrophobicContact CE1-CE2 3.48Å; F31-F177 VanDerWaalsContact CE1-CE2 3.48Å; F31-F177 AromaticContact CE1-CG 3.94Å; F31-F177 HydrophobicContact CE1-CG 3.94Å; F31-F177 AromaticContact CE1-CZ 3.36Å; F31-F177 HydrophobicContact CE1-CZ 3.36Å; F31-F177 HydrophobicContact CZ-CD2 4.24Å; F31-F177 HydrophobicContact CZ-CE2 4.06Å; F31-F177 HydrophobicContact CZ-CZ 4.33Å; F31-L180 HydrophobicContact CE1-CD1 4.24Å; F31-L180 HydrophobicContact CZ-CD1 3.82Å
32	T	90.2	Very high	81	Confident	32 Å²	32	81 Å²	81	20%	0.196	42%	0.421	C	S	.	.	H	α-helix	trans	-67.8	-37.5	176.9	46.1	0	0	0	0	112.1	L28 E29 M35 H36 F177	L28-T32 PolarHBondContact O-N 2.97Å; L28-T32 PolarHBondContact O-OG1 3.4Å; E29-T32 WeakPolarHBondContact CA-OG1 3.36Å; E29-T32 PolarHBondContact O-N 2.88Å; E29-T32 VanDerWaalsContact O-N 3.1Å; E29-T32 PolarHBondContact O-OG1 2.77Å; T32-M35 WeakPolarHBondContact O-CB 3.45Å; T32-M35 PolarHBondContact O-N 3.38Å; T32-H36 PolarHBondContact O-CD2 3.28Å; T32-H36 PolarHBondContact O-N 2.99Å; T32-F177 HydrophobicContact CG2-CE1 4.41Å
33	E	90.5	Very high	82.9	Confident	125 Å²	125	76.1 Å²	76.1	58%	0.584	40%	0.404	S	S	*	.	H	α-helix	trans	-63	-46.7	174	-69.3	170.3	177.1	0	0	111.7	E29 M35 H36 S37	E29-E33 WeakPolarHBondContact O-CG 3.44Å; E29-E33 PolarHBondContact O-N 2.94Å; E33-M35 VanDerWaalsContact C-N 3.27Å; E33-M35 PolarHBondContact O-N 3.16Å; E33-H36 PolarHBondContact O-N 3.18Å; E33-S37 WeakPolarHBondContact O-CB 3.32Å; E33-S37 PolarHBondContact O-N 3.1Å
34	E	91.1	Very high	84	Confident	74 Å²	74	74.5 Å²	74.5	35%	0.346	39%	0.394	S	S	.	.	H	α-helix	trans	-61.3	-36.2	175	-72.3	178.3	-173.3	0	0	111.8	K26 T30 F31 A38 P57	K26-E34 IonicContact NZ-OE1 2.9Å; K26-E34 PolarHBondContact NZ-OE1 3.02Å; K26-E34 IonicContact NZ-OE2 2.79Å; K26-E34 PolarHBondContact NZ-OE2 3.48Å; T30-E34 WeakPolarHBondContact O-CB 3.36Å; T30-E34 VanDerWaalsContact O-CG 3.32Å; T30-E34 WeakPolarHBondContact O-CG 3.38Å; T30-E34 PolarHBondContact O-N 2.99Å; F31-E34 PolarHBondContact O-N 3.17Å; E34-A38 WeakPolarHBondContact O-CB 3.49Å; E34-A38 PolarHBondContact O-N 3.11Å; E34-P57 HydrophobicContact CB-CB 3.71Å; E34-P57 WeakPolarHBondContact OE2-CB 3.47Å
35	M	91.3	Very high	84.3	Confident	10 Å²	10	68.8 Å²	68.8	5%	0.049	38%	0.378	C	S	.	.	H	α-helix	trans	-62.5	-51.1	174.6	174.9	-172.3	78.3	0	0	111.8	F31 T32 E33 S37 A38 L39 P57 F177 E179 L180	F31-M35 WeakPolarHBondContact O-CB 3.46Å; F31-M35 PolarHBondContact O-N 3.32Å; T32-M35 WeakPolarHBondContact O-CB 3.45Å; T32-M35 PolarHBondContact O-N 3.38Å; E33-M35 VanDerWaalsContact C-N 3.27Å; E33-M35 PolarHBondContact O-N 3.16Å; M35-S37 VanDerWaalsContact C-N 3.32Å; M35-S37 PolarHBondContact O-N 3.12Å; M35-A38 WeakPolarHBondContact O-CB 3.44Å; M35-A38 PolarHBondContact O-N 3.06Å; M35-A38 VanDerWaalsContact O-N 3.17Å; M35-L39 PolarHBondContact O-N 3.37Å; M35-P57 HydrophobicContact CB-CG 4.19Å; M35-F177 HydrophobicContact SD-CB 4.09Å; M35-F177 HydrophobicContact SD-CD1 4.23Å; M35-E179 HydrophobicContact CE-CB 4.18Å; M35-E179 HydrophobicContact CE-CG 4.11Å; M35-E179 HydrophobicContact CG-CB 4.01Å; M35-E179 HydrophobicContact SD-CB 3.95Å; M35-E179 HydrophobicContact SD-CG 4.5Å; M35-L180 HydrophobicContact CB-CD2 4.23Å; M35-L180 HydrophobicContact CG-CD1 4.44Å; M35-L180 HydrophobicContact CG-CD2 3.64Å; M35-L180 HydrophobicContact CG-CG 3.74Å; M35-L180 HydrophobicContact SD-CD1 4.49Å; M35-L180 HydrophobicContact SD-CG 3.98Å
36	H	88.9	Confident	84	Confident	93 Å²	93	73.8 Å²	73.8	43%	0.431	39%	0.389	S	S	.	.	H	α-helix	trans	-61.6	-42.7	179.7	-69.8	-56.9	0	0	0	111.3	T32 E33 A38 L39 E40 E179	T32-H36 PolarHBondContact O-CD2 3.28Å; T32-H36 PolarHBondContact O-N 2.99Å; E33-H36 PolarHBondContact O-N 3.18Å; H36-A38 VanDerWaalsContact C-N 3.32Å; H36-A38 PolarHBondContact O-N 3.24Å; H36-L39 PolarHBondContact O-N 3.3Å; H36-L39 VanDerWaalsContact O-N 3.16Å; H36-E40 PolarHBondContact O-N 3.12Å; H36-E179 IonicContact CE1-OE1 2.83Å; H36-E179 PolarHBondContact CE1-OE1 2.73Å; H36-E179 IonicContact CE1-OE2 2.82Å; H36-E179 IonicContact CG-OE2 3.8Å; H36-E179 IonicContact ND1-OE1 2.73Å; H36-E179 PolarHBondContact ND1-OE1 3.3Å; H36-E179 IonicContact ND1-OE2 3.26Å; H36-E179 PolarHBondContact ND1-OE2 2.88Å
37	S	89.8	Confident	82.6	Confident	75 Å²	75	78.6 Å²	78.6	52%	0.524	41%	0.413	S	S	.	.	H	α-helix	trans	-60.7	-40.2	175.1	-178.2	0	0	0	0	112.2	E33 M35 E40 A41	E33-S37 WeakPolarHBondContact O-CB 3.32Å; E33-S37 PolarHBondContact O-N 3.1Å; M35-S37 VanDerWaalsContact C-N 3.32Å; M35-S37 PolarHBondContact O-N 3.12Å; S37-E40 PolarHBondContact O-N 2.77Å; S37-A41 WeakPolarHBondContact O-CB 3.19Å; S37-A41 PolarHBondContact O-N 3.26Å
38	A	87.9	Confident	80.8	Confident	7 Å²	7	78.3 Å²	78.3	6%	0.058	42%	0.419	C	S	.	.	H	α-helix	trans	-66.3	-37.5	175.5	0	0	0	0	0	112.4	E34 M35 H36 S42 V54 K55 L183	E34-A38 WeakPolarHBondContact O-CB 3.49Å; E34-A38 PolarHBondContact O-N 3.11Å; M35-A38 WeakPolarHBondContact O-CB 3.44Å; M35-A38 PolarHBondContact O-N 3.06Å; M35-A38 VanDerWaalsContact O-N 3.17Å; H36-A38 VanDerWaalsContact C-N 3.32Å; H36-A38 PolarHBondContact O-N 3.24Å; A38-S42 PolarHBondContact O-N 2.64Å; A38-V54 HydrophobicContact CB-CG1 3.87Å; A38-V54 WeakPolarHBondContact O-CG1 3.48Å; A38-K55 WeakPolarHBondContact CB-O 3.2Å; A38-L183 HydrophobicContact CB-CD1 4.1Å
39	L	86.4	Confident	78.8	Confident	32 Å²	32	80.9 Å²	80.9	17%	0.168	45%	0.45	C	S	.	.	H	α-helix	trans	-65.2	-47.6	175.4	-178	67.9	0	0	0	111.1	M35 H36 A41 S42 L43 E179	M35-L39 PolarHBondContact O-N 3.37Å; H36-L39 PolarHBondContact O-N 3.3Å; H36-L39 VanDerWaalsContact O-N 3.16Å; L39-A41 PolarHBondContact O-N 3.48Å; L39-S42 WeakPolarHBondContact O-CA 3.43Å; L39-S42 WeakPolarHBondContact O-CB 3.33Å; L39-S42 PolarHBondContact O-N 2.73Å; L39-S42 PolarHBondContact O-OG 2.83Å; L39-L43 PolarHBondContact O-N 2.98Å; L39-E179 HydrophobicContact CD2-CB 3.98Å; L39-E179 HydrophobicContact CD2-CG 3.76Å; L39-E179 WeakPolarHBondContact CD2-OE2 3.44Å
40	E	86.4	Confident	77	Confident	128 Å²	128	81.5 Å²	81.5	60%	0.598	46%	0.458	S	S	*	.	H	α-helix	trans	-59.4	-46.4	178.7	-172.1	175.9	-169.2	0	0	111.6	H36 S37 S42 L43 H44	H36-E40 PolarHBondContact O-N 3.12Å; S37-E40 PolarHBondContact O-N 2.77Å; E40-S42 PolarHBondContact O-N 3.23Å; E40-S42 VanDerWaalsContact O-N 3.12Å; E40-L43 PolarHBondContact O-N 3.1Å; E40-H44 PolarHBondContact O-N 2.82Å
41	A	85.9	Confident	75.2	Confident	53 Å²	53	81.4 Å²	81.4	44%	0.438	46%	0.462	S	S	.	.	H	α-helix	trans	-60.7	-23.2	174.1	0	0	0	0	0	113.3	S37 L39 V54	S37-A41 WeakPolarHBondContact O-CB 3.19Å; S37-A41 PolarHBondContact O-N 3.26Å; L39-A41 PolarHBondContact O-N 3.48Å; A41-V54 HydrophobicContact CB-CG2 4.47Å
42	S	83.1	Confident	73.4	Confident	26 Å²	26	86.4 Å²	86.4	18%	0.182	50%	0.495	C	S	.	.	H	α-helix	trans	-81.6	-20.8	175.7	85.2	0	0	0	0	113.9	A38 L39 E40	A38-S42 PolarHBondContact O-N 2.64Å; L39-S42 WeakPolarHBondContact O-CA 3.43Å; L39-S42 WeakPolarHBondContact O-CB 3.33Å; L39-S42 PolarHBondContact O-N 2.73Å; L39-S42 PolarHBondContact O-OG 2.83Å; E40-S42 PolarHBondContact O-N 3.23Å; E40-S42 VanDerWaalsContact O-N 3.12Å
43	L	80.1	Confident	72.3	Confident	100 Å²	100	91.2 Å²	91.2	52%	0.524	52%	0.516	S	S	.	.	H	α-helix	trans	-87.7	-31.6	179.6	-66.3	174.6	0	0	0	112.2	L39 E40 P45	L39-L43 PolarHBondContact O-N 2.98Å; E40-L43 PolarHBondContact O-N 3.1Å; L43-P45 WeakPolarHBondContact O-CD 3.38Å
44	H	73.1	Confident	71.9	Confident	137 Å²	137	86.2 Å²	86.2	63%	0.634	49%	0.493	S	S	*	.	S	Bend	trans	-111.8	73.4	175.4	-64.3	-72	0	0	0	110.5	E40 E46	E40-H44 PolarHBondContact O-N 2.82Å; H44-E46 PolarHBondContact O-N 2.9Å
45	P	63.3	Low	71.6	Confident	86 Å²	86	91.4 Å²	91.4	56%	0.558	52%	0.515	S	S	*	.			trans	-66.1	109.4	169.6	27.2	-29.7	0	0	0	108	L43 E47	L43-P45 WeakPolarHBondContact O-CD 3.38Å; P45-E47 PolarHBondContact O-N 2.94Å
46	E	57.1	Low	71.5	Confident	151 Å²	151	92.2 Å²	92.2	71%	0.706	52%	0.519	S	S	*	.			trans	-53.4	113.7	165.2	-68	-72.7	134.7	0	0	107.7	H44 G48 A51	H44-E46 PolarHBondContact O-N 2.9Å; E46-G48 PolarHBondContact O-N 2.99Å; E46-A51 WeakPolarHBondContact O-CB 3.44Å
47	E	43.2	Very low	71.7	Confident	201 Å²	201	88.5 Å²	88.5	94%	0.939	50%	0.503	S	S	*	.			trans	-69.6	103.1	-177.8	-72.4	-172.5	157.6	0	0	109.7	P45	P45-E47 PolarHBondContact O-N 2.94Å
48	G	49.8	Very low	71.8	Confident	52 Å²	52	85.2 Å²	85.2	54%	0.536	48%	0.48	S	S	.	.	S	Bend	trans	-173	156.4	177.9	0	0	0	0	0	112	E46 D50 A51	E46-G48 PolarHBondContact O-N 2.99Å; G48-D50 PolarHBondContact O-N 2.97Å; G48-A51 PolarHBondContact O-N 2.96Å
49	A	48.1	Very low	72.1	Confident	121 Å²	121	88 Å²	88	100%	1	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-6	-179.1	0	0	0	0	0	114.6
50	D	48.8	Very low	72.6	Confident	157 Å²	157	86.7 Å²	86.7	84%	0.84	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.9	32.9	-179.6	-155.2	22.1	0	0	0	112.3	G48	G48-D50 PolarHBondContact O-N 2.97Å
51	A	52.4	Low	73.1	Confident	48 Å²	48	80.7 Å²	80.7	40%	0.397	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-55.5	124.7	177.3	0	0	0	0	0	110.5	E46 G48 Q53	E46-A51 WeakPolarHBondContact O-CB 3.44Å; G48-A51 PolarHBondContact O-N 2.96Å; A51-Q53 PolarHBondContact O-N 3.27Å; A51-Q53 VanDerWaalsContact O-N 3.14Å
52	P	54.8	Low	73.6	Confident	106 Å²	106	78.1 Å²	78.1	69%	0.688	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-60.9	121.7	-176	21	-30.2	0	0	0	110.1	V54	P52-V54 PolarHBondContact O-N 3.01Å; P52-V54 VanDerWaalsContact O-N 3.11Å
53	Q	66.4	Low	74.1	Confident	134 Å²	134	77 Å²	77	63%	0.626	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-59.7	119.8	173.6	-68.6	-173.2	-2.1	0	0	109	A51 K55	A51-Q53 PolarHBondContact O-N 3.27Å; A51-Q53 VanDerWaalsContact O-N 3.14Å; Q53-K55 PolarHBondContact O-N 2.96Å
54	V	81.4	Confident	74.6	Confident	20 Å²	20	74.9 Å²	74.9	12%	0.121	42%	0.421	C	S	.	.			trans	-53.7	114.7	176	179.4	0	0	0	0	109.2	A38 A41 P52 F83 L183	A38-V54 HydrophobicContact CB-CG1 3.87Å; A38-V54 WeakPolarHBondContact O-CG1 3.48Å; A41-V54 HydrophobicContact CB-CG2 4.47Å; P52-V54 PolarHBondContact O-N 3.01Å; P52-V54 VanDerWaalsContact O-N 3.11Å; V54-F83 WeakPolarHBondContact O-CE1 3.4Å; V54-L183 HydrophobicContact CG1-CD1 3.51Å; V54-L183 HydrophobicContact CG1-CD2 4.13Å; V54-L183 HydrophobicContact CG1-CG 4.24Å
55	K	85.4	Confident	75.3	Confident	182 Å²	182	69.7 Å²	69.7	79%	0.791	40%	0.398	S	S	*	.			trans	-88.7	134.6	178.9	-70	179.3	-175.9	169.6	0	109.5	A38 Q53	A38-K55 WeakPolarHBondContact CB-O 3.2Å; Q53-K55 PolarHBondContact O-N 2.96Å
56	L	89.9	Confident	76.2	Confident	28 Å²	28	67.9 Å²	67.9	15%	0.147	40%	0.395	C	S	.	.			trans	-79.2	146.6	173.3	-65.3	169.4	0	0	0	110.5	C58 L60 F83 L180 L183 L184	L56-C58 VanDerWaalsContact C-N 3.26Å; L56-C58 PolarHBondContact O-N 3.27Å; L56-L60 HydrophobicContact CD1-CD1 3.37Å; L56-L60 HydrophobicContact CD1-CG 3.84Å; L56-F83 HydrophobicContact CD1-CB 4.27Å; L56-F83 HydrophobicContact CD1-CD1 3.66Å; L56-F83 HydrophobicContact CD1-CG 4.41Å; L56-F83 HydrophobicContact CD2-CD1 4.45Å; L56-F83 HydrophobicContact CG-CD1 3.79Å; L56-F83 HydrophobicContact CG-CE1 4.25Å; L56-L180 HydrophobicContact CD2-CD2 3.8Å; L56-L183 HydrophobicContact CD2-CD1 4.28Å; L56-L183 HydrophobicContact CD2-CD2 4.12Å; L56-L184 HydrophobicContact CD1-CD2 4.16Å
57	P	92	Very high	77.4	Confident	14 Å²	14	63.7 Å²	63.7	9%	0.091	38%	0.375	C	S	.	.	S	Bend	trans	-71.6	-18.8	-179.4	29.6	-37	0	0	0	113.5	F31 E34 M35 L180	F31-P57 HydrophobicContact CD2-CB 3.69Å; F31-P57 HydrophobicContact CD2-CG 4.07Å; F31-P57 HydrophobicContact CE1-CG 4.33Å; F31-P57 HydrophobicContact CE2-CB 3.5Å; F31-P57 HydrophobicContact CE2-CG 3.45Å; F31-P57 VanDerWaalsContact CE2-CG 3.45Å; F31-P57 HydrophobicContact CG-CB 4.48Å; F31-P57 HydrophobicContact CZ-CB 4.19Å; F31-P57 HydrophobicContact CZ-CG 3.63Å; E34-P57 HydrophobicContact CB-CB 3.71Å; E34-P57 WeakPolarHBondContact OE2-CB 3.47Å; M35-P57 HydrophobicContact CB-CG 4.19Å; P57-L180 HydrophobicContact CG-CD1 4.05Å; P57-L180 HydrophobicContact CG-CD2 3.95Å
58	C	92.8	Very high	79.3	Confident	6 Å²	6	55.6 Å²	55.6	4%	0.041	34%	0.34	C	S	.	.	S	Bend	trans	-122.8	154.2	173.8	58.5	0	0	0	0	112.4	F31 L56 V114	F31-C58 HydrophobicContact CE2-CB 3.66Å; F31-C58 HydrophobicContact CZ-CB 4.23Å; L56-C58 VanDerWaalsContact C-N 3.26Å; L56-C58 PolarHBondContact O-N 3.27Å; C58-V114 WeakPolarHBondContact CB-O 3.47Å
59	P	94.8	Very high	81	Confident	66 Å²	66	56.8 Å²	56.8	43%	0.429	33%	0.334	S	S	.	.			trans	-72.8	130.8	176.8	29	-33.4	0	0	0	111.1	G118 L119	P59-G118 VanDerWaalsContact O-CA 3.23Å; P59-G118 WeakPolarHBondContact O-CA 3.2Å; P59-L119 PolarHBondContact O-N 2.94Å; P59-L119 VanDerWaalsContact O-N 3.1Å
60	L	96.9	Very high	82.7	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	140.6	164.4	-57.6	-176.9	0	0	0	110.3	L56 F83 V84 R85 L119 F168 F172 L184	L56-L60 HydrophobicContact CD1-CD1 3.37Å; L56-L60 HydrophobicContact CD1-CG 3.84Å; L60-F83 WeakPolarHBondContact CB-O 3.41Å; L60-V84 HydrophobicContact CB-CB 4.42Å; L60-V84 HydrophobicContact CB-CG2 3.77Å; L60-V84 HydrophobicContact CD1-CG2 4.12Å; L60-R85 PolarHBondContact O-N 3.13Å; L60-L119 CarbonylContact C-O 3.6Å; L60-L119 WeakPolarHBondContact CA-O 3.26Å; L60-L119 HydrophobicContact CD2-CB 3.73Å; L60-L119 HydrophobicContact CD2-CD1 4.25Å; L60-L119 HydrophobicContact CD2-CG 4.25Å; L60-F168 HydrophobicContact CB-CE1 4.29Å; L60-F168 HydrophobicContact CB-CZ 4.23Å; L60-F168 HydrophobicContact CD1-CD1 4.48Å; L60-F168 HydrophobicContact CD2-CD1 3.9Å; L60-F168 HydrophobicContact CD2-CE1 3.85Å; L60-F172 HydrophobicContact CD1-CE2 4.33Å; L60-F172 HydrophobicContact CD2-CE2 4.02Å; L60-F172 HydrophobicContact CD2-CZ 3.74Å; L60-L184 HydrophobicContact CD1-CD1 3.95Å; L60-L184 HydrophobicContact CD1-CD2 4.1Å
61	A	96.6	Very high	84.4	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.008	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	159.6	-179.5	0	0	0	0	0	112.5	R85 L87 F93 L119 A120 V121 F168	A61-R85 CarbonylContact C-O 3.47Å; A61-R85 WeakPolarHBondContact CA-O 3.43Å; A61-L87 HydrophobicContact CB-CD1 3.66Å; A61-L87 HydrophobicContact CB-CD2 4.03Å; A61-L87 HydrophobicContact CB-CG 3.79Å; A61-F93 HydrophobicContact CB-CD2 3.79Å; A61-F93 HydrophobicContact CB-CE2 3.64Å; A61-F93 HydrophobicContact CB-CZ 4.35Å; A61-L119 PolarHBondContact N-O 2.77Å; A61-A120 HydrophobicContact CB-CB 4.13Å; A61-A120 WeakPolarHBondContact O-CA 3.29Å; A61-V121 PolarHBondContact O-N 3.3Å; A61-F168 WeakPolarHBondContact O-CZ 3.4Å
62	M	95.6	Very high	86.1	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	134	-179.2	176.5	179.3	90.7	0	0	110.6	E64 G75 R76 V79 V84 R85 N86 L87 V121 D123	M62-E64 HydrophobicContact CE-CB 4.09Å; M62-E64 HydrophobicContact CE-CG 4.44Å; M62-G75 WeakPolarHBondContact SD-CA 3.46Å; M62-R76 HydrophobicContact CE-CG 4.43Å; M62-V79 HydrophobicContact CE-CG2 3.99Å; M62-V84 HydrophobicContact CB-CG1 3.54Å; M62-R85 PolarHBondContact N-O 3.33Å; M62-N86 CarbonylContact O-C 3.51Å; M62-N86 WeakPolarHBondContact O-CA 3.33Å; M62-N86 PolarHBondContact O-OD1 3.4Å; M62-L87 PolarHBondContact O-N 2.99Å; M62-V121 VanDerWaalsContact CA-O 3.26Å; M62-V121 WeakPolarHBondContact CA-O 3.35Å; M62-V121 HydrophobicContact CB-CG2 3.91Å; M62-V121 HydrophobicContact CG-CG2 3.78Å; M62-V121 HydrophobicContact SD-CG2 4.25Å; M62-D123 HydrophobicContact CE-CB 3.95Å; M62-D123 HydrophobicContact CG-CB 3.76Å; M62-D123 HydrophobicContact SD-CB 3.5Å; M62-D123 WeakPolarHBondContact SD-CB 3.19Å
63	W	94.6	Very high	87.8	Confident	1 Å²	1	58.2 Å²	58.2	0%	0.004	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	117.6	163.2	-68.5	-84.9	0	0	0	109.1	L87 R88 Q91 F93 I97 A120 V121 I122 D123 M137	W63-L87 HydrophobicContact CD2-CB 4.25Å; W63-L87 HydrophobicContact CD2-CD1 3.81Å; W63-L87 HydrophobicContact CE3-CD1 4.12Å; W63-L87 HydrophobicContact CG-CB 4Å; W63-L87 HydrophobicContact CG-CD1 4.42Å; W63-L87 HydrophobicContact CH2-CD1 3.97Å; W63-L87 HydrophobicContact CZ2-CD1 3.62Å; W63-L87 HydrophobicContact CZ3-CD1 4.19Å; W63-R88 VanDerWaalsContact CD1-O 3.25Å; W63-R88 PolarHBondContact NE1-O 3.41Å; W63-Q91 VanDerWaalsContact CZ2-O 3.31Å; W63-Q91 WeakPolarHBondContact CZ2-O 3.43Å; W63-Q91 PolarHBondContact NE1-O 3Å; W63-Q91 VanDerWaalsContact NE1-O 3.11Å; W63-F93 HydrophobicContact CH2-CB 3.63Å; W63-F93 HydrophobicContact CZ2-CB 4Å; W63-I97 HydrophobicContact CH2-CD1 3.73Å; W63-I97 HydrophobicContact CH2-CG1 3.98Å; W63-I97 HydrophobicContact CH2-CG2 4.32Å; W63-I97 HydrophobicContact CZ3-CD1 4.29Å; W63-I97 HydrophobicContact CZ3-CG1 4.12Å; W63-I97 HydrophobicContact CZ3-CG2 3.81Å; W63-A120 HydrophobicContact CE3-CB 4.35Å; W63-A120 HydrophobicContact CH2-CB 4.18Å; W63-A120 HydrophobicContact CZ3-CB 3.62Å; W63-V121 PolarHBondContact N-O 3.03Å; W63-I122 HydrophobicContact CE3-CG1 3.97Å; W63-D123 PolarHBondContact O-N 3.27Å; W63-M137 HydrophobicContact CB-CG 4.06Å; W63-M137 HydrophobicContact CB-SD 3.5Å; W63-M137 VanDerWaalsContact CB-SD 3.5Å; W63-M137 HydrophobicContact CD2-CB 4.03Å; W63-M137 HydrophobicContact CD2-CG 3.8Å; W63-M137 HydrophobicContact CD2-SD 4.1Å; W63-M137 HydrophobicContact CE3-CB 4.36Å; W63-M137 HydrophobicContact CE3-CG 4.44Å; W63-M137 HydrophobicContact CE3-SD 4.45Å; W63-M137 HydrophobicContact CG-CB 4.38Å; W63-M137 HydrophobicContact CG-CG 3.61Å; W63-M137 HydrophobicContact CG-SD 3.72Å; W63-M137 HydrophobicContact CZ2-CB 4.37Å
64	E	90.2	Very high	89	Confident	56 Å²	56	52.6 Å²	52.6	26%	0.262	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	122.1	175.9	-173.9	-178.5	164	0	0	110.5	M62 R76 N86	M62-E64 HydrophobicContact CE-CB 4.09Å; M62-E64 HydrophobicContact CE-CG 4.44Å; E64-R76 VanDerWaalsContact OE1-CD 3.24Å; E64-R76 WeakPolarHBondContact OE1-CD 3.23Å; E64-R76 IonicContact OE1-CZ 2.82Å; E64-R76 IonicContact OE1-NE 3.71Å; E64-R76 PolarHBondContact OE1-NE 3.38Å; E64-R76 IonicContact OE1-NH1 3.54Å; E64-R76 PolarHBondContact OE1-NH1 3.34Å; E64-R76 IonicContact OE1-NH2 3.08Å; E64-R76 PolarHBondContact OE1-NH2 3.23Å; E64-N86 PolarHBondContact OE2-ND2 3.19Å
