A0A087YPY7_POEFO Loading...

Potassium channel tetramerisation domain containing 12.1

Auxiliary subunit of GABA-B receptors that determine the pharmacology and kinetics of the receptor response. Increases agonist potency and markedly alter the G-protein signaling of the receptors by accelerating onset and promoting desensitization.

AlphaFold DB , UniProt , Accession A0A087YPY7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 286 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	36.5	Very low	37.9	Very low	235 Å²	235	142 Å²	142	100%	1.158	82%	0.824	S	S	*	*				0	109.1	0	-68.9	168.8	-179.4	0	0	105.9
2	A	34	Very low	37.9	Very low	87 Å²	87	136.4 Å²	136.4	72%	0.719	82%	0.82	S	S	*	*			cis	59.7	130.9	26	0	0	0	0	0	110.5
3	L	39.3	Very low	37.5	Very low	171 Å²	171	136 Å²	136	90%	0.895	83%	0.825	S	S	*	*			cis	-153.6	169.2	13.1	-80.5	169.7	0	0	0	107.7
4	A	41.9	Very low	38	Very low	73 Å²	73	132.4 Å²	132.4	60%	0.603	83%	0.829	S	S	*	*			cis	-169	176.8	-13.4	0	0	0	0	0	110.7
5	D	32.3	Very low	38.5	Very low	130 Å²	130	132.1 Å²	132.1	70%	0.695	82%	0.82	S	S	*	*			trans	14.4	144	152.6	-61.4	-59.9	0	0	0	124.1
6	T	36.4	Very low	39.6	Very low	142 Å²	142	131.3 Å²	131.3	87%	0.871	82%	0.82	S	S	*	*				-145.3	93	119.6	-62.6	0	0	0	0	109.5
7	E	37.7	Very low	40.9	Very low	165 Å²	165	127.1 Å²	127.1	77%	0.771	81%	0.809	S	S	*	*			trans	-63.1	148.6	157.5	-70.2	-166.5	112.6	0	0	109.9
8	R	37.4	Very low	42.8	Very low	247 Å²	247	122.4 Å²	122.4	93%	0.932	78%	0.78	S	S	*	*			trans	-125.1	82.3	162.6	-152.2	176.4	-168.7	-177.5	3.5	109.9
9	A	37.3	Very low	45.1	Very low	87 Å²	87	120.8 Å²	120.8	72%	0.719	77%	0.771	S	S	*	*			trans	-63.7	135.8	172.4	0	0	0	0	0	111
10	A	43.1	Very low	47.5	Very low	102 Å²	102	115.5 Å²	115.5	84%	0.843	74%	0.735	S	S	*	*			trans	-125.7	90.8	161.9	0	0	0	0	0	107.9
11	S	41.5	Very low	49.7	Very low	123 Å²	123	114.2 Å²	114.2	86%	0.86	73%	0.73	S	S	*	*			trans	-73.3	150	162	43	0	0	0	0	109.5
12	G	37.4	Very low	52.5	Low	75 Å²	75	108.5 Å²	108.5	77%	0.773	70%	0.7	S	S	*	*			cis	168.5	137.7	-7	0	0	0	0	0	109.5
13	C	32.2	Very low	55.5	Low	131 Å²	131	108.7 Å²	108.7	89%	0.885	69%	0.688	S	S	*	*			trans	-155.2	128.4	167.7	-176.7	0	0	0	0	106.4	D15	C13-D15 PolarHBondContact O-N 3.17Å
14	G	44.8	Very low	58.3	Low	86 Å²	86	100.8 Å²	100.8	89%	0.887	65%	0.647	S	S	*	*			trans	-60.6	116.8	-160.3	0	0	0	0	0	114
15	D	45.8	Very low	60.9	Low	128 Å²	128	101.7 Å²	101.7	68%	0.684	64%	0.639	S	S	*	*			trans	-102.5	129.2	162.2	-173.4	38.4	0	0	0	108.9	C13 G17	C13-D15 PolarHBondContact O-N 3.17Å; D15-G17 PolarHBondContact O-N 2.86Å
16	S	55.7	Low	64.1	Low	118 Å²	118	95.5 Å²	95.5	83%	0.825	61%	0.606	S	S	*	*			trans	-74.4	78.5	170.5	51.9	0	0	0	0	108	S18	S16-S18 PolarHBondContact O-N 3Å
17	G	62.7	Low	67	Low	61 Å²	61	89.5 Å²	89.5	63%	0.629	57%	0.568	S	S	*	*			trans	-49	101.4	-156.2	0	0	0	0	0	115.4	D15	D15-G17 PolarHBondContact O-N 2.86Å
18	S	73.6	Confident	69.9	Low	42 Å²	42	81.7 Å²	81.7	29%	0.294	53%	0.532	S	S	.	.			trans	-61.1	138.4	165.1	178	0	0	0	0	109.6	S16 F20 H37	S16-S18 PolarHBondContact O-N 3Å; S18-F20 PolarHBondContact O-N 2.65Å; S18-F20 VanDerWaalsContact O-N 3.1Å; S18-F20 PolarHBondContact OG-N 3.1Å; S18-H37 PolarHBondContact OG-CE1 3.5Å; S18-H37 VanDerWaalsContact OG-CE1 3.27Å; S18-H37 PolarHBondContact OG-NE2 3.07Å
19	P	87.9	Confident	72.8	Confident	92 Å²	92	72.2 Å²	72.2	60%	0.597	51%	0.511	S	S	*	.	S	Bend	trans	-71.2	0.5	172.9	31.8	-35.9	0	0	0	112.8	P57	P19-P57 HydrophobicContact CB-CG 4.02Å; P19-P57 HydrophobicContact CG-CG 4.39Å; P19-P57 WeakPolarHBondContact O-CG 3.45Å
20	F	91.8	Very high	75.5	Confident	14 Å²	14	70.7 Å²	70.7	6%	0.061	50%	0.504	C	S	.	.	S	Bend	trans	-105.3	137.6	-179.9	-64.2	-86.1	0	0	0	111.5	S18 I24 H37 F52 K55 P57 L60 F68	S18-F20 PolarHBondContact O-N 2.65Å; S18-F20 VanDerWaalsContact O-N 3.1Å; S18-F20 PolarHBondContact OG-N 3.1Å; F20-I24 HydrophobicContact CB-CD1 4.15Å; F20-I24 HydrophobicContact CD1-CD1 4.46Å; F20-H37 VanDerWaalsContact CB-CD2 3.45Å; F20-H37 WeakPolarHBondContact CB-CD2 3.32Å; F20-H37 AromaticContact CD2-NE2 3.86Å; F20-H37 AromaticContact CG-CD2 3.94Å; F20-F52 AromaticContact CD1-CD1 3.61Å; F20-F52 HydrophobicContact CD1-CD1 3.61Å; F20-F52 HydrophobicContact CD1-CE1 4.01Å; F20-F52 VanDerWaalsContact CD2-O 3.23Å; F20-F52 WeakPolarHBondContact CD2-O 3.4Å; F20-F52 AromaticContact CE1-CD1 3.59Å; F20-F52 HydrophobicContact CE1-CD1 3.59Å; F20-F52 AromaticContact CE1-CE1 3.92Å; F20-F52 HydrophobicContact CE1-CE1 3.92Å; F20-F52 VanDerWaalsContact CE2-O 3.24Å; F20-F52 WeakPolarHBondContact CE2-O 3.22Å; F20-F52 HydrophobicContact CG-CD1 4.16Å; F20-F52 HydrophobicContact CZ-CD1 4.13Å; F20-K55 WeakPolarHBondContact CE2-O 3.18Å; F20-K55 WeakPolarHBondContact CZ-O 3.49Å; F20-P57 HydrophobicContact CD1-CB 4.24Å; F20-P57 HydrophobicContact CD1-CG 3.87Å; F20-P57 HydrophobicContact CD2-CG 4.48Å; F20-P57 HydrophobicContact CE1-CB 3.92Å; F20-P57 HydrophobicContact CE1-CG 3.73Å; F20-P57 HydrophobicContact CE2-CG 4.36Å; F20-P57 HydrophobicContact CG-CG 4.24Å; F20-P57 HydrophobicContact CZ-CB 4.47Å; F20-P57 HydrophobicContact CZ-CG 3.99Å; F20-L60 HydrophobicContact CE1-CD1 3.74Å; F20-L60 HydrophobicContact CZ-CD1 3.98Å; F20-F68 HydrophobicContact CD1-CE2 4.45Å; F20-F68 AromaticContact CD1-CZ 3.93Å; F20-F68 HydrophobicContact CD1-CZ 3.93Å; F20-F68 HydrophobicContact CE1-CE1 4.18Å; F20-F68 AromaticContact CE1-CZ 3.92Å; F20-F68 HydrophobicContact CE1-CZ 3.92Å
21	S	93.5	Very high	78.2	Confident	89 Å²	89	69.5 Å²	69.5	62%	0.622	48%	0.481	S	S	*	.			trans	-57.3	150.9	172.4	-53	0	0	0	0	112.5	I23 I24	S21-I23 VanDerWaalsContact C-N 3.25Å; S21-I23 WeakPolarHBondContact CB-O 3.21Å; S21-I23 PolarHBondContact O-N 3.3Å; S21-I24 VanDerWaalsContact O-CD1 3.29Å; S21-I24 WeakPolarHBondContact O-CD1 3.29Å
22	E	95.2	Very high	80.9	Confident	116 Å²	116	66 Å²	66	54%	0.542	45%	0.454	S	S	.	.	S	Bend	trans	-59	-38.4	177.8	-159.7	-149.4	149.4	0	0	112.2	R36 H37	E22-R36 CarbonylContact O-C 3.57Å; E22-R36 WeakPolarHBondContact O-CA 3.46Å; E22-R36 IonicContact OE1-CZ 3.58Å; E22-R36 IonicContact OE1-NE 2.72Å; E22-R36 IonicContact OE1-NH1 2.65Å; E22-R36 PolarHBondContact OE1-NH1 2.96Å; E22-H37 PolarHBondContact O-N 2.86Å
23	I	97.3	Very high	83.8	Confident	91 Å²	91	64 Å²	64	47%	0.467	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.3	175.2	-53.3	-55.3	0	0	0	109.6	S21 V34 R36	S21-I23 VanDerWaalsContact C-N 3.25Å; S21-I23 WeakPolarHBondContact CB-O 3.21Å; S21-I23 PolarHBondContact O-N 3.3Å; I23-V34 HydrophobicContact CG2-CG1 3.59Å; I23-R36 HydrophobicContact CD1-CG 4.01Å
24	I	97.8	Very high	86.9	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.021	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	127.7	-176.3	-60	-64.5	0	0	0	109.8	F20 S21 L26 T35 H37 L40 F52 F68	F20-I24 HydrophobicContact CB-CD1 4.15Å; F20-I24 HydrophobicContact CD1-CD1 4.46Å; S21-I24 VanDerWaalsContact O-CD1 3.29Å; S21-I24 WeakPolarHBondContact O-CD1 3.29Å; I24-L26 HydrophobicContact CG2-CD2 3.65Å; I24-L26 HydrophobicContact CG2-CG 4.24Å; I24-T35 PolarHBondContact N-O 3.34Å; I24-T35 PolarHBondContact O-N 3.22Å; I24-H37 HydrophobicContact CG1-CB 4.12Å; I24-L40 HydrophobicContact CB-CD1 4.06Å; I24-L40 HydrophobicContact CG1-CD1 4.31Å; I24-L40 HydrophobicContact CG2-CD1 3.69Å; I24-F52 HydrophobicContact CD1-CE1 4.5Å; I24-F52 HydrophobicContact CG2-CE1 3.87Å; I24-F52 HydrophobicContact CG2-CZ 4.2Å; I24-F68 HydrophobicContact CD1-CE2 4.07Å; I24-F68 HydrophobicContact CG2-CD2 3.8Å; I24-F68 HydrophobicContact CG2-CE2 4.12Å
25	E	98.1	Very high	89.5	Confident	93 Å²	93	58 Å²	58	44%	0.435	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.4	168.6	-63.6	-167.3	-156.3	0	0	110.8	Y33 V34 R67 F68	E25-Y33 WeakPolarHBondContact CA-O 3.46Å; E25-V34 HydrophobicContact CG-CG2 4.23Å; E25-R67 HydrophobicContact CB-CB 4.16Å; E25-R67 HydrophobicContact CB-CG 3.83Å; E25-R67 WeakPolarHBondContact OE2-CD 3.35Å; E25-R67 WeakPolarHBondContact OE2-CG 3.28Å; E25-F68 PolarHBondContact O-N 3.25Å; E25-F68 VanDerWaalsContact O-N 3.12Å
26	L	98.4	Very high	91.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.9	175	-54.1	-178.3	0	0	0	109.8	I24 V28 V32 Y33 L40 F52 F68 L70 F77	I24-L26 HydrophobicContact CG2-CD2 3.65Å; I24-L26 HydrophobicContact CG2-CG 4.24Å; L26-V28 HydrophobicContact CB-CG2 4.08Å; L26-V32 CarbonylContact O-C 3.43Å; L26-V32 VanDerWaalsContact O-CA 3.32Å; L26-V32 WeakPolarHBondContact O-CA 3.29Å; L26-Y33 PolarHBondContact N-O 3.36Å; L26-Y33 PolarHBondContact O-N 2.86Å; L26-L40 HydrophobicContact CD1-CD1 4.3Å; L26-L40 HydrophobicContact CD1-CD2 3.93Å; L26-L40 HydrophobicContact CD2-CD1 4.26Å; L26-F52 HydrophobicContact CD2-CE2 4.29Å; L26-F52 HydrophobicContact CD2-CZ 3.72Å; L26-F68 CarbonylContact C-O 3.6Å; L26-F68 WeakPolarHBondContact CA-O 3.13Å; L26-F68 HydrophobicContact CD2-CB 3.87Å; L26-L70 HydrophobicContact CD1-CD1 4.35Å; L26-F77 HydrophobicContact CD1-CE1 3.83Å; L26-F77 HydrophobicContact CD1-CZ 3.68Å
27	N	98.5	Very high	93.9	Very high	16 Å²	16	53 Å²	53	9%	0.086	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	111.6	164.3	176.6	-5.8	0	0	0	107.7	G30 D63 F68 F69 L70	N27-G30 WeakPolarHBondContact OD1-CA 3.07Å; N27-G30 PolarHBondContact OD1-N 3.25Å; N27-D63 WeakPolarHBondContact CB-OD2 3.14Å; N27-D63 PolarHBondContact ND2-OD2 2.9Å; N27-F68 PolarHBondContact N-O 2.81Å; N27-F69 HydrophobicContact CB-CD2 4.14Å; N27-F69 CarbonylContact O-C 3.53Å; N27-F69 WeakPolarHBondContact O-CA 3.3Å; N27-F69 WeakPolarHBondContact O-CD2 3.22Å; N27-L70 PolarHBondContact O-N 3.27Å
28	V	98.6	Very high	95.6	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	100.8	-175.1	-168.9	0	0	0	0	108.7	L26 G30 Q31 Y33 L70 R72 G74 F77	L26-V28 HydrophobicContact CB-CG2 4.08Å; V28-G30 PolarHBondContact O-N 2.81Å; V28-G30 VanDerWaalsContact O-N 3.11Å; V28-Q31 PolarHBondContact N-O 3.05Å; V28-Q31 WeakPolarHBondContact O-CB 3.34Å; V28-Q31 PolarHBondContact O-N 3.27Å; V28-Y33 HydrophobicContact CB-CD2 4.44Å; V28-Y33 HydrophobicContact CG2-CD2 4.08Å; V28-L70 CarbonylContact C-O 3.56Å; V28-L70 VanDerWaalsContact CA-O 3.31Å; V28-L70 WeakPolarHBondContact CA-O 3.48Å; V28-L70 HydrophobicContact CB-CB 4.49Å; V28-L70 HydrophobicContact CG1-CB 4.18Å; V28-L70 HydrophobicContact CG2-CB 4.21Å; V28-L70 HydrophobicContact CG2-CD1 4.05Å; V28-R72 CarbonylContact C-O 3.59Å; V28-R72 HydrophobicContact CG1-CB 3.96Å; V28-G74 WeakPolarHBondContact O-CA 3.41Å; V28-F77 HydrophobicContact CB-CB 4.4Å; V28-F77 HydrophobicContact CB-CD1 4.5Å; V28-F77 HydrophobicContact CB-CG 4.29Å; V28-F77 HydrophobicContact CG1-CB 3.89Å; V28-F77 HydrophobicContact CG1-CD2 4.04Å; V28-F77 HydrophobicContact CG1-CG 3.92Å; V28-F77 HydrophobicContact CG2-CD1 3.83Å; V28-F77 HydrophobicContact CG2-CD2 4.28Å; V28-F77 HydrophobicContact CG2-CE1 4.02Å; V28-F77 HydrophobicContact CG2-CE2 4.44Å; V28-F77 HydrophobicContact CG2-CG 3.97Å; V28-F77 HydrophobicContact CG2-CZ 4.32Å