65	L	86.6	Confident	89.6	Confident	29 Å²	29	51.7 Å²	51.7	15%	0.152	26%	0.263	C	S	.	.			trans	-98.1	-7.1	177.4	-55.4	-173.6	0	0	0	113.8	H67 L89 I122 D123 C124 T132 M137	L65-H67 PolarHBondContact O-CD2 3.28Å; L65-H67 PolarHBondContact O-N 3.26Å; L65-L89 HydrophobicContact CD2-CD2 3.37Å; L65-L89 HydrophobicContact CD2-CG 4.37Å; L65-I122 HydrophobicContact CD1-CG2 4.37Å; L65-D123 PolarHBondContact N-O 3.39Å; L65-C124 HydrophobicContact CD1-CB 3.65Å; L65-C124 HydrophobicContact CG-CB 4.46Å; L65-T132 HydrophobicContact CD1-CG2 3.29Å; L65-M137 HydrophobicContact CD1-CE 4.44Å; L65-M137 HydrophobicContact CD2-CE 4.42Å; L65-M137 HydrophobicContact CD2-SD 4.44Å
66	G	83.2	Confident	90	Very high	47 Å²	47	45.1 Å²	45.1	49%	0.485	23%	0.233	S	C	.	.	S	Bend	trans	75.1	9.1	-179.6	0	0	0	0	0	114.7
67	H	83	Confident	90.1	Very high	64 Å²	64	46.4 Å²	46.4	30%	0.296	24%	0.238	S	C	.	.			trans	-78.3	-20.4	-176.6	-61.1	175.8	0	0	0	113.9	L65 K128	L65-H67 PolarHBondContact O-CD2 3.28Å; L65-H67 PolarHBondContact O-N 3.26Å; H67-K128 HydrophobicContact CB-CD 4.36Å
68	C	82.3	Confident	90.3	Very high	31 Å²	31	45.8 Å²	45.8	21%	0.209	23%	0.233	C	C	.	.	S	Bend	trans	-96.4	153.6	-177.3	-60.4	0	0	0	0	112	P70 C73 R76 D123	C68-P70 WeakPolarHBondContact O-CD 3.41Å; C68-C73 HydrophobicContact CB-CB 4.02Å; C68-R76 PolarHBondContact O-NH2 3.11Å; C68-D123 PolarHBondContact SG-OD1 3.49Å
69	D	84.9	Confident	90.3	Very high	77 Å²	77	47.7 Å²	47.7	41%	0.412	25%	0.245	S	C	.	.			trans	-61.5	121.8	168.9	174.9	-5.5	0	0	0	110.1	K71 R72 C73	D69-K71 PolarHBondContact O-N 2.93Å; D69-K71 VanDerWaalsContact O-N 3.12Å; D69-K71 PolarHBondContact OD1-N 3.42Å; D69-R72 HydrophobicContact CB-CB 4.33Å; D69-R72 PolarHBondContact O-N 2.86Å; D69-R72 VanDerWaalsContact O-N 3.14Å; D69-R72 IonicContact OD2-NE 2.94Å; D69-C73 WeakPolarHBondContact O-CB 3.41Å; D69-C73 PolarHBondContact O-N 3.48Å
70	P	84.3	Confident	90.2	Very high	69 Å²	69	52 Å²	52	45%	0.448	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-31.7	179.9	-10.6	9.2	0	0	0	114.9	C68 R76	C68-P70 WeakPolarHBondContact O-CD 3.41Å; P70-R76 VanDerWaalsContact CB-NH1 3.29Å; P70-R76 VanDerWaalsContact CG-NH1 3.28Å
71	K	85.1	Confident	90	Very high	186 Å²	186	55.9 Å²	55.9	81%	0.809	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-34.1	-177.5	-67.7	-175.8	178.8	179.9	0	112.1	D69	D69-K71 PolarHBondContact O-N 2.93Å; D69-K71 VanDerWaalsContact O-N 3.12Å; D69-K71 PolarHBondContact OD1-N 3.42Å
72	R	86.4	Confident	89.7	Confident	196 Å²	196	58.4 Å²	58.4	74%	0.74	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-19.9	-177.7	-62.1	-178.4	-177.8	-158	-1	113.2	D69 T74	D69-R72 HydrophobicContact CB-CB 4.33Å; D69-R72 PolarHBondContact O-N 2.86Å; D69-R72 VanDerWaalsContact O-N 3.14Å; D69-R72 IonicContact OD2-NE 2.94Å; R72-T74 PolarHBondContact O-N 2.99Å; R72-T74 VanDerWaalsContact O-N 3.14Å
73	C	91	Very high	89.7	Confident	10 Å²	10	59.4 Å²	59.4	7%	0.068	30%	0.3	C	S	.	.			trans	-63.1	114.9	-179.7	177	0	0	0	0	111.5	C68 D69 G75 R76 K77 D123	C68-C73 HydrophobicContact CB-CB 4.02Å; D69-C73 WeakPolarHBondContact O-CB 3.41Å; D69-C73 PolarHBondContact O-N 3.48Å; C73-G75 VanDerWaalsContact C-N 3.3Å; C73-G75 PolarHBondContact O-N 2.96Å; C73-G75 PolarHBondContact SG-N 3.45Å; C73-G75 VanDerWaalsContact SG-N 3.41Å; C73-R76 HydrophobicContact CB-CB 4.14Å; C73-R76 HydrophobicContact CB-CG 4.15Å; C73-R76 PolarHBondContact SG-N 3.39Å; C73-K77 PolarHBondContact O-N 2.88Å; C73-K77 VanDerWaalsContact O-N 3.12Å; C73-D123 PolarHBondContact SG-OD1 3.5Å; C73-D123 VanDerWaalsContact SG-OD1 3.37Å; C73-D123 PolarHBondContact SG-OD2 2.85Å
74	T	93.1	Very high	89.7	Confident	17 Å²	17	59.7 Å²	59.7	10%	0.104	30%	0.302	C	S	.	.	H	α-helix	trans	-65.4	-36.2	177.4	60.4	0	0	0	0	111.4	R72 K77 L78 C164 V165 F188 W190	R72-T74 PolarHBondContact O-N 2.99Å; R72-T74 VanDerWaalsContact O-N 3.14Å; T74-K77 WeakPolarHBondContact O-CB 3.47Å; T74-K77 PolarHBondContact O-N 2.94Å; T74-L78 WeakPolarHBondContact O-CG 3.3Å; T74-L78 PolarHBondContact O-N 3.4Å; T74-C164 PolarHBondContact OG1-N 2.89Å; T74-V165 HydrophobicContact CG2-CG1 3.9Å; T74-V165 PolarHBondContact OG1-N 3.37Å; T74-F188 HydrophobicContact CG2-CD1 4.35Å; T74-F188 HydrophobicContact CG2-CE1 3.73Å; T74-F188 HydrophobicContact CG2-CZ 4.36Å; T74-W190 HydrophobicContact CG2-CH2 4.25Å; T74-W190 HydrophobicContact CG2-CZ2 3.93Å
75	G	93	Very high	89.9	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.2	-52.9	176	0	0	0	0	0	112.4	M62 C73 K77 L78 V79	M62-G75 WeakPolarHBondContact SD-CA 3.46Å; C73-G75 VanDerWaalsContact C-N 3.3Å; C73-G75 PolarHBondContact O-N 2.96Å; C73-G75 PolarHBondContact SG-N 3.45Å; C73-G75 VanDerWaalsContact SG-N 3.41Å; G75-K77 VanDerWaalsContact C-N 3.25Å; G75-K77 PolarHBondContact O-N 3.43Å; G75-L78 WeakPolarHBondContact O-CB 3.16Å; G75-L78 PolarHBondContact O-N 3.28Å; G75-V79 WeakPolarHBondContact O-CG2 3.36Å; G75-V79 PolarHBondContact O-N 2.97Å
76	R	92.9	Very high	90.3	Very high	44 Å²	44	64.4 Å²	64.4	17%	0.166	32%	0.32	C	S	.	.	H	α-helix	trans	-62	-32.1	175.7	-68	-168.7	-140.3	-169.6	1.5	112.9	M62 E64 C68 P70 C73 L78 V79 R80	M62-R76 HydrophobicContact CE-CG 4.43Å; E64-R76 VanDerWaalsContact OE1-CD 3.24Å; E64-R76 WeakPolarHBondContact OE1-CD 3.23Å; E64-R76 IonicContact OE1-CZ 2.82Å; E64-R76 IonicContact OE1-NE 3.71Å; E64-R76 PolarHBondContact OE1-NE 3.38Å; E64-R76 IonicContact OE1-NH1 3.54Å; E64-R76 PolarHBondContact OE1-NH1 3.34Å; E64-R76 IonicContact OE1-NH2 3.08Å; E64-R76 PolarHBondContact OE1-NH2 3.23Å; C68-R76 PolarHBondContact O-NH2 3.11Å; P70-R76 VanDerWaalsContact CB-NH1 3.29Å; P70-R76 VanDerWaalsContact CG-NH1 3.28Å; C73-R76 HydrophobicContact CB-CB 4.14Å; C73-R76 HydrophobicContact CB-CG 4.15Å; C73-R76 PolarHBondContact SG-N 3.39Å; R76-L78 VanDerWaalsContact C-N 3.35Å; R76-V79 PolarHBondContact O-N 3.12Å; R76-R80 WeakPolarHBondContact O-CG 3.49Å; R76-R80 PolarHBondContact O-N 3.05Å
77	K	93.6	Very high	90.9	Very high	56 Å²	56	62.4 Å²	62.4	24%	0.243	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-40.1	173	-175	170.4	166.1	-167.6	0	112	C73 T74 G75 R80 K81 K187 F188	C73-K77 PolarHBondContact O-N 2.88Å; C73-K77 VanDerWaalsContact O-N 3.12Å; T74-K77 WeakPolarHBondContact O-CB 3.47Å; T74-K77 PolarHBondContact O-N 2.94Å; G75-K77 VanDerWaalsContact C-N 3.25Å; G75-K77 PolarHBondContact O-N 3.43Å; K77-R80 PolarHBondContact O-N 3.45Å; K77-K81 PolarHBondContact O-N 3.27Å; K77-K81 VanDerWaalsContact O-N 3.11Å; K77-K187 WeakPolarHBondContact CE-O 3.39Å; K77-K187 PolarHBondContact NZ-O 3.19Å; K77-F188 HydrophobicContact CB-CE1 4.35Å; K77-F188 HydrophobicContact CB-CZ 4.24Å; K77-F188 HydrophobicContact CD-CD1 4.21Å; K77-F188 HydrophobicContact CD-CE1 3.59Å; K77-F188 HydrophobicContact CD-CZ 3.94Å; K77-F188 HydrophobicContact CG-CE1 4.32Å; K77-F188 HydrophobicContact CG-CZ 4.22Å
78	L	94.6	Very high	91.2	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-67	-37	174.4	-67.6	177.5	0	0	0	112.3	T74 G75 R76 K81 G82 F83 V84 V165 F168 L184 F188	T74-L78 WeakPolarHBondContact O-CG 3.3Å; T74-L78 PolarHBondContact O-N 3.4Å; G75-L78 WeakPolarHBondContact O-CB 3.16Å; G75-L78 PolarHBondContact O-N 3.28Å; R76-L78 VanDerWaalsContact C-N 3.35Å; L78-K81 CarbonylContact O-C 3.36Å; L78-K81 PolarHBondContact O-N 3.13Å; L78-G82 PolarHBondContact O-N 2.89Å; L78-F83 HydrophobicContact CB-CB 4.42Å; L78-F83 HydrophobicContact CD2-CB 4.41Å; L78-F83 HydrophobicContact CD2-CD2 4.26Å; L78-F83 PolarHBondContact O-N 3.25Å; L78-V84 HydrophobicContact CB-CB 4.03Å; L78-V84 HydrophobicContact CB-CG2 3.53Å; L78-V84 HydrophobicContact CD1-CG2 3.86Å; L78-V84 HydrophobicContact CG-CG2 4.33Å; L78-V84 PolarHBondContact O-N 3.4Å; L78-V165 HydrophobicContact CD1-CB 4.05Å; L78-V165 HydrophobicContact CD1-CG2 4.11Å; L78-F168 HydrophobicContact CD1-CD2 4.01Å; L78-F168 HydrophobicContact CD1-CE2 4.29Å; L78-L184 HydrophobicContact CD1-CD2 4.49Å; L78-L184 HydrophobicContact CD2-CD2 3.9Å; L78-F188 HydrophobicContact CD2-CE2 3.97Å; L78-F188 HydrophobicContact CD2-CZ 4.31Å; L78-F188 HydrophobicContact CG-CE2 4.46Å; L78-F188 HydrophobicContact CG-CZ 4.37Å
79	V	94.3	Very high	91.5	Very high	46 Å²	46	71 Å²	71	28%	0.279	33%	0.328	S	S	.	.	H	α-helix	trans	-61	-47.8	172.9	176.8	0	0	0	0	111	M62 G75 R76 K81 G82 V84	M62-V79 HydrophobicContact CE-CG2 3.99Å; G75-V79 WeakPolarHBondContact O-CG2 3.36Å; G75-V79 PolarHBondContact O-N 2.97Å; R76-V79 PolarHBondContact O-N 3.12Å; V79-K81 PolarHBondContact O-N 2.99Å; V79-G82 PolarHBondContact O-N 2.75Å; V79-V84 WeakPolarHBondContact CA-O 3.38Å; V79-V84 HydrophobicContact CG2-CB 4.07Å; V79-V84 HydrophobicContact CG2-CG1 4.02Å; V79-V84 WeakPolarHBondContact CG2-O 3.43Å
80	R	92.7	Very high	91.7	Very high	158 Å²	158	73.4 Å²	73.4	60%	0.596	34%	0.341	S	S	*	.	H	α-helix	trans	-60.8	-30.5	177	-74.6	-177.8	-71.8	119.7	-11.8	113.5	R76 K77 G82	R76-R80 WeakPolarHBondContact O-CG 3.49Å; R76-R80 PolarHBondContact O-N 3.05Å; K77-R80 PolarHBondContact O-N 3.45Å; R80-G82 VanDerWaalsContact C-N 3.31Å
81	K	91.3	Very high	92	Very high	86 Å²	86	73.3 Å²	73.3	37%	0.374	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	2.5	176.5	-76.6	-171.6	168.2	-74.6	0	113.7	K77 L78 V79 F83 K187	K77-K81 PolarHBondContact O-N 3.27Å; K77-K81 VanDerWaalsContact O-N 3.11Å; L78-K81 CarbonylContact O-C 3.36Å; L78-K81 PolarHBondContact O-N 3.13Å; V79-K81 PolarHBondContact O-N 2.99Å; K81-F83 VanDerWaalsContact C-N 3.3Å; K81-F83 HydrophobicContact CB-CD2 3.61Å; K81-F83 HydrophobicContact CB-CE2 3.85Å; K81-F83 HydrophobicContact CD-CE2 4.34Å; K81-F83 PolarHBondContact O-N 2.98Å; K81-K187 HydrophobicContact CD-CB 4Å; K81-K187 HydrophobicContact CD-CD 4.27Å; K81-K187 HydrophobicContact CD-CG 4.03Å
82	G	92.2	Very high	92.4	Very high	54 Å²	54	73.5 Å²	73.5	56%	0.557	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	4.8	177.3	0	0	0	0	0	115.4	L78 V79 R80	L78-G82 PolarHBondContact O-N 2.89Å; V79-G82 PolarHBondContact O-N 2.75Å; R80-G82 VanDerWaalsContact C-N 3.31Å
83	F	93.6	Very high	92.8	Very high	21 Å²	21	64.6 Å²	64.6	9%	0.092	30%	0.297	C	S	.	.	S	Bend	trans	-80.3	-35.1	-178.7	-70.9	-69.1	0	0	0	113.2	V54 L56 L60 L78 K81 L183 L184 K187	V54-F83 WeakPolarHBondContact O-CE1 3.4Å; L56-F83 HydrophobicContact CD1-CB 4.27Å; L56-F83 HydrophobicContact CD1-CD1 3.66Å; L56-F83 HydrophobicContact CD1-CG 4.41Å; L56-F83 HydrophobicContact CD2-CD1 4.45Å; L56-F83 HydrophobicContact CG-CD1 3.79Å; L56-F83 HydrophobicContact CG-CE1 4.25Å; L60-F83 WeakPolarHBondContact CB-O 3.41Å; L78-F83 HydrophobicContact CB-CB 4.42Å; L78-F83 HydrophobicContact CD2-CB 4.41Å; L78-F83 HydrophobicContact CD2-CD2 4.26Å; L78-F83 PolarHBondContact O-N 3.25Å; K81-F83 VanDerWaalsContact C-N 3.3Å; K81-F83 HydrophobicContact CB-CD2 3.61Å; K81-F83 HydrophobicContact CB-CE2 3.85Å; K81-F83 HydrophobicContact CD-CE2 4.34Å; K81-F83 PolarHBondContact O-N 2.98Å; F83-L183 HydrophobicContact CD1-CD2 4.44Å; F83-L183 HydrophobicContact CE1-CD2 3.52Å; F83-L183 HydrophobicContact CZ-CD2 3.77Å; F83-L184 HydrophobicContact CB-CD2 4.22Å; F83-L184 HydrophobicContact CD1-CD2 4.31Å; F83-L184 HydrophobicContact CG-CD2 4.15Å; F83-K187 HydrophobicContact CE2-CD 4.34Å; F83-K187 HydrophobicContact CE2-CG 4.07Å
84	V	95.9	Very high	92.9	Very high	7 Å²	7	67.5 Å²	67.5	4%	0.042	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	133	-172	175	0	0	0	0	110.3	L60 M62 L78 V79 F168	L60-V84 HydrophobicContact CB-CB 4.42Å; L60-V84 HydrophobicContact CB-CG2 3.77Å; L60-V84 HydrophobicContact CD1-CG2 4.12Å; M62-V84 HydrophobicContact CB-CG1 3.54Å; L78-V84 HydrophobicContact CB-CB 4.03Å; L78-V84 HydrophobicContact CB-CG2 3.53Å; L78-V84 HydrophobicContact CD1-CG2 3.86Å; L78-V84 HydrophobicContact CG-CG2 4.33Å; L78-V84 PolarHBondContact O-N 3.4Å; V79-V84 WeakPolarHBondContact CA-O 3.38Å; V79-V84 HydrophobicContact CG2-CB 4.07Å; V79-V84 HydrophobicContact CG2-CG1 4.02Å; V79-V84 WeakPolarHBondContact CG2-O 3.43Å; V84-F168 HydrophobicContact CG2-CE2 3.82Å; V84-F168 HydrophobicContact CG2-CZ 4.22Å
85	R	95	Very high	93	Very high	119 Å²	119	66.7 Å²	66.7	45%	0.449	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	130.1	173.3	-176.6	171.7	64.8	91.6	-2.1	111.1	L60 A61 M62 L87	L60-R85 PolarHBondContact O-N 3.13Å; A61-R85 CarbonylContact C-O 3.47Å; A61-R85 WeakPolarHBondContact CA-O 3.43Å; M62-R85 PolarHBondContact N-O 3.33Å; R85-L87 VanDerWaalsContact CZ-CD2 3.42Å
86	N	94.8	Very high	93.1	Very high	65 Å²	65	66.7 Å²	66.7	35%	0.348	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	133.9	173	-158.4	-22.8	0	0	0	111.1	M62 E64	M62-N86 CarbonylContact O-C 3.51Å; M62-N86 WeakPolarHBondContact O-CA 3.33Å; M62-N86 PolarHBondContact O-OD1 3.4Å; E64-N86 PolarHBondContact OE2-ND2 3.19Å
87	L	94.1	Very high	93.3	Very high	5 Å²	5	64.8 Å²	64.8	3%	0.026	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	140	178.4	-61.2	-179.2	0	0	0	110.3	A61 M62 W63 R85 Q91 F93	A61-L87 HydrophobicContact CB-CD1 3.66Å; A61-L87 HydrophobicContact CB-CD2 4.03Å; A61-L87 HydrophobicContact CB-CG 3.79Å; M62-L87 PolarHBondContact O-N 2.99Å; W63-L87 HydrophobicContact CD2-CB 4.25Å; W63-L87 HydrophobicContact CD2-CD1 3.81Å; W63-L87 HydrophobicContact CE3-CD1 4.12Å; W63-L87 HydrophobicContact CG-CB 4Å; W63-L87 HydrophobicContact CG-CD1 4.42Å; W63-L87 HydrophobicContact CH2-CD1 3.97Å; W63-L87 HydrophobicContact CZ2-CD1 3.62Å; W63-L87 HydrophobicContact CZ3-CD1 4.19Å; R85-L87 VanDerWaalsContact CZ-CD2 3.42Å; L87-Q91 HydrophobicContact CD2-CG 4.17Å; L87-F93 HydrophobicContact CD1-CB 4.08Å; L87-F93 HydrophobicContact CD1-CD2 4.31Å; L87-F93 HydrophobicContact CD1-CG 4.47Å
88	R	91.3	Very high	93.4	Very high	209 Å²	209	62.9 Å²	62.9	79%	0.789	30%	0.297	S	S	*	.			trans	-71.3	149.4	168.4	-58.5	179.9	-174.6	-179.4	-1.1	109.4	W63 N90 Q91	W63-R88 VanDerWaalsContact CD1-O 3.25Å; W63-R88 PolarHBondContact NE1-O 3.41Å; R88-N90 VanDerWaalsContact C-N 3.26Å; R88-N90 PolarHBondContact O-N 3.42Å; R88-Q91 HydrophobicContact CB-CB 4.2Å; R88-Q91 WeakPolarHBondContact O-CB 3.43Å; R88-Q91 PolarHBondContact O-N 3.1Å
89	L	87.4	Confident	93.3	Very high	66 Å²	66	63.6 Å²	63.6	35%	0.346	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.1	-40.9	-177.1	-85.7	170.6	0	0	0	115.3	L65 P133 K136 M137	L65-L89 HydrophobicContact CD2-CD2 3.37Å; L65-L89 HydrophobicContact CD2-CG 4.37Å; L89-P133 HydrophobicContact CD2-CG 4.39Å; L89-K136 CarbonylContact O-C 3.56Å; L89-M137 HydrophobicContact CD2-CG 4.4Å
90	N	88.6	Confident	92.9	Very high	127 Å²	127	64 Å²	64	68%	0.679	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	5.5	-179	-60.6	-30.6	0	0	0	113.4	R88	R88-N90 VanDerWaalsContact C-N 3.26Å; R88-N90 PolarHBondContact O-N 3.42Å
91	Q	92.3	Very high	92.6	Very high	67 Å²	67	62 Å²	62	31%	0.313	31%	0.305	S	S	.	.			trans	-79.8	127.5	178.4	-176	170.5	4.9	0	0	109.5	W63 L87 R88	W63-Q91 VanDerWaalsContact CZ2-O 3.31Å; W63-Q91 WeakPolarHBondContact CZ2-O 3.43Å; W63-Q91 PolarHBondContact NE1-O 3Å; W63-Q91 VanDerWaalsContact NE1-O 3.11Å; L87-Q91 HydrophobicContact CD2-CG 4.17Å; R88-Q91 HydrophobicContact CB-CB 4.2Å; R88-Q91 WeakPolarHBondContact O-CB 3.43Å; R88-Q91 PolarHBondContact O-N 3.1Å
92	R	92.6	Very high	92.4	Very high	191 Å²	191	58.3 Å²	58.3	72%	0.721	29%	0.291	S	S	*	.			trans	-77.9	148.8	177.3	-66.9	-176.7	175.6	173	-2.1	111.9	V138	R92-V138 WeakPolarHBondContact CA-O 3.35Å; R92-V138 HydrophobicContact CG-CB 4.4Å
93	F	94.9	Very high	92.2	Very high	9 Å²	9	61.4 Å²	61.4	4%	0.039	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	135.1	168.6	-171	-106.1	0	0	0	109.7	A61 W63 L87 G95 I97 S117 L119 A120 G139	A61-F93 HydrophobicContact CB-CD2 3.79Å; A61-F93 HydrophobicContact CB-CE2 3.64Å; A61-F93 HydrophobicContact CB-CZ 4.35Å; W63-F93 HydrophobicContact CH2-CB 3.63Å; W63-F93 HydrophobicContact CZ2-CB 4Å; L87-F93 HydrophobicContact CD1-CB 4.08Å; L87-F93 HydrophobicContact CD1-CD2 4.31Å; L87-F93 HydrophobicContact CD1-CG 4.47Å; F93-G95 VanDerWaalsContact CD1-N 3.33Å; F93-I97 HydrophobicContact CB-CD1 4.41Å; F93-I97 HydrophobicContact CD1-CG1 4.05Å; F93-S117 VanDerWaalsContact CZ-O 3.23Å; F93-S117 WeakPolarHBondContact CZ-O 3.44Å; F93-L119 WeakPolarHBondContact CZ-O 3.31Å; F93-A120 HydrophobicContact CB-CB 4.28Å; F93-A120 HydrophobicContact CD1-CB 3.41Å; F93-A120 VanDerWaalsContact CD1-CB 3.41Å; F93-A120 HydrophobicContact CD2-CB 4.27Å; F93-A120 HydrophobicContact CE1-CB 3.67Å; F93-A120 HydrophobicContact CG-CB 3.73Å; F93-A120 HydrophobicContact CZ-CB 4.22Å; F93-G139 VanDerWaalsContact O-CA 3.29Å; F93-G139 WeakPolarHBondContact O-CA 3.37Å
94	S	92.8	Very high	92.2	Very high	71 Å²	71	65.6 Å²	65.6	50%	0.497	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-22.7	-175.4	50.6	0	0	0	0	113.7	H141	S94-H141 PolarHBondContact O-ND1 3.48Å
95	G	94.7	Very high	92.2	Very high	0 Å²	0	68 Å²	68	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-159.6	-179.2	0	0	0	0	0	113.9	F93 G118	F93-G95 VanDerWaalsContact CD1-N 3.33Å; G95-G118 WeakPolarHBondContact CA-O 3.46Å
96	L	96.6	Very high	92.3	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	135.2	-180	-172.5	153.9	0	0	0	110.1	L98 V106 D110 I113 V114 G118 L119 A120 R143 T171	L96-L98 HydrophobicContact CD2-CD2 3.44Å; L96-L98 VanDerWaalsContact CD2-CD2 3.44Å; L96-L98 HydrophobicContact CD2-CG 4.12Å; L96-V106 HydrophobicContact CD2-CG2 4.24Å; L96-D110 HydrophobicContact CD1-CB 3.45Å; L96-D110 VanDerWaalsContact CD1-CB 3.45Å; L96-I113 HydrophobicContact CB-CG2 4.29Å; L96-V114 HydrophobicContact CD1-CG2 4.26Å; L96-G118 PolarHBondContact N-O 3.38Å; L96-L119 HydrophobicContact CB-CD2 3.78Å; L96-L119 HydrophobicContact CD2-CD2 3.9Å; L96-L119 HydrophobicContact CG-CD2 4.31Å; L96-L119 CarbonylContact O-C 3.51Å; L96-L119 WeakPolarHBondContact O-CA 3.24Å; L96-A120 PolarHBondContact O-N 3.03Å; L96-R143 HydrophobicContact CD1-CG 3.8Å; L96-R143 HydrophobicContact CD2-CB 4.05Å; L96-R143 HydrophobicContact CD2-CG 4.02Å; L96-R143 HydrophobicContact CG-CB 4.33Å; L96-R143 HydrophobicContact CG-CG 3.74Å; L96-T171 HydrophobicContact CD2-CG2 4.33Å