29	G	96.9	Very high	96.7	Very high	49 Å²	49	55.3 Å²	55.3	51%	0.505	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	26.3	-177.7	0	0	0	0	0	114.7	L70 R72	G29-L70 PolarHBondContact N-O 2.71Å; G29-R72 VanDerWaalsContact CA-O 3.24Å; G29-R72 WeakPolarHBondContact CA-O 3.48Å; G29-R72 PolarHBondContact N-O 2.95Å
30	G	95.6	Very high	97.2	Very high	55 Å²	55	51 Å²	51	57%	0.567	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.4	-20.7	-173.9	0	0	0	0	0	114.5	N27 V28	N27-G30 WeakPolarHBondContact OD1-CA 3.07Å; N27-G30 PolarHBondContact OD1-N 3.25Å; V28-G30 PolarHBondContact O-N 2.81Å; V28-G30 VanDerWaalsContact O-N 3.11Å
31	Q	98.1	Very high	97.4	Very high	77 Å²	77	52.7 Å²	52.7	36%	0.36	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	125.1	176.8	-177.6	55	59.7	0	0	110.8	V28 Y33	V28-Q31 PolarHBondContact N-O 3.05Å; V28-Q31 WeakPolarHBondContact O-CB 3.34Å; V28-Q31 PolarHBondContact O-N 3.27Å; Q31-Y33 HydrophobicContact CB-CE2 4.05Å; Q31-Y33 HydrophobicContact CG-CD2 4.09Å; Q31-Y33 HydrophobicContact CG-CE2 3.35Å
32	V	98.3	Very high	97.6	Very high	48 Å²	48	50.2 Å²	50.2	29%	0.291	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	134.9	180	-175.5	0	0	0	0	110.3	L26 R67	L26-V32 CarbonylContact O-C 3.43Å; L26-V32 VanDerWaalsContact O-CA 3.32Å; L26-V32 WeakPolarHBondContact O-CA 3.29Å; V32-R67 VanDerWaalsContact CG2-NH1 3.32Å
33	Y	98.6	Very high	97.7	Very high	35 Å²	35	45.9 Å²	45.9	14%	0.137	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	142	173	-74.1	-82.7	0	0	0	110.5	E25 L26 V28 Q31 G74 F77 R78 L81	E25-Y33 WeakPolarHBondContact CA-O 3.46Å; L26-Y33 PolarHBondContact N-O 3.36Å; L26-Y33 PolarHBondContact O-N 2.86Å; V28-Y33 HydrophobicContact CB-CD2 4.44Å; V28-Y33 HydrophobicContact CG2-CD2 4.08Å; Q31-Y33 HydrophobicContact CB-CE2 4.05Å; Q31-Y33 HydrophobicContact CG-CD2 4.09Å; Q31-Y33 HydrophobicContact CG-CE2 3.35Å; Y33-G74 VanDerWaalsContact CE2-O 3.28Å; Y33-G74 WeakPolarHBondContact CE2-O 3.35Å; Y33-G74 PolarHBondContact OH-O 3.19Å; Y33-F77 HydrophobicContact CD1-CD1 4.48Å; Y33-F77 AromaticContact CD2-CD1 3.59Å; Y33-F77 HydrophobicContact CD2-CD1 3.59Å; Y33-F77 HydrophobicContact CD2-CE1 4.2Å; Y33-F77 HydrophobicContact CE2-CB 4.13Å; Y33-F77 AromaticContact CE2-CD1 3.76Å; Y33-F77 HydrophobicContact CE2-CD1 3.76Å; Y33-F77 HydrophobicContact CE2-CG 4.4Å; Y33-F77 AromaticContact CG-CD1 3.98Å; Y33-F77 HydrophobicContact CG-CD1 3.98Å; Y33-F77 HydrophobicContact CG-CE1 4.28Å; Y33-R78 HydrophobicContact CE1-CB 4.33Å; Y33-L81 HydrophobicContact CD1-CD2 3.69Å; Y33-L81 HydrophobicContact CE1-CD2 4.48Å; Y33-L81 HydrophobicContact CG-CD2 4.21Å
34	V	98.2	Very high	97.7	Very high	80 Å²	80	45.8 Å²	45.8	49%	0.485	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.2	170.3	-169.8	0	0	0	0	108.2	I23 E25	I23-V34 HydrophobicContact CG2-CG1 3.59Å; E25-V34 HydrophobicContact CG-CG2 4.23Å
35	T	98.1	Very high	97.5	Very high	10 Å²	10	50.4 Å²	50.4	6%	0.061	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	178.8	-179.4	-164.4	0	0	0	0	111.1	I24 L40 L81	I24-T35 PolarHBondContact N-O 3.34Å; I24-T35 PolarHBondContact O-N 3.22Å; T35-L40 HydrophobicContact CG2-CD1 3.94Å; T35-L40 HydrophobicContact CG2-CD2 3.86Å; T35-L40 HydrophobicContact CG2-CG 3.78Å; T35-L81 HydrophobicContact CG2-CD1 4.05Å
36	R	97.8	Very high	97.5	Very high	118 Å²	118	46 Å²	46	45%	0.445	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	147.3	174.1	-60.1	-174.7	-175.3	-134.1	6.7	111	E22 I23 K38 T39 L40	E22-R36 CarbonylContact O-C 3.57Å; E22-R36 WeakPolarHBondContact O-CA 3.46Å; E22-R36 IonicContact OE1-CZ 3.58Å; E22-R36 IonicContact OE1-NE 2.72Å; E22-R36 IonicContact OE1-NH1 2.65Å; E22-R36 PolarHBondContact OE1-NH1 2.96Å; I23-R36 HydrophobicContact CD1-CG 4.01Å; R36-K38 VanDerWaalsContact C-N 3.26Å; R36-K38 HydrophobicContact CB-CG 3.9Å; R36-K38 PolarHBondContact O-N 3.05Å; R36-T39 WeakPolarHBondContact O-CB 3.24Å; R36-T39 PolarHBondContact O-N 3.14Å; R36-L40 PolarHBondContact O-N 3.32Å
37	H	97.4	Very high	97.5	Very high	22 Å²	22	47.9 Å²	47.9	10%	0.102	28%	0.275	C	S	.	.	H	α-helix	trans	-50.8	-46.9	172.5	175	-97.3	0	0	0	111.5	S18 F20 E22 I24 T39 L40 I41 F52	S18-H37 PolarHBondContact OG-CE1 3.5Å; S18-H37 VanDerWaalsContact OG-CE1 3.27Å; S18-H37 PolarHBondContact OG-NE2 3.07Å; F20-H37 VanDerWaalsContact CB-CD2 3.45Å; F20-H37 WeakPolarHBondContact CB-CD2 3.32Å; F20-H37 AromaticContact CD2-NE2 3.86Å; F20-H37 AromaticContact CG-CD2 3.94Å; E22-H37 PolarHBondContact O-N 2.86Å; I24-H37 HydrophobicContact CG1-CB 4.12Å; H37-T39 PolarHBondContact O-N 3.47Å; H37-L40 PolarHBondContact O-N 2.98Å; H37-I41 PolarHBondContact O-N 3.05Å; H37-F52 PolarHBondContact NE2-O 3.19Å
38	K	97.2	Very high	97.4	Very high	137 Å²	137	47.2 Å²	47.2	60%	0.596	27%	0.271	S	S	*	.	H	α-helix	trans	-53.3	-28.6	176.3	73.1	173.4	-175.2	174.3	0	115.1	R36 A42	R36-K38 VanDerWaalsContact C-N 3.26Å; R36-K38 HydrophobicContact CB-CG 3.9Å; R36-K38 PolarHBondContact O-N 3.05Å; K38-A42 PolarHBondContact O-N 3.19Å
39	T	97.8	Very high	97.4	Very high	16 Å²	16	49.9 Å²	49.9	10%	0.098	28%	0.282	C	S	.	.	H	α-helix	trans	-75.8	-40.9	177.3	-60	0	0	0	0	111	R36 H37 I41 A42 L81 L84 R85	R36-T39 WeakPolarHBondContact O-CB 3.24Å; R36-T39 PolarHBondContact O-N 3.14Å; H37-T39 PolarHBondContact O-N 3.47Å; T39-I41 PolarHBondContact O-N 2.96Å; T39-A42 VanDerWaalsContact O-CB 3.29Å; T39-A42 WeakPolarHBondContact O-CB 3.23Å; T39-A42 PolarHBondContact O-N 2.87Å; T39-L81 HydrophobicContact CG2-CD1 4.03Å; T39-L84 HydrophobicContact CG2-CB 3.8Å; T39-R85 HydrophobicContact CG2-CG 3.79Å
40	L	97.8	Very high	97.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-68.7	-23	178.2	-60.1	176.5	0	0	0	112.6	I24 L26 T35 R36 H37 L48 W49 F52 L81	I24-L40 HydrophobicContact CB-CD1 4.06Å; I24-L40 HydrophobicContact CG1-CD1 4.31Å; I24-L40 HydrophobicContact CG2-CD1 3.69Å; L26-L40 HydrophobicContact CD1-CD1 4.3Å; L26-L40 HydrophobicContact CD1-CD2 3.93Å; L26-L40 HydrophobicContact CD2-CD1 4.26Å; T35-L40 HydrophobicContact CG2-CD1 3.94Å; T35-L40 HydrophobicContact CG2-CD2 3.86Å; T35-L40 HydrophobicContact CG2-CG 3.78Å; R36-L40 PolarHBondContact O-N 3.32Å; H37-L40 PolarHBondContact O-N 2.98Å; L40-L48 HydrophobicContact CD2-CD1 4.2Å; L40-L48 CarbonylContact O-C 3.45Å; L40-W49 PolarHBondContact O-N 2.91Å; L40-F52 HydrophobicContact CB-CB 4.35Å; L40-F52 HydrophobicContact CB-CD2 4.04Å; L40-F52 HydrophobicContact CB-CG 4.2Å; L40-F52 HydrophobicContact CD1-CD1 4.1Å; L40-F52 HydrophobicContact CD1-CD2 3.83Å; L40-F52 HydrophobicContact CD1-CE1 4.03Å; L40-F52 HydrophobicContact CD1-CE2 3.77Å; L40-F52 HydrophobicContact CD1-CG 4.02Å; L40-F52 HydrophobicContact CD1-CZ 3.88Å; L40-F52 HydrophobicContact CG-CD2 4.49Å; L40-L81 HydrophobicContact CD2-CD1 4.4Å
41	I	97.1	Very high	97.4	Very high	50 Å²	50	48.7 Å²	48.7	26%	0.256	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	12.1	174.9	69.7	157.5	0	0	0	113.7	H37 T39 V43 W49 F52 S53	H37-I41 PolarHBondContact O-N 3.05Å; T39-I41 PolarHBondContact O-N 2.96Å; I41-V43 VanDerWaalsContact C-N 3.3Å; I41-V43 PolarHBondContact O-N 3.01Å; I41-W49 HydrophobicContact CB-CG 4.5Å; I41-F52 HydrophobicContact CG2-CB 3.97Å; I41-S53 WeakPolarHBondContact CG2-OG 3.34Å
42	A	97.1	Very high	97.3	Very high	37 Å²	37	45.1 Å²	45.1	31%	0.306	23%	0.233	S	C	.	.	S	Bend	trans	-68.7	-25.9	-176	0	0	0	0	0	114.1	K38 T39 L84 L87	K38-A42 PolarHBondContact O-N 3.19Å; T39-A42 VanDerWaalsContact O-CB 3.29Å; T39-A42 WeakPolarHBondContact O-CB 3.23Å; T39-A42 PolarHBondContact O-N 2.87Å; A42-L84 VanDerWaalsContact CB-O 3.3Å; A42-L84 WeakPolarHBondContact CB-O 3.34Å; A42-L87 HydrophobicContact CB-CD2 4.4Å
43	V	97.3	Very high	97.1	Very high	25 Å²	25	45.4 Å²	45.4	15%	0.152	24%	0.238	C	C	.	.	S	Bend	trans	-115.6	105.2	178.5	178.7	0	0	0	0	109.2	I41 S46 W49 Y83 L84 L87 L110	I41-V43 VanDerWaalsContact C-N 3.3Å; I41-V43 PolarHBondContact O-N 3.01Å; V43-S46 VanDerWaalsContact O-CB 3.32Å; V43-S46 WeakPolarHBondContact O-CB 3.34Å; V43-S46 PolarHBondContact O-N 2.93Å; V43-S46 PolarHBondContact O-OG 2.98Å; V43-W49 WeakPolarHBondContact O-CB 3.15Å; V43-Y83 HydrophobicContact CG2-CE1 4.14Å; V43-L84 HydrophobicContact CB-CD2 4.08Å; V43-L84 HydrophobicContact CG2-CD2 3.68Å; V43-L87 HydrophobicContact CG2-CD2 3.63Å; V43-L110 HydrophobicContact CB-CD2 3.96Å; V43-L110 HydrophobicContact CG1-CD2 3.88Å; V43-L110 HydrophobicContact CG2-CD2 4.2Å
44	P	96.4	Very high	96.7	Very high	89 Å²	89	49.9 Å²	49.9	58%	0.578	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	150.3	176.7	-27.7	35.9	0	0	0	113.2	S46	P44-S46 PolarHBondContact O-N 2.57Å
45	D	95.1	Very high	96.4	Very high	101 Å²	101	50.6 Å²	50.6	54%	0.54	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	1.8	-178.4	-64.4	-49.2	0	0	0	117.2	W49 N50 K54	D45-W49 VanDerWaalsContact OD1-CZ3 3.28Å; D45-W49 WeakPolarHBondContact OD1-CZ3 3.05Å; D45-N50 PolarHBondContact O-ND2 2.84Å; D45-K54 IonicContact OD1-NZ 3.8Å
46	S	97.8	Very high	96	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.007	27%	0.265	C	S	.	.	S	Bend	trans	-62.6	161.3	167.4	68.8	0	0	0	0	111.9	V43 P44 L48 W49 N50	V43-S46 VanDerWaalsContact O-CB 3.32Å; V43-S46 WeakPolarHBondContact O-CB 3.34Å; V43-S46 PolarHBondContact O-N 2.93Å; V43-S46 PolarHBondContact O-OG 2.98Å; P44-S46 PolarHBondContact O-N 2.57Å; S46-L48 VanDerWaalsContact C-N 3.31Å; S46-L48 PolarHBondContact O-N 3.02Å; S46-W49 PolarHBondContact O-N 2.83Å; S46-W49 VanDerWaalsContact OG-CB 3.22Å; S46-W49 WeakPolarHBondContact OG-CB 3.47Å; S46-W49 PolarHBondContact OG-N 3.42Å; S46-W49 VanDerWaalsContact OG-N 3.13Å; S46-N50 PolarHBondContact O-N 2.78Å; S46-N50 PolarHBondContact O-ND2 3.24Å
47	L	97.5	Very high	95.6	Very high	39 Å²	39	47.7 Å²	47.7	20%	0.204	25%	0.252	C	S	.	.	H	α-helix	trans	-60	-43.4	179.3	-177.2	64.6	0	0	0	111.5	N50 M51 F107 F108 L109	L47-N50 PolarHBondContact O-N 3.41Å; L47-M51 HydrophobicContact CD1-CE 4.21Å; L47-M51 HydrophobicContact CD2-CE 4.21Å; L47-M51 HydrophobicContact CG-CE 4.06Å; L47-M51 HydrophobicContact CG-SD 4.37Å; L47-M51 WeakPolarHBondContact O-CG 3.49Å; L47-M51 PolarHBondContact O-N 3.29Å; L47-F107 HydrophobicContact CD2-CD1 4Å; L47-F107 HydrophobicContact CD2-CE1 3.42Å; L47-F107 VanDerWaalsContact CD2-CE1 3.42Å; L47-F107 HydrophobicContact CD2-CZ 3.76Å; L47-F108 HydrophobicContact CB-CD1 4.43Å; L47-F108 HydrophobicContact CD2-CD1 4.11Å; L47-F108 PolarHBondContact N-O 3.44Å; L47-L109 HydrophobicContact CB-CD1 4.39Å; L47-L109 HydrophobicContact CB-CG 4.41Å
48	L	97.6	Very high	95.3	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-67.4	-41.4	178.2	-68.4	168.2	0	0	0	111.3	L40 S46 N50 M51 F52 L70 F77 L84 F108	L40-L48 HydrophobicContact CD2-CD1 4.2Å; L40-L48 CarbonylContact O-C 3.45Å; S46-L48 VanDerWaalsContact C-N 3.31Å; S46-L48 PolarHBondContact O-N 3.02Å; L48-N50 VanDerWaalsContact C-N 3.33Å; L48-N50 PolarHBondContact O-N 3.13Å; L48-M51 HydrophobicContact CD2-SD 4.46Å; L48-M51 PolarHBondContact O-N 2.72Å; L48-F52 HydrophobicContact CD2-CD2 4.48Å; L48-F52 HydrophobicContact CD2-CE2 4.16Å; L48-F52 WeakPolarHBondContact O-CD2 3.18Å; L48-F52 PolarHBondContact O-N 3.42Å; L48-L70 HydrophobicContact CD2-CD1 3.92Å; L48-F77 HydrophobicContact CD1-CE2 4.09Å; L48-F77 HydrophobicContact CD1-CZ 4.2Å; L48-L84 HydrophobicContact CD1-CD1 3.62Å; L48-F108 HydrophobicContact CD1-CD1 4Å; L48-F108 HydrophobicContact CD1-CE1 4.33Å; L48-F108 HydrophobicContact CD2-CD1 4.31Å; L48-F108 HydrophobicContact CD2-CE1 4.19Å; L48-F108 HydrophobicContact CG-CD1 3.85Å; L48-F108 HydrophobicContact CG-CE1 4.21Å
49	W	97.4	Very high	95.1	Very high	57 Å²	57	55.3 Å²	55.3	22%	0.216	29%	0.286	C	S	.	.	H	α-helix	trans	-61.1	-41.8	174	178.4	94.6	0	0	0	112	L40 I41 V43 D45 S46 F52 S53 K54	L40-W49 PolarHBondContact O-N 2.91Å; I41-W49 HydrophobicContact CB-CG 4.5Å; V43-W49 WeakPolarHBondContact O-CB 3.15Å; D45-W49 VanDerWaalsContact OD1-CZ3 3.28Å; D45-W49 WeakPolarHBondContact OD1-CZ3 3.05Å; S46-W49 PolarHBondContact O-N 2.83Å; S46-W49 VanDerWaalsContact OG-CB 3.22Å; S46-W49 WeakPolarHBondContact OG-CB 3.47Å; S46-W49 PolarHBondContact OG-N 3.42Å; S46-W49 VanDerWaalsContact OG-N 3.13Å; W49-F52 PolarHBondContact O-N 3.49Å; W49-S53 PolarHBondContact NE1-OG 2.99Å; W49-S53 WeakPolarHBondContact O-CA 3.32Å; W49-S53 WeakPolarHBondContact O-CB 3.35Å; W49-S53 PolarHBondContact O-N 2.89Å; W49-S53 PolarHBondContact O-OG 2.82Å; W49-K54 HydrophobicContact CZ3-CD 4.32Å
50	N	96.2	Very high	95	Very high	41 Å²	41	55.4 Å²	55.4	22%	0.219	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-42.2	174.9	-75.3	-69.6	0	0	0	111.9	D45 S46 L47 L48 K54	D45-N50 PolarHBondContact O-ND2 2.84Å; S46-N50 PolarHBondContact O-N 2.78Å; S46-N50 PolarHBondContact O-ND2 3.24Å; L47-N50 PolarHBondContact O-N 3.41Å; L48-N50 VanDerWaalsContact C-N 3.33Å; L48-N50 PolarHBondContact O-N 3.13Å; N50-K54 WeakPolarHBondContact O-CB 3.37Å; N50-K54 PolarHBondContact O-N 2.93Å; N50-K54 VanDerWaalsContact O-N 3.07Å; N50-K54 WeakPolarHBondContact OD1-CD 3.41Å; N50-K54 WeakPolarHBondContact OD1-CE 3.34Å; N50-K54 PolarHBondContact OD1-NZ 3.41Å
51	M	96.1	Very high	94.9	Very high	37 Å²	37	58.3 Å²	58.3	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-62.7	-44	176.9	-75.7	177.5	170.3	0	0	112.8	L47 L48 L60 L70	L47-M51 HydrophobicContact CD1-CE 4.21Å; L47-M51 HydrophobicContact CD2-CE 4.21Å; L47-M51 HydrophobicContact CG-CE 4.06Å; L47-M51 HydrophobicContact CG-SD 4.37Å; L47-M51 WeakPolarHBondContact O-CG 3.49Å; L47-M51 PolarHBondContact O-N 3.29Å; L48-M51 HydrophobicContact CD2-SD 4.46Å; L48-M51 PolarHBondContact O-N 2.72Å; M51-L60 HydrophobicContact CB-CD1 4.39Å; M51-L60 HydrophobicContact CB-CD2 4Å; M51-L60 HydrophobicContact CG-CD2 4.06Å; M51-L70 HydrophobicContact CE-CD2 4.17Å; M51-L70 HydrophobicContact SD-CD2 3.91Å
52	F	96.3	Very high	94.9	Very high	2 Å²	2	61.9 Å²	61.9	1%	0.009	32%	0.321	C	S	.	.	H	α-helix	trans	-99	-1.3	-172.2	-70.8	-83.5	0	0	0	114.5	F20 I24 L26 H37 L40 I41 L48 W49 L60 F68	F20-F52 AromaticContact CD1-CD1 3.61Å; F20-F52 HydrophobicContact CD1-CD1 3.61Å; F20-F52 HydrophobicContact CD1-CE1 4.01Å; F20-F52 VanDerWaalsContact CD2-O 3.23Å; F20-F52 WeakPolarHBondContact CD2-O 3.4Å; F20-F52 AromaticContact CE1-CD1 3.59Å; F20-F52 HydrophobicContact CE1-CD1 3.59Å; F20-F52 AromaticContact CE1-CE1 3.92Å; F20-F52 HydrophobicContact CE1-CE1 3.92Å; F20-F52 VanDerWaalsContact CE2-O 3.24Å; F20-F52 WeakPolarHBondContact CE2-O 3.22Å; F20-F52 HydrophobicContact CG-CD1 4.16Å; F20-F52 HydrophobicContact CZ-CD1 4.13Å; I24-F52 HydrophobicContact CD1-CE1 4.5Å; I24-F52 HydrophobicContact CG2-CE1 3.87Å; I24-F52 HydrophobicContact CG2-CZ 4.2Å; L26-F52 HydrophobicContact CD2-CE2 4.29Å; L26-F52 HydrophobicContact CD2-CZ 3.72Å; H37-F52 PolarHBondContact NE2-O 3.19Å; L40-F52 HydrophobicContact CB-CB 4.35Å; L40-F52 HydrophobicContact CB-CD2 4.04Å; L40-F52 HydrophobicContact CB-CG 4.2Å; L40-F52 HydrophobicContact CD1-CD1 4.1Å; L40-F52 HydrophobicContact CD1-CD2 3.83Å; L40-F52 HydrophobicContact CD1-CE1 4.03Å; L40-F52 HydrophobicContact CD1-CE2 3.77Å; L40-F52 HydrophobicContact CD1-CG 4.02Å; L40-F52 HydrophobicContact CD1-CZ 3.88Å; L40-F52 HydrophobicContact CG-CD2 4.49Å; I41-F52 HydrophobicContact CG2-CB 3.97Å; L48-F52 HydrophobicContact CD2-CD2 4.48Å; L48-F52 HydrophobicContact CD2-CE2 4.16Å; L48-F52 WeakPolarHBondContact O-CD2 3.18Å; L48-F52 PolarHBondContact O-N 3.42Å; W49-F52 PolarHBondContact O-N 3.49Å; F52-L60 HydrophobicContact CD1-CD1 4.35Å; F52-L60 HydrophobicContact CE1-CD1 3.97Å; F52-L60 HydrophobicContact CE2-CD1 4.43Å; F52-L60 HydrophobicContact CZ-CD1 4.01Å; F52-F68 AromaticContact CE1-CD2 3.91Å; F52-F68 HydrophobicContact CE1-CD2 3.91Å; F52-F68 HydrophobicContact CE1-CE2 4Å; F52-F68 HydrophobicContact CE1-CG 4.16Å; F52-F68 HydrophobicContact CE1-CZ 4.34Å; F52-F68 HydrophobicContact CZ-CB 4.24Å; F52-F68 HydrophobicContact CZ-CD2 4.16Å; F52-F68 HydrophobicContact CZ-CG 4.08Å
53	S	93.7	Very high	94.9	Very high	55 Å²	55	61.3 Å²	61.3	39%	0.385	31%	0.313	S	S	.	.	H	α-helix	trans	-116.2	-31.7	173	-51.5	0	0	0	0	114.5	I41 W49	I41-S53 WeakPolarHBondContact CG2-OG 3.34Å; W49-S53 PolarHBondContact NE1-OG 2.99Å; W49-S53 WeakPolarHBondContact O-CA 3.32Å; W49-S53 WeakPolarHBondContact O-CB 3.35Å; W49-S53 PolarHBondContact O-N 2.89Å; W49-S53 PolarHBondContact O-OG 2.82Å
54	K	90.9	Very high	94.8	Very high	128 Å²	128	66.3 Å²	66.3	56%	0.557	35%	0.348	S	S	*	.	H	α-helix	trans	-108.1	-24.3	-172.5	-62.9	-178.1	-178.6	159.6	0	115	D45 W49 N50	D45-K54 IonicContact OD1-NZ 3.8Å; W49-K54 HydrophobicContact CZ3-CD 4.32Å; N50-K54 WeakPolarHBondContact O-CB 3.37Å; N50-K54 PolarHBondContact O-N 2.93Å; N50-K54 VanDerWaalsContact O-N 3.07Å; N50-K54 WeakPolarHBondContact OD1-CD 3.41Å; N50-K54 WeakPolarHBondContact OD1-CE 3.34Å; N50-K54 PolarHBondContact OD1-NZ 3.41Å
55	K	91.3	Very high	94.8	Very high	96 Å²	96	69.7 Å²	69.7	42%	0.417	35%	0.354	S	S	.	.	S	Bend	trans	-97.7	153.3	-178.4	-64.1	-169.9	172.8	-169.8	0	111.6	F20 E59 L60	F20-K55 WeakPolarHBondContact CE2-O 3.18Å; F20-K55 WeakPolarHBondContact CZ-O 3.49Å; K55-E59 HydrophobicContact CB-CB 4.48Å; K55-E59 WeakPolarHBondContact CB-OE2 3.41Å; K55-L60 HydrophobicContact CB-CD2 4.17Å; K55-L60 HydrophobicContact CD-CD2 3.73Å
56	S	89.7	Confident	94.8	Very high	42 Å²	42	66.4 Å²	66.4	29%	0.294	34%	0.344	S	S	.	.			trans	-76.2	151.6	169.4	76.3	0	0	0	0	111.6	K58 E59	S56-K58 PolarHBondContact O-N 3.32Å; S56-E59 WeakPolarHBondContact CB-OE1 3.42Å; S56-E59 PolarHBondContact N-OE1 3.35Å; S56-E59 PolarHBondContact O-N 3.39Å; S56-E59 PolarHBondContact OG-OE1 3.29Å
57	P	90.9	Very high	94.8	Very high	24 Å²	24	68.4 Å²	68.4	16%	0.156	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-5.4	176.8	-20.7	28.6	0	0	0	115.9	P19 F20 R62 F68	P19-P57 HydrophobicContact CB-CG 4.02Å; P19-P57 HydrophobicContact CG-CG 4.39Å; P19-P57 WeakPolarHBondContact O-CG 3.45Å; F20-P57 HydrophobicContact CD1-CB 4.24Å; F20-P57 HydrophobicContact CD1-CG 3.87Å; F20-P57 HydrophobicContact CD2-CG 4.48Å; F20-P57 HydrophobicContact CE1-CB 3.92Å; F20-P57 HydrophobicContact CE1-CG 3.73Å; F20-P57 HydrophobicContact CE2-CG 4.36Å; F20-P57 HydrophobicContact CG-CG 4.24Å; F20-P57 HydrophobicContact CZ-CB 4.47Å; F20-P57 HydrophobicContact CZ-CG 3.99Å; P57-R62 PolarHBondContact O-NE 3.07Å; P57-R62 PolarHBondContact O-NH2 3.02Å; P57-F68 HydrophobicContact CB-CE1 4.37Å; P57-F68 HydrophobicContact CB-CZ 4.26Å
58	K	90.8	Very high	94.8	Very high	200 Å²	200	67.5 Å²	67.5	87%	0.87	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-21.9	175.8	-66.9	179.9	178.6	177.6	0	112.9	S56	S56-K58 PolarHBondContact O-N 3.32Å
59	E	93.1	Very high	94.9	Very high	119 Å²	119	70.8 Å²	70.8	56%	0.556	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-17.5	178.1	-69.1	153.3	-125.2	0	0	113.2	K55 S56	K55-E59 HydrophobicContact CB-CB 4.48Å; K55-E59 WeakPolarHBondContact CB-OE2 3.41Å; S56-E59 WeakPolarHBondContact CB-OE1 3.42Å; S56-E59 PolarHBondContact N-OE1 3.35Å; S56-E59 PolarHBondContact O-N 3.39Å; S56-E59 PolarHBondContact OG-OE1 3.29Å
60	L	95	Very high	94.9	Very high	18 Å²	18	68.7 Å²	68.7	9%	0.094	35%	0.353	C	S	.	.	S	Bend	trans	-83.4	133.2	178.7	-58.9	-173	0	0	0	110.3	F20 M51 F52 K55 F68	F20-L60 HydrophobicContact CE1-CD1 3.74Å; F20-L60 HydrophobicContact CZ-CD1 3.98Å; M51-L60 HydrophobicContact CB-CD1 4.39Å; M51-L60 HydrophobicContact CB-CD2 4Å; M51-L60 HydrophobicContact CG-CD2 4.06Å; F52-L60 HydrophobicContact CD1-CD1 4.35Å; F52-L60 HydrophobicContact CE1-CD1 3.97Å; F52-L60 HydrophobicContact CE2-CD1 4.43Å; F52-L60 HydrophobicContact CZ-CD1 4.01Å; K55-L60 HydrophobicContact CB-CD2 4.17Å; K55-L60 HydrophobicContact CD-CD2 3.73Å; L60-F68 HydrophobicContact CB-CD1 3.64Å; L60-F68 HydrophobicContact CB-CE1 3.93Å; L60-F68 HydrophobicContact CD1-CD1 3.82Å; L60-F68 HydrophobicContact CD1-CE1 3.86Å; L60-F68 HydrophobicContact CG-CD1 4.37Å; L60-F68 HydrophobicContact CG-CE1 4.42Å
61	A	96.3	Very high	95	Very high	62 Å²	62	73.1 Å²	73.1	51%	0.512	38%	0.377	S	S	.	.			trans	-57.1	145.8	175.5	0	0	0	0	0	111.2	F68 F69	A61-F68 WeakPolarHBondContact O-CA 3.45Å; A61-F69 HydrophobicContact CB-CB 4.38Å; A61-F69 PolarHBondContact O-N 2.86Å
62	R	97.1	Very high	95.1	Very high	124 Å²	124	74.7 Å²	74.7	47%	0.468	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-134.1	150.9	177.6	-67.4	176	-175.9	-118.9	8.4	111.2	P57 G66 R67 F68	P57-R62 PolarHBondContact O-NE 3.07Å; P57-R62 PolarHBondContact O-NH2 3.02Å; R62-G66 WeakPolarHBondContact CD-O 3.35Å; R62-G66 PolarHBondContact NH1-O 3.48Å; R62-R67 CarbonylContact C-O 3.57Å; R62-R67 WeakPolarHBondContact CA-O 3.32Å; R62-R67 WeakPolarHBondContact CB-O 3.48Å; R62-F68 HydrophobicContact CG-CD1 4.34Å
63	D	96.6	Very high	95.1	Very high	26 Å²	26	76.2 Å²	76.2	14%	0.139	39%	0.389	C	S	.	.			trans	-80.3	177.3	170.6	73.7	7.9	0	0	0	112.3	N27 K65 G66 R67	N27-D63 WeakPolarHBondContact CB-OD2 3.14Å; N27-D63 PolarHBondContact ND2-OD2 2.9Å; D63-K65 PolarHBondContact O-N 2.89Å; D63-K65 WeakPolarHBondContact OD1-CA 3.42Å; D63-K65 WeakPolarHBondContact OD1-CB 3.39Å; D63-K65 PolarHBondContact OD1-N 3.16Å; D63-G66 PolarHBondContact O-N 3.2Å; D63-G66 PolarHBondContact OD1-N 2.93Å; D63-G66 VanDerWaalsContact OD1-N 3.12Å; D63-R67 PolarHBondContact N-O 2.86Å; D63-R67 PolarHBondContact OD1-N 2.68Å; D63-R67 IonicContact OD1-NE 3.2Å; D63-R67 IonicContact OD2-CZ 3.81Å; D63-R67 IonicContact OD2-NE 2.68Å; D63-R67 PolarHBondContact OD2-NE 2.8Å; D63-R67 IonicContact OD2-NH2 3.8Å; D63-R67 PolarHBondContact OD2-NH2 3.12Å