97	I	96.5	Very high	92.4	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.4	-175.8	-62.6	164.8	0	0	0	108.9	W63 F93 S99 A120 H141 P142 R143	W63-I97 HydrophobicContact CH2-CD1 3.73Å; W63-I97 HydrophobicContact CH2-CG1 3.98Å; W63-I97 HydrophobicContact CH2-CG2 4.32Å; W63-I97 HydrophobicContact CZ3-CD1 4.29Å; W63-I97 HydrophobicContact CZ3-CG1 4.12Å; W63-I97 HydrophobicContact CZ3-CG2 3.81Å; F93-I97 HydrophobicContact CB-CD1 4.41Å; F93-I97 HydrophobicContact CD1-CG1 4.05Å; I97-S99 PolarHBondContact O-N 3.5Å; I97-A120 WeakPolarHBondContact CA-O 3.35Å; I97-A120 HydrophobicContact CG1-CB 4.27Å; I97-H141 PolarHBondContact N-O 3.39Å; I97-P142 CarbonylContact O-C 3.42Å; I97-P142 WeakPolarHBondContact O-CA 3.44Å; I97-R143 PolarHBondContact O-N 3.04Å
98	L	95.9	Very high	92.5	Very high	15 Å²	15	61 Å²	61	8%	0.079	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	108.5	172.5	-55.3	179	0	0	0	108.1	L96 V106 A120 V121 L145 A167 T171	L96-L98 HydrophobicContact CD2-CD2 3.44Å; L96-L98 VanDerWaalsContact CD2-CD2 3.44Å; L96-L98 HydrophobicContact CD2-CG 4.12Å; L98-V106 HydrophobicContact CD2-CG2 3.66Å; L98-A120 PolarHBondContact N-O 3.22Å; L98-V121 HydrophobicContact CB-CG1 4.13Å; L98-V121 HydrophobicContact CD1-CG1 3.79Å; L98-V121 HydrophobicContact CG-CG1 4.32Å; L98-L145 HydrophobicContact CD1-CD1 4.28Å; L98-L145 HydrophobicContact CD2-CD2 4.35Å; L98-L145 HydrophobicContact CD2-CG 4.25Å; L98-A167 HydrophobicContact CD1-CB 3.91Å; L98-A167 VanDerWaalsContact CD1-O 3.3Å; L98-A167 WeakPolarHBondContact CD1-O 3.21Å; L98-T171 WeakPolarHBondContact CD1-OG1 3.21Å; L98-T171 WeakPolarHBondContact CD2-OG1 3.49Å
99	S	91.8	Very high	92.7	Very high	15 Å²	15	54.5 Å²	54.5	11%	0.105	29%	0.291	C	S	.	.			trans	-140.4	136.7	-175.3	176	0	0	0	0	110.1	I97 M101 G102 R143 L144	I97-S99 PolarHBondContact O-N 3.5Å; S99-M101 PolarHBondContact O-N 2.99Å; S99-M101 VanDerWaalsContact O-N 3.08Å; S99-M101 PolarHBondContact OG-N 3.28Å; S99-G102 PolarHBondContact O-N 3.12Å; S99-R143 PolarHBondContact N-O 2.96Å; S99-L144 VanDerWaalsContact O-CD2 3.3Å; S99-L144 WeakPolarHBondContact O-CD2 3.43Å
100	P	86.3	Confident	93.1	Very high	55 Å²	55	51.6 Å²	51.6	36%	0.357	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-12.9	174	29.4	-35.8	0	0	0	112.7	L129 F134	P100-L129 HydrophobicContact CG-CD2 4.44Å; P100-F134 HydrophobicContact CG-CD1 4.21Å; P100-F134 HydrophobicContact CG-CE1 3.44Å; P100-F134 VanDerWaalsContact CG-CE1 3.44Å; P100-F134 HydrophobicContact CG-CE2 4.11Å; P100-F134 HydrophobicContact CG-CZ 3.4Å
101	M	85.5	Confident	93.4	Very high	117 Å²	117	49.1 Å²	49.1	58%	0.576	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	4	174.6	-55	-69.8	85.4	0	0	113.1	S99 F134	S99-M101 PolarHBondContact O-N 2.99Å; S99-M101 VanDerWaalsContact O-N 3.08Å; S99-M101 PolarHBondContact OG-N 3.28Å; M101-F134 HydrophobicContact CG-CB 3.61Å; M101-F134 HydrophobicContact CG-CD1 4.18Å; M101-F134 HydrophobicContact CG-CD2 3.71Å; M101-F134 HydrophobicContact CG-CE2 4.44Å; M101-F134 HydrophobicContact CG-CG 3.57Å; M101-F134 HydrophobicContact SD-CD2 4.04Å; M101-F134 HydrophobicContact SD-CG 4.47Å
102	G	87.2	Confident	93.5	Very high	7 Å²	7	51.9 Å²	51.9	7%	0.072	27%	0.269	C	S	.	.			trans	-61.7	146.8	172.5	0	0	0	0	0	111	S99 L144	S99-G102 PolarHBondContact O-N 3.12Å; G102-L144 WeakPolarHBondContact O-CD1 3.14Å; G102-L144 VanDerWaalsContact O-CG 3.26Å; G102-L144 WeakPolarHBondContact O-CG 3.3Å
103	T	88.1	Confident	93.6	Very high	120 Å²	120	44.6 Å²	44.6	74%	0.736	24%	0.244	S	C	*	.	S	Bend	trans	-103.9	-14.7	175.3	51.9	0	0	0	0	113
104	K	94.4	Very high	93.7	Very high	108 Å²	108	44.1 Å²	44.1	47%	0.47	24%	0.243	S	C	.	.	S	Bend	trans	-117	143.7	-179.1	-64.7	-170.2	175.8	-164.7	0	110.7	R143 L144 E211	K104-R143 CarbonylContact O-C 3.57Å; K104-R143 WeakPolarHBondContact O-CA 3.45Å; K104-R143 WeakPolarHBondContact O-CD 3.44Å; K104-L144 PolarHBondContact O-N 3.32Å; K104-E211 VanDerWaalsContact CA-OE1 3.26Å; K104-E211 WeakPolarHBondContact CA-OE1 3.46Å
105	Y	96.4	Very high	93.8	Very high	59 Å²	59	41.1 Å²	41.1	23%	0.231	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-77.7	151.2	172.3	-70.8	-86.9	0	0	0	112.7	T107 R143 L144 P146 E211 L214 L215	Y105-T107 PolarHBondContact O-N 3.36Å; Y105-R143 WeakPolarHBondContact O-CD 3.46Å; Y105-L144 CarbonylContact C-O 3.51Å; Y105-L144 VanDerWaalsContact CA-O 3.32Å; Y105-L144 WeakPolarHBondContact CA-O 3.07Å; Y105-L144 HydrophobicContact CD1-CB 3.82Å; Y105-L144 HydrophobicContact CE1-CB 3.85Å; Y105-L144 HydrophobicContact CE1-CD1 4.39Å; Y105-L144 HydrophobicContact CG-CB 4.41Å; Y105-P146 HydrophobicContact CD1-CB 4.24Å; Y105-E211 HydrophobicContact CD2-CG 4.24Å; Y105-E211 VanDerWaalsContact CD2-OE1 3.32Å; Y105-E211 WeakPolarHBondContact CD2-OE1 3.49Å; Y105-E211 PolarHBondContact N-OE1 3.28Å; Y105-L214 HydrophobicContact CG-CD2 4.37Å; Y105-L215 HydrophobicContact CD2-CD2 4.04Å; Y105-L215 HydrophobicContact CD2-CG 4.44Å; Y105-L215 HydrophobicContact CE2-CD2 3.71Å; Y105-L215 HydrophobicContact CE2-CG 4.48Å
106	V	96.8	Very high	93.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.247	C	C	.	.			trans	-61.4	128.4	167.1	175.4	0	0	0	0	108.3	L96 L98 R143 L144 L145 T171 I174 V175 L214	L96-V106 HydrophobicContact CD2-CG2 4.24Å; L98-V106 HydrophobicContact CD2-CG2 3.66Å; V106-R143 HydrophobicContact CG2-CB 3.6Å; V106-R143 HydrophobicContact CG2-CG 4.21Å; V106-L144 PolarHBondContact N-O 3.19Å; V106-L145 HydrophobicContact CB-CD2 4.4Å; V106-L145 HydrophobicContact CG2-CD2 4.02Å; V106-T171 HydrophobicContact CG1-CG2 3.96Å; V106-T171 HydrophobicContact CG2-CG2 4.46Å; V106-I174 HydrophobicContact CG1-CB 4.19Å; V106-I174 HydrophobicContact CG1-CD1 4.4Å; V106-I174 HydrophobicContact CG1-CG2 3.9Å; V106-V175 HydrophobicContact CG1-CG1 4.28Å; V106-L214 WeakPolarHBondContact O-CD1 3.43Å
107	T	96.6	Very high	93.6	Very high	13 Å²	13	48.1 Å²	48.1	8%	0.08	26%	0.258	C	S	.	.			trans	-133.1	165.5	176.8	57.7	0	0	0	0	110.4	Y105 A109 D110 E211 L214	Y105-T107 PolarHBondContact O-N 3.36Å; T107-A109 PolarHBondContact O-N 3.04Å; T107-D110 PolarHBondContact N-OD2 3.02Å; T107-D110 WeakPolarHBondContact O-CB 3.19Å; T107-D110 PolarHBondContact O-N 3.06Å; T107-E211 HydrophobicContact CG2-CB 4.25Å; T107-L214 HydrophobicContact CG2-CD1 4.17Å
108	P	96.4	Very high	93.6	Very high	28 Å²	28	47.9 Å²	47.9	18%	0.182	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-57.6	-21.3	174.7	-29.5	39.9	0	0	0	114.4	D110 R111 I174 Y205 A206 C208	P108-D110 PolarHBondContact O-N 3.28Å; P108-R111 WeakPolarHBondContact O-CB 3.42Å; P108-R111 PolarHBondContact O-N 3.05Å; P108-I174 WeakPolarHBondContact CG-O 3.48Å; P108-Y205 WeakPolarHBondContact CG-O 3.26Å; P108-A206 WeakPolarHBondContact CG-O 3.26Å; P108-C208 WeakPolarHBondContact CD-O 3.31Å; P108-C208 WeakPolarHBondContact CG-O 3.23Å
109	A	94.9	Very high	93.6	Very high	73 Å²	73	47.2 Å²	47.2	60%	0.603	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-63.8	-21.1	174.1	0	0	0	0	0	113.6	T107 R111	T107-A109 PolarHBondContact O-N 3.04Å; A109-R111 PolarHBondContact O-N 3.35Å
110	D	95.7	Very high	93.9	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.027	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-77.7	-5	178.4	-69.8	-49.3	0	0	0	113.1	L96 T107 P108 E112 I113 V114 R143 V175	L96-D110 HydrophobicContact CD1-CB 3.45Å; L96-D110 VanDerWaalsContact CD1-CB 3.45Å; T107-D110 PolarHBondContact N-OD2 3.02Å; T107-D110 WeakPolarHBondContact O-CB 3.19Å; T107-D110 PolarHBondContact O-N 3.06Å; P108-D110 PolarHBondContact O-N 3.28Å; D110-E112 VanDerWaalsContact C-N 3.31Å; D110-E112 PolarHBondContact O-N 3.33Å; D110-I113 WeakPolarHBondContact O-CB 3.46Å; D110-I113 PolarHBondContact O-N 3.45Å; D110-V114 WeakPolarHBondContact O-CG2 3.43Å; D110-V114 PolarHBondContact O-N 2.84Å; D110-R143 IonicContact OD1-CZ 3.83Å; D110-R143 IonicContact OD1-NE 3.86Å; D110-R143 PolarHBondContact OD1-NE 2.8Å; D110-R143 IonicContact OD1-NH2 3.87Å; D110-R143 PolarHBondContact OD1-NH2 2.86Å; D110-R143 IonicContact OD2-NE 2.82Å; D110-R143 PolarHBondContact OD2-NE 3.06Å; D110-R143 VanDerWaalsContact OD2-NE 3.08Å; D110-V175 HydrophobicContact CB-CG1 4.3Å
111	R	95.1	Very high	94.3	Very high	74 Å²	74	44 Å²	44	28%	0.279	23%	0.233	S	C	.	.	H	α-helix	trans	-49.6	-44.4	-176.4	-173.9	-179.1	-179.6	112.2	-4.7	113.9	L28 P108 A109 V114 A115 V175 G176 F177	L28-R111 HydrophobicContact CD1-CG 4.26Å; P108-R111 WeakPolarHBondContact O-CB 3.42Å; P108-R111 PolarHBondContact O-N 3.05Å; A109-R111 PolarHBondContact O-N 3.35Å; R111-V114 PolarHBondContact O-N 2.68Å; R111-A115 PolarHBondContact O-N 2.76Å; R111-V175 HydrophobicContact CB-CB 4.14Å; R111-V175 WeakPolarHBondContact CD-O 3.41Å; R111-V175 WeakPolarHBondContact CG-O 3.32Å; R111-V175 PolarHBondContact NH1-O 3.04Å; R111-G176 PolarHBondContact NH1-O 3.35Å; R111-F177 HydrophobicContact CG-CE1 3.87Å; R111-F177 HydrophobicContact CG-CE2 3.83Å; R111-F177 HydrophobicContact CG-CZ 3.31Å; R111-F177 VanDerWaalsContact CZ-CE1 3.47Å
112	E	94.6	Very high	94.7	Very high	125 Å²	125	39.3 Å²	39.3	58%	0.584	21%	0.209	S	C	*	.	H	α-helix	trans	-67.5	-38.4	179.3	-68.4	-173.6	-178.1	0	0	112.7	D110 V114 A115 Q116	D110-E112 VanDerWaalsContact C-N 3.31Å; D110-E112 PolarHBondContact O-N 3.33Å; E112-V114 VanDerWaalsContact C-N 3.31Å; E112-V114 PolarHBondContact O-N 3.23Å; E112-A115 PolarHBondContact O-N 3.06Å; E112-Q116 WeakPolarHBondContact O-CB 3.17Å; E112-Q116 WeakPolarHBondContact O-CG 3.37Å; E112-Q116 PolarHBondContact O-N 3.11Å
113	I	94.9	Very high	94.9	Very high	38 Å²	38	39.2 Å²	39.2	20%	0.195	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-43.2	178.3	-57	174	0	0	0	109.2	L96 D110 S117 G118	L96-I113 HydrophobicContact CB-CG2 4.29Å; D110-I113 WeakPolarHBondContact O-CB 3.46Å; D110-I113 PolarHBondContact O-N 3.45Å; I113-S117 WeakPolarHBondContact O-CA 3.42Å; I113-S117 WeakPolarHBondContact O-CB 3.49Å; I113-S117 PolarHBondContact O-N 3.02Å; I113-G118 PolarHBondContact O-N 3.5Å
114	V	95.9	Very high	94.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-47.4	177	177.7	0	0	0	0	111.2	C58 L96 D110 R111 E112 Q116 G118 L119 F172 V175 F177	C58-V114 WeakPolarHBondContact CB-O 3.47Å; L96-V114 HydrophobicContact CD1-CG2 4.26Å; D110-V114 WeakPolarHBondContact O-CG2 3.43Å; D110-V114 PolarHBondContact O-N 2.84Å; R111-V114 PolarHBondContact O-N 2.68Å; E112-V114 VanDerWaalsContact C-N 3.31Å; E112-V114 PolarHBondContact O-N 3.23Å; V114-Q116 PolarHBondContact O-N 3.22Å; V114-G118 WeakPolarHBondContact O-CA 3.4Å; V114-G118 PolarHBondContact O-N 3.48Å; V114-L119 HydrophobicContact CB-CD2 4.25Å; V114-L119 HydrophobicContact CG1-CD1 4.25Å; V114-L119 HydrophobicContact CG1-CD2 3.98Å; V114-L119 HydrophobicContact CG1-CG 3.95Å; V114-L119 HydrophobicContact CG2-CD2 3.49Å; V114-L119 VanDerWaalsContact CG2-CD2 3.49Å; V114-L119 HydrophobicContact CG2-CG 4.38Å; V114-F172 HydrophobicContact CG1-CD1 4.19Å; V114-F172 HydrophobicContact CG1-CE1 3.76Å; V114-V175 HydrophobicContact CG1-CG2 4.47Å; V114-V175 HydrophobicContact CG2-CG1 4.19Å; V114-V175 HydrophobicContact CG2-CG2 4.43Å; V114-F177 HydrophobicContact CB-CE2 4.16Å; V114-F177 HydrophobicContact CG1-CD2 4.03Å; V114-F177 HydrophobicContact CG1-CE2 3.97Å
115	A	95.1	Very high	94.3	Very high	7 Å²	7	30.4 Å²	30.4	6%	0.058	16%	0.164	C	C	.	.	H	α-helix	trans	-63.3	-42	-179.7	0	0	0	0	0	112.6	L28 F31 R111 E112 F177	L28-A115 HydrophobicContact CD1-CB 3.98Å; F31-A115 HydrophobicContact CB-CB 4.28Å; F31-A115 HydrophobicContact CD1-CB 3.92Å; F31-A115 HydrophobicContact CD2-CB 3.89Å; F31-A115 HydrophobicContact CE1-CB 4.23Å; F31-A115 HydrophobicContact CE2-CB 4.21Å; F31-A115 HydrophobicContact CG-CB 3.74Å; F31-A115 HydrophobicContact CZ-CB 4.36Å; R111-A115 PolarHBondContact O-N 2.76Å; E112-A115 PolarHBondContact O-N 3.06Å; A115-F177 HydrophobicContact CB-CE2 4.39Å; A115-F177 HydrophobicContact CB-CZ 4.16Å
116	Q	93.5	Very high	93.6	Very high	113 Å²	113	33.2 Å²	33.2	53%	0.528	17%	0.174	S	C	.	.	H	α-helix	trans	-83.8	-40.1	-175.1	-67.2	177.7	12.3	0	0	113.6	E112 V114	E112-Q116 WeakPolarHBondContact O-CB 3.17Å; E112-Q116 WeakPolarHBondContact O-CG 3.37Å; E112-Q116 PolarHBondContact O-N 3.11Å; V114-Q116 PolarHBondContact O-N 3.22Å
117	S	94.2	Very high	92.9	Very high	34 Å²	34	37.8 Å²	37.8	24%	0.238	21%	0.212	C	C	.	.	H	α-helix	trans	-120.7	-10.2	-167.7	-63.5	0	0	0	0	114.1	F93 I113	F93-S117 VanDerWaalsContact CZ-O 3.23Å; F93-S117 WeakPolarHBondContact CZ-O 3.44Å; I113-S117 WeakPolarHBondContact O-CA 3.42Å; I113-S117 WeakPolarHBondContact O-CB 3.49Å; I113-S117 PolarHBondContact O-N 3.02Å
118	G	95.7	Very high	92.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.226	C	C	.	.			trans	77.6	-165.3	176.2	0	0	0	0	0	115	P59 G95 L96 I113 V114	P59-G118 VanDerWaalsContact O-CA 3.23Å; P59-G118 WeakPolarHBondContact O-CA 3.2Å; G95-G118 WeakPolarHBondContact CA-O 3.46Å; L96-G118 PolarHBondContact N-O 3.38Å; I113-G118 PolarHBondContact O-N 3.5Å; V114-G118 WeakPolarHBondContact O-CA 3.4Å; V114-G118 PolarHBondContact O-N 3.48Å
119	L	97.1	Very high	91.6	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	146.5	-173.8	-59.6	178	0	0	0	111.8	P59 L60 A61 F93 L96 V114 F168 T171 F172	P59-L119 PolarHBondContact O-N 2.94Å; P59-L119 VanDerWaalsContact O-N 3.1Å; L60-L119 CarbonylContact C-O 3.6Å; L60-L119 WeakPolarHBondContact CA-O 3.26Å; L60-L119 HydrophobicContact CD2-CB 3.73Å; L60-L119 HydrophobicContact CD2-CD1 4.25Å; L60-L119 HydrophobicContact CD2-CG 4.25Å; A61-L119 PolarHBondContact N-O 2.77Å; F93-L119 WeakPolarHBondContact CZ-O 3.31Å; L96-L119 HydrophobicContact CB-CD2 3.78Å; L96-L119 HydrophobicContact CD2-CD2 3.9Å; L96-L119 HydrophobicContact CG-CD2 4.31Å; L96-L119 CarbonylContact O-C 3.51Å; L96-L119 WeakPolarHBondContact O-CA 3.24Å; V114-L119 HydrophobicContact CB-CD2 4.25Å; V114-L119 HydrophobicContact CG1-CD1 4.25Å; V114-L119 HydrophobicContact CG1-CD2 3.98Å; V114-L119 HydrophobicContact CG1-CG 3.95Å; V114-L119 HydrophobicContact CG2-CD2 3.49Å; V114-L119 VanDerWaalsContact CG2-CD2 3.49Å; V114-L119 HydrophobicContact CG2-CG 4.38Å; L119-F168 HydrophobicContact CB-CD1 3.84Å; L119-F168 HydrophobicContact CB-CE1 3.71Å; L119-F168 HydrophobicContact CD1-CD1 4.03Å; L119-T171 HydrophobicContact CD1-CG2 3.75Å; L119-T171 HydrophobicContact CD2-CG2 3.68Å; L119-T171 HydrophobicContact CG-CG2 4.39Å; L119-F172 HydrophobicContact CD1-CD1 4.07Å; L119-F172 HydrophobicContact CD1-CD2 4.26Å; L119-F172 HydrophobicContact CD1-CE1 3.73Å; L119-F172 HydrophobicContact CD1-CE2 3.94Å; L119-F172 HydrophobicContact CD1-CG 4.33Å; L119-F172 HydrophobicContact CD1-CZ 3.69Å; L119-F172 HydrophobicContact CG-CE1 4.49Å; L119-F172 HydrophobicContact CG-CZ 4.49Å
120	A	97.1	Very high	91	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	145.3	168.3	0	0	0	0	0	112.9	A61 W63 F93 L96 I97 L98	A61-A120 HydrophobicContact CB-CB 4.13Å; A61-A120 WeakPolarHBondContact O-CA 3.29Å; W63-A120 HydrophobicContact CE3-CB 4.35Å; W63-A120 HydrophobicContact CH2-CB 4.18Å; W63-A120 HydrophobicContact CZ3-CB 3.62Å; F93-A120 HydrophobicContact CB-CB 4.28Å; F93-A120 HydrophobicContact CD1-CB 3.41Å; F93-A120 VanDerWaalsContact CD1-CB 3.41Å; F93-A120 HydrophobicContact CD2-CB 4.27Å; F93-A120 HydrophobicContact CE1-CB 3.67Å; F93-A120 HydrophobicContact CG-CB 3.73Å; F93-A120 HydrophobicContact CZ-CB 4.22Å; L96-A120 PolarHBondContact O-N 3.03Å; I97-A120 WeakPolarHBondContact CA-O 3.35Å; I97-A120 HydrophobicContact CG1-CB 4.27Å; L98-A120 PolarHBondContact N-O 3.22Å
121	V	95.8	Very high	90.4	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.024	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	162.7	174.3	-64.9	0	0	0	0	111.2	A61 M62 W63 L98 C164 A167 F168	A61-V121 PolarHBondContact O-N 3.3Å; M62-V121 VanDerWaalsContact CA-O 3.26Å; M62-V121 WeakPolarHBondContact CA-O 3.35Å; M62-V121 HydrophobicContact CB-CG2 3.91Å; M62-V121 HydrophobicContact CG-CG2 3.78Å; M62-V121 HydrophobicContact SD-CG2 4.25Å; W63-V121 PolarHBondContact N-O 3.03Å; L98-V121 HydrophobicContact CB-CG1 4.13Å; L98-V121 HydrophobicContact CD1-CG1 3.79Å; L98-V121 HydrophobicContact CG-CG1 4.32Å; V121-C164 HydrophobicContact CG2-CB 4.08Å; V121-A167 HydrophobicContact CG1-CB 4.31Å; V121-F168 HydrophobicContact CB-CE1 4.42Å; V121-F168 HydrophobicContact CB-CE2 4.27Å; V121-F168 HydrophobicContact CB-CZ 4Å; V121-F168 HydrophobicContact CG1-CD1 3.92Å; V121-F168 HydrophobicContact CG1-CD2 4.15Å; V121-F168 HydrophobicContact CG1-CE1 3.6Å; V121-F168 HydrophobicContact CG1-CE2 3.85Å; V121-F168 HydrophobicContact CG1-CG 4.18Å; V121-F168 HydrophobicContact CG1-CZ 3.57Å; V121-F168 HydrophobicContact CG2-CD2 4.38Å; V121-F168 HydrophobicContact CG2-CE1 4.28Å; V121-F168 HydrophobicContact CG2-CE2 3.44Å; V121-F168 VanDerWaalsContact CG2-CE2 3.44Å; V121-F168 HydrophobicContact CG2-CZ 3.4Å
122	I	93.7	Very high	89.9	Confident	17 Å²	17	50 Å²	50	9%	0.087	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	109.5	174.9	-58.4	174.9	0	0	0	108.1	W63 L65 C124 F134 M137	W63-I122 HydrophobicContact CE3-CG1 3.97Å; L65-I122 HydrophobicContact CD1-CG2 4.37Å; I122-C124 HydrophobicContact CG2-CB 4.39Å; I122-C124 PolarHBondContact O-N 2.88Å; I122-F134 HydrophobicContact CD1-CD1 3.82Å; I122-F134 HydrophobicContact CD1-CE1 4.12Å; I122-F134 HydrophobicContact CG2-CE1 4.23Å; I122-M137 HydrophobicContact CB-SD 4.17Å; I122-M137 HydrophobicContact CD1-CB 4.34Å; I122-M137 HydrophobicContact CD1-CE 4.09Å; I122-M137 HydrophobicContact CD1-SD 3.77Å; I122-M137 HydrophobicContact CG1-SD 3.7Å; I122-M137 HydrophobicContact CG2-CE 3.75Å; I122-M137 HydrophobicContact CG2-SD 3.49Å; I122-M137 WeakPolarHBondContact CG2-SD 3.49Å