64	S	95.8	Very high	95.3	Very high	129 Å²	129	73.9 Å²	73.9	90%	0.902	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-7.6	178.6	56.8	0	0	0	0	114.9
65	K	96.1	Very high	95.6	Very high	160 Å²	160	75.2 Å²	75.2	70%	0.696	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	7.2	173.6	-61.9	-173.3	177.4	-175.7	0	112.3	D63 R67	D63-K65 PolarHBondContact O-N 2.89Å; D63-K65 WeakPolarHBondContact OD1-CA 3.42Å; D63-K65 WeakPolarHBondContact OD1-CB 3.39Å; D63-K65 PolarHBondContact OD1-N 3.16Å; K65-R67 VanDerWaalsContact C-N 3.32Å; K65-R67 PolarHBondContact O-N 2.84Å
66	G	95.2	Very high	95.9	Very high	33 Å²	33	70.7 Å²	70.7	34%	0.34	36%	0.36	S	S	.	.	S	Bend	trans	80	6.4	176	0	0	0	0	0	115.1	R62 D63	R62-G66 WeakPolarHBondContact CD-O 3.35Å; R62-G66 PolarHBondContact NH1-O 3.48Å; D63-G66 PolarHBondContact O-N 3.2Å; D63-G66 PolarHBondContact OD1-N 2.93Å; D63-G66 VanDerWaalsContact OD1-N 3.12Å
67	R	97.6	Very high	96.3	Very high	43 Å²	43	68.8 Å²	68.8	16%	0.162	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-81.8	146.8	179.6	-56.7	173.2	-64.2	-163.3	9.5	109.9	E25 V32 R62 D63 K65 F69	E25-R67 HydrophobicContact CB-CB 4.16Å; E25-R67 HydrophobicContact CB-CG 3.83Å; E25-R67 WeakPolarHBondContact OE2-CD 3.35Å; E25-R67 WeakPolarHBondContact OE2-CG 3.28Å; V32-R67 VanDerWaalsContact CG2-NH1 3.32Å; R62-R67 CarbonylContact C-O 3.57Å; R62-R67 WeakPolarHBondContact CA-O 3.32Å; R62-R67 WeakPolarHBondContact CB-O 3.48Å; D63-R67 PolarHBondContact N-O 2.86Å; D63-R67 PolarHBondContact OD1-N 2.68Å; D63-R67 IonicContact OD1-NE 3.2Å; D63-R67 IonicContact OD2-CZ 3.81Å; D63-R67 IonicContact OD2-NE 2.68Å; D63-R67 PolarHBondContact OD2-NE 2.8Å; D63-R67 IonicContact OD2-NH2 3.8Å; D63-R67 PolarHBondContact OD2-NH2 3.12Å; K65-R67 VanDerWaalsContact C-N 3.32Å; K65-R67 PolarHBondContact O-N 2.84Å; R67-F69 PolarHBondContact O-N 3.36Å
68	F	98.1	Very high	96.6	Very high	19 Å²	19	73.5 Å²	73.5	8%	0.083	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	129.3	-178.6	-62.1	-77.1	0	0	0	110.4	F20 I24 E25 L26 N27 F52 P57 L60 A61 R62	F20-F68 HydrophobicContact CD1-CE2 4.45Å; F20-F68 AromaticContact CD1-CZ 3.93Å; F20-F68 HydrophobicContact CD1-CZ 3.93Å; F20-F68 HydrophobicContact CE1-CE1 4.18Å; F20-F68 AromaticContact CE1-CZ 3.92Å; F20-F68 HydrophobicContact CE1-CZ 3.92Å; I24-F68 HydrophobicContact CD1-CE2 4.07Å; I24-F68 HydrophobicContact CG2-CD2 3.8Å; I24-F68 HydrophobicContact CG2-CE2 4.12Å; E25-F68 PolarHBondContact O-N 3.25Å; E25-F68 VanDerWaalsContact O-N 3.12Å; L26-F68 CarbonylContact C-O 3.6Å; L26-F68 WeakPolarHBondContact CA-O 3.13Å; L26-F68 HydrophobicContact CD2-CB 3.87Å; N27-F68 PolarHBondContact N-O 2.81Å; F52-F68 AromaticContact CE1-CD2 3.91Å; F52-F68 HydrophobicContact CE1-CD2 3.91Å; F52-F68 HydrophobicContact CE1-CE2 4Å; F52-F68 HydrophobicContact CE1-CG 4.16Å; F52-F68 HydrophobicContact CE1-CZ 4.34Å; F52-F68 HydrophobicContact CZ-CB 4.24Å; F52-F68 HydrophobicContact CZ-CD2 4.16Å; F52-F68 HydrophobicContact CZ-CG 4.08Å; P57-F68 HydrophobicContact CB-CE1 4.37Å; P57-F68 HydrophobicContact CB-CZ 4.26Å; L60-F68 HydrophobicContact CB-CD1 3.64Å; L60-F68 HydrophobicContact CB-CE1 3.93Å; L60-F68 HydrophobicContact CD1-CD1 3.82Å; L60-F68 HydrophobicContact CD1-CE1 3.86Å; L60-F68 HydrophobicContact CG-CD1 4.37Å; L60-F68 HydrophobicContact CG-CE1 4.42Å; A61-F68 WeakPolarHBondContact O-CA 3.45Å; R62-F68 HydrophobicContact CG-CD1 4.34Å
69	F	98.3	Very high	97	Very high	71 Å²	71	65.2 Å²	65.2	31%	0.311	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.5	-172.9	-177.3	-108.5	0	0	0	112.1	N27 A61 R67 D71	N27-F69 HydrophobicContact CB-CD2 4.14Å; N27-F69 CarbonylContact O-C 3.53Å; N27-F69 WeakPolarHBondContact O-CA 3.3Å; N27-F69 WeakPolarHBondContact O-CD2 3.22Å; A61-F69 HydrophobicContact CB-CB 4.38Å; A61-F69 PolarHBondContact O-N 2.86Å; R67-F69 PolarHBondContact O-N 3.36Å; F69-D71 HydrophobicContact CE1-CB 3.85Å; F69-D71 HydrophobicContact CZ-CB 4.22Å
70	L	98.1	Very high	97.2	Very high	13 Å²	13	59.6 Å²	59.6	7%	0.068	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	119.3	174.2	-60.9	176.7	0	0	0	108.6	L26 N27 V28 G29 L48 M51 R72 F77 F108	L26-L70 HydrophobicContact CD1-CD1 4.35Å; N27-L70 PolarHBondContact O-N 3.27Å; V28-L70 CarbonylContact C-O 3.56Å; V28-L70 VanDerWaalsContact CA-O 3.31Å; V28-L70 WeakPolarHBondContact CA-O 3.48Å; V28-L70 HydrophobicContact CB-CB 4.49Å; V28-L70 HydrophobicContact CG1-CB 4.18Å; V28-L70 HydrophobicContact CG2-CB 4.21Å; V28-L70 HydrophobicContact CG2-CD1 4.05Å; G29-L70 PolarHBondContact N-O 2.71Å; L48-L70 HydrophobicContact CD2-CD1 3.92Å; M51-L70 HydrophobicContact CE-CD2 4.17Å; M51-L70 HydrophobicContact SD-CD2 3.91Å; L70-R72 PolarHBondContact O-N 2.85Å; L70-F77 HydrophobicContact CD1-CE2 4.12Å; L70-F77 HydrophobicContact CD1-CZ 4.33Å; L70-F108 HydrophobicContact CD1-CE1 4.19Å; L70-F108 HydrophobicContact CD1-CZ 4.44Å
71	D	97.9	Very high	97.4	Very high	135 Å²	135	58.7 Å²	58.7	72%	0.722	29%	0.294	S	S	*	.			trans	-82.6	63.6	-179.2	-169.1	27.6	0	0	0	111.6	F69	F69-D71 HydrophobicContact CE1-CB 3.85Å; F69-D71 HydrophobicContact CZ-CB 4.22Å
72	R	98.2	Very high	97.4	Very high	70 Å²	70	58.3 Å²	58.3	26%	0.264	28%	0.283	S	S	.	.	S	Bend	trans	-136.5	171.3	-174.3	-62.4	-55.3	-63	171.5	-2.4	112.1	V28 G29 L70 G74 E104 F107 F108	V28-R72 CarbonylContact C-O 3.59Å; V28-R72 HydrophobicContact CG1-CB 3.96Å; G29-R72 VanDerWaalsContact CA-O 3.24Å; G29-R72 WeakPolarHBondContact CA-O 3.48Å; G29-R72 PolarHBondContact N-O 2.95Å; L70-R72 PolarHBondContact O-N 2.85Å; R72-G74 PolarHBondContact O-N 3.12Å; R72-E104 IonicContact CZ-OE1 2.85Å; R72-E104 IonicContact CZ-OE2 3.2Å; R72-E104 VanDerWaalsContact CZ-OE2 3.26Å; R72-E104 IonicContact NE-OE1 2.71Å; R72-E104 IonicContact NE-OE2 2.67Å; R72-E104 PolarHBondContact NE-OE2 3.25Å; R72-E104 IonicContact NH2-OE1 3.57Å; R72-E104 PolarHBondContact NH2-OE1 3.04Å; R72-E104 IonicContact NH2-OE2 2.72Å; R72-E104 PolarHBondContact NH2-OE2 3.27Å; R72-F107 VanDerWaalsContact CD-CE1 3.41Å; R72-F107 HydrophobicContact CG-CD1 3.83Å; R72-F107 HydrophobicContact CG-CE1 3.46Å; R72-F107 VanDerWaalsContact CG-CE1 3.46Å; R72-F107 HydrophobicContact CG-CZ 3.98Å; R72-F108 HydrophobicContact CB-CZ 4.2Å; R72-F108 HydrophobicContact CG-CE2 4.42Å; R72-F108 HydrophobicContact CG-CZ 3.87Å
73	D	97.5	Very high	97.5	Very high	33 Å²	33	53 Å²	53	18%	0.176	26%	0.263	C	S	.	.			trans	-64	106.5	177.8	-168.8	-48.6	0	0	0	111.7	F75 L76 F77 R100 E104	D73-F75 PolarHBondContact O-N 3.47Å; D73-F75 PolarHBondContact OD1-N 2.92Å; D73-L76 HydrophobicContact CB-CB 4.18Å; D73-L76 HydrophobicContact CB-CD1 4.16Å; D73-L76 HydrophobicContact CB-CG 4.35Å; D73-L76 PolarHBondContact OD1-N 2.78Å; D73-F77 WeakPolarHBondContact O-CB 3.24Å; D73-F77 PolarHBondContact O-N 2.92Å; D73-F77 VanDerWaalsContact O-N 3.08Å; D73-R100 IonicContact OD2-CZ 2.97Å; D73-R100 IonicContact OD2-NE 2.68Å; D73-R100 IonicContact OD2-NH2 2.76Å; D73-R100 PolarHBondContact OD2-NH2 3.36Å; D73-E104 HydrophobicContact CB-CG 4.48Å
74	G	97.5	Very high	97.5	Very high	6 Å²	6	51.8 Å²	51.8	6%	0.062	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-38.6	-179.7	0	0	0	0	0	113.9	V28 Y33 R72 F77	V28-G74 WeakPolarHBondContact O-CA 3.41Å; Y33-G74 VanDerWaalsContact CE2-O 3.28Å; Y33-G74 WeakPolarHBondContact CE2-O 3.35Å; Y33-G74 PolarHBondContact OH-O 3.19Å; R72-G74 PolarHBondContact O-N 3.12Å; G74-F77 WeakPolarHBondContact O-CB 3.38Å; G74-F77 PolarHBondContact O-N 3.03Å
75	F	97.1	Very high	97.6	Very high	157 Å²	157	51 Å²	51	69%	0.689	23%	0.234	S	C	*	.	H	α-helix	trans	-72.5	-41.3	-176.3	-68.5	-77.8	0	0	0	111.8	D73 F77 R78	D73-F75 PolarHBondContact O-N 3.47Å; D73-F75 PolarHBondContact OD1-N 2.92Å; F75-F77 VanDerWaalsContact C-N 3.3Å; F75-R78 WeakPolarHBondContact O-CB 3.48Å; F75-R78 PolarHBondContact O-N 2.99Å
76	L	97.4	Very high	97.5	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-71	-27.6	176.7	-63.2	177.2	0	0	0	112.3	D73 R78 Y79 F95 E97 R100 L101 E104	D73-L76 HydrophobicContact CB-CB 4.18Å; D73-L76 HydrophobicContact CB-CD1 4.16Å; D73-L76 HydrophobicContact CB-CG 4.35Å; D73-L76 PolarHBondContact OD1-N 2.78Å; L76-R78 PolarHBondContact O-N 3.07Å; L76-R78 VanDerWaalsContact O-N 3.12Å; L76-Y79 HydrophobicContact CD2-CE2 4.49Å; L76-Y79 PolarHBondContact O-N 3.21Å; L76-Y79 VanDerWaalsContact O-N 3.1Å; L76-F95 HydrophobicContact CD2-CZ 4.01Å; L76-E97 HydrophobicContact CD2-CB 3.99Å; L76-R100 HydrophobicContact CD1-CB 3.44Å; L76-R100 VanDerWaalsContact CD1-CB 3.44Å; L76-L101 HydrophobicContact CB-CD1 4.32Å; L76-L101 HydrophobicContact CD2-CB 4.41Å; L76-E104 HydrophobicContact CB-CG 4.04Å; L76-E104 HydrophobicContact CD1-CG 4.09Å
77	F	98.4	Very high	97.4	Very high	1 Å²	1	52 Å²	52	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-58.2	-24.1	175.7	-168.8	-96.8	0	0	0	113.6	L26 V28 Y33 L48 L70 D73 G74 F75 Y79 I80 L81 F108	L26-F77 HydrophobicContact CD1-CE1 3.83Å; L26-F77 HydrophobicContact CD1-CZ 3.68Å; V28-F77 HydrophobicContact CB-CB 4.4Å; V28-F77 HydrophobicContact CB-CD1 4.5Å; V28-F77 HydrophobicContact CB-CG 4.29Å; V28-F77 HydrophobicContact CG1-CB 3.89Å; V28-F77 HydrophobicContact CG1-CD2 4.04Å; V28-F77 HydrophobicContact CG1-CG 3.92Å; V28-F77 HydrophobicContact CG2-CD1 3.83Å; V28-F77 HydrophobicContact CG2-CD2 4.28Å; V28-F77 HydrophobicContact CG2-CE1 4.02Å; V28-F77 HydrophobicContact CG2-CE2 4.44Å; V28-F77 HydrophobicContact CG2-CG 3.97Å; V28-F77 HydrophobicContact CG2-CZ 4.32Å; Y33-F77 HydrophobicContact CD1-CD1 4.48Å; Y33-F77 AromaticContact CD2-CD1 3.59Å; Y33-F77 HydrophobicContact CD2-CD1 3.59Å; Y33-F77 HydrophobicContact CD2-CE1 4.2Å; Y33-F77 HydrophobicContact CE2-CB 4.13Å; Y33-F77 AromaticContact CE2-CD1 3.76Å; Y33-F77 HydrophobicContact CE2-CD1 3.76Å; Y33-F77 HydrophobicContact CE2-CG 4.4Å; Y33-F77 AromaticContact CG-CD1 3.98Å; Y33-F77 HydrophobicContact CG-CD1 3.98Å; Y33-F77 HydrophobicContact CG-CE1 4.28Å; L48-F77 HydrophobicContact CD1-CE2 4.09Å; L48-F77 HydrophobicContact CD1-CZ 4.2Å; L70-F77 HydrophobicContact CD1-CE2 4.12Å; L70-F77 HydrophobicContact CD1-CZ 4.33Å; D73-F77 WeakPolarHBondContact O-CB 3.24Å; D73-F77 PolarHBondContact O-N 2.92Å; D73-F77 VanDerWaalsContact O-N 3.08Å; G74-F77 WeakPolarHBondContact O-CB 3.38Å; G74-F77 PolarHBondContact O-N 3.03Å; F75-F77 VanDerWaalsContact C-N 3.3Å; F77-Y79 VanDerWaalsContact C-N 3.32Å; F77-Y79 PolarHBondContact O-N 2.94Å; F77-I80 HydrophobicContact CD2-CB 4.22Å; F77-I80 HydrophobicContact CD2-CG2 4.26Å; F77-I80 HydrophobicContact CE2-CG2 4.14Å; F77-I80 WeakPolarHBondContact O-CB 3.49Å; F77-I80 PolarHBondContact O-N 3.46Å; F77-L81 HydrophobicContact CD1-CB 4.36Å; F77-L81 HydrophobicContact CE1-CB 4.13Å; F77-L81 HydrophobicContact CE1-CD1 4.34Å; F77-L81 HydrophobicContact CE1-CD2 4.38Å; F77-L81 WeakPolarHBondContact O-CB 3.44Å; F77-L81 PolarHBondContact O-N 2.91Å; F77-F108 HydrophobicContact CD2-CE1 4.5Å; F77-F108 AromaticContact CD2-CE2 3.7Å; F77-F108 HydrophobicContact CD2-CE2 3.7Å; F77-F108 AromaticContact CD2-CZ 3.63Å; F77-F108 HydrophobicContact CD2-CZ 3.63Å; F77-F108 HydrophobicContact CE2-CE1 4.05Å; F77-F108 AromaticContact CE2-CE2 3.98Å; F77-F108 HydrophobicContact CE2-CE2 3.98Å; F77-F108 AromaticContact CE2-CZ 3.62Å; F77-F108 HydrophobicContact CE2-CZ 3.62Å
78	R	97.4	Very high	97.1	Very high	123 Å²	123	53.9 Å²	53.9	46%	0.464	25%	0.252	S	S	.	.	H	α-helix	trans	-51.3	-51.3	171.3	-176.1	173.1	69.6	169.7	2.6	111.8	Y33 F75 L76 I80 L81 D82	Y33-R78 HydrophobicContact CE1-CB 4.33Å; F75-R78 WeakPolarHBondContact O-CB 3.48Å; F75-R78 PolarHBondContact O-N 2.99Å; L76-R78 PolarHBondContact O-N 3.07Å; L76-R78 VanDerWaalsContact O-N 3.12Å; R78-I80 VanDerWaalsContact C-N 3.35Å; R78-I80 PolarHBondContact O-N 3.01Å; R78-L81 PolarHBondContact O-N 2.85Å; R78-L81 VanDerWaalsContact O-N 3.16Å; R78-D82 WeakPolarHBondContact CG-OD2 3.48Å; R78-D82 VanDerWaalsContact O-CG 3.26Å; R78-D82 PolarHBondContact O-N 3.32Å
79	Y	97.8	Very high	96.7	Very high	27 Å²	27	54.6 Å²	54.6	11%	0.106	26%	0.257	C	S	.	.	H	α-helix	trans	-71.8	-29.7	-177	-52.3	-75	0	0	0	112.6	L76 F77 L81 Y83 L91 F95 L101	L76-Y79 HydrophobicContact CD2-CE2 4.49Å; L76-Y79 PolarHBondContact O-N 3.21Å; L76-Y79 VanDerWaalsContact O-N 3.1Å; F77-Y79 VanDerWaalsContact C-N 3.32Å; F77-Y79 PolarHBondContact O-N 2.94Å; Y79-L81 VanDerWaalsContact C-N 3.35Å; Y79-Y83 WeakPolarHBondContact O-CB 3.45Å; Y79-Y83 PolarHBondContact O-N 3.01Å; Y79-L91 HydrophobicContact CD1-CD2 3.66Å; Y79-L91 HydrophobicContact CE1-CD2 4.01Å; Y79-L91 HydrophobicContact CG-CD2 4.06Å; Y79-F95 HydrophobicContact CD2-CE2 4.4Å; Y79-F95 HydrophobicContact CD2-CZ 4.03Å; Y79-F95 HydrophobicContact CE1-CE2 4.41Å; Y79-F95 AromaticContact CE2-CE2 3.56Å; Y79-F95 HydrophobicContact CE2-CE2 3.56Å; Y79-F95 AromaticContact CE2-CZ 3.58Å; Y79-F95 HydrophobicContact CE2-CZ 3.58Å; Y79-F95 AromaticContact CZ-CE2 3.56Å; Y79-F95 WeakPolarHBondContact OH-CE2 3.39Å; Y79-L101 HydrophobicContact CD2-CD1 4.33Å; Y79-L101 HydrophobicContact CD2-CD2 4.13Å; Y79-L101 HydrophobicContact CG-CD2 4.01Å
80	I	98.3	Very high	96.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.7	-46	169.5	-59	-61.3	0	0	0	109.9	F77 R78 Y83 L84 L101 E104 A105 F108 L110 L113	F77-I80 HydrophobicContact CD2-CB 4.22Å; F77-I80 HydrophobicContact CD2-CG2 4.26Å; F77-I80 HydrophobicContact CE2-CG2 4.14Å; F77-I80 WeakPolarHBondContact O-CB 3.49Å; F77-I80 PolarHBondContact O-N 3.46Å; R78-I80 VanDerWaalsContact C-N 3.35Å; R78-I80 PolarHBondContact O-N 3.01Å; I80-Y83 PolarHBondContact O-N 3.17Å; I80-L84 HydrophobicContact CG2-CD1 4.33Å; I80-L84 WeakPolarHBondContact O-CG 3.13Å; I80-L84 PolarHBondContact O-N 3.48Å; I80-L101 HydrophobicContact CD1-CD1 3.84Å; I80-L101 HydrophobicContact CG1-CD1 4.13Å; I80-E104 HydrophobicContact CD1-CB 4.05Å; I80-E104 HydrophobicContact CG1-CB 4.24Å; I80-A105 HydrophobicContact CD1-CB 4.24Å; I80-F108 HydrophobicContact CD1-CD2 4.3Å; I80-F108 HydrophobicContact CG1-CD2 4.09Å; I80-F108 HydrophobicContact CG1-CE2 4.36Å; I80-F108 HydrophobicContact CG2-CD2 3.88Å; I80-F108 HydrophobicContact CG2-CE2 4.39Å; I80-F108 HydrophobicContact CG2-CG 4.3Å; I80-L110 HydrophobicContact CD1-CD1 4.35Å; I80-L110 HydrophobicContact CG2-CD1 3.76Å; I80-L113 HydrophobicContact CD1-CD2 3.83Å
81	L	98.1	Very high	96	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-70.5	-37.3	-178.6	-169.9	63	0	0	0	112.7	Y33 T35 T39 L40 F77 R78 Y79 L84 R85	Y33-L81 HydrophobicContact CD1-CD2 3.69Å; Y33-L81 HydrophobicContact CE1-CD2 4.48Å; Y33-L81 HydrophobicContact CG-CD2 4.21Å; T35-L81 HydrophobicContact CG2-CD1 4.05Å; T39-L81 HydrophobicContact CG2-CD1 4.03Å; L40-L81 HydrophobicContact CD2-CD1 4.4Å; F77-L81 HydrophobicContact CD1-CB 4.36Å; F77-L81 HydrophobicContact CE1-CB 4.13Å; F77-L81 HydrophobicContact CE1-CD1 4.34Å; F77-L81 HydrophobicContact CE1-CD2 4.38Å; F77-L81 WeakPolarHBondContact O-CB 3.44Å; F77-L81 PolarHBondContact O-N 2.91Å; R78-L81 PolarHBondContact O-N 2.85Å; R78-L81 VanDerWaalsContact O-N 3.16Å; Y79-L81 VanDerWaalsContact C-N 3.35Å; L81-L84 PolarHBondContact O-N 3.24Å; L81-R85 WeakPolarHBondContact O-CG 3.28Å; L81-R85 PolarHBondContact O-N 3.1Å; L81-R85 VanDerWaalsContact O-N 3.14Å
82	D	97.4	Very high	95.5	Very high	53 Å²	53	55.4 Å²	55.4	28%	0.283	27%	0.272	S	S	.	.	H	α-helix	trans	-65.9	-43.3	174.4	-65.4	-27.9	0	0	0	111.1	R78 L84 R85 D86	R78-D82 WeakPolarHBondContact CG-OD2 3.48Å; R78-D82 VanDerWaalsContact O-CG 3.26Å; R78-D82 PolarHBondContact O-N 3.32Å; D82-L84 VanDerWaalsContact C-N 3.29Å; D82-L84 PolarHBondContact O-N 3.37Å; D82-R85 WeakPolarHBondContact O-CB 3.47Å; D82-R85 PolarHBondContact O-N 3.12Å; D82-R85 IonicContact OD1-CZ 3.91Å; D82-R85 IonicContact OD1-NH1 2.81Å; D82-R85 PolarHBondContact OD1-NH1 3.27Å; D82-D86 PolarHBondContact O-N 3.43Å
83	Y	97.9	Very high	94.8	Very high	12 Å²	12	59 Å²	59	5%	0.047	30%	0.297	C	S	.	.	H	α-helix	trans	-58.1	-39.2	171.3	176.4	-98.1	0	0	0	112.8	V43 Y79 I80 R85 L87 N88 L89 L110 L113	V43-Y83 HydrophobicContact CG2-CE1 4.14Å; Y79-Y83 WeakPolarHBondContact O-CB 3.45Å; Y79-Y83 PolarHBondContact O-N 3.01Å; I80-Y83 PolarHBondContact O-N 3.17Å; Y83-R85 VanDerWaalsContact C-N 3.28Å; Y83-R85 PolarHBondContact O-N 2.88Å; Y83-L87 WeakPolarHBondContact O-CA 3.5Å; Y83-L87 PolarHBondContact O-N 3.44Å; Y83-N88 WeakPolarHBondContact CA-O 3.19Å; Y83-L89 HydrophobicContact CD2-CB 4.39Å; Y83-L110 HydrophobicContact CD1-CD1 4.15Å; Y83-L110 HydrophobicContact CE1-CD2 4.41Å; Y83-L113 HydrophobicContact CD1-CB 4.12Å; Y83-L113 HydrophobicContact CD1-CD2 3.85Å; Y83-L113 HydrophobicContact CD1-CG 4.42Å; Y83-L113 HydrophobicContact CD2-CB 4.31Å; Y83-L113 HydrophobicContact CD2-CD1 3.86Å; Y83-L113 HydrophobicContact CD2-CD2 4.45Å; Y83-L113 HydrophobicContact CD2-CG 4.42Å; Y83-L113 HydrophobicContact CE1-CB 3.92Å; Y83-L113 HydrophobicContact CE1-CD2 4.47Å; Y83-L113 HydrophobicContact CE2-CB 4.12Å; Y83-L113 HydrophobicContact CE2-CD1 4.3Å; Y83-L113 HydrophobicContact CG-CB 4.3Å; Y83-L113 HydrophobicContact CG-CD1 4.04Å; Y83-L113 HydrophobicContact CG-CD2 3.83Å; Y83-L113 HydrophobicContact CG-CG 4.28Å
84	L	97.7	Very high	94.2	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-71.3	-18.4	177	-72.7	173.1	0	0	0	114.2	T39 A42 V43 L48 I80 L81 D82 L110	T39-L84 HydrophobicContact CG2-CB 3.8Å; A42-L84 VanDerWaalsContact CB-O 3.3Å; A42-L84 WeakPolarHBondContact CB-O 3.34Å; V43-L84 HydrophobicContact CB-CD2 4.08Å; V43-L84 HydrophobicContact CG2-CD2 3.68Å; L48-L84 HydrophobicContact CD1-CD1 3.62Å; I80-L84 HydrophobicContact CG2-CD1 4.33Å; I80-L84 WeakPolarHBondContact O-CG 3.13Å; I80-L84 PolarHBondContact O-N 3.48Å; L81-L84 PolarHBondContact O-N 3.24Å; D82-L84 VanDerWaalsContact C-N 3.29Å; D82-L84 PolarHBondContact O-N 3.37Å; L84-L110 HydrophobicContact CD2-CD2 4Å
85	R	97.2	Very high	93.8	Very high	114 Å²	114	65.1 Å²	65.1	43%	0.43	32%	0.317	S	S	.	.	H	α-helix	trans	-80.5	-49	175.6	-72.1	163.4	177.2	157	-5.4	111.3	T39 L81 D82 Y83	T39-R85 HydrophobicContact CG2-CG 3.79Å; L81-R85 WeakPolarHBondContact O-CG 3.28Å; L81-R85 PolarHBondContact O-N 3.1Å; L81-R85 VanDerWaalsContact O-N 3.14Å; D82-R85 WeakPolarHBondContact O-CB 3.47Å; D82-R85 PolarHBondContact O-N 3.12Å; D82-R85 IonicContact OD1-CZ 3.91Å; D82-R85 IonicContact OD1-NH1 2.81Å; D82-R85 PolarHBondContact OD1-NH1 3.27Å; Y83-R85 VanDerWaalsContact C-N 3.28Å; Y83-R85 PolarHBondContact O-N 2.88Å
86	D	94.1	Very high	93.2	Very high	123 Å²	123	63.4 Å²	63.4	66%	0.658	32%	0.321	S	S	*	.	H	α-helix	trans	-108.5	-6.4	-166.8	-56.7	-32.7	0	0	0	113.4	D82 N88	D82-D86 PolarHBondContact O-N 3.43Å; D86-N88 PolarHBondContact O-N 3.08Å
87	L	92.8	Very high	93	Very high	90 Å²	90	66.3 Å²	66.3	47%	0.471	34%	0.335	S	S	.	.	S	Bend	trans	53.3	20.8	-170	-57.7	180	0	0	0	113.7	A42 V43 Y83	A42-L87 HydrophobicContact CB-CD2 4.4Å; V43-L87 HydrophobicContact CG2-CD2 3.63Å; Y83-L87 WeakPolarHBondContact O-CA 3.5Å; Y83-L87 PolarHBondContact O-N 3.44Å
88	N	91.4	Very high	92.8	Very high	82 Å²	82	70.5 Å²	70.5	44%	0.439	35%	0.353	S	S	.	.	S	Bend	trans	-131.7	150.9	178.8	-169.4	33.5	0	0	0	110.1	Y83 D86 R116	Y83-N88 WeakPolarHBondContact CA-O 3.19Å; D86-N88 PolarHBondContact O-N 3.08Å; N88-R116 PolarHBondContact OD1-NH1 3.36Å
89	L	90.4	Very high	92.6	Very high	35 Å²	35	68 Å²	68	18%	0.183	36%	0.355	C	S	.	.			trans	-109.3	116.7	177.6	178.4	70.1	0	0	0	109	Y83 L91 L113 L117	Y83-L89 HydrophobicContact CD2-CB 4.39Å; L89-L91 HydrophobicContact CD1-CD2 3.95Å; L89-L91 HydrophobicContact CD1-CG 4Å; L89-L91 HydrophobicContact CD2-CD1 3.92Å; L89-L91 HydrophobicContact CD2-CG 4.05Å; L89-L91 HydrophobicContact CG-CD1 4.4Å; L89-L91 HydrophobicContact CG-CD2 4.47Å; L89-L91 HydrophobicContact CG-CG 3.96Å; L89-L113 HydrophobicContact CB-CD1 3.96Å; L89-L113 HydrophobicContact CD1-CD1 3.87Å; L89-L113 HydrophobicContact CD2-CD1 3.71Å; L89-L113 HydrophobicContact CG-CD1 4.03Å; L89-L117 HydrophobicContact CD2-CD2 3.61Å; L89-L117 HydrophobicContact CD2-CG 4Å
90	V	89.9	Confident	92.6	Very high	118 Å²	118	71.7 Å²	71.7	72%	0.715	37%	0.369	S	S	*	.			trans	-110.8	123.4	166	-176.8	0	0	0	0	107.5
91	L	90.9	Very high	92.6	Very high	41 Å²	41	71.7 Å²	71.7	22%	0.215	37%	0.369	C	S	.	.			trans	-117.5	151.5	174	-69.2	177.5	0	0	0	109.1	Y79 L89 F95 L101 L117	Y79-L91 HydrophobicContact CD1-CD2 3.66Å; Y79-L91 HydrophobicContact CE1-CD2 4.01Å; Y79-L91 HydrophobicContact CG-CD2 4.06Å; L89-L91 HydrophobicContact CD1-CD2 3.95Å; L89-L91 HydrophobicContact CD1-CG 4Å; L89-L91 HydrophobicContact CD2-CD1 3.92Å; L89-L91 HydrophobicContact CD2-CG 4.05Å; L89-L91 HydrophobicContact CG-CD1 4.4Å; L89-L91 HydrophobicContact CG-CD2 4.47Å; L89-L91 HydrophobicContact CG-CG 3.96Å; L91-F95 HydrophobicContact CB-CB 4.14Å; L91-F95 HydrophobicContact CB-CG 4.43Å; L91-F95 HydrophobicContact CD1-CB 4.27Å; L91-F95 HydrophobicContact CD1-CD1 3.74Å; L91-F95 HydrophobicContact CD1-CE1 4.44Å; L91-F95 HydrophobicContact CD1-CG 4.19Å; L91-F95 HydrophobicContact CD2-CD1 3.98Å; L91-F95 HydrophobicContact CD2-CD2 4.48Å; L91-F95 HydrophobicContact CD2-CE1 4.17Å; L91-F95 HydrophobicContact CD2-CG 4.14Å; L91-F95 HydrophobicContact CG-CD1 4.37Å; L91-F95 HydrophobicContact CG-CG 4.49Å; L91-L101 HydrophobicContact CD1-CD2 4.46Å; L91-L101 HydrophobicContact CD2-CD2 3.78Å; L91-L117 HydrophobicContact CD1-CD2 3.98Å