123	D	90.3	Very high	89.5	Confident	5 Å²	5	46 Å²	46	3%	0.027	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	95.4	176.8	179.8	40.1	0	0	0	110.1	M62 W63 L65 C68 C73	M62-D123 HydrophobicContact CE-CB 3.95Å; M62-D123 HydrophobicContact CG-CB 3.76Å; M62-D123 HydrophobicContact SD-CB 3.5Å; M62-D123 WeakPolarHBondContact SD-CB 3.19Å; W63-D123 PolarHBondContact O-N 3.27Å; L65-D123 PolarHBondContact N-O 3.39Å; C68-D123 PolarHBondContact SG-OD1 3.49Å; C73-D123 PolarHBondContact SG-OD1 3.5Å; C73-D123 VanDerWaalsContact SG-OD1 3.37Å; C73-D123 PolarHBondContact SG-OD2 2.85Å
124	C	85.6	Confident	89.1	Confident	21 Å²	21	45.7 Å²	45.7	14%	0.142	24%	0.244	C	C	.	.			trans	-132.9	151.5	175.7	63.8	0	0	0	0	109.8	L65 I122 L129	L65-C124 HydrophobicContact CD1-CB 3.65Å; L65-C124 HydrophobicContact CG-CB 4.46Å; I122-C124 HydrophobicContact CG2-CB 4.39Å; I122-C124 PolarHBondContact O-N 2.88Å; C124-L129 VanDerWaalsContact SG-CD2 3.59Å
125	S	84.6	Confident	88.6	Confident	23 Å²	23	50.7 Å²	50.7	16%	0.161	28%	0.279	C	S	.	.			trans	-73.1	136.8	172.2	63.5	0	0	0	0	109.4	A127 K128	S125-A127 PolarHBondContact O-N 2.96Å; S125-K128 PolarHBondContact O-N 3.17Å; S125-K128 WeakPolarHBondContact OG-CB 3.33Å; S125-K128 WeakPolarHBondContact OG-CG 3.4Å
126	W	81.8	Confident	88.2	Confident	117 Å²	117	55.4 Å²	55.4	44%	0.443	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-52.3	-26.1	172.7	-72.1	104.6	0	0	0	113.9	K128 L129 C160 L162	W126-K128 VanDerWaalsContact C-N 3.32Å; W126-K128 PolarHBondContact O-N 2.88Å; W126-L129 HydrophobicContact CE3-CD1 3.62Å; W126-L129 HydrophobicContact CE3-CG 4.44Å; W126-L129 HydrophobicContact CZ3-CD1 3.91Å; W126-C160 WeakPolarHBondContact CH2-O 3.31Å; W126-C160 WeakPolarHBondContact CZ2-O 3.25Å; W126-L162 WeakPolarHBondContact CZ2-O 3.44Å; W126-L162 PolarHBondContact NE1-O 3.41Å
127	A	82.8	Confident	87.9	Confident	96 Å²	96	50.7 Å²	50.7	79%	0.793	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-76.1	-13	177.9	0	0	0	0	0	114.8	S125	S125-A127 PolarHBondContact O-N 2.96Å
128	K	82.8	Confident	87.4	Confident	88 Å²	88	52.2 Å²	52.2	38%	0.383	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-127.2	32.2	-173.9	-61.1	-171.7	176.4	-166.4	0	112.2	H67 S125 W126 T132	H67-K128 HydrophobicContact CB-CD 4.36Å; S125-K128 PolarHBondContact O-N 3.17Å; S125-K128 WeakPolarHBondContact OG-CB 3.33Å; S125-K128 WeakPolarHBondContact OG-CG 3.4Å; W126-K128 VanDerWaalsContact C-N 3.32Å; W126-K128 PolarHBondContact O-N 2.88Å; K128-T132 PolarHBondContact O-N 2.87Å; K128-T132 PolarHBondContact O-OG1 3.26Å
129	L	82.7	Confident	86.8	Confident	42 Å²	42	53.5 Å²	53.5	22%	0.22	30%	0.298	C	S	.	.	S	Bend	trans	-63.4	-44	177.2	-71.8	176.6	0	0	0	110.9	P100 C124 W126 E131 T132 F134	P100-L129 HydrophobicContact CG-CD2 4.44Å; C124-L129 VanDerWaalsContact SG-CD2 3.59Å; W126-L129 HydrophobicContact CE3-CD1 3.62Å; W126-L129 HydrophobicContact CE3-CG 4.44Å; W126-L129 HydrophobicContact CZ3-CD1 3.91Å; L129-E131 VanDerWaalsContact C-N 3.27Å; L129-E131 PolarHBondContact O-N 3.32Å; L129-T132 WeakPolarHBondContact O-CB 3.48Å; L129-T132 PolarHBondContact O-N 3.49Å; L129-F134 HydrophobicContact CD2-CZ 3.99Å; L129-F134 VanDerWaalsContact O-CE2 3.26Å; L129-F134 WeakPolarHBondContact O-CE2 3.28Å
130	D	82	Confident	86.3	Confident	169 Å²	169	57.3 Å²	57.3	90%	0.904	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-29.4	-176.4	-56.4	-36.1	0	0	0	113.2	T132	D130-T132 VanDerWaalsContact C-N 3.33Å
131	E	83.3	Confident	86.1	Confident	142 Å²	142	60.2 Å²	60.2	66%	0.664	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-10.6	177.7	-61.7	177.2	-179.8	0	0	112.8	L129	L129-E131 VanDerWaalsContact C-N 3.27Å; L129-E131 PolarHBondContact O-N 3.32Å
132	T	84.9	Confident	86.1	Confident	9 Å²	9	62.4 Å²	62.4	6%	0.055	35%	0.352	C	S	.	.	S	Bend	trans	-78.6	125.9	-171.6	-70.5	0	0	0	0	111.1	L65 K128 L129 D130 F134 M137	L65-T132 HydrophobicContact CD1-CG2 3.29Å; K128-T132 PolarHBondContact O-N 2.87Å; K128-T132 PolarHBondContact O-OG1 3.26Å; L129-T132 WeakPolarHBondContact O-CB 3.48Å; L129-T132 PolarHBondContact O-N 3.49Å; D130-T132 VanDerWaalsContact C-N 3.33Å; T132-F134 VanDerWaalsContact C-N 3.25Å; T132-F134 HydrophobicContact CG2-CD1 3.77Å; T132-F134 HydrophobicContact CG2-CD2 4.13Å; T132-F134 HydrophobicContact CG2-CE1 3.45Å; T132-F134 VanDerWaalsContact CG2-CE1 3.45Å; T132-F134 HydrophobicContact CG2-CE2 3.86Å; T132-F134 HydrophobicContact CG2-CG 4.08Å; T132-F134 HydrophobicContact CG2-CZ 3.49Å; T132-F134 VanDerWaalsContact CG2-CZ 3.49Å; T132-F134 VanDerWaalsContact O-CD2 3.31Å; T132-F134 WeakPolarHBondContact O-CD2 3.39Å; T132-F134 PolarHBondContact O-N 3.45Å; T132-M137 HydrophobicContact CG2-CE 3.64Å
133	P	86.1	Confident	86.2	Confident	40 Å²	40	63.1 Å²	63.1	26%	0.26	35%	0.354	S	S	.	.			trans	-79.7	68.2	-177.7	33.8	-37.4	0	0	0	112	L89 S135 K136	L89-P133 HydrophobicContact CD2-CG 4.39Å; P133-S135 PolarHBondContact O-N 2.96Å; P133-S135 VanDerWaalsContact O-N 3.11Å; P133-K136 HydrophobicContact CB-CD 4.02Å; P133-K136 HydrophobicContact CB-CG 4.23Å; P133-K136 HydrophobicContact CG-CD 4.38Å; P133-K136 PolarHBondContact O-N 3.33Å
134	F	85.8	Confident	86.4	Confident	32 Å²	32	64.9 Å²	64.9	14%	0.14	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-54.5	-30.9	179.4	-64.7	-67.9	0	0	0	113.3	P100 M101 I122 L129 T132 K136 M137	P100-F134 HydrophobicContact CG-CD1 4.21Å; P100-F134 HydrophobicContact CG-CE1 3.44Å; P100-F134 VanDerWaalsContact CG-CE1 3.44Å; P100-F134 HydrophobicContact CG-CE2 4.11Å; P100-F134 HydrophobicContact CG-CZ 3.4Å; M101-F134 HydrophobicContact CG-CB 3.61Å; M101-F134 HydrophobicContact CG-CD1 4.18Å; M101-F134 HydrophobicContact CG-CD2 3.71Å; M101-F134 HydrophobicContact CG-CE2 4.44Å; M101-F134 HydrophobicContact CG-CG 3.57Å; M101-F134 HydrophobicContact SD-CD2 4.04Å; M101-F134 HydrophobicContact SD-CG 4.47Å; I122-F134 HydrophobicContact CD1-CD1 3.82Å; I122-F134 HydrophobicContact CD1-CE1 4.12Å; I122-F134 HydrophobicContact CG2-CE1 4.23Å; L129-F134 HydrophobicContact CD2-CZ 3.99Å; L129-F134 VanDerWaalsContact O-CE2 3.26Å; L129-F134 WeakPolarHBondContact O-CE2 3.28Å; T132-F134 VanDerWaalsContact C-N 3.25Å; T132-F134 HydrophobicContact CG2-CD1 3.77Å; T132-F134 HydrophobicContact CG2-CD2 4.13Å; T132-F134 HydrophobicContact CG2-CE1 3.45Å; T132-F134 VanDerWaalsContact CG2-CE1 3.45Å; T132-F134 HydrophobicContact CG2-CE2 3.86Å; T132-F134 HydrophobicContact CG2-CG 4.08Å; T132-F134 HydrophobicContact CG2-CZ 3.49Å; T132-F134 VanDerWaalsContact CG2-CZ 3.49Å; T132-F134 VanDerWaalsContact O-CD2 3.31Å; T132-F134 WeakPolarHBondContact O-CD2 3.39Å; T132-F134 PolarHBondContact O-N 3.45Å; F134-K136 PolarHBondContact O-N 3.46Å; F134-M137 HydrophobicContact CD1-CE 3.96Å; F134-M137 PolarHBondContact O-N 2.92Å; F134-M137 VanDerWaalsContact O-N 3.14Å
135	S	85.5	Confident	86.9	Confident	105 Å²	105	65.7 Å²	65.7	73%	0.734	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-62	-21.6	177.6	58.3	0	0	0	0	114.5	P133 V138	P133-S135 PolarHBondContact O-N 2.96Å; P133-S135 VanDerWaalsContact O-N 3.11Å; S135-V138 WeakPolarHBondContact O-CG2 3.5Å
136	K	86.5	Confident	87.5	Confident	107 Å²	107	64.7 Å²	64.7	47%	0.465	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-83.7	-26.5	177.7	-64.7	-176.6	-177.8	173.7	0	112.5	L89 P133 F134 V138	L89-K136 CarbonylContact O-C 3.56Å; P133-K136 HydrophobicContact CB-CD 4.02Å; P133-K136 HydrophobicContact CB-CG 4.23Å; P133-K136 HydrophobicContact CG-CD 4.38Å; P133-K136 PolarHBondContact O-N 3.33Å; F134-K136 PolarHBondContact O-N 3.46Å; K136-V138 VanDerWaalsContact C-N 3.31Å; K136-V138 PolarHBondContact O-N 3.25Å
137	M	88.6	Confident	88.2	Confident	14 Å²	14	61.5 Å²	61.5	7%	0.069	35%	0.347	C	S	.	.	S	Bend	trans	-85.8	74.4	-178.8	-67.1	174.2	-85.5	0	0	109.9	W63 L65 L89 I122 T132 F134	W63-M137 HydrophobicContact CB-CG 4.06Å; W63-M137 HydrophobicContact CB-SD 3.5Å; W63-M137 VanDerWaalsContact CB-SD 3.5Å; W63-M137 HydrophobicContact CD2-CB 4.03Å; W63-M137 HydrophobicContact CD2-CG 3.8Å; W63-M137 HydrophobicContact CD2-SD 4.1Å; W63-M137 HydrophobicContact CE3-CB 4.36Å; W63-M137 HydrophobicContact CE3-CG 4.44Å; W63-M137 HydrophobicContact CE3-SD 4.45Å; W63-M137 HydrophobicContact CG-CB 4.38Å; W63-M137 HydrophobicContact CG-CG 3.61Å; W63-M137 HydrophobicContact CG-SD 3.72Å; W63-M137 HydrophobicContact CZ2-CB 4.37Å; L65-M137 HydrophobicContact CD1-CE 4.44Å; L65-M137 HydrophobicContact CD2-CE 4.42Å; L65-M137 HydrophobicContact CD2-SD 4.44Å; L89-M137 HydrophobicContact CD2-CG 4.4Å; I122-M137 HydrophobicContact CB-SD 4.17Å; I122-M137 HydrophobicContact CD1-CB 4.34Å; I122-M137 HydrophobicContact CD1-CE 4.09Å; I122-M137 HydrophobicContact CD1-SD 3.77Å; I122-M137 HydrophobicContact CG1-SD 3.7Å; I122-M137 HydrophobicContact CG2-CE 3.75Å; I122-M137 HydrophobicContact CG2-SD 3.49Å; I122-M137 WeakPolarHBondContact CG2-SD 3.49Å; T132-M137 HydrophobicContact CG2-CE 3.64Å; F134-M137 HydrophobicContact CD1-CE 3.96Å; F134-M137 PolarHBondContact O-N 2.92Å; F134-M137 VanDerWaalsContact O-N 3.14Å
138	V	82.2	Confident	88.9	Confident	66 Å²	66	57 Å²	57	40%	0.4	31%	0.309	S	S	.	.			trans	-88.4	134	-173.7	-178.2	0	0	0	0	111.2	R92 S135 K136	R92-V138 WeakPolarHBondContact CA-O 3.35Å; R92-V138 HydrophobicContact CG-CB 4.4Å; S135-V138 WeakPolarHBondContact O-CG2 3.5Å; K136-V138 VanDerWaalsContact C-N 3.31Å; K136-V138 PolarHBondContact O-N 3.25Å
139	G	84.4	Confident	89.5	Confident	27 Å²	27	53.8 Å²	53.8	28%	0.278	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	-170.5	162	0	0	0	0	0	113	F93	F93-G139 VanDerWaalsContact O-CA 3.29Å; F93-G139 WeakPolarHBondContact O-CA 3.37Å
140	S	85.4	Confident	90.2	Very high	79 Å²	79	51.8 Å²	51.8	55%	0.552	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	-33.1	-160.9	-64.7	0	0	0	0	114.1
141	H	93.5	Very high	90.9	Very high	61 Å²	61	44 Å²	44	28%	0.282	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	72.6	-168.6	-48.5	98.4	0	0	0	111.6	S94 I97	S94-H141 PolarHBondContact O-ND1 3.48Å; I97-H141 PolarHBondContact N-O 3.39Å
142	P	94.7	Very high	91.4	Very high	51 Å²	51	37.6 Å²	37.6	33%	0.331	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	136.9	172.9	30.4	-34.2	0	0	0	110.6	I97	I97-P142 CarbonylContact O-C 3.42Å; I97-P142 WeakPolarHBondContact O-CA 3.44Å
143	R	96.1	Very high	91.7	Very high	32 Å²	32	41.6 Å²	41.6	12%	0.121	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	150.2	178.7	-64.3	-67.1	-174.5	-89.6	-5.1	112.1	L96 I97 S99 K104 Y105 V106 D110	L96-R143 HydrophobicContact CD1-CG 3.8Å; L96-R143 HydrophobicContact CD2-CB 4.05Å; L96-R143 HydrophobicContact CD2-CG 4.02Å; L96-R143 HydrophobicContact CG-CB 4.33Å; L96-R143 HydrophobicContact CG-CG 3.74Å; I97-R143 PolarHBondContact O-N 3.04Å; S99-R143 PolarHBondContact N-O 2.96Å; K104-R143 CarbonylContact O-C 3.57Å; K104-R143 WeakPolarHBondContact O-CA 3.45Å; K104-R143 WeakPolarHBondContact O-CD 3.44Å; Y105-R143 WeakPolarHBondContact O-CD 3.46Å; V106-R143 HydrophobicContact CG2-CB 3.6Å; V106-R143 HydrophobicContact CG2-CG 4.21Å; D110-R143 IonicContact OD1-CZ 3.83Å; D110-R143 IonicContact OD1-NE 3.86Å; D110-R143 PolarHBondContact OD1-NE 2.8Å; D110-R143 IonicContact OD1-NH2 3.87Å; D110-R143 PolarHBondContact OD1-NH2 2.86Å; D110-R143 IonicContact OD2-NE 2.82Å; D110-R143 PolarHBondContact OD2-NE 3.06Å; D110-R143 VanDerWaalsContact OD2-NE 3.08Å
144	L	95.8	Very high	91.9	Very high	41 Å²	41	44.2 Å²	44.2	22%	0.215	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-95	147.4	167.1	-69.4	171.5	0	0	0	110.1	S99 G102 K104 Y105 V106	S99-L144 VanDerWaalsContact O-CD2 3.3Å; S99-L144 WeakPolarHBondContact O-CD2 3.43Å; G102-L144 WeakPolarHBondContact O-CD1 3.14Å; G102-L144 VanDerWaalsContact O-CG 3.26Å; G102-L144 WeakPolarHBondContact O-CG 3.3Å; K104-L144 PolarHBondContact O-N 3.32Å; Y105-L144 CarbonylContact C-O 3.51Å; Y105-L144 VanDerWaalsContact CA-O 3.32Å; Y105-L144 WeakPolarHBondContact CA-O 3.07Å; Y105-L144 HydrophobicContact CD1-CB 3.82Å; Y105-L144 HydrophobicContact CE1-CB 3.85Å; Y105-L144 HydrophobicContact CE1-CD1 4.39Å; Y105-L144 HydrophobicContact CG-CB 4.41Å; V106-L144 PolarHBondContact N-O 3.19Å
145	L	96.3	Very high	92.2	Very high	38 Å²	38	43.9 Å²	43.9	20%	0.199	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-84.4	141.6	166.1	-75.8	170.2	0	0	0	109.5	L98 V106 L162 A167 A170 I174	L98-L145 HydrophobicContact CD1-CD1 4.28Å; L98-L145 HydrophobicContact CD2-CD2 4.35Å; L98-L145 HydrophobicContact CD2-CG 4.25Å; V106-L145 HydrophobicContact CB-CD2 4.4Å; V106-L145 HydrophobicContact CG2-CD2 4.02Å; L145-L162 HydrophobicContact CD1-CD1 3.78Å; L145-A167 HydrophobicContact CD1-CB 3.66Å; L145-A170 HydrophobicContact CD1-CB 4.31Å; L145-A170 HydrophobicContact CD2-CB 3.98Å; L145-I174 HydrophobicContact CD2-CD1 4.25Å
146	P	95.9	Very high	92.7	Very high	3 Å²	3	43 Å²	43	2%	0.019	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-68.1	173.8	172.1	32.8	-37.1	0	0	0	111	Y105 L148 I174 Y205 L214	Y105-P146 HydrophobicContact CD1-CB 4.24Å; P146-L148 PolarHBondContact O-N 3.24Å; P146-L148 VanDerWaalsContact O-N 3.16Å; P146-I174 HydrophobicContact CG-CD1 3.67Å; P146-Y205 HydrophobicContact CB-CD2 4.4Å; P146-Y205 HydrophobicContact CB-CE1 4.31Å; P146-Y205 HydrophobicContact CB-CE2 3.79Å; P146-Y205 HydrophobicContact CG-CD2 3.75Å; P146-Y205 HydrophobicContact CG-CE2 3.55Å; P146-Y205 HydrophobicContact CG-CG 4.38Å; P146-L214 HydrophobicContact CB-CD1 4.5Å; P146-L214 HydrophobicContact CB-CD2 3.62Å; P146-L214 HydrophobicContact CB-CG 4.41Å; P146-L214 HydrophobicContact CG-CD1 4.35Å; P146-L214 HydrophobicContact CG-CD2 4.35Å
147	Y	96.6	Very high	93	Very high	50 Å²	50	39.9 Å²	39.9	20%	0.196	24%	0.236	C	C	.	.	S	Bend	trans	-53.2	120.3	176	179.3	-87.2	0	0	0	111.2	V149 P159 L201 Y205 E218 F221 L222	Y147-V149 HydrophobicContact CE1-CG2 4.02Å; Y147-P159 HydrophobicContact CD2-CB 4.1Å; Y147-P159 HydrophobicContact CE2-CB 3.3Å; Y147-P159 HydrophobicContact CE2-CG 4.39Å; Y147-L201 HydrophobicContact CD1-CD1 3.83Å; Y147-L201 HydrophobicContact CE1-CD1 4.16Å; Y147-Y205 PolarHBondContact O-OH 3.35Å; Y147-E218 VanDerWaalsContact CB-OE2 3.27Å; Y147-E218 WeakPolarHBondContact CB-OE2 3.33Å; Y147-E218 PolarHBondContact N-OE2 3.32Å; Y147-F221 HydrophobicContact CD1-CD1 4.49Å; Y147-F221 HydrophobicContact CE1-CD1 4.25Å; Y147-F221 HydrophobicContact CE1-CE1 4.07Å; Y147-L222 HydrophobicContact CD1-CD2 4.21Å; Y147-L222 HydrophobicContact CD2-CD2 4Å; Y147-L222 HydrophobicContact CE1-CD2 3.95Å; Y147-L222 HydrophobicContact CE2-CD2 3.67Å; Y147-L222 HydrophobicContact CG-CD2 4.25Å
148	L	97.3	Very high	93.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.252	C	S	.	.			trans	-146.6	152.5	174.2	-68.9	170.1	0	0	0	108.4	P146 C160 L162 A170 F194 N198 L201 L202 Y205	P146-L148 PolarHBondContact O-N 3.24Å; P146-L148 VanDerWaalsContact O-N 3.16Å; L148-C160 PolarHBondContact O-N 2.98Å; L148-L162 HydrophobicContact CB-CD1 4.16Å; L148-L162 HydrophobicContact CB-CD2 4.22Å; L148-L162 HydrophobicContact CD1-CD1 4.18Å; L148-A170 HydrophobicContact CD1-CB 3.45Å; L148-A170 VanDerWaalsContact CD1-CB 3.45Å; L148-F194 HydrophobicContact CD1-CZ 4.23Å; L148-N198 HydrophobicContact CD2-CB 3.84Å; L148-L201 HydrophobicContact CD2-CB 4.21Å; L148-L201 HydrophobicContact CD2-CD1 4.43Å; L148-L202 HydrophobicContact CD1-CD2 4.17Å; L148-L202 HydrophobicContact CD2-CD2 3.85Å; L148-L202 HydrophobicContact CD2-CG 4.22Å; L148-Y205 HydrophobicContact CD2-CD2 4.44Å; L148-Y205 HydrophobicContact CD2-CE2 4.05Å; L148-Y205 HydrophobicContact CG-CE2 4.49Å
149	V	96.9	Very high	93.8	Very high	22 Å²	22	43.6 Å²	43.6	13%	0.133	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-99.1	131.5	-179.4	-172.4	0	0	0	0	109.6	Y147 G157 L197 N198	Y147-V149 HydrophobicContact CE1-CG2 4.02Å; V149-G157 VanDerWaalsContact CG1-C 3.45Å; V149-G157 VanDerWaalsContact CG1-CA 3.48Å; V149-L197 HydrophobicContact CB-CD2 3.97Å; V149-L197 HydrophobicContact CB-CG 4.32Å; V149-L197 HydrophobicContact CG1-CD2 3.81Å; V149-L197 HydrophobicContact CG1-CG 4.49Å; V149-N198 PolarHBondContact N-OD1 3.48Å; V149-N198 PolarHBondContact O-ND2 3.49Å
150	A	96.6	Very high	94.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.26	C	S	.	.			trans	-70.4	137.1	177.9	0	0	0	0	0	112	N152 N155 Y156 G157 K158 K161 L162	A150-N152 WeakPolarHBondContact CB-ND2 3.34Å; A150-N155 HydrophobicContact CB-CB 4.2Å; A150-N155 WeakPolarHBondContact CB-O 3.46Å; A150-Y156 CarbonylContact O-C 3.48Å; A150-Y156 WeakPolarHBondContact O-CA 3.44Å; A150-G157 PolarHBondContact O-N 3.45Å; A150-K158 PolarHBondContact N-O 3.06Å; A150-K158 VanDerWaalsContact N-O 3.1Å; A150-K161 WeakPolarHBondContact CB-O 3.41Å; A150-L162 HydrophobicContact CB-CD2 4.21Å
151	A	96.3	Very high	94.6	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.033	25%	0.252	C	S	.	.			trans	-106	-4.3	169.8	0	0	0	0	0	112.5	E166 V193 F194 L197	A151-E166 WeakPolarHBondContact CA-OE1 3.46Å; A151-E166 PolarHBondContact N-OE1 3.12Å; A151-V193 HydrophobicContact CB-CB 4.29Å; A151-V193 HydrophobicContact CB-CG1 4.24Å; A151-F194 VanDerWaalsContact CB-CA 3.49Å; A151-F194 HydrophobicContact CB-CB 3.84Å; A151-F194 HydrophobicContact CB-CD2 4.29Å; A151-L197 HydrophobicContact CB-CD2 4.19Å