92	P	88.4	Confident	92.5	Very high	76 Å²	76	73.7 Å²	73.7	49%	0.494	38%	0.378	S	S	.	.			trans	-57.8	151.4	165	-20.7	32.8	0	0	0	111.3	F95	P92-F95 WeakPolarHBondContact O-CB 3.36Å; P92-F95 PolarHBondContact O-N 2.83Å
93	D	83.7	Confident	92.5	Very high	146 Å²	146	78.3 Å²	78.3	78%	0.781	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	141.1	170	-58.7	-44.4	0	0	0	110.2	F95	D93-F95 VanDerWaalsContact C-N 3.27Å; D93-F95 PolarHBondContact O-N 2.8Å
94	Y	83.6	Confident	92.5	Very high	143 Å²	143	78.5 Å²	78.5	56%	0.561	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	32.4	-176.8	-49	-81.3	0	0	0	115.5	P96 H252 V254	Y94-P96 WeakPolarHBondContact O-CD 3.31Å; Y94-H252 PolarHBondContact OH-CD2 2.83Å; Y94-H252 PolarHBondContact OH-NE2 2.83Å; Y94-V254 HydrophobicContact CD1-CG1 4.47Å; Y94-V254 HydrophobicContact CE1-CB 4.23Å; Y94-V254 HydrophobicContact CE1-CG1 3.59Å
95	F	90.6	Very high	92.6	Very high	25 Å²	25	78.5 Å²	78.5	11%	0.11	39%	0.392	C	S	.	.			trans	-51.4	106.3	177.5	-177.9	-111.8	0	0	0	112.7	L76 Y79 L91 P92 D93 E97 K98 L101	L76-F95 HydrophobicContact CD2-CZ 4.01Å; Y79-F95 HydrophobicContact CD2-CE2 4.4Å; Y79-F95 HydrophobicContact CD2-CZ 4.03Å; Y79-F95 HydrophobicContact CE1-CE2 4.41Å; Y79-F95 AromaticContact CE2-CE2 3.56Å; Y79-F95 HydrophobicContact CE2-CE2 3.56Å; Y79-F95 AromaticContact CE2-CZ 3.58Å; Y79-F95 HydrophobicContact CE2-CZ 3.58Å; Y79-F95 AromaticContact CZ-CE2 3.56Å; Y79-F95 WeakPolarHBondContact OH-CE2 3.39Å; L91-F95 HydrophobicContact CB-CB 4.14Å; L91-F95 HydrophobicContact CB-CG 4.43Å; L91-F95 HydrophobicContact CD1-CB 4.27Å; L91-F95 HydrophobicContact CD1-CD1 3.74Å; L91-F95 HydrophobicContact CD1-CE1 4.44Å; L91-F95 HydrophobicContact CD1-CG 4.19Å; L91-F95 HydrophobicContact CD2-CD1 3.98Å; L91-F95 HydrophobicContact CD2-CD2 4.48Å; L91-F95 HydrophobicContact CD2-CE1 4.17Å; L91-F95 HydrophobicContact CD2-CG 4.14Å; L91-F95 HydrophobicContact CG-CD1 4.37Å; L91-F95 HydrophobicContact CG-CG 4.49Å; P92-F95 WeakPolarHBondContact O-CB 3.36Å; P92-F95 PolarHBondContact O-N 2.83Å; D93-F95 VanDerWaalsContact C-N 3.27Å; D93-F95 PolarHBondContact O-N 2.8Å; F95-E97 VanDerWaalsContact C-N 3.33Å; F95-E97 VanDerWaalsContact CE1-C 3.43Å; F95-E97 HydrophobicContact CE1-CB 4.05Å; F95-E97 HydrophobicContact CE2-CB 4.38Å; F95-E97 HydrophobicContact CZ-CB 3.81Å; F95-E97 PolarHBondContact O-N 2.91Å; F95-K98 HydrophobicContact CD1-CB 4Å; F95-K98 PolarHBondContact O-N 3.11Å; F95-L101 HydrophobicContact CE1-CB 3.93Å; F95-L101 HydrophobicContact CE1-CD2 3.78Å; F95-L101 HydrophobicContact CZ-CB 4.49Å; F95-L101 HydrophobicContact CZ-CD2 4.27Å
96	P	84.7	Confident	92.6	Very high	120 Å²	120	76.9 Å²	76.9	78%	0.779	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-23	-164.9	29.1	-33.8	0	0	0	112.6	Y94 K98	Y94-P96 WeakPolarHBondContact O-CD 3.31Å; P96-K98 VanDerWaalsContact C-N 3.3Å; P96-K98 PolarHBondContact O-N 2.85Å
97	E	92.3	Very high	92.8	Very high	63 Å²	63	75 Å²	75	29%	0.294	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	17.7	-176.6	-58	-166.7	97.9	0	0	113.1	L76 F95 S99 R100 L101	L76-E97 HydrophobicContact CD2-CB 3.99Å; F95-E97 VanDerWaalsContact C-N 3.33Å; F95-E97 VanDerWaalsContact CE1-C 3.43Å; F95-E97 HydrophobicContact CE1-CB 4.05Å; F95-E97 HydrophobicContact CE2-CB 4.38Å; F95-E97 HydrophobicContact CZ-CB 3.81Å; F95-E97 PolarHBondContact O-N 2.91Å; E97-S99 VanDerWaalsContact C-N 3.26Å; E97-S99 PolarHBondContact O-N 2.96Å; E97-S99 VanDerWaalsContact O-N 3.16Å; E97-R100 HydrophobicContact CB-CB 4.34Å; E97-R100 WeakPolarHBondContact O-CA 3.3Å; E97-R100 WeakPolarHBondContact O-CB 3.18Å; E97-R100 PolarHBondContact O-N 2.94Å; E97-R100 WeakPolarHBondContact OE1-CD 3.24Å; E97-R100 IonicContact OE1-CZ 3.26Å; E97-R100 VanDerWaalsContact OE1-CZ 3.26Å; E97-R100 IonicContact OE1-NE 3.45Å; E97-R100 PolarHBondContact OE1-NE 3.1Å; E97-R100 IonicContact OE1-NH1 3.68Å; E97-R100 PolarHBondContact OE1-NH1 3.04Å; E97-L101 PolarHBondContact O-N 2.83Å
98	K	93.9	Very high	93.1	Very high	88 Å²	88	70.8 Å²	70.8	38%	0.383	36%	0.357	S	S	.	.	H	α-helix	trans	-50.4	-44.1	-177.3	-167.6	177.5	-179.4	-176.8	0	112.8	F95 P96 R100 L101 Q102 L117	F95-K98 HydrophobicContact CD1-CB 4Å; F95-K98 PolarHBondContact O-N 3.11Å; P96-K98 VanDerWaalsContact C-N 3.3Å; P96-K98 PolarHBondContact O-N 2.85Å; K98-R100 VanDerWaalsContact C-N 3.35Å; K98-R100 PolarHBondContact O-N 3.47Å; K98-L101 PolarHBondContact O-N 2.89Å; K98-Q102 PolarHBondContact O-N 3.45Å; K98-L117 VanDerWaalsContact CE-O 3.24Å; K98-L117 WeakPolarHBondContact CE-O 3.11Å; K98-L117 HydrophobicContact CG-CD2 3.84Å
99	S	94	Very high	93.4	Very high	71 Å²	71	71 Å²	71	50%	0.497	36%	0.357	S	S	.	.	H	α-helix	trans	-71.8	-23.3	178.2	-46.3	0	0	0	0	113.9	E97 R103	E97-S99 VanDerWaalsContact C-N 3.26Å; E97-S99 PolarHBondContact O-N 2.96Å; E97-S99 VanDerWaalsContact O-N 3.16Å; S99-R103 PolarHBondContact O-NH1 3.2Å
100	R	96.8	Very high	93.7	Very high	105 Å²	105	69.4 Å²	69.4	40%	0.396	35%	0.349	S	S	.	.	H	α-helix	trans	-76.3	-46.2	169.8	-63.5	177.8	64.6	165.4	5	110.2	D73 L76 E97 K98 Q102 R103 E104	D73-R100 IonicContact OD2-CZ 2.97Å; D73-R100 IonicContact OD2-NE 2.68Å; D73-R100 IonicContact OD2-NH2 2.76Å; D73-R100 PolarHBondContact OD2-NH2 3.36Å; L76-R100 HydrophobicContact CD1-CB 3.44Å; L76-R100 VanDerWaalsContact CD1-CB 3.44Å; E97-R100 HydrophobicContact CB-CB 4.34Å; E97-R100 WeakPolarHBondContact O-CA 3.3Å; E97-R100 WeakPolarHBondContact O-CB 3.18Å; E97-R100 PolarHBondContact O-N 2.94Å; E97-R100 WeakPolarHBondContact OE1-CD 3.24Å; E97-R100 IonicContact OE1-CZ 3.26Å; E97-R100 VanDerWaalsContact OE1-CZ 3.26Å; E97-R100 IonicContact OE1-NE 3.45Å; E97-R100 PolarHBondContact OE1-NE 3.1Å; E97-R100 IonicContact OE1-NH1 3.68Å; E97-R100 PolarHBondContact OE1-NH1 3.04Å; K98-R100 VanDerWaalsContact C-N 3.35Å; K98-R100 PolarHBondContact O-N 3.47Å; R100-Q102 PolarHBondContact O-N 3.09Å; R100-R103 WeakPolarHBondContact O-CB 3.31Å; R100-R103 PolarHBondContact O-N 2.9Å; R100-E104 PolarHBondContact O-N 2.95Å; R100-E104 VanDerWaalsContact O-N 3.12Å
101	L	97.7	Very high	94	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-61	-34.4	177.4	-178.1	59.8	0	0	0	111.8	L76 Y79 I80 L91 F95 E97 K98 R103 E104 A105 L117	L76-L101 HydrophobicContact CB-CD1 4.32Å; L76-L101 HydrophobicContact CD2-CB 4.41Å; Y79-L101 HydrophobicContact CD2-CD1 4.33Å; Y79-L101 HydrophobicContact CD2-CD2 4.13Å; Y79-L101 HydrophobicContact CG-CD2 4.01Å; I80-L101 HydrophobicContact CD1-CD1 3.84Å; I80-L101 HydrophobicContact CG1-CD1 4.13Å; L91-L101 HydrophobicContact CD1-CD2 4.46Å; L91-L101 HydrophobicContact CD2-CD2 3.78Å; F95-L101 HydrophobicContact CE1-CB 3.93Å; F95-L101 HydrophobicContact CE1-CD2 3.78Å; F95-L101 HydrophobicContact CZ-CB 4.49Å; F95-L101 HydrophobicContact CZ-CD2 4.27Å; E97-L101 PolarHBondContact O-N 2.83Å; K98-L101 PolarHBondContact O-N 2.89Å; L101-R103 VanDerWaalsContact C-N 3.34Å; L101-R103 PolarHBondContact O-N 3.24Å; L101-E104 PolarHBondContact O-N 3.33Å; L101-A105 PolarHBondContact O-N 2.86Å; L101-L117 HydrophobicContact CB-CD1 4.44Å; L101-L117 HydrophobicContact CD2-CD1 4.25Å; L101-L117 HydrophobicContact CD2-CD2 4.02Å; L101-L117 HydrophobicContact CG-CD1 3.82Å; L101-L117 HydrophobicContact CG-CD2 4.33Å
102	Q	97.4	Very high	94.2	Very high	42 Å²	42	76.1 Å²	76.1	20%	0.196	37%	0.366	C	S	.	.	H	α-helix	trans	-56.3	-48.1	171	-170	-172.1	-13.1	0	0	111.2	K98 R100 E104 A105 D106 L117	K98-Q102 PolarHBondContact O-N 3.45Å; R100-Q102 PolarHBondContact O-N 3.09Å; Q102-E104 VanDerWaalsContact C-N 3.3Å; Q102-E104 PolarHBondContact O-N 3.38Å; Q102-A105 WeakPolarHBondContact O-CB 3.42Å; Q102-A105 PolarHBondContact O-N 3.43Å; Q102-A105 VanDerWaalsContact O-N 3.09Å; Q102-D106 PolarHBondContact O-N 2.9Å; Q102-L117 HydrophobicContact CB-CB 3.91Å; Q102-L117 HydrophobicContact CG-CB 4.02Å
103	R	97.6	Very high	94.5	Very high	149 Å²	149	72.5 Å²	72.5	56%	0.562	34%	0.342	S	S	*	.	H	α-helix	trans	-64.8	-31.7	178.3	-65.7	-169.8	-63.4	-101.7	11.5	113.2	S99 R100 L101 F107	S99-R103 PolarHBondContact O-NH1 3.2Å; R100-R103 WeakPolarHBondContact O-CB 3.31Å; R100-R103 PolarHBondContact O-N 2.9Å; L101-R103 VanDerWaalsContact C-N 3.34Å; L101-R103 PolarHBondContact O-N 3.24Å; R103-F107 WeakPolarHBondContact O-CB 3.46Å; R103-F107 PolarHBondContact O-N 2.97Å
104	E	98.3	Very high	95.1	Very high	17 Å²	17	65.8 Å²	65.8	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-68.9	-42	170.6	-62	-49.8	134.3	0	0	111.5	R72 D73 L76 I80 R100 L101 Q102 D106 F107 F108	R72-E104 IonicContact CZ-OE1 2.85Å; R72-E104 IonicContact CZ-OE2 3.2Å; R72-E104 VanDerWaalsContact CZ-OE2 3.26Å; R72-E104 IonicContact NE-OE1 2.71Å; R72-E104 IonicContact NE-OE2 2.67Å; R72-E104 PolarHBondContact NE-OE2 3.25Å; R72-E104 IonicContact NH2-OE1 3.57Å; R72-E104 PolarHBondContact NH2-OE1 3.04Å; R72-E104 IonicContact NH2-OE2 2.72Å; R72-E104 PolarHBondContact NH2-OE2 3.27Å; D73-E104 HydrophobicContact CB-CG 4.48Å; L76-E104 HydrophobicContact CB-CG 4.04Å; L76-E104 HydrophobicContact CD1-CG 4.09Å; I80-E104 HydrophobicContact CD1-CB 4.05Å; I80-E104 HydrophobicContact CG1-CB 4.24Å; R100-E104 PolarHBondContact O-N 2.95Å; R100-E104 VanDerWaalsContact O-N 3.12Å; L101-E104 PolarHBondContact O-N 3.33Å; Q102-E104 VanDerWaalsContact C-N 3.3Å; Q102-E104 PolarHBondContact O-N 3.38Å; E104-D106 VanDerWaalsContact C-N 3.33Å; E104-D106 PolarHBondContact O-N 3.24Å; E104-F107 PolarHBondContact O-N 2.76Å; E104-F108 WeakPolarHBondContact O-CD2 3.47Å; E104-F108 PolarHBondContact O-N 3.12Å
105	A	98	Very high	95.6	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-40.4	174.8	0	0	0	0	0	112.3	I80 L101 Q102 L109 L110 L113 A114 L117	I80-A105 HydrophobicContact CD1-CB 4.24Å; L101-A105 PolarHBondContact O-N 2.86Å; Q102-A105 WeakPolarHBondContact O-CB 3.42Å; Q102-A105 PolarHBondContact O-N 3.43Å; Q102-A105 VanDerWaalsContact O-N 3.09Å; A105-L109 PolarHBondContact O-N 2.94Å; A105-L109 VanDerWaalsContact O-N 3.17Å; A105-L110 HydrophobicContact CB-CB 4.48Å; A105-L110 PolarHBondContact O-N 3.25Å; A105-L113 HydrophobicContact CB-CB 4.18Å; A105-L113 HydrophobicContact CB-CD2 3.75Å; A105-L113 HydrophobicContact CB-CG 3.72Å; A105-A114 HydrophobicContact CB-CB 4.05Å; A105-L117 HydrophobicContact CB-CD1 3.95Å
106	D	97.9	Very high	95.7	Very high	81 Å²	81	71.9 Å²	71.9	43%	0.433	33%	0.333	S	S	.	.	H	α-helix	trans	-62.6	-46.9	172.4	-71.3	-45	0	0	0	111.4	Q102 E104 F108 L109 A114	Q102-D106 PolarHBondContact O-N 2.9Å; E104-D106 VanDerWaalsContact C-N 3.33Å; E104-D106 PolarHBondContact O-N 3.24Å; D106-F108 PolarHBondContact O-N 3Å; D106-L109 WeakPolarHBondContact O-CA 3.37Å; D106-L109 PolarHBondContact O-N 2.99Å; D106-A114 WeakPolarHBondContact OD1-CB 3.07Å