152	N	93.3	Very high	94.7	Very high	9 Å²	9	43.7 Å²	43.7	5%	0.048	24%	0.243	C	C	.	.	S	Bend	trans	-63.2	145.8	176.9	69.3	77.9	0	0	0	112.1	A150 V154 N155 Y156 K161 E166 W190	A150-N152 WeakPolarHBondContact CB-ND2 3.34Å; N152-V154 PolarHBondContact O-N 3.18Å; N152-V154 PolarHBondContact OD1-N 3.49Å; N152-N155 PolarHBondContact O-N 3.23Å; N152-N155 WeakPolarHBondContact OD1-CB 3.41Å; N152-N155 PolarHBondContact OD1-N 2.85Å; N152-Y156 WeakPolarHBondContact O-CA 3.5Å; N152-Y156 PolarHBondContact O-N 3.33Å; N152-K161 PolarHBondContact ND2-O 2.87Å; N152-E166 PolarHBondContact N-OE1 3.26Å; N152-E166 PolarHBondContact ND2-OE2 2.82Å; N152-W190 HydrophobicContact CB-CE3 4.38Å; N152-W190 HydrophobicContact CB-CH2 3.58Å; N152-W190 HydrophobicContact CB-CZ2 3.98Å; N152-W190 HydrophobicContact CB-CZ3 3.8Å
153	P	91.9	Very high	94.7	Very high	93 Å²	93	42.1 Å²	42.1	60%	0.604	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-19.7	-175.9	-27.2	34.1	0	0	0	115.6	W190	P153-W190 VanDerWaalsContact CD-CE2 3.44Å; P153-W190 VanDerWaalsContact CG-CD1 3.48Å; P153-W190 HydrophobicContact CG-CD2 4.37Å; P153-W190 HydrophobicContact CG-CG 3.96Å
154	V	90.2	Very high	94.7	Very high	95 Å²	95	41.3 Å²	41.3	58%	0.576	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-35.1	-176.2	-178.9	0	0	0	0	111.5	N152	N152-V154 PolarHBondContact O-N 3.18Å; N152-V154 PolarHBondContact OD1-N 3.49Å
155	N	92.3	Very high	94.8	Very high	24 Å²	24	39.4 Å²	39.4	13%	0.128	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.9	24.8	-173.8	-66.7	-57.4	0	0	0	112.5	A150 N152 G157 K158 K161	A150-N155 HydrophobicContact CB-CB 4.2Å; A150-N155 WeakPolarHBondContact CB-O 3.46Å; N152-N155 PolarHBondContact O-N 3.23Å; N152-N155 WeakPolarHBondContact OD1-CB 3.41Å; N152-N155 PolarHBondContact OD1-N 2.85Å; N155-G157 PolarHBondContact O-N 2.79Å; N155-K158 HydrophobicContact CB-CB 4.3Å; N155-K158 HydrophobicContact CB-CD 4.1Å; N155-K158 VanDerWaalsContact O-CB 3.25Å; N155-K158 WeakPolarHBondContact O-CB 3.42Å; N155-K158 WeakPolarHBondContact O-CG 3.48Å; N155-K158 PolarHBondContact O-N 3.14Å; N155-K161 HydrophobicContact CB-CB 3.95Å
156	Y	94.9	Very high	94.8	Very high	87 Å²	87	37.6 Å²	37.6	34%	0.341	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	131.6	-179.1	-174.1	-93.3	0	0	0	111.5	A150 N152 K158 V193	A150-Y156 CarbonylContact O-C 3.48Å; A150-Y156 WeakPolarHBondContact O-CA 3.44Å; N152-Y156 WeakPolarHBondContact O-CA 3.5Å; N152-Y156 PolarHBondContact O-N 3.33Å; Y156-K158 PolarHBondContact O-N 3.19Å; Y156-V193 HydrophobicContact CE2-CG1 4.34Å
157	G	93.6	Very high	94.9	Very high	42 Å²	42	38 Å²	38	43%	0.433	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	-5.1	-179.5	0	0	0	0	0	114.9	V149 A150 N155	V149-G157 VanDerWaalsContact CG1-C 3.45Å; V149-G157 VanDerWaalsContact CG1-CA 3.48Å; A150-G157 PolarHBondContact O-N 3.45Å; N155-G157 PolarHBondContact O-N 2.79Å
158	K	94.1	Very high	95	Very high	94 Å²	94	35.6 Å²	35.6	41%	0.409	21%	0.207	S	C	.	.			trans	-84.5	130.2	-180	-60.9	-178.5	-172.6	163.9	0	110.6	A150 N155 Y156 K161	A150-K158 PolarHBondContact N-O 3.06Å; A150-K158 VanDerWaalsContact N-O 3.1Å; N155-K158 HydrophobicContact CB-CB 4.3Å; N155-K158 HydrophobicContact CB-CD 4.1Å; N155-K158 VanDerWaalsContact O-CB 3.25Å; N155-K158 WeakPolarHBondContact O-CB 3.42Å; N155-K158 WeakPolarHBondContact O-CG 3.48Å; N155-K158 PolarHBondContact O-N 3.14Å; Y156-K158 PolarHBondContact O-N 3.19Å; K158-K161 HydrophobicContact CB-CB 4.14Å; K158-K161 HydrophobicContact CB-CD 4.2Å; K158-K161 HydrophobicContact CB-CG 4.35Å; K158-K161 HydrophobicContact CD-CD 4.05Å
159	P	94.2	Very high	95	Very high	64 Å²	64	35.6 Å²	35.6	42%	0.416	21%	0.207	S	C	.	.	B	Isolated β-bridge	trans	-69.5	143	178.1	29.6	-35.4	0	0	0	111.1	Y147 K161	Y147-P159 HydrophobicContact CD2-CB 4.1Å; Y147-P159 HydrophobicContact CE2-CB 3.3Å; Y147-P159 HydrophobicContact CE2-CG 4.39Å; P159-K161 PolarHBondContact O-N 3.48Å
160	C	93.3	Very high	95	Very high	63 Å²	63	34.5 Å²	34.5	43%	0.426	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	9	174.2	-52.7	0	0	0	0	115.7	W126 L148 L162	W126-C160 WeakPolarHBondContact CH2-O 3.31Å; W126-C160 WeakPolarHBondContact CZ2-O 3.25Å; L148-C160 PolarHBondContact O-N 2.98Å; C160-L162 VanDerWaalsContact C-N 3.33Å; C160-L162 PolarHBondContact O-N 3.14Å
161	K	93.7	Very high	95.1	Very high	89 Å²	89	34.5 Å²	34.5	39%	0.387	20%	0.2	S	C	.	.			trans	-99.4	49.4	178.4	-66.3	-164.5	-178.9	-175.2	0	112.1	A150 N152 N155 K158 P159	A150-K161 WeakPolarHBondContact CB-O 3.41Å; N152-K161 PolarHBondContact ND2-O 2.87Å; N155-K161 HydrophobicContact CB-CB 3.95Å; K158-K161 HydrophobicContact CB-CB 4.14Å; K158-K161 HydrophobicContact CB-CD 4.2Å; K158-K161 HydrophobicContact CB-CG 4.35Å; K158-K161 HydrophobicContact CD-CD 4.05Å; P159-K161 PolarHBondContact O-N 3.48Å
162	L	95.1	Very high	95.2	Very high	17 Å²	17	34.3 Å²	34.3	9%	0.089	20%	0.199	C	C	.	.			trans	-68.4	148.4	-178.5	-54.7	-175.9	0	0	0	111.4	W126 L145 L148 A150 C160 E166 F194	W126-L162 WeakPolarHBondContact CZ2-O 3.44Å; W126-L162 PolarHBondContact NE1-O 3.41Å; L145-L162 HydrophobicContact CD1-CD1 3.78Å; L148-L162 HydrophobicContact CB-CD1 4.16Å; L148-L162 HydrophobicContact CB-CD2 4.22Å; L148-L162 HydrophobicContact CD1-CD1 4.18Å; A150-L162 HydrophobicContact CB-CD2 4.21Å; C160-L162 VanDerWaalsContact C-N 3.33Å; C160-L162 PolarHBondContact O-N 3.14Å; L162-E166 HydrophobicContact CB-CB 4.08Å; L162-E166 HydrophobicContact CD2-CB 4.37Å; L162-F194 HydrophobicContact CD2-CE2 3.69Å; L162-F194 HydrophobicContact CD2-CZ 4.32Å
163	S	95.3	Very high	95.4	Very high	17 Å²	17	34.3 Å²	34.3	12%	0.119	20%	0.2	C	C	.	.			trans	-81	166.2	166.8	66.6	0	0	0	0	110.8	V165 E166 A167	S163-V165 PolarHBondContact O-N 2.84Å; S163-V165 WeakPolarHBondContact OG-CG1 3.4Å; S163-E166 VanDerWaalsContact CB-OE2 3.24Å; S163-E166 WeakPolarHBondContact CB-OE2 3.09Å; S163-E166 PolarHBondContact N-OE2 2.89Å; S163-E166 PolarHBondContact O-N 2.89Å; S163-E166 WeakPolarHBondContact OG-CG 3.37Å; S163-E166 PolarHBondContact OG-N 3.36Å; S163-E166 PolarHBondContact OG-OE2 3.45Å; S163-A167 WeakPolarHBondContact O-CB 3.34Å; S163-A167 PolarHBondContact O-N 3.26Å
164	C	95.3	Very high	95.7	Very high	16 Å²	16	29.9 Å²	29.9	11%	0.108	17%	0.171	C	C	.	.	H	α-helix	trans	-58.2	-33.5	179.7	-70.9	0	0	0	0	113.1	T74 V121 F168	T74-C164 PolarHBondContact OG1-N 2.89Å; V121-C164 HydrophobicContact CG2-CB 4.08Å; C164-F168 WeakPolarHBondContact O-CD2 3.44Å; C164-F168 PolarHBondContact O-N 3.09Å
165	V	97	Very high	96	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-75.4	-41	179.7	63.1	0	0	0	0	111.2	T74 L78 S163 A167 F168 A169 L184 L185 F188 W190	T74-V165 HydrophobicContact CG2-CG1 3.9Å; T74-V165 PolarHBondContact OG1-N 3.37Å; L78-V165 HydrophobicContact CD1-CB 4.05Å; L78-V165 HydrophobicContact CD1-CG2 4.11Å; S163-V165 PolarHBondContact O-N 2.84Å; S163-V165 WeakPolarHBondContact OG-CG1 3.4Å; V165-A167 VanDerWaalsContact C-N 3.28Å; V165-A167 PolarHBondContact O-N 3.33Å; V165-F168 PolarHBondContact O-N 2.79Å; V165-A169 WeakPolarHBondContact O-CB 3.37Å; V165-A169 PolarHBondContact O-N 3.34Å; V165-L184 HydrophobicContact CG2-CB 4.16Å; V165-L185 HydrophobicContact CG2-CD2 4.1Å; V165-F188 HydrophobicContact CB-CE2 3.99Å; V165-F188 HydrophobicContact CB-CZ 4.14Å; V165-F188 HydrophobicContact CG1-CD2 4.31Å; V165-F188 HydrophobicContact CG1-CE1 4.36Å; V165-F188 HydrophobicContact CG1-CE2 4.05Å; V165-F188 HydrophobicContact CG1-CZ 4.07Å; V165-F188 HydrophobicContact CG2-CD2 4.04Å; V165-F188 HydrophobicContact CG2-CE2 3.6Å; V165-F188 HydrophobicContact CG2-CZ 4.26Å; V165-W190 HydrophobicContact CG1-CH2 3.8Å; V165-W190 HydrophobicContact CG1-CZ2 4.49Å
166	E	97.6	Very high	96.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.4	-37.7	174.8	-69.9	165.4	132.6	0	0	110.6	A151 N152 L162 S163 A169 A170 W190 F194	A151-E166 WeakPolarHBondContact CA-OE1 3.46Å; A151-E166 PolarHBondContact N-OE1 3.12Å; N152-E166 PolarHBondContact N-OE1 3.26Å; N152-E166 PolarHBondContact ND2-OE2 2.82Å; L162-E166 HydrophobicContact CB-CB 4.08Å; L162-E166 HydrophobicContact CD2-CB 4.37Å; S163-E166 VanDerWaalsContact CB-OE2 3.24Å; S163-E166 WeakPolarHBondContact CB-OE2 3.09Å; S163-E166 PolarHBondContact N-OE2 2.89Å; S163-E166 PolarHBondContact O-N 2.89Å; S163-E166 WeakPolarHBondContact OG-CG 3.37Å; S163-E166 PolarHBondContact OG-N 3.36Å; S163-E166 PolarHBondContact OG-OE2 3.45Å; E166-A169 PolarHBondContact O-N 3.04Å; E166-A170 WeakPolarHBondContact O-CB 3.45Å; E166-A170 PolarHBondContact O-N 2.88Å; E166-W190 HydrophobicContact CG-CH2 4.3Å; E166-W190 HydrophobicContact CG-CZ3 3.97Å; E166-F194 HydrophobicContact CB-CD1 4.49Å; E166-F194 HydrophobicContact CB-CD2 4.01Å; E166-F194 HydrophobicContact CB-CE1 4.34Å; E166-F194 HydrophobicContact CB-CE2 3.87Å; E166-F194 HydrophobicContact CB-CG 4.32Å; E166-F194 HydrophobicContact CB-CZ 4.03Å; E166-F194 HydrophobicContact CG-CB 4.33Å; E166-F194 HydrophobicContact CG-CD1 4.38Å; E166-F194 HydrophobicContact CG-CD2 3.63Å; E166-F194 HydrophobicContact CG-CE2 4.03Å; E166-F194 HydrophobicContact CG-CG 3.83Å
167	A	97.4	Very high	96.2	Very high	11 Å²	11	21.8 Å²	21.8	9%	0.091	14%	0.138	C	C	.	.	H	α-helix	trans	-62.9	-43.7	176.2	0	0	0	0	0	112.7	L98 V121 L145 S163 V165 T171	L98-A167 HydrophobicContact CD1-CB 3.91Å; L98-A167 VanDerWaalsContact CD1-O 3.3Å; L98-A167 WeakPolarHBondContact CD1-O 3.21Å; V121-A167 HydrophobicContact CG1-CB 4.31Å; L145-A167 HydrophobicContact CD1-CB 3.66Å; S163-A167 WeakPolarHBondContact O-CB 3.34Å; S163-A167 PolarHBondContact O-N 3.26Å; V165-A167 VanDerWaalsContact C-N 3.28Å; V165-A167 PolarHBondContact O-N 3.33Å; A167-T171 PolarHBondContact O-N 3.35Å; A167-T171 VanDerWaalsContact O-N 3.15Å; A167-T171 PolarHBondContact O-OG1 3.09Å
168	F	97.8	Very high	96.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.4	-49.3	172.4	-75.9	-57	0	0	0	111.6	L60 A61 L78 V84 L119 V121 C164 V165 A170 T171 F172 L184	L60-F168 HydrophobicContact CB-CE1 4.29Å; L60-F168 HydrophobicContact CB-CZ 4.23Å; L60-F168 HydrophobicContact CD1-CD1 4.48Å; L60-F168 HydrophobicContact CD2-CD1 3.9Å; L60-F168 HydrophobicContact CD2-CE1 3.85Å; A61-F168 WeakPolarHBondContact O-CZ 3.4Å; L78-F168 HydrophobicContact CD1-CD2 4.01Å; L78-F168 HydrophobicContact CD1-CE2 4.29Å; V84-F168 HydrophobicContact CG2-CE2 3.82Å; V84-F168 HydrophobicContact CG2-CZ 4.22Å; L119-F168 HydrophobicContact CB-CD1 3.84Å; L119-F168 HydrophobicContact CB-CE1 3.71Å; L119-F168 HydrophobicContact CD1-CD1 4.03Å; V121-F168 HydrophobicContact CB-CE1 4.42Å; V121-F168 HydrophobicContact CB-CE2 4.27Å; V121-F168 HydrophobicContact CB-CZ 4Å; V121-F168 HydrophobicContact CG1-CD1 3.92Å; V121-F168 HydrophobicContact CG1-CD2 4.15Å; V121-F168 HydrophobicContact CG1-CE1 3.6Å; V121-F168 HydrophobicContact CG1-CE2 3.85Å; V121-F168 HydrophobicContact CG1-CG 4.18Å; V121-F168 HydrophobicContact CG1-CZ 3.57Å; V121-F168 HydrophobicContact CG2-CD2 4.38Å; V121-F168 HydrophobicContact CG2-CE1 4.28Å; V121-F168 HydrophobicContact CG2-CE2 3.44Å; V121-F168 VanDerWaalsContact CG2-CE2 3.44Å; V121-F168 HydrophobicContact CG2-CZ 3.4Å; C164-F168 WeakPolarHBondContact O-CD2 3.44Å; C164-F168 PolarHBondContact O-N 3.09Å; V165-F168 PolarHBondContact O-N 2.79Å; F168-A170 PolarHBondContact O-N 2.88Å; F168-T171 WeakPolarHBondContact O-CB 3.34Å; F168-T171 PolarHBondContact O-N 3.18Å; F168-F172 WeakPolarHBondContact O-CD2 3.14Å; F168-F172 PolarHBondContact O-N 3.29Å; F168-L184 HydrophobicContact CB-CD1 3.74Å; F168-L184 HydrophobicContact CG-CD1 4.48Å
169	A	97.9	Very high	96.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.8	-43.6	-178.4	0	0	0	0	0	112.5	V165 E166 T171 F172 A173 A181 L185 F194	V165-A169 WeakPolarHBondContact O-CB 3.37Å; V165-A169 PolarHBondContact O-N 3.34Å; E166-A169 PolarHBondContact O-N 3.04Å; A169-T171 VanDerWaalsContact C-N 3.34Å; A169-T171 PolarHBondContact O-N 3.14Å; A169-F172 PolarHBondContact O-N 3.27Å; A169-A173 WeakPolarHBondContact O-CB 3.24Å; A169-A173 PolarHBondContact O-N 3.43Å; A169-A181 HydrophobicContact CB-CB 3.86Å; A169-A181 WeakPolarHBondContact O-CB 3.32Å; A169-L185 HydrophobicContact CB-CD1 3.61Å; A169-L185 HydrophobicContact CB-CD2 4.01Å; A169-L185 HydrophobicContact CB-CG 3.72Å; A169-F194 HydrophobicContact CB-CD1 4.41Å; A169-F194 HydrophobicContact CB-CE1 4.37Å
170	A	98	Very high	96.3	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-56.8	-48.3	174.4	0	0	0	0	0	111.2	L145 L148 E166 F168 F172 A173 I174 F194	L145-A170 HydrophobicContact CD1-CB 4.31Å; L145-A170 HydrophobicContact CD2-CB 3.98Å; L148-A170 HydrophobicContact CD1-CB 3.45Å; L148-A170 VanDerWaalsContact CD1-CB 3.45Å; E166-A170 WeakPolarHBondContact O-CB 3.45Å; E166-A170 PolarHBondContact O-N 2.88Å; F168-A170 PolarHBondContact O-N 2.88Å; A170-F172 VanDerWaalsContact C-N 3.35Å; A170-F172 PolarHBondContact O-N 3.31Å; A170-A173 PolarHBondContact O-N 3.43Å; A170-I174 WeakPolarHBondContact O-CB 3.16Å; A170-I174 WeakPolarHBondContact O-CD1 3.2Å; A170-I174 WeakPolarHBondContact O-CG1 3.47Å; A170-I174 PolarHBondContact O-N 3.02Å; A170-F194 HydrophobicContact CB-CE1 4.12Å; A170-F194 HydrophobicContact CB-CZ 3.99Å
171	T	97.9	Very high	96.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.2	-47.1	178.2	-57	0	0	0	0	111	L96 L98 V106 L119 A167 F168 A169 A173 I174 V175	L96-T171 HydrophobicContact CD2-CG2 4.33Å; L98-T171 WeakPolarHBondContact CD1-OG1 3.21Å; L98-T171 WeakPolarHBondContact CD2-OG1 3.49Å; V106-T171 HydrophobicContact CG1-CG2 3.96Å; V106-T171 HydrophobicContact CG2-CG2 4.46Å; L119-T171 HydrophobicContact CD1-CG2 3.75Å; L119-T171 HydrophobicContact CD2-CG2 3.68Å; L119-T171 HydrophobicContact CG-CG2 4.39Å; A167-T171 PolarHBondContact O-N 3.35Å; A167-T171 VanDerWaalsContact O-N 3.15Å; A167-T171 PolarHBondContact O-OG1 3.09Å; F168-T171 WeakPolarHBondContact O-CB 3.34Å; F168-T171 PolarHBondContact O-N 3.18Å; A169-T171 VanDerWaalsContact C-N 3.34Å; A169-T171 PolarHBondContact O-N 3.14Å; T171-A173 PolarHBondContact O-N 2.91Å; T171-I174 PolarHBondContact O-N 3.12Å; T171-V175 WeakPolarHBondContact O-CG2 3.46Å; T171-V175 PolarHBondContact O-N 2.9Å
172	F	98	Very high	96.5	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-60.9	-43.6	178	-78.5	-49.6	0	0	0	112.7	L60 V114 L119 F168 A169 A170 V175 G176 F177 L180 A181 L184	L60-F172 HydrophobicContact CD1-CE2 4.33Å; L60-F172 HydrophobicContact CD2-CE2 4.02Å; L60-F172 HydrophobicContact CD2-CZ 3.74Å; V114-F172 HydrophobicContact CG1-CD1 4.19Å; V114-F172 HydrophobicContact CG1-CE1 3.76Å; L119-F172 HydrophobicContact CD1-CD1 4.07Å; L119-F172 HydrophobicContact CD1-CD2 4.26Å; L119-F172 HydrophobicContact CD1-CE1 3.73Å; L119-F172 HydrophobicContact CD1-CE2 3.94Å; L119-F172 HydrophobicContact CD1-CG 4.33Å; L119-F172 HydrophobicContact CD1-CZ 3.69Å; L119-F172 HydrophobicContact CG-CE1 4.49Å; L119-F172 HydrophobicContact CG-CZ 4.49Å; F168-F172 WeakPolarHBondContact O-CD2 3.14Å; F168-F172 PolarHBondContact O-N 3.29Å; A169-F172 PolarHBondContact O-N 3.27Å; A170-F172 VanDerWaalsContact C-N 3.35Å; A170-F172 PolarHBondContact O-N 3.31Å; F172-V175 PolarHBondContact O-N 3.09Å; F172-G176 PolarHBondContact O-N 3.47Å; F172-F177 HydrophobicContact CB-CB 4.42Å; F172-F177 HydrophobicContact CD1-CB 4.01Å; F172-F177 HydrophobicContact CD1-CD2 4.16Å; F172-F177 CarbonylContact O-C 3.59Å; F172-F177 WeakPolarHBondContact O-CA 3.4Å; F172-F177 PolarHBondContact O-N 3.36Å; F172-L180 HydrophobicContact CB-CB 4.38Å; F172-L180 HydrophobicContact CD1-CB 3.99Å; F172-L180 HydrophobicContact CD1-CD1 3.82Å; F172-L180 HydrophobicContact CD2-CB 3.91Å; F172-L180 HydrophobicContact CE1-CB 4.17Å; F172-L180 HydrophobicContact CE1-CD1 3.48Å; F172-L180 VanDerWaalsContact CE1-CD1 3.48Å; F172-L180 HydrophobicContact CE1-CG 4.47Å; F172-L180 HydrophobicContact CE2-CB 4.08Å; F172-L180 HydrophobicContact CG-CB 3.85Å; F172-L180 HydrophobicContact CZ-CB 4.18Å; F172-L180 HydrophobicContact CZ-CD1 3.91Å; F172-A181 HydrophobicContact CB-CB 3.97Å; F172-L184 HydrophobicContact CD2-CD1 4.02Å; F172-L184 HydrophobicContact CE2-CD1 3.75Å
173	A	97.6	Very high	96.5	Very high	9 Å²	9	13.1 Å²	13.1	7%	0.074	8%	0.079	C	C	.	.	H	α-helix	trans	-61.6	-48.1	175.2	0	0	0	0	0	111.4	A169 A170 T171 V175 G176 L202	A169-A173 WeakPolarHBondContact O-CB 3.24Å; A169-A173 PolarHBondContact O-N 3.43Å; A170-A173 PolarHBondContact O-N 3.43Å; T171-A173 PolarHBondContact O-N 2.91Å; A173-V175 PolarHBondContact O-N 3.48Å; A173-G176 PolarHBondContact O-N 3.35Å; A173-L202 HydrophobicContact CB-CB 4.49Å; A173-L202 HydrophobicContact CB-CD1 4.19Å; A173-L202 HydrophobicContact CB-CD2 3.98Å; A173-L202 HydrophobicContact CB-CG 4.45Å
174	I	97.8	Very high	96.5	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-61.3	-42.2	179.9	-65.8	163.6	0	0	0	111.3	V106 P108 L145 P146 A170 T171 G176 L202 Y205	V106-I174 HydrophobicContact CG1-CB 4.19Å; V106-I174 HydrophobicContact CG1-CD1 4.4Å; V106-I174 HydrophobicContact CG1-CG2 3.9Å; P108-I174 WeakPolarHBondContact CG-O 3.48Å; L145-I174 HydrophobicContact CD2-CD1 4.25Å; P146-I174 HydrophobicContact CG-CD1 3.67Å; A170-I174 WeakPolarHBondContact O-CB 3.16Å; A170-I174 WeakPolarHBondContact O-CD1 3.2Å; A170-I174 WeakPolarHBondContact O-CG1 3.47Å; A170-I174 PolarHBondContact O-N 3.02Å; T171-I174 PolarHBondContact O-N 3.12Å; I174-G176 PolarHBondContact O-N 3.25Å; I174-L202 HydrophobicContact CG1-CD2 4.26Å; I174-Y205 HydrophobicContact CD1-CD2 4.49Å; I174-Y205 HydrophobicContact CG1-CD2 4.45Å
175	V	96.7	Very high	96.5	Very high	2 Å²	2	11.6 Å²	11.6	1%	0.012	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-0.7	178.6	-55.5	0	0	0	0	114	V106 D110 R111 V114 T171 F172 A173 F177	V106-V175 HydrophobicContact CG1-CG1 4.28Å; D110-V175 HydrophobicContact CB-CG1 4.3Å; R111-V175 HydrophobicContact CB-CB 4.14Å; R111-V175 WeakPolarHBondContact CD-O 3.41Å; R111-V175 WeakPolarHBondContact CG-O 3.32Å; R111-V175 PolarHBondContact NH1-O 3.04Å; V114-V175 HydrophobicContact CG1-CG2 4.47Å; V114-V175 HydrophobicContact CG2-CG1 4.19Å; V114-V175 HydrophobicContact CG2-CG2 4.43Å; T171-V175 WeakPolarHBondContact O-CG2 3.46Å; T171-V175 PolarHBondContact O-N 2.9Å; F172-V175 PolarHBondContact O-N 3.09Å; A173-V175 PolarHBondContact O-N 3.48Å; V175-F177 HydrophobicContact CG2-CB 4.33Å; V175-F177 HydrophobicContact CG2-CD2 3.35Å; V175-F177 HydrophobicContact CG2-CE2 3.86Å; V175-F177 HydrophobicContact CG2-CG 4Å
176	G	95.1	Very high	96.4	Very high	33 Å²	33	16.3 Å²	16.3	34%	0.34	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	32.5	178.6	0	0	0	0	0	114.5	R111 F172 A173 I174	R111-G176 PolarHBondContact NH1-O 3.35Å; F172-G176 PolarHBondContact O-N 3.47Å; A173-G176 PolarHBondContact O-N 3.35Å; I174-G176 PolarHBondContact O-N 3.25Å
177	F	96	Very high	96.1	Very high	1 Å²	1	19.1 Å²	19.1	0%	0.004	10%	0.102	C	C	.	.			trans	-112.5	48.3	169.8	-59.2	-39	0	0	0	110.7	L28 F31 T32 M35 R111 V114 A115 F172 V175 E179 L180	L28-F177 HydrophobicContact CD1-CE1 4.17Å; L28-F177 HydrophobicContact CD1-CZ 3.83Å; F31-F177 HydrophobicContact CD1-CD1 4.4Å; F31-F177 AromaticContact CD1-CE1 3.77Å; F31-F177 HydrophobicContact CD1-CE1 3.77Å; F31-F177 HydrophobicContact CD1-CE2 4.23Å; F31-F177 AromaticContact CD1-CZ 3.67Å; F31-F177 HydrophobicContact CD1-CZ 3.67Å; F31-F177 AromaticContact CE1-CD1 3.84Å; F31-F177 HydrophobicContact CE1-CD1 3.84Å; F31-F177 AromaticContact CE1-CD2 3.75Å; F31-F177 HydrophobicContact CE1-CD2 3.75Å; F31-F177 AromaticContact CE1-CE1 3.55Å; F31-F177 HydrophobicContact CE1-CE1 3.55Å; F31-F177 AromaticContact CE1-CE2 3.48Å; F31-F177 HydrophobicContact CE1-CE2 3.48Å; F31-F177 VanDerWaalsContact CE1-CE2 3.48Å; F31-F177 AromaticContact CE1-CG 3.94Å; F31-F177 HydrophobicContact CE1-CG 3.94Å; F31-F177 AromaticContact CE1-CZ 3.36Å; F31-F177 HydrophobicContact CE1-CZ 3.36Å; F31-F177 HydrophobicContact CZ-CD2 4.24Å; F31-F177 HydrophobicContact CZ-CE2 4.06Å; F31-F177 HydrophobicContact CZ-CZ 4.33Å; T32-F177 HydrophobicContact CG2-CE1 4.41Å; M35-F177 HydrophobicContact SD-CB 4.09Å; M35-F177 HydrophobicContact SD-CD1 4.23Å; R111-F177 HydrophobicContact CG-CE1 3.87Å; R111-F177 HydrophobicContact CG-CE2 3.83Å; R111-F177 HydrophobicContact CG-CZ 3.31Å; R111-F177 VanDerWaalsContact CZ-CE1 3.47Å; V114-F177 HydrophobicContact CB-CE2 4.16Å; V114-F177 HydrophobicContact CG1-CD2 4.03Å; V114-F177 HydrophobicContact CG1-CE2 3.97Å; A115-F177 HydrophobicContact CB-CE2 4.39Å; A115-F177 HydrophobicContact CB-CZ 4.16Å; F172-F177 HydrophobicContact CB-CB 4.42Å; F172-F177 HydrophobicContact CD1-CB 4.01Å; F172-F177 HydrophobicContact CD1-CD2 4.16Å; F172-F177 CarbonylContact O-C 3.59Å; F172-F177 WeakPolarHBondContact O-CA 3.4Å; F172-F177 PolarHBondContact O-N 3.36Å; V175-F177 HydrophobicContact CG2-CB 4.33Å; V175-F177 HydrophobicContact CG2-CD2 3.35Å; V175-F177 HydrophobicContact CG2-CE2 3.86Å; V175-F177 HydrophobicContact CG2-CG 4Å; F177-E179 PolarHBondContact O-N 3.17Å; F177-E179 VanDerWaalsContact O-N 3.13Å; F177-L180 HydrophobicContact CB-CD1 4.06Å; F177-L180 HydrophobicContact CB-CG 4.35Å; F177-L180 WeakPolarHBondContact O-CB 3.17Å; F177-L180 PolarHBondContact O-N 2.74Å
178	E	94.8	Very high	96	Very high	105 Å²	105	19.2 Å²	19.2	49%	0.491	10%	0.1	S	C	.	.	H	α-helix	trans	-55.7	-33.4	-172.4	-169.5	-179.2	174.5	0	0	113.3	L180 A181 V182	E178-L180 VanDerWaalsContact C-N 3.28Å; E178-L180 PolarHBondContact O-N 2.76Å; E178-A181 WeakPolarHBondContact O-CA 3.49Å; E178-A181 WeakPolarHBondContact O-CB 3.41Å; E178-A181 PolarHBondContact O-N 3.15Å; E178-V182 WeakPolarHBondContact O-CG2 3.5Å; E178-V182 PolarHBondContact O-N 2.9Å
179	E	94.8	Very high	95.8	Very high	48 Å²	48	29.4 Å²	29.4	22%	0.224	14%	0.144	C	C	.	.	H	α-helix	trans	-59.4	-37.1	178	-61	-174.2	-171.3	0	0	113	M35 H36 L39 F177 A181 V182 L183	M35-E179 HydrophobicContact CE-CB 4.18Å; M35-E179 HydrophobicContact CE-CG 4.11Å; M35-E179 HydrophobicContact CG-CB 4.01Å; M35-E179 HydrophobicContact SD-CB 3.95Å; M35-E179 HydrophobicContact SD-CG 4.5Å; H36-E179 IonicContact CE1-OE1 2.83Å; H36-E179 PolarHBondContact CE1-OE1 2.73Å; H36-E179 IonicContact CE1-OE2 2.82Å; H36-E179 IonicContact CG-OE2 3.8Å; H36-E179 IonicContact ND1-OE1 2.73Å; H36-E179 PolarHBondContact ND1-OE1 3.3Å; H36-E179 IonicContact ND1-OE2 3.26Å; H36-E179 PolarHBondContact ND1-OE2 2.88Å; L39-E179 HydrophobicContact CD2-CB 3.98Å; L39-E179 HydrophobicContact CD2-CG 3.76Å; L39-E179 WeakPolarHBondContact CD2-OE2 3.44Å; F177-E179 PolarHBondContact O-N 3.17Å; F177-E179 VanDerWaalsContact O-N 3.13Å; E179-A181 VanDerWaalsContact C-N 3.32Å; E179-V182 PolarHBondContact O-N 2.78Å; E179-L183 WeakPolarHBondContact O-CB 3.35Å; E179-L183 PolarHBondContact O-N 2.65Å
180	L	95.6	Very high	95.6	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67.8	-35.8	174.6	-60.6	-178.3	0	0	0	111.4	F31 M35 L56 P57 F172 F177 E178 L183 L184	F31-L180 HydrophobicContact CE1-CD1 4.24Å; F31-L180 HydrophobicContact CZ-CD1 3.82Å; M35-L180 HydrophobicContact CB-CD2 4.23Å; M35-L180 HydrophobicContact CG-CD1 4.44Å; M35-L180 HydrophobicContact CG-CD2 3.64Å; M35-L180 HydrophobicContact CG-CG 3.74Å; M35-L180 HydrophobicContact SD-CD1 4.49Å; M35-L180 HydrophobicContact SD-CG 3.98Å; L56-L180 HydrophobicContact CD2-CD2 3.8Å; P57-L180 HydrophobicContact CG-CD1 4.05Å; P57-L180 HydrophobicContact CG-CD2 3.95Å; F172-L180 HydrophobicContact CB-CB 4.38Å; F172-L180 HydrophobicContact CD1-CB 3.99Å; F172-L180 HydrophobicContact CD1-CD1 3.82Å; F172-L180 HydrophobicContact CD2-CB 3.91Å; F172-L180 HydrophobicContact CE1-CB 4.17Å; F172-L180 HydrophobicContact CE1-CD1 3.48Å; F172-L180 VanDerWaalsContact CE1-CD1 3.48Å; F172-L180 HydrophobicContact CE1-CG 4.47Å; F172-L180 HydrophobicContact CE2-CB 4.08Å; F172-L180 HydrophobicContact CG-CB 3.85Å; F172-L180 HydrophobicContact CZ-CB 4.18Å; F172-L180 HydrophobicContact CZ-CD1 3.91Å; F177-L180 HydrophobicContact CB-CD1 4.06Å; F177-L180 HydrophobicContact CB-CG 4.35Å; F177-L180 WeakPolarHBondContact O-CB 3.17Å; F177-L180 PolarHBondContact O-N 2.74Å; E178-L180 VanDerWaalsContact C-N 3.28Å; E178-L180 PolarHBondContact O-N 2.76Å; L180-L183 PolarHBondContact O-N 2.75Å; L180-L184 WeakPolarHBondContact O-CG 3.36Å; L180-L184 PolarHBondContact O-N 3.49Å; L180-L184 VanDerWaalsContact O-N 3.13Å
181	A	96.3	Very high	95.4	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.4	-49	174.4	0	0	0	0	0	110.6	A169 F172 E178 E179 L183 L184 L185 L195	A169-A181 HydrophobicContact CB-CB 3.86Å; A169-A181 WeakPolarHBondContact O-CB 3.32Å; F172-A181 HydrophobicContact CB-CB 3.97Å; E178-A181 WeakPolarHBondContact O-CA 3.49Å; E178-A181 WeakPolarHBondContact O-CB 3.41Å; E178-A181 PolarHBondContact O-N 3.15Å; E179-A181 VanDerWaalsContact C-N 3.32Å; A181-L183 VanDerWaalsContact C-N 3.34Å; A181-L183 PolarHBondContact O-N 2.74Å; A181-L184 PolarHBondContact O-N 2.9Å; A181-L185 WeakPolarHBondContact O-CB 3.25Å; A181-L185 VanDerWaalsContact O-CG 3.28Å; A181-L185 WeakPolarHBondContact O-CG 3.24Å; A181-L185 PolarHBondContact O-N 3.19Å; A181-L195 HydrophobicContact CB-CD2 4.39Å
182	V	95.1	Very high	95.2	Very high	33 Å²	33	34.8 Å²	34.8	20%	0.2	17%	0.171	C	C	.	.	H	α-helix	trans	-58.5	-45.6	176.7	173.8	0	0	0	0	110.9	E178 E179 L184 L185 K186 L195	E178-V182 WeakPolarHBondContact O-CG2 3.5Å; E178-V182 PolarHBondContact O-N 2.9Å; E179-V182 PolarHBondContact O-N 2.78Å; V182-L184 VanDerWaalsContact C-N 3.34Å; V182-L184 PolarHBondContact O-N 3.29Å; V182-L185 PolarHBondContact O-N 3.41Å; V182-K186 HydrophobicContact CG1-CD 3.9Å; V182-K186 VanDerWaalsContact CG1-CE 3.5Å; V182-K186 HydrophobicContact CG1-CG 4.16Å; V182-K186 WeakPolarHBondContact O-CB 3.12Å; V182-K186 VanDerWaalsContact O-CG 3.3Å; V182-K186 WeakPolarHBondContact O-CG 3.38Å; V182-K186 PolarHBondContact O-N 2.84Å; V182-L195 HydrophobicContact CG2-CD1 3.61Å
183	L	94.6	Very high	95.1	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-58.9	-44.5	-179.4	-165.7	161.1	0	0	0	112.1	A38 V54 L56 F83 E179 L180 A181	A38-L183 HydrophobicContact CB-CD1 4.1Å; V54-L183 HydrophobicContact CG1-CD1 3.51Å; V54-L183 HydrophobicContact CG1-CD2 4.13Å; V54-L183 HydrophobicContact CG1-CG 4.24Å; L56-L183 HydrophobicContact CD2-CD1 4.28Å; L56-L183 HydrophobicContact CD2-CD2 4.12Å; F83-L183 HydrophobicContact CD1-CD2 4.44Å; F83-L183 HydrophobicContact CE1-CD2 3.52Å; F83-L183 HydrophobicContact CZ-CD2 3.77Å; E179-L183 WeakPolarHBondContact O-CB 3.35Å; E179-L183 PolarHBondContact O-N 2.65Å; L180-L183 PolarHBondContact O-N 2.75Å; A181-L183 VanDerWaalsContact C-N 3.34Å; A181-L183 PolarHBondContact O-N 2.74Å
184	L	94.9	Very high	95.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.9	-46.7	176.3	-72.7	179.9	0	0	0	112.1	L56 L60 L78 F83 V165 F168 F172 L180 A181 V182 K187	L56-L184 HydrophobicContact CD1-CD2 4.16Å; L60-L184 HydrophobicContact CD1-CD1 3.95Å; L60-L184 HydrophobicContact CD1-CD2 4.1Å; L78-L184 HydrophobicContact CD1-CD2 4.49Å; L78-L184 HydrophobicContact CD2-CD2 3.9Å; F83-L184 HydrophobicContact CB-CD2 4.22Å; F83-L184 HydrophobicContact CD1-CD2 4.31Å; F83-L184 HydrophobicContact CG-CD2 4.15Å; V165-L184 HydrophobicContact CG2-CB 4.16Å; F168-L184 HydrophobicContact CB-CD1 3.74Å; F168-L184 HydrophobicContact CG-CD1 4.48Å; F172-L184 HydrophobicContact CD2-CD1 4.02Å; F172-L184 HydrophobicContact CE2-CD1 3.75Å; L180-L184 WeakPolarHBondContact O-CG 3.36Å; L180-L184 PolarHBondContact O-N 3.49Å; L180-L184 VanDerWaalsContact O-N 3.13Å; A181-L184 PolarHBondContact O-N 2.9Å; V182-L184 VanDerWaalsContact C-N 3.34Å; V182-L184 PolarHBondContact O-N 3.29Å; L184-K187 WeakPolarHBondContact O-CB 3.21Å; L184-K187 PolarHBondContact O-N 2.8Å
185	L	95.8	Very high	95	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-69.5	-33.7	-175	-71.5	171.3	0	0	0	112.6	V165 A169 A181 V182 K187 F188 F194 L195	V165-L185 HydrophobicContact CG2-CD2 4.1Å; A169-L185 HydrophobicContact CB-CD1 3.61Å; A169-L185 HydrophobicContact CB-CD2 4.01Å; A169-L185 HydrophobicContact CB-CG 3.72Å; A181-L185 WeakPolarHBondContact O-CB 3.25Å; A181-L185 VanDerWaalsContact O-CG 3.28Å; A181-L185 WeakPolarHBondContact O-CG 3.24Å; A181-L185 PolarHBondContact O-N 3.19Å; V182-L185 PolarHBondContact O-N 3.41Å; L185-K187 PolarHBondContact O-N 3.06Å; L185-F188 PolarHBondContact O-N 3.22Å; L185-F194 HydrophobicContact CD1-CB 4.34Å; L185-F194 HydrophobicContact CD1-CD1 4Å; L185-F194 HydrophobicContact CD2-CB 4.38Å; L185-L195 HydrophobicContact CD1-CD1 3.85Å; L185-L195 HydrophobicContact CD1-CD2 3.96Å; L185-L195 HydrophobicContact CD1-CG 3.55Å
186	K	94.4	Very high	95	Very high	100 Å²	100	42.7 Å²	42.7	44%	0.435	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-17.5	173.6	-81.6	179.7	174.3	-179.8	0	113.7	V182 F188	V182-K186 HydrophobicContact CG1-CD 3.9Å; V182-K186 VanDerWaalsContact CG1-CE 3.5Å; V182-K186 HydrophobicContact CG1-CG 4.16Å; V182-K186 WeakPolarHBondContact O-CB 3.12Å; V182-K186 VanDerWaalsContact O-CG 3.3Å; V182-K186 WeakPolarHBondContact O-CG 3.38Å; V182-K186 PolarHBondContact O-N 2.84Å; K186-F188 PolarHBondContact O-N 3.08Å
187	K	92.8	Very high	95	Very high	59 Å²	59	44.5 Å²	44.5	26%	0.257	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-4.1	174.4	-52.5	-50.9	176.8	-170.1	0	113.1	K77 K81 F83 L184 L185	K77-K187 WeakPolarHBondContact CE-O 3.39Å; K77-K187 PolarHBondContact NZ-O 3.19Å; K81-K187 HydrophobicContact CD-CB 4Å; K81-K187 HydrophobicContact CD-CD 4.27Å; K81-K187 HydrophobicContact CD-CG 4.03Å; F83-K187 HydrophobicContact CE2-CD 4.34Å; F83-K187 HydrophobicContact CE2-CG 4.07Å; L184-K187 WeakPolarHBondContact O-CB 3.21Å; L184-K187 PolarHBondContact O-N 2.8Å; L185-K187 PolarHBondContact O-N 3.06Å
188	F	94.4	Very high	95	Very high	12 Å²	12	44.6 Å²	44.6	5%	0.053	21%	0.211	C	C	.	.	S	Bend	trans	-127	128.1	-178.9	-58.8	-99.6	0	0	0	108.9	T74 K77 L78 V165 L185 K186 W190 G191	T74-F188 HydrophobicContact CG2-CD1 4.35Å; T74-F188 HydrophobicContact CG2-CE1 3.73Å; T74-F188 HydrophobicContact CG2-CZ 4.36Å; K77-F188 HydrophobicContact CB-CE1 4.35Å; K77-F188 HydrophobicContact CB-CZ 4.24Å; K77-F188 HydrophobicContact CD-CD1 4.21Å; K77-F188 HydrophobicContact CD-CE1 3.59Å; K77-F188 HydrophobicContact CD-CZ 3.94Å; K77-F188 HydrophobicContact CG-CE1 4.32Å; K77-F188 HydrophobicContact CG-CZ 4.22Å; L78-F188 HydrophobicContact CD2-CE2 3.97Å; L78-F188 HydrophobicContact CD2-CZ 4.31Å; L78-F188 HydrophobicContact CG-CE2 4.46Å; L78-F188 HydrophobicContact CG-CZ 4.37Å; V165-F188 HydrophobicContact CB-CE2 3.99Å; V165-F188 HydrophobicContact CB-CZ 4.14Å; V165-F188 HydrophobicContact CG1-CD2 4.31Å; V165-F188 HydrophobicContact CG1-CE1 4.36Å; V165-F188 HydrophobicContact CG1-CE2 4.05Å; V165-F188 HydrophobicContact CG1-CZ 4.07Å; V165-F188 HydrophobicContact CG2-CD2 4.04Å; V165-F188 HydrophobicContact CG2-CE2 3.6Å; V165-F188 HydrophobicContact CG2-CZ 4.26Å; L185-F188 PolarHBondContact O-N 3.22Å; K186-F188 PolarHBondContact O-N 3.08Å; F188-W190 HydrophobicContact CB-CD2 4.31Å; F188-W190 HydrophobicContact CB-CZ2 4.25Å; F188-W190 AromaticContact CD1-CZ2 3.79Å; F188-W190 HydrophobicContact CD1-CZ2 3.79Å; F188-W190 HydrophobicContact CG-CZ2 4.22Å; F188-W190 PolarHBondContact O-N 2.94Å; F188-G191 PolarHBondContact O-N 3.08Å
189	K	93.6	Very high	95.1	Very high	215 Å²	215	44 Å²	44	94%	0.935	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-35.6	-177.6	-65.7	-172.5	174.9	-170.5	0	113
190	W	94.1	Very high	95.1	Very high	54 Å²	54	45.6 Å²	45.6	21%	0.205	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-4.8	177.3	54.9	-100	0	0	0	113.5	T74 N152 P153 V165 E166 F188 T192 V193	T74-W190 HydrophobicContact CG2-CH2 4.25Å; T74-W190 HydrophobicContact CG2-CZ2 3.93Å; N152-W190 HydrophobicContact CB-CE3 4.38Å; N152-W190 HydrophobicContact CB-CH2 3.58Å; N152-W190 HydrophobicContact CB-CZ2 3.98Å; N152-W190 HydrophobicContact CB-CZ3 3.8Å; P153-W190 VanDerWaalsContact CD-CE2 3.44Å; P153-W190 VanDerWaalsContact CG-CD1 3.48Å; P153-W190 HydrophobicContact CG-CD2 4.37Å; P153-W190 HydrophobicContact CG-CG 3.96Å; V165-W190 HydrophobicContact CG1-CH2 3.8Å; V165-W190 HydrophobicContact CG1-CZ2 4.49Å; E166-W190 HydrophobicContact CG-CH2 4.3Å; E166-W190 HydrophobicContact CG-CZ3 3.97Å; F188-W190 HydrophobicContact CB-CD2 4.31Å; F188-W190 HydrophobicContact CB-CZ2 4.25Å; F188-W190 AromaticContact CD1-CZ2 3.79Å; F188-W190 HydrophobicContact CD1-CZ2 3.79Å; F188-W190 HydrophobicContact CG-CZ2 4.22Å; F188-W190 PolarHBondContact O-N 2.94Å; W190-T192 PolarHBondContact O-N 2.73Å; W190-V193 VanDerWaalsContact O-CB 3.31Å; W190-V193 WeakPolarHBondContact O-CB 3.09Å; W190-V193 PolarHBondContact O-N 3.11Å
191	G	94.1	Very high	95.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-39.9	-165.3	0	0	0	0	0	113.7	F188 V193 F194	F188-G191 PolarHBondContact O-N 3.08Å; G191-V193 PolarHBondContact O-N 3.22Å; G191-F194 VanDerWaalsContact O-CB 3.25Å; G191-F194 WeakPolarHBondContact O-CB 3.37Å; G191-F194 PolarHBondContact O-N 3.29Å; G191-F194 VanDerWaalsContact O-N 3.09Å
192	T	92.8	Very high	95.2	Very high	59 Å²	59	46.1 Å²	46.1	36%	0.362	22%	0.221	S	C	.	.	H	α-helix	trans	-63.3	-30.3	-179	51.8	0	0	0	0	112.7	W190 F194 L195 E196	W190-T192 PolarHBondContact O-N 2.73Å; T192-F194 PolarHBondContact O-N 2.92Å; T192-F194 VanDerWaalsContact O-N 3.12Å; T192-L195 PolarHBondContact O-N 2.83Å; T192-L195 VanDerWaalsContact O-N 3.09Å; T192-E196 PolarHBondContact O-N 3.18Å
193	V	95.9	Very high	95.2	Very high	38 Å²	38	48.4 Å²	48.4	23%	0.23	23%	0.232	C	C	.	.	H	α-helix	trans	-57.4	-29	175.7	-174.9	0	0	0	0	111.4	A151 Y156 W190 G191 L195 E196 L197	A151-V193 HydrophobicContact CB-CB 4.29Å; A151-V193 HydrophobicContact CB-CG1 4.24Å; Y156-V193 HydrophobicContact CE2-CG1 4.34Å; W190-V193 VanDerWaalsContact O-CB 3.31Å; W190-V193 WeakPolarHBondContact O-CB 3.09Å; W190-V193 PolarHBondContact O-N 3.11Å; G191-V193 PolarHBondContact O-N 3.22Å; V193-L195 PolarHBondContact O-N 3.34Å; V193-E196 PolarHBondContact O-N 3.33Å; V193-L197 WeakPolarHBondContact O-CB 3.45Å; V193-L197 PolarHBondContact O-N 2.84Å
194	F	97.8	Very high	95.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.9	-44.3	177	178	-105.3	0	0	0	113.1	L148 A151 L162 E166 A169 A170 L185 G191 T192 N198	L148-F194 HydrophobicContact CD1-CZ 4.23Å; A151-F194 VanDerWaalsContact CB-CA 3.49Å; A151-F194 HydrophobicContact CB-CB 3.84Å; A151-F194 HydrophobicContact CB-CD2 4.29Å; L162-F194 HydrophobicContact CD2-CE2 3.69Å; L162-F194 HydrophobicContact CD2-CZ 4.32Å; E166-F194 HydrophobicContact CB-CD1 4.49Å; E166-F194 HydrophobicContact CB-CD2 4.01Å; E166-F194 HydrophobicContact CB-CE1 4.34Å; E166-F194 HydrophobicContact CB-CE2 3.87Å; E166-F194 HydrophobicContact CB-CG 4.32Å; E166-F194 HydrophobicContact CB-CZ 4.03Å; E166-F194 HydrophobicContact CG-CB 4.33Å; E166-F194 HydrophobicContact CG-CD1 4.38Å; E166-F194 HydrophobicContact CG-CD2 3.63Å; E166-F194 HydrophobicContact CG-CE2 4.03Å; E166-F194 HydrophobicContact CG-CG 3.83Å; A169-F194 HydrophobicContact CB-CD1 4.41Å; A169-F194 HydrophobicContact CB-CE1 4.37Å; A170-F194 HydrophobicContact CB-CE1 4.12Å; A170-F194 HydrophobicContact CB-CZ 3.99Å; L185-F194 HydrophobicContact CD1-CB 4.34Å; L185-F194 HydrophobicContact CD1-CD1 4Å; L185-F194 HydrophobicContact CD2-CB 4.38Å; G191-F194 VanDerWaalsContact O-CB 3.25Å; G191-F194 WeakPolarHBondContact O-CB 3.37Å; G191-F194 PolarHBondContact O-N 3.29Å; G191-F194 VanDerWaalsContact O-N 3.09Å; T192-F194 PolarHBondContact O-N 2.92Å; T192-F194 VanDerWaalsContact O-N 3.12Å; F194-N198 WeakPolarHBondContact CE2-ND2 3.49Å; F194-N198 PolarHBondContact O-N 3.29Å; F194-N198 PolarHBondContact O-ND2 3.3Å