107	F	98.3	Very high	96.1	Very high	83 Å²	83	66.3 Å²	66.3	36%	0.364	30%	0.297	S	S	.	.	H	α-helix	trans	-58.6	-44.5	176.7	175.7	-91.1	0	0	0	112.4	L47 R72 R103 E104 L109	L47-F107 HydrophobicContact CD2-CD1 4Å; L47-F107 HydrophobicContact CD2-CE1 3.42Å; L47-F107 VanDerWaalsContact CD2-CE1 3.42Å; L47-F107 HydrophobicContact CD2-CZ 3.76Å; R72-F107 VanDerWaalsContact CD-CE1 3.41Å; R72-F107 HydrophobicContact CG-CD1 3.83Å; R72-F107 HydrophobicContact CG-CE1 3.46Å; R72-F107 VanDerWaalsContact CG-CE1 3.46Å; R72-F107 HydrophobicContact CG-CZ 3.98Å; R103-F107 WeakPolarHBondContact O-CB 3.46Å; R103-F107 PolarHBondContact O-N 2.97Å; E104-F107 PolarHBondContact O-N 2.76Å; F107-L109 PolarHBondContact O-N 3.06Å
108	F	98.3	Very high	95.9	Very high	2 Å²	2	65 Å²	65	1%	0.009	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	4	176.9	-68.9	-65.6	0	0	0	113.8	L47 L48 L70 R72 F77 I80 E104 D106 L110	L47-F108 HydrophobicContact CB-CD1 4.43Å; L47-F108 HydrophobicContact CD2-CD1 4.11Å; L47-F108 PolarHBondContact N-O 3.44Å; L48-F108 HydrophobicContact CD1-CD1 4Å; L48-F108 HydrophobicContact CD1-CE1 4.33Å; L48-F108 HydrophobicContact CD2-CD1 4.31Å; L48-F108 HydrophobicContact CD2-CE1 4.19Å; L48-F108 HydrophobicContact CG-CD1 3.85Å; L48-F108 HydrophobicContact CG-CE1 4.21Å; L70-F108 HydrophobicContact CD1-CE1 4.19Å; L70-F108 HydrophobicContact CD1-CZ 4.44Å; R72-F108 HydrophobicContact CB-CZ 4.2Å; R72-F108 HydrophobicContact CG-CE2 4.42Å; R72-F108 HydrophobicContact CG-CZ 3.87Å; F77-F108 HydrophobicContact CD2-CE1 4.5Å; F77-F108 AromaticContact CD2-CE2 3.7Å; F77-F108 HydrophobicContact CD2-CE2 3.7Å; F77-F108 AromaticContact CD2-CZ 3.63Å; F77-F108 HydrophobicContact CD2-CZ 3.63Å; F77-F108 HydrophobicContact CE2-CE1 4.05Å; F77-F108 AromaticContact CE2-CE2 3.98Å; F77-F108 HydrophobicContact CE2-CE2 3.98Å; F77-F108 AromaticContact CE2-CZ 3.62Å; F77-F108 HydrophobicContact CE2-CZ 3.62Å; I80-F108 HydrophobicContact CD1-CD2 4.3Å; I80-F108 HydrophobicContact CG1-CD2 4.09Å; I80-F108 HydrophobicContact CG1-CE2 4.36Å; I80-F108 HydrophobicContact CG2-CD2 3.88Å; I80-F108 HydrophobicContact CG2-CE2 4.39Å; I80-F108 HydrophobicContact CG2-CG 4.3Å; E104-F108 WeakPolarHBondContact O-CD2 3.47Å; E104-F108 PolarHBondContact O-N 3.12Å; D106-F108 PolarHBondContact O-N 3Å; F108-L110 HydrophobicContact CB-CD1 4.11Å; F108-L110 HydrophobicContact CB-CG 4.05Å; F108-L110 PolarHBondContact O-N 2.92Å
109	L	97.8	Very high	95.2	Very high	86 Å²	86	65.1 Å²	65.1	45%	0.45	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	27.6	-179.4	-53.9	173.7	0	0	0	113.9	L47 A105 D106 F107 R111	L47-L109 HydrophobicContact CB-CD1 4.39Å; L47-L109 HydrophobicContact CB-CG 4.41Å; A105-L109 PolarHBondContact O-N 2.94Å; A105-L109 VanDerWaalsContact O-N 3.17Å; D106-L109 WeakPolarHBondContact O-CA 3.37Å; D106-L109 PolarHBondContact O-N 2.99Å; F107-L109 PolarHBondContact O-N 3.06Å; L109-R111 VanDerWaalsContact C-N 3.28Å; L109-R111 PolarHBondContact O-N 2.85Å
110	L	97.8	Very high	94	Very high	2 Å²	2	73.5 Å²	73.5	1%	0.01	33%	0.325	C	S	.	.			trans	-83.7	70.1	178.5	-61.1	175.7	0	0	0	110.3	V43 I80 Y83 L84 A105 F108 D112 L113 A114	V43-L110 HydrophobicContact CB-CD2 3.96Å; V43-L110 HydrophobicContact CG1-CD2 3.88Å; V43-L110 HydrophobicContact CG2-CD2 4.2Å; I80-L110 HydrophobicContact CD1-CD1 4.35Å; I80-L110 HydrophobicContact CG2-CD1 3.76Å; Y83-L110 HydrophobicContact CD1-CD1 4.15Å; Y83-L110 HydrophobicContact CE1-CD2 4.41Å; L84-L110 HydrophobicContact CD2-CD2 4Å; A105-L110 HydrophobicContact CB-CB 4.48Å; A105-L110 PolarHBondContact O-N 3.25Å; F108-L110 HydrophobicContact CB-CD1 4.11Å; F108-L110 HydrophobicContact CB-CG 4.05Å; F108-L110 PolarHBondContact O-N 2.92Å; L110-D112 VanDerWaalsContact C-N 3.33Å; L110-D112 PolarHBondContact O-N 3.22Å; L110-L113 HydrophobicContact CB-CB 3.92Å; L110-L113 HydrophobicContact CB-CD2 4.28Å; L110-L113 HydrophobicContact CD1-CD2 3.91Å; L110-L113 WeakPolarHBondContact O-CA 3.47Å; L110-L113 WeakPolarHBondContact O-CB 3.24Å; L110-L113 PolarHBondContact O-N 3.1Å; L110-A114 PolarHBondContact O-N 3.3Å
111	R	95.4	Very high	91.9	Very high	199 Å²	199	74.3 Å²	74.3	75%	0.751	34%	0.341	S	S	*	.	H	α-helix	trans	-51.3	-44.7	-170.5	-62.3	179.1	-176.6	164.4	2.2	114.1	L109 A114 K115	L109-R111 VanDerWaalsContact C-N 3.28Å; L109-R111 PolarHBondContact O-N 2.85Å; R111-A114 PolarHBondContact O-N 3.39Å; R111-K115 VanDerWaalsContact O-CB 3.3Å; R111-K115 WeakPolarHBondContact O-CB 3.47Å; R111-K115 PolarHBondContact O-N 3.01Å
112	D	95.1	Very high	89.3	Confident	100 Å²	100	78.9 Å²	78.9	54%	0.535	37%	0.373	S	S	.	.	H	α-helix	trans	-69	-34.8	179.5	-69.3	-47.6	0	0	0	112.7	L110 R116	L110-D112 VanDerWaalsContact C-N 3.33Å; L110-D112 PolarHBondContact O-N 3.22Å; D112-R116 VanDerWaalsContact O-CG 3.24Å; D112-R116 WeakPolarHBondContact O-CG 3.39Å; D112-R116 PolarHBondContact O-N 3.1Å
113	L	95.9	Very high	86.5	Confident	0 Å²	0	86.6 Å²	86.6	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-67.8	-48.2	174.2	177	60.9	0	0	0	110.5	I80 Y83 L89 A105 L110 K115 R116 L117	I80-L113 HydrophobicContact CD1-CD2 3.83Å; Y83-L113 HydrophobicContact CD1-CB 4.12Å; Y83-L113 HydrophobicContact CD1-CD2 3.85Å; Y83-L113 HydrophobicContact CD1-CG 4.42Å; Y83-L113 HydrophobicContact CD2-CB 4.31Å; Y83-L113 HydrophobicContact CD2-CD1 3.86Å; Y83-L113 HydrophobicContact CD2-CD2 4.45Å; Y83-L113 HydrophobicContact CD2-CG 4.42Å; Y83-L113 HydrophobicContact CE1-CB 3.92Å; Y83-L113 HydrophobicContact CE1-CD2 4.47Å; Y83-L113 HydrophobicContact CE2-CB 4.12Å; Y83-L113 HydrophobicContact CE2-CD1 4.3Å; Y83-L113 HydrophobicContact CG-CB 4.3Å; Y83-L113 HydrophobicContact CG-CD1 4.04Å; Y83-L113 HydrophobicContact CG-CD2 3.83Å; Y83-L113 HydrophobicContact CG-CG 4.28Å; L89-L113 HydrophobicContact CB-CD1 3.96Å; L89-L113 HydrophobicContact CD1-CD1 3.87Å; L89-L113 HydrophobicContact CD2-CD1 3.71Å; L89-L113 HydrophobicContact CG-CD1 4.03Å; A105-L113 HydrophobicContact CB-CB 4.18Å; A105-L113 HydrophobicContact CB-CD2 3.75Å; A105-L113 HydrophobicContact CB-CG 3.72Å; L110-L113 HydrophobicContact CB-CB 3.92Å; L110-L113 HydrophobicContact CB-CD2 4.28Å; L110-L113 HydrophobicContact CD1-CD2 3.91Å; L110-L113 WeakPolarHBondContact O-CA 3.47Å; L110-L113 WeakPolarHBondContact O-CB 3.24Å; L110-L113 PolarHBondContact O-N 3.1Å; L113-K115 VanDerWaalsContact C-N 3.3Å; L113-K115 PolarHBondContact O-N 3.48Å; L113-R116 PolarHBondContact O-N 3.36Å; L113-R116 VanDerWaalsContact O-N 3.1Å; L113-L117 HydrophobicContact CD1-CD1 3.85Å; L113-L117 HydrophobicContact CD1-CG 4.21Å; L113-L117 HydrophobicContact CG-CD1 3.77Å; L113-L117 WeakPolarHBondContact O-CB 3.16Å; L113-L117 VanDerWaalsContact O-CG 3.31Å; L113-L117 WeakPolarHBondContact O-CG 3.41Å; L113-L117 PolarHBondContact O-N 2.9Å
114	A	96.2	Very high	83.8	Confident	6 Å²	6	86.6 Å²	86.6	5%	0.05	42%	0.417	C	S	.	.	H	α-helix	trans	-57.8	-41.9	176	0	0	0	0	0	112.1	A105 D106 L110 R111 R116 L117 S118	A105-A114 HydrophobicContact CB-CB 4.05Å; D106-A114 WeakPolarHBondContact OD1-CB 3.07Å; L110-A114 PolarHBondContact O-N 3.3Å; R111-A114 PolarHBondContact O-N 3.39Å; A114-R116 PolarHBondContact O-N 3.42Å; A114-L117 CarbonylContact O-C 3.53Å; A114-L117 PolarHBondContact O-N 3.47Å; A114-S118 PolarHBondContact O-N 3.02Å
115	K	94.4	Very high	80.8	Confident	160 Å²	160	93.2 Å²	93.2	70%	0.696	45%	0.454	S	S	*	.	H	α-helix	trans	-66.6	-29.9	175.2	-176.3	-179.7	175.8	-174.4	0	114	R111 L113 S118	R111-K115 VanDerWaalsContact O-CB 3.3Å; R111-K115 WeakPolarHBondContact O-CB 3.47Å; R111-K115 PolarHBondContact O-N 3.01Å; L113-K115 VanDerWaalsContact C-N 3.3Å; L113-K115 PolarHBondContact O-N 3.48Å; K115-S118 PolarHBondContact O-OG 3.49Å
116	R	92.6	Very high	78.1	Confident	135 Å²	135	98.7 Å²	98.7	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-76.4	-30.5	172	-71.2	168.2	-174.2	-135.7	11.1	112	N88 D112 L113 A114	N88-R116 PolarHBondContact OD1-NH1 3.36Å; D112-R116 VanDerWaalsContact O-CG 3.24Å; D112-R116 WeakPolarHBondContact O-CG 3.39Å; D112-R116 PolarHBondContact O-N 3.1Å; L113-R116 PolarHBondContact O-N 3.36Å; L113-R116 VanDerWaalsContact O-N 3.1Å; A114-R116 PolarHBondContact O-N 3.42Å
117	L	93.1	Very high	75.4	Confident	3 Å²	3	103 Å²	103	2%	0.016	51%	0.513	C	S	.	.	H	α-helix	trans	-83.1	-25.4	179.2	-71.6	167.1	0	0	0	113.4	L89 L91 K98 L101 Q102 A105 L113 A114	L89-L117 HydrophobicContact CD2-CD2 3.61Å; L89-L117 HydrophobicContact CD2-CG 4Å; L91-L117 HydrophobicContact CD1-CD2 3.98Å; K98-L117 VanDerWaalsContact CE-O 3.24Å; K98-L117 WeakPolarHBondContact CE-O 3.11Å; K98-L117 HydrophobicContact CG-CD2 3.84Å; L101-L117 HydrophobicContact CB-CD1 4.44Å; L101-L117 HydrophobicContact CD2-CD1 4.25Å; L101-L117 HydrophobicContact CD2-CD2 4.02Å; L101-L117 HydrophobicContact CG-CD1 3.82Å; L101-L117 HydrophobicContact CG-CD2 4.33Å; Q102-L117 HydrophobicContact CB-CB 3.91Å; Q102-L117 HydrophobicContact CG-CB 4.02Å; A105-L117 HydrophobicContact CB-CD1 3.95Å; L113-L117 HydrophobicContact CD1-CD1 3.85Å; L113-L117 HydrophobicContact CD1-CG 4.21Å; L113-L117 HydrophobicContact CG-CD1 3.77Å; L113-L117 WeakPolarHBondContact O-CB 3.16Å; L113-L117 VanDerWaalsContact O-CG 3.31Å; L113-L117 WeakPolarHBondContact O-CG 3.41Å; L113-L117 PolarHBondContact O-N 2.9Å; A114-L117 CarbonylContact O-C 3.53Å; A114-L117 PolarHBondContact O-N 3.47Å
118	S	88.3	Confident	72.3	Confident	37 Å²	37	104.1 Å²	104.1	26%	0.259	53%	0.531	S	S	.	.	S	Bend	trans	-58	148.6	-179.6	65.7	0	0	0	0	111.9	A114 K115 R120	A114-S118 PolarHBondContact O-N 3.02Å; K115-S118 PolarHBondContact O-OG 3.49Å; S118-R120 PolarHBondContact O-N 2.87Å
119	P	77.9	Confident	69.6	Low	89 Å²	89	113.4 Å²	113.4	58%	0.578	57%	0.574	S	S	*	*			trans	-51.4	137.4	166	-23.1	33.3	0	0	0	109.7	V121	P119-V121 VanDerWaalsContact C-N 3.28Å; P119-V121 PolarHBondContact O-N 3.5Å
120	R	68.8	Low	66.7	Low	247 Å²	247	117.6 Å²	117.6	93%	0.932	59%	0.592	S	S	*	*			trans	-68.3	93.4	169.5	-76.2	-173.2	177.1	175.4	1.5	107.8	S118 S122	S118-R120 PolarHBondContact O-N 2.87Å; R120-S122 PolarHBondContact O-N 2.68Å
121	V	52.2	Low	63.7	Low	122 Å²	122	124 Å²	124	74%	0.739	63%	0.625	S	S	*	*			trans	-68.7	97.6	169.7	-176.5	0	0	0	0	107.1	P119 K123	P119-V121 VanDerWaalsContact C-N 3.28Å; P119-V121 PolarHBondContact O-N 3.5Å; V121-K123 PolarHBondContact O-N 3.16Å
122	S	44	Very low	60.9	Low	96 Å²	96	120.6 Å²	120.6	67%	0.671	63%	0.631	S	S	*	*			trans	-53.1	127.1	163.9	-62.5	0	0	0	0	108	R120 D124	R120-S122 PolarHBondContact O-N 2.68Å; S122-D124 PolarHBondContact O-N 2.66Å