195	L	96.4	Very high	95.5	Very high	21 Å²	21	53.1 Å²	53.1	11%	0.11	25%	0.249	C	C	.	.	H	α-helix	trans	-70.8	-41.3	179.7	-64.7	176.2	0	0	0	110.5	A181 V182 L185 T192 V193 N198 R199 L202	A181-L195 HydrophobicContact CB-CD2 4.39Å; V182-L195 HydrophobicContact CG2-CD1 3.61Å; L185-L195 HydrophobicContact CD1-CD1 3.85Å; L185-L195 HydrophobicContact CD1-CD2 3.96Å; L185-L195 HydrophobicContact CD1-CG 3.55Å; T192-L195 PolarHBondContact O-N 2.83Å; T192-L195 VanDerWaalsContact O-N 3.09Å; V193-L195 PolarHBondContact O-N 3.34Å; L195-N198 CarbonylContact O-C 3.55Å; L195-N198 PolarHBondContact O-N 3.24Å; L195-R199 VanDerWaalsContact O-CA 3.25Å; L195-R199 WeakPolarHBondContact O-CA 3.34Å; L195-R199 WeakPolarHBondContact O-CB 3.32Å; L195-R199 PolarHBondContact O-N 3.28Å; L195-L202 HydrophobicContact CD2-CD1 3.79Å
196	E	95.4	Very high	95.5	Very high	117 Å²	117	55 Å²	55	55%	0.547	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-48.7	177.4	-67.1	171.7	-167.4	0	0	111.5	T192 V193 N198 R199	T192-E196 PolarHBondContact O-N 3.18Å; V193-E196 PolarHBondContact O-N 3.33Å; E196-N198 VanDerWaalsContact C-N 3.26Å; E196-N198 PolarHBondContact O-N 2.89Å; E196-R199 WeakPolarHBondContact O-CB 3.46Å; E196-R199 PolarHBondContact O-N 3.26Å
197	L	95.4	Very high	95.6	Very high	71 Å²	71	54 Å²	54	37%	0.372	28%	0.275	S	S	.	.	H	α-helix	trans	-59.7	-36.6	-179.4	179.6	62.7	0	0	0	112.5	V149 A151 V193	V149-L197 HydrophobicContact CB-CD2 3.97Å; V149-L197 HydrophobicContact CB-CG 4.32Å; V149-L197 HydrophobicContact CG1-CD2 3.81Å; V149-L197 HydrophobicContact CG1-CG 4.49Å; A151-L197 HydrophobicContact CB-CD2 4.19Å; V193-L197 WeakPolarHBondContact O-CB 3.45Å; V193-L197 PolarHBondContact O-N 2.84Å
198	N	97	Very high	95.7	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.016	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	10.8	-175.4	-63.5	-81.1	0	0	0	113.3	L148 V149 F194 L195 E196 V200 L201 L202	L148-N198 HydrophobicContact CD2-CB 3.84Å; V149-N198 PolarHBondContact N-OD1 3.48Å; V149-N198 PolarHBondContact O-ND2 3.49Å; F194-N198 WeakPolarHBondContact CE2-ND2 3.49Å; F194-N198 PolarHBondContact O-N 3.29Å; F194-N198 PolarHBondContact O-ND2 3.3Å; L195-N198 CarbonylContact O-C 3.55Å; L195-N198 PolarHBondContact O-N 3.24Å; E196-N198 VanDerWaalsContact C-N 3.26Å; E196-N198 PolarHBondContact O-N 2.89Å; N198-V200 VanDerWaalsContact C-N 3.34Å; N198-V200 PolarHBondContact O-N 2.87Å; N198-L201 PolarHBondContact O-N 3.04Å; N198-L202 HydrophobicContact CB-CD1 3.93Å; N198-L202 HydrophobicContact CB-CG 3.98Å; N198-L202 WeakPolarHBondContact O-CG 3.35Å; N198-L202 PolarHBondContact O-N 2.82Å
199	R	96	Very high	95.5	Very high	93 Å²	93	61.1 Å²	61.1	35%	0.351	30%	0.301	S	S	.	.	H	α-helix	trans	-52.6	-50	-169.2	-176.1	172.3	-178.1	158.7	3.4	112.9	L195 E196 L201 L202 D203	L195-R199 VanDerWaalsContact O-CA 3.25Å; L195-R199 WeakPolarHBondContact O-CA 3.34Å; L195-R199 WeakPolarHBondContact O-CB 3.32Å; L195-R199 PolarHBondContact O-N 3.28Å; E196-R199 WeakPolarHBondContact O-CB 3.46Å; E196-R199 PolarHBondContact O-N 3.26Å; R199-L201 VanDerWaalsContact C-N 3.3Å; R199-L201 PolarHBondContact O-N 2.86Å; R199-L202 PolarHBondContact O-N 3.26Å; R199-D203 WeakPolarHBondContact CG-OD2 3.12Å; R199-D203 IonicContact NE-OD2 2.9Å; R199-D203 WeakPolarHBondContact O-CB 3.26Å; R199-D203 PolarHBondContact O-N 2.92Å
200	V	94.9	Very high	95.4	Very high	82 Å²	82	52.6 Å²	52.6	50%	0.497	27%	0.268	S	S	.	.	H	α-helix	trans	-58.5	-42.5	-179.4	179.5	0	0	0	0	111.6	N198 R204	N198-V200 VanDerWaalsContact C-N 3.34Å; N198-V200 PolarHBondContact O-N 2.87Å; V200-R204 VanDerWaalsContact O-CG 3.24Å; V200-R204 WeakPolarHBondContact O-CG 3.3Å; V200-R204 PolarHBondContact O-N 2.85Å
201	L	95.9	Very high	95.4	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-70.5	-46.8	178.4	-78.8	173.8	0	0	0	111.7	Y147 L148 N198 R199 D203 R204 Y205 F221	Y147-L201 HydrophobicContact CD1-CD1 3.83Å; Y147-L201 HydrophobicContact CE1-CD1 4.16Å; L148-L201 HydrophobicContact CD2-CB 4.21Å; L148-L201 HydrophobicContact CD2-CD1 4.43Å; N198-L201 PolarHBondContact O-N 3.04Å; R199-L201 VanDerWaalsContact C-N 3.3Å; R199-L201 PolarHBondContact O-N 2.86Å; L201-D203 PolarHBondContact O-N 2.86Å; L201-R204 PolarHBondContact O-N 3.1Å; L201-Y205 HydrophobicContact CB-CD2 4.3Å; L201-Y205 HydrophobicContact CB-CE2 3.91Å; L201-Y205 HydrophobicContact CD2-CE1 4.44Å; L201-Y205 HydrophobicContact CD2-CE2 4.22Å; L201-Y205 WeakPolarHBondContact O-CB 3.12Å; L201-Y205 WeakPolarHBondContact O-CD2 3.47Å; L201-Y205 PolarHBondContact O-N 3.36Å; L201-F221 HydrophobicContact CD1-CD1 3.89Å; L201-F221 HydrophobicContact CD1-CE1 3.72Å; L201-F221 HydrophobicContact CD1-CE2 4.37Å; L201-F221 HydrophobicContact CD1-CG 4.29Å; L201-F221 HydrophobicContact CD1-CZ 3.98Å; L201-F221 HydrophobicContact CD2-CB 3.69Å; L201-F221 HydrophobicContact CD2-CD1 3.84Å; L201-F221 HydrophobicContact CD2-CD2 3.69Å; L201-F221 HydrophobicContact CD2-CE1 4.39Å; L201-F221 HydrophobicContact CD2-CE2 4.26Å; L201-F221 HydrophobicContact CD2-CG 3.45Å; L201-F221 VanDerWaalsContact CD2-CG 3.45Å; L201-F221 HydrophobicContact CG-CD1 4.1Å; L201-F221 HydrophobicContact CG-CD2 3.91Å; L201-F221 HydrophobicContact CG-CE1 4.14Å; L201-F221 HydrophobicContact CG-CE2 3.95Å; L201-F221 HydrophobicContact CG-CG 3.98Å; L201-F221 HydrophobicContact CG-CZ 4.07Å
202	L	97.4	Very high	95.4	Very high	8 Å²	8	58.4 Å²	58.4	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-43.7	-179	-68.9	174.1	0	0	0	111.6	L148 A173 I174 L195 N198 R199 R204 Y205 A206	L148-L202 HydrophobicContact CD1-CD2 4.17Å; L148-L202 HydrophobicContact CD2-CD2 3.85Å; L148-L202 HydrophobicContact CD2-CG 4.22Å; A173-L202 HydrophobicContact CB-CB 4.49Å; A173-L202 HydrophobicContact CB-CD1 4.19Å; A173-L202 HydrophobicContact CB-CD2 3.98Å; A173-L202 HydrophobicContact CB-CG 4.45Å; I174-L202 HydrophobicContact CG1-CD2 4.26Å; L195-L202 HydrophobicContact CD2-CD1 3.79Å; N198-L202 HydrophobicContact CB-CD1 3.93Å; N198-L202 HydrophobicContact CB-CG 3.98Å; N198-L202 WeakPolarHBondContact O-CG 3.35Å; N198-L202 PolarHBondContact O-N 2.82Å; R199-L202 PolarHBondContact O-N 3.26Å; L202-R204 PolarHBondContact O-N 3.39Å; L202-Y205 PolarHBondContact O-N 3.26Å; L202-A206 WeakPolarHBondContact O-CB 3.39Å; L202-A206 PolarHBondContact O-N 3.01Å
203	D	96.4	Very high	95.6	Very high	81 Å²	81	59.6 Å²	59.6	43%	0.433	30%	0.3	S	S	.	.	H	α-helix	trans	-61.6	-43.9	177.1	-70.4	-12.6	0	0	0	111	R199 L201 A207	R199-D203 WeakPolarHBondContact CG-OD2 3.12Å; R199-D203 IonicContact NE-OD2 2.9Å; R199-D203 WeakPolarHBondContact O-CB 3.26Å; R199-D203 PolarHBondContact O-N 2.92Å; L201-D203 PolarHBondContact O-N 2.86Å; D203-A207 PolarHBondContact O-N 2.81Å
204	R	96.8	Very high	95.5	Very high	99 Å²	99	57.8 Å²	57.8	37%	0.374	29%	0.289	S	S	.	.	H	α-helix	trans	-67.2	-43.6	176.7	-70	179.7	-175.3	-150.9	2.7	111.9	V200 L201 L202 A206 A207 C208 V217 E220	V200-R204 VanDerWaalsContact O-CG 3.24Å; V200-R204 WeakPolarHBondContact O-CG 3.3Å; V200-R204 PolarHBondContact O-N 2.85Å; L201-R204 PolarHBondContact O-N 3.1Å; L202-R204 PolarHBondContact O-N 3.39Å; R204-A206 VanDerWaalsContact C-N 3.35Å; R204-A206 PolarHBondContact O-N 3.29Å; R204-A207 PolarHBondContact O-N 2.64Å; R204-C208 PolarHBondContact O-N 3.23Å; R204-C208 PolarHBondContact O-SG 2.99Å; R204-V217 HydrophobicContact CB-CG1 3.58Å; R204-V217 HydrophobicContact CB-CG2 4.42Å; R204-V217 HydrophobicContact CG-CG1 4.37Å; R204-E220 IonicContact CZ-OE1 3.45Å; R204-E220 IonicContact NH1-OE1 3.19Å; R204-E220 PolarHBondContact NH1-OE1 3.2Å; R204-E220 IonicContact NH1-OE2 3.41Å
205	Y	97.4	Very high	95.4	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.6	-37.4	178.5	-66.8	-30.1	0	0	0	112.8	P108 P146 Y147 L148 I174 L201 L202 A207 C208 L214 V217 E218	P108-Y205 WeakPolarHBondContact CG-O 3.26Å; P146-Y205 HydrophobicContact CB-CD2 4.4Å; P146-Y205 HydrophobicContact CB-CE1 4.31Å; P146-Y205 HydrophobicContact CB-CE2 3.79Å; P146-Y205 HydrophobicContact CG-CD2 3.75Å; P146-Y205 HydrophobicContact CG-CE2 3.55Å; P146-Y205 HydrophobicContact CG-CG 4.38Å; Y147-Y205 PolarHBondContact O-OH 3.35Å; L148-Y205 HydrophobicContact CD2-CD2 4.44Å; L148-Y205 HydrophobicContact CD2-CE2 4.05Å; L148-Y205 HydrophobicContact CG-CE2 4.49Å; I174-Y205 HydrophobicContact CD1-CD2 4.49Å; I174-Y205 HydrophobicContact CG1-CD2 4.45Å; L201-Y205 HydrophobicContact CB-CD2 4.3Å; L201-Y205 HydrophobicContact CB-CE2 3.91Å; L201-Y205 HydrophobicContact CD2-CE1 4.44Å; L201-Y205 HydrophobicContact CD2-CE2 4.22Å; L201-Y205 WeakPolarHBondContact O-CB 3.12Å; L201-Y205 WeakPolarHBondContact O-CD2 3.47Å; L201-Y205 PolarHBondContact O-N 3.36Å; L202-Y205 PolarHBondContact O-N 3.26Å; Y205-A207 PolarHBondContact O-N 3.48Å; Y205-C208 WeakPolarHBondContact O-CB 3.41Å; Y205-C208 PolarHBondContact O-N 2.85Å; Y205-L214 HydrophobicContact CD1-CD1 4.21Å; Y205-L214 HydrophobicContact CD1-CG 3.72Å; Y205-L214 HydrophobicContact CE1-CD2 4.29Å; Y205-L214 HydrophobicContact CE1-CG 3.97Å; Y205-L214 HydrophobicContact CG-CD1 4.43Å; Y205-L214 HydrophobicContact CG-CG 4.42Å; Y205-V217 HydrophobicContact CD1-CB 4.35Å; Y205-V217 HydrophobicContact CD1-CG1 3.86Å; Y205-V217 HydrophobicContact CE1-CB 4.16Å; Y205-V217 HydrophobicContact CE1-CG1 3.68Å; Y205-E218 HydrophobicContact CE1-CB 4.39Å
206	A	96.3	Very high	95.4	Very high	40 Å²	40	63.1 Å²	63.1	33%	0.331	32%	0.32	S	S	.	.	H	α-helix	trans	-66.3	-24.5	175.8	0	0	0	0	0	112.8	P108 L202 R204	P108-A206 WeakPolarHBondContact CG-O 3.26Å; L202-A206 WeakPolarHBondContact O-CB 3.39Å; L202-A206 PolarHBondContact O-N 3.01Å; R204-A206 VanDerWaalsContact C-N 3.35Å; R204-A206 PolarHBondContact O-N 3.29Å
207	A	95.9	Very high	95.4	Very high	78 Å²	78	58.5 Å²	58.5	65%	0.645	30%	0.3	S	S	*	.	H	α-helix	trans	-84.1	-16.1	176.4	0	0	0	0	0	113.9	D203 R204 Y205	D203-A207 PolarHBondContact O-N 2.81Å; R204-A207 PolarHBondContact O-N 2.64Å; Y205-A207 PolarHBondContact O-N 3.48Å
208	C	94.9	Very high	95.3	Very high	9 Å²	9	56.6 Å²	56.6	6%	0.061	29%	0.289	C	S	.	.			trans	-68.2	147.7	-179.5	-65.8	0	0	0	0	112.3	P108 R204 Y205 E213 L214	P108-C208 WeakPolarHBondContact CD-O 3.31Å; P108-C208 WeakPolarHBondContact CG-O 3.23Å; R204-C208 PolarHBondContact O-N 3.23Å; R204-C208 PolarHBondContact O-SG 2.99Å; Y205-C208 WeakPolarHBondContact O-CB 3.41Å; Y205-C208 PolarHBondContact O-N 2.85Å; C208-E213 HydrophobicContact CB-CB 4.18Å; C208-L214 HydrophobicContact CB-CB 4.28Å
209	R	90.5	Very high	95.2	Very high	213 Å²	213	63 Å²	63	80%	0.804	32%	0.317	S	S	*	.			trans	-106.8	-21.5	176.4	-64.2	179	-179	176.6	0.9	113.1	E213	R209-E213 PolarHBondContact N-OE2 3.26Å
210	S	92.9	Very high	95.2	Very high	35 Å²	35	63.1 Å²	63.1	25%	0.245	32%	0.321	C	S	.	.	S	Bend	trans	-134.9	164.9	-177.6	88.3	0	0	0	0	112.5	E212 E213 L214	S210-E212 VanDerWaalsContact C-N 3.29Å; S210-E212 WeakPolarHBondContact CB-OE2 3.26Å; S210-E212 PolarHBondContact OG-N 3.29Å; S210-E212 PolarHBondContact OG-OE2 3.34Å; S210-E213 PolarHBondContact O-N 2.89Å; S210-E213 PolarHBondContact OG-N 3.39Å; S210-L214 PolarHBondContact O-N 3.4Å
211	E	93.6	Very high	95.1	Very high	49 Å²	49	62.4 Å²	62.4	23%	0.229	31%	0.312	C	S	.	.	H	α-helix	trans	-65.5	-34.2	176.3	-179.5	166.6	-162.4	0	0	111.5	K104 Y105 T107 L214 L215	K104-E211 VanDerWaalsContact CA-OE1 3.26Å; K104-E211 WeakPolarHBondContact CA-OE1 3.46Å; Y105-E211 HydrophobicContact CD2-CG 4.24Å; Y105-E211 VanDerWaalsContact CD2-OE1 3.32Å; Y105-E211 WeakPolarHBondContact CD2-OE1 3.49Å; Y105-E211 PolarHBondContact N-OE1 3.28Å; T107-E211 HydrophobicContact CG2-CB 4.25Å; E211-L214 PolarHBondContact O-N 3.05Å; E211-L215 HydrophobicContact CG-CD1 4.39Å; E211-L215 WeakPolarHBondContact O-CG 3.43Å; E211-L215 PolarHBondContact O-N 2.91Å
212	E	94.8	Very high	94.9	Very high	127 Å²	127	66.7 Å²	66.7	59%	0.593	33%	0.334	S	S	*	.	H	α-helix	trans	-68.2	-40.1	178.1	-55.4	78	-168	0	0	112.4	S210 L214 L215 T216	S210-E212 VanDerWaalsContact C-N 3.29Å; S210-E212 WeakPolarHBondContact CB-OE2 3.26Å; S210-E212 PolarHBondContact OG-N 3.29Å; S210-E212 PolarHBondContact OG-OE2 3.34Å; E212-L214 VanDerWaalsContact C-N 3.35Å; E212-L215 PolarHBondContact O-N 3.28Å; E212-T216 PolarHBondContact O-N 3.15Å; E212-T216 PolarHBondContact O-OG1 2.99Å
213	E	95.1	Very high	94.6	Very high	85 Å²	85	71.7 Å²	71.7	40%	0.397	37%	0.365	S	S	.	.	H	α-helix	trans	-63.1	-44.3	174.1	-72.2	178.3	-176.4	0	0	110.7	C208 R209 S210 L215 T216 V217	C208-E213 HydrophobicContact CB-CB 4.18Å; R209-E213 PolarHBondContact N-OE2 3.26Å; S210-E213 PolarHBondContact O-N 2.89Å; S210-E213 PolarHBondContact OG-N 3.39Å; E213-L215 PolarHBondContact O-N 3Å; E213-T216 WeakPolarHBondContact O-CB 3.47Å; E213-T216 PolarHBondContact O-N 2.91Å; E213-T216 VanDerWaalsContact O-N 3.11Å; E213-V217 WeakPolarHBondContact O-CG2 3.27Å; E213-V217 PolarHBondContact O-N 3.41Å
214	L	95.3	Very high	94.2	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-61.2	-43.2	178.9	-179.8	153.6	0	0	0	111.9	Y105 V106 T107 P146 Y205 C208 S210 E211 E212 T216 V217 E218	Y105-L214 HydrophobicContact CG-CD2 4.37Å; V106-L214 WeakPolarHBondContact O-CD1 3.43Å; T107-L214 HydrophobicContact CG2-CD1 4.17Å; P146-L214 HydrophobicContact CB-CD1 4.5Å; P146-L214 HydrophobicContact CB-CD2 3.62Å; P146-L214 HydrophobicContact CB-CG 4.41Å; P146-L214 HydrophobicContact CG-CD1 4.35Å; P146-L214 HydrophobicContact CG-CD2 4.35Å; Y205-L214 HydrophobicContact CD1-CD1 4.21Å; Y205-L214 HydrophobicContact CD1-CG 3.72Å; Y205-L214 HydrophobicContact CE1-CD2 4.29Å; Y205-L214 HydrophobicContact CE1-CG 3.97Å; Y205-L214 HydrophobicContact CG-CD1 4.43Å; Y205-L214 HydrophobicContact CG-CG 4.42Å; C208-L214 HydrophobicContact CB-CB 4.28Å; S210-L214 PolarHBondContact O-N 3.4Å; E211-L214 PolarHBondContact O-N 3.05Å; E212-L214 VanDerWaalsContact C-N 3.35Å; L214-T216 VanDerWaalsContact C-N 3.31Å; L214-T216 PolarHBondContact O-N 2.92Å; L214-V217 PolarHBondContact O-N 2.93Å; L214-E218 PolarHBondContact O-N 3.44Å
215	L	94.9	Very high	92.6	Very high	46 Å²	46	75 Å²	75	24%	0.241	39%	0.387	C	S	.	.	H	α-helix	trans	-68.3	-30.7	175.4	-72	173.1	0	0	0	112.7	Y105 E211 E212 E213 K219	Y105-L215 HydrophobicContact CD2-CD2 4.04Å; Y105-L215 HydrophobicContact CD2-CG 4.44Å; Y105-L215 HydrophobicContact CE2-CD2 3.71Å; Y105-L215 HydrophobicContact CE2-CG 4.48Å; E211-L215 HydrophobicContact CG-CD1 4.39Å; E211-L215 WeakPolarHBondContact O-CG 3.43Å; E211-L215 PolarHBondContact O-N 2.91Å; E212-L215 PolarHBondContact O-N 3.28Å; E213-L215 PolarHBondContact O-N 3Å; L215-K219 VanDerWaalsContact O-CG 3.28Å; L215-K219 WeakPolarHBondContact O-CG 3.37Å; L215-K219 PolarHBondContact O-N 3.35Å
216	T	95.8	Very high	90.9	Very high	86 Å²	86	80.4 Å²	80.4	53%	0.528	42%	0.421	S	S	.	.	H	α-helix	trans	-66.1	-47.1	173.4	-58.4	0	0	0	0	110.7	E212 E213 L214 E218 K219 E220	E212-T216 PolarHBondContact O-N 3.15Å; E212-T216 PolarHBondContact O-OG1 2.99Å; E213-T216 WeakPolarHBondContact O-CB 3.47Å; E213-T216 PolarHBondContact O-N 2.91Å; E213-T216 VanDerWaalsContact O-N 3.11Å; L214-T216 VanDerWaalsContact C-N 3.31Å; L214-T216 PolarHBondContact O-N 2.92Å; T216-E218 VanDerWaalsContact C-N 3.31Å; T216-E218 PolarHBondContact O-N 2.82Å; T216-K219 PolarHBondContact O-N 2.92Å; T216-E220 WeakPolarHBondContact O-CB 3.25Å; T216-E220 PolarHBondContact O-N 3.16Å
217	V	95.7	Very high	89	Confident	21 Å²	21	87.2 Å²	87.2	13%	0.127	45%	0.446	C	S	.	.	H	α-helix	trans	-58	-44.7	175	167.4	0	0	0	0	111.2	R204 Y205 E213 L214 E220 F221	R204-V217 HydrophobicContact CB-CG1 3.58Å; R204-V217 HydrophobicContact CB-CG2 4.42Å; R204-V217 HydrophobicContact CG-CG1 4.37Å; Y205-V217 HydrophobicContact CD1-CB 4.35Å; Y205-V217 HydrophobicContact CD1-CG1 3.86Å; Y205-V217 HydrophobicContact CE1-CB 4.16Å; Y205-V217 HydrophobicContact CE1-CG1 3.68Å; E213-V217 WeakPolarHBondContact O-CG2 3.27Å; E213-V217 PolarHBondContact O-N 3.41Å; L214-V217 PolarHBondContact O-N 2.93Å; V217-E220 PolarHBondContact O-N 3.36Å; V217-F221 WeakPolarHBondContact O-CB 3.38Å; V217-F221 PolarHBondContact O-N 3.11Å
218	E	94.3	Very high	86.7	Confident	30 Å²	30	92.2 Å²	92.2	14%	0.14	46%	0.456	C	S	.	.	H	α-helix	trans	-59.8	-48.4	177.5	178.8	174.1	109.1	0	0	111.9	Y147 Y205 L214 T216 F221 L222	Y147-E218 VanDerWaalsContact CB-OE2 3.27Å; Y147-E218 WeakPolarHBondContact CB-OE2 3.33Å; Y147-E218 PolarHBondContact N-OE2 3.32Å; Y205-E218 HydrophobicContact CE1-CB 4.39Å; L214-E218 PolarHBondContact O-N 3.44Å; T216-E218 VanDerWaalsContact C-N 3.31Å; T216-E218 PolarHBondContact O-N 2.82Å; E218-F221 PolarHBondContact O-N 3.47Å; E218-L222 HydrophobicContact CG-CD1 4.11Å; E218-L222 VanDerWaalsContact O-CG 3.31Å; E218-L222 WeakPolarHBondContact O-CG 3.5Å; E218-L222 PolarHBondContact O-N 2.81Å
219	K	95.1	Very high	84.6	Confident	137 Å²	137	97.8 Å²	97.8	60%	0.596	48%	0.482	S	S	*	.	H	α-helix	trans	-62.6	-44.8	177.9	-73.4	170.7	-173.5	173.4	0	111.8	L215 T216 F221 L222 T223	L215-K219 VanDerWaalsContact O-CG 3.28Å; L215-K219 WeakPolarHBondContact O-CG 3.37Å; L215-K219 PolarHBondContact O-N 3.35Å; T216-K219 PolarHBondContact O-N 2.92Å; K219-F221 VanDerWaalsContact C-N 3.32Å; K219-F221 PolarHBondContact O-N 2.99Å; K219-L222 PolarHBondContact O-N 2.91Å; K219-T223 WeakPolarHBondContact O-CB 3.28Å; K219-T223 VanDerWaalsContact O-CG2 3.32Å; K219-T223 WeakPolarHBondContact O-CG2 3.48Å; K219-T223 PolarHBondContact O-N 3.22Å; K219-T223 PolarHBondContact O-OG1 2.83Å
220	E	95	Very high	82.4	Confident	97 Å²	97	95.7 Å²	95.7	45%	0.453	48%	0.481	S	S	.	.	H	α-helix	trans	-56.9	-49.3	178.1	-171.6	-167.6	136	0	0	110.3	R204 T216 V217 L222 T223 S224	R204-E220 IonicContact CZ-OE1 3.45Å; R204-E220 IonicContact NH1-OE1 3.19Å; R204-E220 PolarHBondContact NH1-OE1 3.2Å; R204-E220 IonicContact NH1-OE2 3.41Å; T216-E220 WeakPolarHBondContact O-CB 3.25Å; T216-E220 PolarHBondContact O-N 3.16Å; V217-E220 PolarHBondContact O-N 3.36Å; E220-L222 PolarHBondContact O-N 2.9Å; E220-T223 PolarHBondContact O-N 3.23Å; E220-T223 PolarHBondContact O-OG1 2.76Å; E220-S224 WeakPolarHBondContact O-CB 3.39Å; E220-S224 PolarHBondContact O-N 2.98Å
221	F	92.7	Very high	80.1	Confident	67 Å²	67	101.3 Å²	101.3	29%	0.294	50%	0.501	S	S	.	.	H	α-helix	trans	-59.5	-44.1	178.5	-174.2	-94.2	0	0	0	112.6	Y147 L201 V217 E218 K219 T223 S224	Y147-F221 HydrophobicContact CD1-CD1 4.49Å; Y147-F221 HydrophobicContact CE1-CD1 4.25Å; Y147-F221 HydrophobicContact CE1-CE1 4.07Å; L201-F221 HydrophobicContact CD1-CD1 3.89Å; L201-F221 HydrophobicContact CD1-CE1 3.72Å; L201-F221 HydrophobicContact CD1-CE2 4.37Å; L201-F221 HydrophobicContact CD1-CG 4.29Å; L201-F221 HydrophobicContact CD1-CZ 3.98Å; L201-F221 HydrophobicContact CD2-CB 3.69Å; L201-F221 HydrophobicContact CD2-CD1 3.84Å; L201-F221 HydrophobicContact CD2-CD2 3.69Å; L201-F221 HydrophobicContact CD2-CE1 4.39Å; L201-F221 HydrophobicContact CD2-CE2 4.26Å; L201-F221 HydrophobicContact CD2-CG 3.45Å; L201-F221 VanDerWaalsContact CD2-CG 3.45Å; L201-F221 HydrophobicContact CG-CD1 4.1Å; L201-F221 HydrophobicContact CG-CD2 3.91Å; L201-F221 HydrophobicContact CG-CE1 4.14Å; L201-F221 HydrophobicContact CG-CE2 3.95Å; L201-F221 HydrophobicContact CG-CG 3.98Å; L201-F221 HydrophobicContact CG-CZ 4.07Å; V217-F221 WeakPolarHBondContact O-CB 3.38Å; V217-F221 PolarHBondContact O-N 3.11Å; E218-F221 PolarHBondContact O-N 3.47Å; K219-F221 VanDerWaalsContact C-N 3.32Å; K219-F221 PolarHBondContact O-N 2.99Å; F221-T223 VanDerWaalsContact C-N 3.3Å; F221-T223 PolarHBondContact O-N 3.03Å; F221-S224 PolarHBondContact O-N 3.48Å; F221-S224 PolarHBondContact O-OG 3.49Å
222	L	91.3	Very high	78	Confident	92 Å²	92	104.7 Å²	104.7	48%	0.482	53%	0.525	S	S	.	.	H	α-helix	trans	-69.4	-26.4	179.2	-67.8	174.5	0	0	0	113.6	Y147 E218 K219 E220	Y147-L222 HydrophobicContact CD1-CD2 4.21Å; Y147-L222 HydrophobicContact CD2-CD2 4Å; Y147-L222 HydrophobicContact CE1-CD2 3.95Å; Y147-L222 HydrophobicContact CE2-CD2 3.67Å; Y147-L222 HydrophobicContact CG-CD2 4.25Å; E218-L222 HydrophobicContact CG-CD1 4.11Å; E218-L222 VanDerWaalsContact O-CG 3.31Å; E218-L222 WeakPolarHBondContact O-CG 3.5Å; E218-L222 PolarHBondContact O-N 2.81Å; K219-L222 PolarHBondContact O-N 2.91Å; E220-L222 PolarHBondContact O-N 2.9Å
223	T	92.4	Very high	76.1	Confident	114 Å²	114	101.7 Å²	101.7	70%	0.699	52%	0.516	S	S	*	.	H	α-helix	trans	-92.5	-22.2	178.2	59.5	0	0	0	0	113.6	K219 E220 F221 K225	K219-T223 WeakPolarHBondContact O-CB 3.28Å; K219-T223 VanDerWaalsContact O-CG2 3.32Å; K219-T223 WeakPolarHBondContact O-CG2 3.48Å; K219-T223 PolarHBondContact O-N 3.22Å; K219-T223 PolarHBondContact O-OG1 2.83Å; E220-T223 PolarHBondContact O-N 3.23Å; E220-T223 PolarHBondContact O-OG1 2.76Å; F221-T223 VanDerWaalsContact C-N 3.3Å; F221-T223 PolarHBondContact O-N 3.03Å; T223-K225 PolarHBondContact O-N 3.17Å
224	S	86.7	Confident	74.3	Confident	64 Å²	64	102 Å²	102	45%	0.448	52%	0.52	S	S	.	.	S	Bend	trans	-62.7	126.8	175.3	66.1	0	0	0	0	109.1	E220 F221	E220-S224 WeakPolarHBondContact O-CB 3.39Å; E220-S224 PolarHBondContact O-N 2.98Å; F221-S224 PolarHBondContact O-N 3.48Å; F221-S224 PolarHBondContact O-OG 3.49Å
225	K	64.3	Low	72.5	Confident	186 Å²	186	107.8 Å²	107.8	81%	0.809	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-66.6	138.3	168.8	-69.2	-178.6	178.6	-178.5	0	107	T223 E227	T223-K225 PolarHBondContact O-N 3.17Å; K225-E227 PolarHBondContact O-N 3.39Å; K225-E227 VanDerWaalsContact O-N 3.15Å
226	P	62	Low	70.6	Confident	112 Å²	112	114 Å²	114	73%	0.727	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-53.2	128.4	167	23	-29.6	0	0	0	106.6	E228	P226-E228 PolarHBondContact O-N 3.25Å
227	E	56.4	Low	69.1	Low	183 Å²	183	113.2 Å²	113.2	86%	0.855	58%	0.576	S	S	*	*			trans	-54.3	114.3	165.8	-71.1	-176.4	175.5	0	0	104.9	K225 E229	K225-E227 PolarHBondContact O-N 3.39Å; K225-E227 VanDerWaalsContact O-N 3.15Å; E227-E229 PolarHBondContact O-N 2.8Å
228	E	48.2	Very low	67.4	Low	183 Å²	183	118.7 Å²	118.7	86%	0.855	61%	0.609	S	S	*	*			trans	-62.9	88.9	165.4	-68.7	177	-169.9	0	0	103.7	P226 E230	P226-E228 PolarHBondContact O-N 3.25Å; E228-E230 VanDerWaalsContact C-N 3.26Å; E228-E230 PolarHBondContact O-N 3.48Å
229	E	49.5	Very low	65.6	Low	127 Å²	127	124.4 Å²	124.4	59%	0.593	64%	0.64	S	S	*	*			trans	-51.7	108.6	158.6	-74.8	-170.8	-175.9	0	0	103.4	E227 F231 L251	E227-E229 PolarHBondContact O-N 2.8Å; E229-F231 VanDerWaalsContact C-N 3.29Å; E229-F231 VanDerWaalsContact O-CD2 3.24Å; E229-F231 WeakPolarHBondContact O-CD2 3.49Å; E229-F231 PolarHBondContact O-N 3.41Å; E229-L251 WeakPolarHBondContact OE2-CD1 3.48Å
230	E	43.7	Very low	64.1	Low	169 Å²	169	119.9 Å²	119.9	79%	0.79	63%	0.626	S	S	*	*			trans	-51.1	102.7	179.2	-71.8	-178.5	154.9	0	0	106.3	E228 V232	E228-E230 VanDerWaalsContact C-N 3.26Å; E228-E230 PolarHBondContact O-N 3.48Å; E230-V232 HydrophobicContact CB-CG2 3.64Å; E230-V232 PolarHBondContact O-N 3.4Å
231	F	46.4	Very low	62.3	Low	152 Å²	152	118.9 Å²	118.9	67%	0.667	64%	0.642	S	S	*	*			trans	-67.3	78.8	162.8	-76.5	-94.3	0	0	0	104.7	E229 T233	E229-F231 VanDerWaalsContact C-N 3.29Å; E229-F231 VanDerWaalsContact O-CD2 3.24Å; E229-F231 WeakPolarHBondContact O-CD2 3.49Å; E229-F231 PolarHBondContact O-N 3.41Å; F231-T233 PolarHBondContact O-N 3.27Å
232	V	48.1	Very low	60.6	Low	121 Å²	121	119.6 Å²	119.6	73%	0.733	65%	0.651	S	S	*	*			trans	-68.9	13.3	172	-174.2	0	0	0	0	110.5	E230	E230-V232 HydrophobicContact CB-CG2 3.64Å; E230-V232 PolarHBondContact O-N 3.4Å
233	T	55.7	Low	58.7	Low	64 Å²	64	124.3 Å²	124.3	39%	0.393	67%	0.671	S	S	.	*	S	Bend	trans	-120.8	104.2	167.9	-14.1	0	0	0	0	107.2	F231 S240	F231-T233 PolarHBondContact O-N 3.27Å; T233-S240 WeakPolarHBondContact CG2-OG 3.34Å
234	D	56.5	Low	56.8	Low	90 Å²	90	124.6 Å²	124.6	48%	0.481	68%	0.676	S	S	.	*			trans	-45.7	125.5	168	166.6	15.5	0	0	0	108.5	F236 D237	D234-F236 PolarHBondContact O-N 3.05Å; D234-F236 WeakPolarHBondContact OD1-CB 3.32Å; D234-F236 PolarHBondContact OD1-N 3.44Å; D234-D237 HydrophobicContact CB-CB 4.03Å; D234-D237 VanDerWaalsContact O-CB 3.29Å; D234-D237 WeakPolarHBondContact O-CB 3.44Å; D234-D237 PolarHBondContact O-N 3.38Å
235	P	57.5	Low	55.3	Low	123 Å²	123	130 Å²	130	80%	0.799	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-15.7	176.6	-24.9	34	0	0	0	114.3
236	F	55.3	Low	55.1	Low	175 Å²	175	126.7 Å²	126.7	77%	0.768	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	6.3	173.1	-63.2	-82.9	0	0	0	114	D234 V238	D234-F236 PolarHBondContact O-N 3.05Å; D234-F236 WeakPolarHBondContact OD1-CB 3.32Å; D234-F236 PolarHBondContact OD1-N 3.44Å; F236-V238 VanDerWaalsContact C-N 3.3Å; F236-V238 WeakPolarHBondContact O-CG2 3.35Å; F236-V238 PolarHBondContact O-N 3.17Å
237	D	64.6	Low	54.9	Low	71 Å²	71	129.6 Å²	129.6	38%	0.38	69%	0.686	S	S	.	*			trans	-73.8	87.6	174.7	-174	6.4	0	0	0	110.2	D234 N239 S240	D234-D237 HydrophobicContact CB-CB 4.03Å; D234-D237 VanDerWaalsContact O-CB 3.29Å; D234-D237 WeakPolarHBondContact O-CB 3.44Å; D234-D237 PolarHBondContact O-N 3.38Å; D237-N239 PolarHBondContact O-N 2.99Å; D237-N239 VanDerWaalsContact O-N 3.1Å; D237-N239 WeakPolarHBondContact OD1-CB 3.08Å; D237-N239 PolarHBondContact OD1-N 2.96Å; D237-S240 WeakPolarHBondContact CB-OG 3.24Å; D237-S240 WeakPolarHBondContact O-CB 3.31Å; D237-S240 PolarHBondContact O-N 2.9Å; D237-S240 VanDerWaalsContact O-N 3.09Å; D237-S240 PolarHBondContact O-OG 2.79Å; D237-S240 PolarHBondContact OD2-OG 3.03Å
238	V	59.3	Low	54.8	Low	136 Å²	136	126.1 Å²	126.1	82%	0.824	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-59.4	-15.5	175.6	-176.9	0	0	0	0	111.9	F236	F236-V238 VanDerWaalsContact C-N 3.3Å; F236-V238 WeakPolarHBondContact O-CG2 3.35Å; F236-V238 PolarHBondContact O-N 3.17Å
239	N	58	Low	55.5	Low	150 Å²	150	127 Å²	127	80%	0.802	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-90.4	-0.8	178.2	-74.3	25.5	0	0	0	113.8	D237 G241	D237-N239 PolarHBondContact O-N 2.99Å; D237-N239 VanDerWaalsContact O-N 3.1Å; D237-N239 WeakPolarHBondContact OD1-CB 3.08Å; D237-N239 PolarHBondContact OD1-N 2.96Å; N239-G241 PolarHBondContact O-N 3.27Å
240	S	61.9	Low	55.6	Low	41 Å²	41	124.5 Å²	124.5	29%	0.287	66%	0.664	S	S	.	*	G	3₁₀ helix	trans	-67.8	-17.7	-179	-49.3	0	0	0	0	114.3	T233 D237 V242	T233-S240 WeakPolarHBondContact CG2-OG 3.34Å; D237-S240 WeakPolarHBondContact CB-OG 3.24Å; D237-S240 WeakPolarHBondContact O-CB 3.31Å; D237-S240 PolarHBondContact O-N 2.9Å; D237-S240 VanDerWaalsContact O-N 3.09Å; D237-S240 PolarHBondContact O-OG 2.79Å; D237-S240 PolarHBondContact OD2-OG 3.03Å; S240-V242 PolarHBondContact O-N 3.42Å; S240-V242 VanDerWaalsContact O-N 3.17Å
241	G	57.9	Low	55.9	Low	77 Å²	77	121.8 Å²	121.8	79%	0.794	65%	0.654	S	S	*	*			trans	65.6	11.7	-173.6	0	0	0	0	0	114.4	N239	N239-G241 PolarHBondContact O-N 3.27Å
242	V	56.3	Low	55.7	Low	81 Å²	81	125.5 Å²	125.5	49%	0.491	66%	0.664	S	S	.	*			trans	-102.2	95.1	178.5	-175.6	0	0	0	0	108.3	S240 C244 R245	S240-V242 PolarHBondContact O-N 3.42Å; S240-V242 VanDerWaalsContact O-N 3.17Å; V242-C244 VanDerWaalsContact C-N 3.35Å; V242-C244 PolarHBondContact O-N 3.24Å; V242-R245 HydrophobicContact CG1-CG 3.78Å
243	E	52.2	Low	55.2	Low	191 Å²	191	124.1 Å²	124.1	89%	0.893	66%	0.659	S	S	*	*			trans	-72.6	-25.5	-166.8	-160.2	160.6	-166.2	0	0	113.5
244	C	52.4	Low	54.1	Low	121 Å²	121	130.5 Å²	130.5	82%	0.818	68%	0.684	S	S	*	*			trans	-161.2	134.1	174.1	-78.3	0	0	0	0	110.2	V242	V242-C244 VanDerWaalsContact C-N 3.35Å; V242-C244 PolarHBondContact O-N 3.24Å
245	R	56.2	Low	53.3	Low	178 Å²	178	129.4 Å²	129.4	67%	0.672	68%	0.683	S	S	*	*			trans	-116.7	126.5	163.4	-86.8	-176.2	171.8	173.4	-0.7	110.6	V242 L247	V242-R245 HydrophobicContact CG1-CG 3.78Å; R245-L247 PolarHBondContact O-N 2.75Å
246	N	58.9	Low	52.7	Low	116 Å²	116	135.3 Å²	135.3	62%	0.62	69%	0.69	S	S	*	*			trans	-72.3	111.5	167.3	-177.3	-18.6	0	0	0	108.5	N248 R249	N246-N248 PolarHBondContact O-N 3.09Å; N246-N248 VanDerWaalsContact O-N 3.15Å; N246-N248 WeakPolarHBondContact OD1-CB 3.47Å; N246-N248 PolarHBondContact OD1-N 2.95Å; N246-R249 HydrophobicContact CB-CB 4.26Å; N246-R249 VanDerWaalsContact O-CB 3.26Å; N246-R249 WeakPolarHBondContact O-CB 3.36Å; N246-R249 PolarHBondContact O-N 2.68Å
247	L	56.9	Low	51.6	Low	172 Å²	172	132 Å²	132	90%	0.901	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-19.5	179.8	-72.8	153	0	0	0	113.5	R245	R245-L247 PolarHBondContact O-N 2.75Å
248	N	55.3	Low	50.2	Low	110 Å²	110	135.4 Å²	135.4	59%	0.588	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	3.8	173.8	-83.3	-14.6	0	0	0	113.5	N246 P250	N246-N248 PolarHBondContact O-N 3.09Å; N246-N248 VanDerWaalsContact O-N 3.15Å; N246-N248 WeakPolarHBondContact OD1-CB 3.47Å; N246-N248 PolarHBondContact OD1-N 2.95Å; N248-P250 WeakPolarHBondContact O-CD 3.29Å
249	R	62.8	Low	49.2	Very low	201 Å²	201	137.2 Å²	137.2	76%	0.758	70%	0.7	S	S	*	*	S	Bend	trans	-78.7	120	174.3	-164.6	177.5	-154.4	-159.3	6.4	108.7	N246 L251	N246-R249 HydrophobicContact CB-CB 4.26Å; N246-R249 VanDerWaalsContact O-CB 3.26Å; N246-R249 WeakPolarHBondContact O-CB 3.36Å; N246-R249 PolarHBondContact O-N 2.68Å; R249-L251 PolarHBondContact O-N 2.85Å
250	P	51.7	Low	48.1	Very low	75 Å²	75	134 Å²	134	49%	0.487	70%	0.702	S	S	.	*	P	Polyproline II helix	trans	-59.5	132.5	177.7	-20.2	30.9	0	0	0	110.7	N248 R252	N248-P250 WeakPolarHBondContact O-CD 3.29Å; P250-R252 PolarHBondContact O-N 2.72Å
251	L	49.2	Very low	46.8	Very low	112 Å²	112	138.2 Å²	138.2	59%	0.586	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-64	120.8	166.9	-69.5	164.6	0	0	0	107.1	E229 R249 C253	E229-L251 WeakPolarHBondContact OE2-CD1 3.48Å; R249-L251 PolarHBondContact O-N 2.85Å; L251-C253 PolarHBondContact O-N 2.94Å
252	R	43.9	Very low	45.6	Very low	230 Å²	230	140.6 Å²	140.6	87%	0.868	73%	0.725	S	S	*	*			trans	-62.7	103	174.5	-85.7	-169.7	174.8	-160.8	1.3	108.2	P250 H254	P250-R252 PolarHBondContact O-N 2.72Å; R252-H254 PolarHBondContact O-N 2.76Å
253	C	35.9	Very low	44.5	Very low	93 Å²	93	145.7 Å²	145.7	63%	0.628	74%	0.743	S	S	*	*			trans	-66	118.8	168.2	70.1	0	0	0	0	108.1	L251 S255	L251-C253 PolarHBondContact O-N 2.94Å; C253-S255 PolarHBondContact O-N 3.15Å
254	H	33.7	Very low	43.6	Very low	197 Å²	197	144.1 Å²	144.1	91%	0.912	74%	0.741	S	S	*	*			trans	-73.8	73.5	176.8	-101.7	71.8	0	0	0	109.8	R252	R252-H254 PolarHBondContact O-N 2.76Å
255	S	38.9	Very low	42.7	Very low	68 Å²	68	145.4 Å²	145.4	48%	0.476	74%	0.739	S	S	.	*			trans	-111	115	162.5	173.2	0	0	0	0	107.8	C253 I257	C253-S255 PolarHBondContact O-N 3.15Å; S255-I257 PolarHBondContact O-N 3.33Å
256	R	44.9	Very low	41.6	Very low	247 Å²	247	143.9 Å²	143.9	93%	0.932	75%	0.745	S	S	*	*			trans	-56.9	105	-171.2	-63.9	176.1	-162	162.4	5.1	111.5
257	I	32.9	Very low	40.5	Very low	106 Å²	106	143 Å²	143	54%	0.544	75%	0.747	S	S	.	*			trans	-138.6	104.1	148.6	-57	-175.7	0	0	0	107.2	S255 F259	S255-I257 PolarHBondContact O-N 3.33Å; I257-F259 HydrophobicContact CB-CD2 4.5Å; I257-F259 HydrophobicContact CG2-CD2 3.21Å; I257-F259 HydrophobicContact CG2-CE2 3.17Å; I257-F259 HydrophobicContact CG2-CG 4.2Å; I257-F259 HydrophobicContact CG2-CZ 4.12Å; I257-F259 PolarHBondContact O-N 3Å
258	T	35.7	Very low	39.6	Very low	142 Å²	142	139.5 Å²	139.5	87%	0.871	74%	0.737	S	S	*	*			trans	-76.4	96.7	168.7	47	0	0	0	0	108.5
259	F	37.1	Very low	38.6	Very low	174 Å²	174	143.2 Å²	143.2	76%	0.763	75%	0.751	S	S	*	*			trans	-105.6	115.6	156.2	-76.9	-65.5	0	0	0	107.2	I257 V261	I257-F259 HydrophobicContact CB-CD2 4.5Å; I257-F259 HydrophobicContact CG2-CD2 3.21Å; I257-F259 HydrophobicContact CG2-CE2 3.17Å; I257-F259 HydrophobicContact CG2-CG 4.2Å; I257-F259 HydrophobicContact CG2-CZ 4.12Å; I257-F259 PolarHBondContact O-N 3Å; F259-V261 PolarHBondContact O-N 3.1Å; F259-V261 VanDerWaalsContact O-N 3.12Å
260	G	36.1	Very low	37.2	Very low	83 Å²	83	141.1 Å²	141.1	86%	0.856	76%	0.755	S	S	*	*			trans	-58.5	113.1	-179.7	0	0	0	0	0	110.3
261	V	34.7	Very low	36.3	Very low	129 Å²	129	142.7 Å²	142.7	78%	0.782	77%	0.768	S	S	*	*			trans	-92.9	112	163.3	-178	0	0	0	0	104.9	F259 E263	F259-V261 PolarHBondContact O-N 3.1Å; F259-V261 VanDerWaalsContact O-N 3.12Å; V261-E263 PolarHBondContact O-N 3.42Å
262	V	32.8	Very low	35.6	Very low	127 Å²	127	145.4 Å²	145.4	77%	0.77	78%	0.783	S	S	*	*			trans	-58.4	122.2	162.6	-98.6	0	0	0	0	107.7	D264	V262-D264 PolarHBondContact O-N 2.82Å
263	E	32.6	Very low	35.2	Very low	188 Å²	188	138.5 Å²	138.5	88%	0.879	78%	0.775	S	S	*	*			trans	-76.3	107.3	170.9	-65.6	-176	157.4	0	0	107.3	V261 D265	V261-E263 PolarHBondContact O-N 3.42Å; E263-D265 PolarHBondContact O-N 2.88Å
264	D	32.1	Very low	35.1	Very low	158 Å²	158	139.2 Å²	139.2	85%	0.845	78%	0.781	S	S	*	*			trans	-78.7	110.2	163.1	-84.7	-47.5	0	0	0	107.8	V262	V262-D264 PolarHBondContact O-N 2.82Å
265	D	34.3	Very low	35.3	Very low	147 Å²	147	138.2 Å²	138.2	79%	0.786	78%	0.777	S	S	*	*			trans	-77.5	111.1	167.9	-176.9	31.9	0	0	0	108.2	E263	E263-D265 PolarHBondContact O-N 2.88Å
266	D	33.5	Very low	35.1	Very low	147 Å²	147	142.3 Å²	142.3	79%	0.786	79%	0.793	S	S	*	*			trans	-128.5	88.1	170.6	-157.2	-3.5	0	0	0	108.7	S268	D266-S268 PolarHBondContact O-N 2.99Å
267	S	36.1	Very low	34.9	Very low	96 Å²	96	135.6 Å²	135.6	67%	0.671	78%	0.784	S	S	*	*			trans	-80.6	103.3	169.7	64.2	0	0	0	0	109.4
268	S	38	Very low	35.3	Very low	100 Å²	100	139.4 Å²	139.4	70%	0.699	80%	0.8	S	S	*	*			trans	-111.8	95.3	163.1	66.5	0	0	0	0	109.4	D266 D270	D266-S268 PolarHBondContact O-N 2.99Å; S268-D270 PolarHBondContact O-N 2.88Å
269	E	32.8	Very low	35.9	Very low	187 Å²	187	141.7 Å²	141.7	87%	0.874	80%	0.801	S	S	*	*			trans	-71.4	112.2	161.7	-65.5	-179.6	151.1	0	0	108
270	D	34.2	Very low	36.5	Very low	158 Å²	158	139.3 Å²	139.3	85%	0.845	80%	0.802	S	S	*	*			trans	-104.5	102.6	164.5	-107.1	-27.5	0	0	0	108.1	S268	S268-D270 PolarHBondContact O-N 2.88Å
271	S	33.7	Very low	36.8	Very low	108 Å²	108	144.7 Å²	144.7	76%	0.755	81%	0.806	S	S	*	*			trans	-95.4	100	171.1	55.3	0	0	0	0	109.2
272	D	33.5	Very low	37.4	Very low	168 Å²	168	146 Å²	146	90%	0.898	81%	0.808	S	S	*	*			trans	-99.3	103.3	165.9	-95.3	-29.4	0	0	0	109.3
273	A	34.9	Very low	37.9	Very low	86 Å²	86	146.5 Å²	146.5	71%	0.711	81%	0.812	S	S	*	*			trans	-134.7	149.7	168.4	0	0	0	0	0	109.2
274	S	34.3	Very low	38.2	Very low	107 Å²	107	144.9 Å²	144.9	75%	0.748	85%	0.845	S	S	*	*			trans	89.8	134.2	179.6	75.5	0	0	0	0	114.6
275	E	37.8	Very low	38.5	Very low	177 Å²	177	144.2 Å²	144.2	83%	0.827	85%	0.845	S	S	*	*			cis	-162.7	139.8	13.1	-121.6	155.6	-150	0	0	109.3
276	D	34.6	Very low	38.7	Very low	153 Å²	153	144.1 Å²	144.1	82%	0.818	85%	0.848	S	S	*	*			trans	-79.9	137.1	170.8	-168.6	19.5	0	0	0	108.6
277	S	42.1	Very low	39	Very low	106 Å²	106	143.9 Å²	143.9	74%	0.741	85%	0.851	S	S	*	*			trans	-128.5	108.7	178.9	-71.3	0	0	0	0	109.6
278	E	39.6	Very low	39.2	Very low	187 Å²	187	146.7 Å²	146.7	87%	0.874	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-69.1	137.1	173.1	-62	-174.6	150	0	0	111.4
279	E	49.4	Very low	39.3	Very low	190 Å²	190	149.6 Å²	149.6	89%	0.888	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-90.4	147.5	168.2	-76.2	-160.2	160.4	0	0	111.7
280	P	50.2	Low	39.7	Very low	123 Å²	123	147.1 Å²	147.1	80%	0.799	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-86.8	151.3	-172.6	33.6	-33.8	0	0	0	114.7
281	E	42.3	Very low	40.1	Very low	197 Å²	197	146.4 Å²	146.4	92%	0.921	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-57.2	136.1	172.1	-65.8	-175.4	144.8	0	0	113.3
282	N	47.3	Very low	40.6	Very low	157 Å²	157	149.3 Å²	149.3	84%	0.84	88%	0.883	S	S	*	*	P	Polyproline II helix	trans	-95.5	119.7	170.5	-169.6	26.1	0	0	0	109.5
283	T	42.8	Very low	41.2	Very low	137 Å²	137	147.8 Å²	147.8	84%	0.84	88%	0.882	S	S	*	*	P	Polyproline II helix	trans	-67.4	131.7	171.4	41.9	0	0	0	0	111.8
284	G	38.7	Very low	41.7	Very low	153 Å²	153	153.4 Å²	153.4	100%	1.577	90%	0.898	S	S	*	*			trans	-150.7	0	162.5	0	0	0	0	0	109.6

Retrieved 284 of 284 residues in 142.7 ms (Link to these results)

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