123	K	39.8	Very low	58	Low	205 Å²	205	124.2 Å²	124.2	89%	0.891	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	31.9	-160.3	-153.1	-178.4	178.9	-175.2	0	114	V121	V121-K123 PolarHBondContact O-N 3.16Å
124	D	40.8	Very low	55	Low	148 Å²	148	129.2 Å²	129.2	79%	0.791	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.3	1.8	-170.7	-68.1	-48.4	0	0	0	114	S122	S122-D124 PolarHBondContact O-N 2.66Å
125	N	34	Very low	52.1	Low	157 Å²	157	137 Å²	137	84%	0.84	72%	0.721	S	S	*	*			trans	-114.9	78.1	176.5	-92.8	20.2	0	0	0	112.3
126	S	41.8	Very low	49.4	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	73%	0.725	S	S	*	*			trans	-129.5	90.9	161.1	62.3	0	0	0	0	109.8
127	I	40.2	Very low	47.3	Very low	173 Å²	173	138.1 Å²	138.1	89%	0.887	74%	0.743	S	S	*	*			trans	-140.4	142.1	163.8	-96	153.5	0	0	0	107.9
128	S	35	Very low	44.5	Very low	106 Å²	106	145.9 Å²	145.9	74%	0.741	78%	0.784	S	S	*	*			trans	-48.4	151.5	-159.2	-48.9	0	0	0	0	118.8	E130	S128-E130 PolarHBondContact O-N 2.66Å
129	E	41.2	Very low	41.9	Very low	196 Å²	196	146.8 Å²	146.8	92%	0.916	80%	0.8	S	S	*	*			trans	-63.7	118.1	148	-61.9	175.3	120.8	0	0	109.3
130	E	35.8	Very low	39.9	Very low	174 Å²	174	146.8 Å²	146.8	81%	0.813	81%	0.807	S	S	*	*			trans	-131.2	106.1	151.1	-81.5	-152.6	132.2	0	0	109.8	S128	S128-E130 PolarHBondContact O-N 2.66Å
131	I	35.2	Very low	38.3	Very low	138 Å²	138	143.7 Å²	143.7	71%	0.708	80%	0.804	S	S	*	*			trans	29.1	105.1	140.1	-59.8	165.4	0	0	0	116	Q133	I131-Q133 HydrophobicContact CG2-CG 4.1Å; I131-Q133 PolarHBondContact O-N 3.44Å; I131-Q133 VanDerWaalsContact O-N 3.14Å
132	S	36.4	Very low	37.3	Very low	126 Å²	126	143.4 Å²	143.4	88%	0.881	81%	0.806	S	S	*	*			trans	-58.8	112.2	160.4	-53.1	0	0	0	0	110.5
133	Q	34.2	Very low	36.8	Very low	177 Å²	177	144 Å²	144	83%	0.827	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-96.5	131	162.4	-67.1	-172.2	-3.4	0	0	109.1	I131	I131-Q133 HydrophobicContact CG2-CG 4.1Å; I131-Q133 PolarHBondContact O-N 3.44Å; I131-Q133 VanDerWaalsContact O-N 3.14Å
134	S	33.8	Very low	36.3	Very low	105 Å²	105	140.3 Å²	140.3	73%	0.734	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-78.2	130	-178.1	47.4	0	0	0	0	111.3	T136	S134-T136 PolarHBondContact O-N 3.34Å
135	D	34.9	Very low	36	Very low	170 Å²	170	138.6 Å²	138.6	91%	0.909	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-53.6	131.3	168.9	-65.6	-51.3	0	0	0	110.4
136	T	37.5	Very low	36	Very low	128 Å²	128	137.3 Å²	137.3	79%	0.785	81%	0.811	S	S	*	*			trans	-136.4	133.6	166.9	-47.8	0	0	0	0	107.3	S134	S134-T136 PolarHBondContact O-N 3.34Å
137	E	48.8	Very low	35.5	Very low	189 Å²	189	135.7 Å²	135.7	88%	0.883	81%	0.813	S	S	*	*			trans	-73.2	148.6	-173.2	-56.3	175	113.1	0	0	112.1
138	D	35.2	Very low	35.3	Very low	166 Å²	166	136.3 Å²	136.3	89%	0.888	81%	0.812	S	S	*	*				151.8	155.7	122.5	-167.5	27.2	0	0	0	113.1
139	G	33.5	Very low	35.7	Very low	56 Å²	56	136 Å²	136	58%	0.577	81%	0.808	S	S	*	*			trans	91.9	91.8	135.4	0	0	0	0	0	120.8
140	A	34.6	Very low	35.2	Very low	90 Å²	90	134.5 Å²	134.5	74%	0.744	81%	0.805	S	S	*	*			trans	70.5	126.4	133.9	0	0	0	0	0	123
141	Q	34.8	Very low	34.9	Very low	182 Å²	182	137.3 Å²	137.3	85%	0.85	81%	0.808	S	S	*	*				33.3	129.8	128.4	-66.4	168.4	-28.7	0	0	118.7
142	C	31.5	Very low	34.8	Very low	116 Å²	116	135.2 Å²	135.2	78%	0.784	81%	0.811	S	S	*	*			cis	-177.1	178.5	42.7	-133.7	0	0	0	0	112.4
143	C	33.2	Very low	34.5	Very low	107 Å²	107	137.6 Å²	137.6	72%	0.723	81%	0.813	S	S	*	*			trans	-64.7	146.1	-178.1	50	0	0	0	0	116.8
144	S	31.1	Very low	34.6	Very low	128 Å²	128	135.5 Å²	135.5	90%	0.895	82%	0.818	S	S	*	*			trans	-169.8	143	130.4	-82.4	0	0	0	0	112.9
145	S	33.6	Very low	34.5	Very low	112 Å²	112	135 Å²	135	78%	0.783	82%	0.821	S	S	*	*			trans	-93.3	144.1	-178.5	52.3	0	0	0	0	113.7
146	S	32.9	Very low	34.9	Very low	130 Å²	130	133 Å²	133	91%	0.909	82%	0.82	S	S	*	*			trans	158.8	151.5	134.6	50.8	0	0	0	0	112.5
147	G	31.7	Very low	34.7	Very low	81 Å²	81	130.2 Å²	130.2	84%	0.835	82%	0.816	S	S	*	*			trans	135.4	86.2	163.9	0	0	0	0	0	116.7
148	E	35.9	Very low	34.1	Very low	185 Å²	185	125.7 Å²	125.7	86%	0.864	81%	0.811	S	S	*	*			trans	-51.4	167.5	177.6	-84.8	-74.7	99.8	0	0	118.2
149	P	43.7	Very low	34.2	Very low	100 Å²	100	126.8 Å²	126.8	65%	0.649	81%	0.813	S	S	*	*			trans	-98.1	163	-159.8	39	-37.7	0	0	0	115.9
150	L	31	Very low	34.6	Very low	165 Å²	165	135.7 Å²	135.7	86%	0.864	83%	0.829	S	S	*	*			trans	-135.9	112.8	168.3	-76.3	176.2	0	0	0	114.9
151	R	29.6	Very low	34.9	Very low	233 Å²	233	136 Å²	136	88%	0.879	83%	0.826	S	S	*	*			trans	43.4	99.6	144.8	-70.8	-175.4	168.5	174.9	-2.7	120.9
152	A	33.8	Very low	35.4	Very low	93 Å²	93	130.7 Å²	130.7	77%	0.769	81%	0.807	S	S	*	*				33.5	117.3	112.9	0	0	0	0	0	120.4
153	L	28.8	Very low	35.9	Very low	177 Å²	177	128.9 Å²	128.9	93%	0.927	80%	0.796	S	S	*	*			trans	-138.3	124	138.5	-86.5	177.2	0	0	0	109.9
154	S	36.1	Very low	36.7	Very low	132 Å²	132	130.1 Å²	130.1	92%	0.923	80%	0.795	S	S	*	*			trans	-78.1	121.4	171.1	-59.8	0	0	0	0	109.9
155	A	32.9	Very low	37.6	Very low	96 Å²	96	129.8 Å²	129.8	79%	0.793	78%	0.783	S	S	*	*			trans	-127.4	111.6	165.2	0	0	0	0	0	109	G157	A155-G157 VanDerWaalsContact C-N 3.28Å; A155-G157 PolarHBondContact O-N 3.11Å
156	S	43.8	Very low	38.5	Very low	128 Å²	128	128.4 Å²	128.4	90%	0.895	77%	0.773	S	S	*	*			trans	-72.2	78.1	-179.7	51.2	0	0	0	0	111.5	A158	S156-A158 PolarHBondContact O-N 3.39Å
157	G	31.5	Very low	39.7	Very low	68 Å²	68	127.7 Å²	127.7	70%	0.701	75%	0.75	S	S	*	*			trans	-79.8	93.7	167.4	0	0	0	0	0	110.3	A155 M159	A155-G157 VanDerWaalsContact C-N 3.28Å; A155-G157 PolarHBondContact O-N 3.11Å; G157-M159 PolarHBondContact O-N 2.83Å; G157-M159 VanDerWaalsContact O-N 3.08Å
158	A	37	Very low	41.9	Very low	94 Å²	94	128.9 Å²	128.9	78%	0.777	73%	0.733	S	S	*	*			trans	-57.1	116.2	173.9	0	0	0	0	0	109.6	S156 R160	S156-A158 PolarHBondContact O-N 3.39Å; A158-R160 PolarHBondContact O-N 3.01Å
159	M	37.1	Very low	44.7	Very low	190 Å²	190	122.3 Å²	122.3	94%	0.936	71%	0.707	S	S	*	*			trans	-62.3	106.6	178.3	-72.1	-154.3	143.3	0	0	109.4	G157 S161	G157-M159 PolarHBondContact O-N 2.83Å; G157-M159 VanDerWaalsContact O-N 3.08Å; M159-S161 VanDerWaalsContact C-N 3.3Å; M159-S161 PolarHBondContact O-N 2.81Å
160	R	42	Very low	47.2	Very low	243 Å²	243	118.2 Å²	118.2	92%	0.917	68%	0.683	S	S	*	*			trans	-67.5	95	167.6	-81.4	-179.7	160.3	-111.1	-3.9	107.8	A158	A158-R160 PolarHBondContact O-N 3.01Å
161	S	41.8	Very low	50.4	Low	97 Å²	97	116.4 Å²	116.4	68%	0.678	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-48.7	134.5	162.6	41.6	0	0	0	0	109	M159 S163	M159-S161 VanDerWaalsContact C-N 3.3Å; M159-S161 PolarHBondContact O-N 2.81Å; S161-S163 PolarHBondContact O-N 2.8Å
162	P	43.6	Very low	53.7	Low	70 Å²	70	105.3 Å²	105.3	46%	0.455	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-52.7	138.3	168.2	-24.5	33.8	0	0	0	109.2	L164	P162-L164 PolarHBondContact O-N 3.12Å
163	S	42.4	Very low	56.7	Low	77 Å²	77	102.2 Å²	102.2	54%	0.538	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-53.6	135.4	171.3	50	0	0	0	0	109	S161 D165 S166	S161-S163 PolarHBondContact O-N 2.8Å; S163-D165 PolarHBondContact O-N 2.98Å; S163-S166 PolarHBondContact O-N 3.4Å; S163-S166 VanDerWaalsContact O-N 3.11Å
164	L	50.2	Low	60.1	Low	134 Å²	134	93.8 Å²	93.8	70%	0.702	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-57.1	-24.5	-173	-79.1	160.7	0	0	0	112.8	P162	P162-L164 PolarHBondContact O-N 3.12Å
165	D	50	Low	63	Low	121 Å²	121	87.6 Å²	87.6	65%	0.647	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-73.2	-36.8	-179.1	-51.7	-51	0	0	0	113.1	S163 R167 K168	S163-D165 PolarHBondContact O-N 2.98Å; D165-R167 PolarHBondContact O-N 3.32Å; D165-R167 VanDerWaalsContact O-N 3.08Å; D165-K168 PolarHBondContact O-N 2.95Å; D165-K168 VanDerWaalsContact O-N 3.12Å
166	S	51.9	Low	66	Low	83 Å²	83	83.6 Å²	83.6	58%	0.58	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-65.9	-15.1	-178.7	-172.4	0	0	0	0	113.6	S163	S163-S166 PolarHBondContact O-N 3.4Å; S163-S166 VanDerWaalsContact O-N 3.11Å
167	R	58.2	Low	68.2	Low	114 Å²	114	84.9 Å²	84.9	43%	0.43	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-86.4	-9.1	177.8	-71.4	-175.1	177.9	155.7	-2.3	114.3	D165	D165-R167 PolarHBondContact O-N 3.32Å; D165-R167 VanDerWaalsContact O-N 3.08Å
168	K	79.4	Confident	70.8	Confident	107 Å²	107	81.7 Å²	81.7	47%	0.465	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-27.2	-175.1	-68.6	-176.5	178	178.8	0	113.5	D165 L206 R285	D165-K168 PolarHBondContact O-N 2.95Å; D165-K168 VanDerWaalsContact O-N 3.12Å; K168-L206 WeakPolarHBondContact O-CD2 3.43Å; K168-R285 VanDerWaalsContact O-CZ 3.22Å; K168-R285 PolarHBondContact O-NE 3.24Å; K168-R285 PolarHBondContact O-NH2 3.15Å
169	S	93.2	Very high	72.7	Confident	46 Å²	46	79.7 Å²	79.7	32%	0.322	41%	0.405	S	S	.	.			trans	-72.7	153.4	-179.9	70.3	0	0	0	0	112.6	R285 E286	S169-R285 CarbonylContact C-O 3.54Å; S169-R285 WeakPolarHBondContact CA-O 3.24Å; S169-R285 WeakPolarHBondContact CB-O 3.46Å; S169-E286 WeakPolarHBondContact CB-O 3.19Å; S169-E286 WeakPolarHBondContact CB-OXT 3.4Å
170	G	96.3	Very high	74.4	Confident	15 Å²	15	74.9 Å²	74.9	16%	0.155	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	147.4	-169.6	177.9	0	0	0	0	0	114.2	R285	G170-R285 PolarHBondContact N-O 3.11Å; G170-R285 PolarHBondContact O-N 3.31Å
171	Y	98.3	Very high	75.6	Confident	126 Å²	126	67.2 Å²	67.2	49%	0.494	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	143.8	-174.9	-68.8	-100.9	0	0	0	111.9	V254 V282 F283 C284	Y171-V254 HydrophobicContact CE1-CG2 4.27Å; Y171-V282 HydrophobicContact CD1-CG1 3.93Å; Y171-F283 VanDerWaalsContact CA-O 3.26Å; Y171-F283 WeakPolarHBondContact CA-O 3.47Å; Y171-C284 HydrophobicContact CD1-CB 3.9Å; Y171-C284 HydrophobicContact CE1-CB 3.61Å; Y171-C284 VanDerWaalsContact CZ-SG 3.53Å
172	I	98.5	Very high	76.7	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	132	166.5	-64.8	174.9	0	0	0	107.3	V174 V200 C201 L206 V210 F211 L246 F251 F283	I172-V174 HydrophobicContact CG2-CG1 4.19Å; I172-V200 HydrophobicContact CG2-CG1 4.12Å; I172-C201 WeakPolarHBondContact CA-O 3.45Å; I172-L206 HydrophobicContact CD1-CB 4.08Å; I172-L206 HydrophobicContact CG1-CB 4.32Å; I172-V210 HydrophobicContact CD1-CB 4.39Å; I172-V210 HydrophobicContact CD1-CG2 3.78Å; I172-F211 HydrophobicContact CG2-CE2 4.24Å; I172-L246 HydrophobicContact CB-CD2 4.06Å; I172-L246 HydrophobicContact CD1-CD2 3.77Å; I172-L246 HydrophobicContact CG1-CD2 4.49Å; I172-L246 HydrophobicContact CG2-CD2 4.04Å; I172-F251 HydrophobicContact CB-CE1 4.36Å; I172-F251 HydrophobicContact CD1-CE1 3.89Å; I172-F251 HydrophobicContact CD1-CE2 4.01Å; I172-F251 HydrophobicContact CD1-CZ 3.61Å; I172-F251 HydrophobicContact CG1-CE1 3.85Å; I172-F251 HydrophobicContact CG1-CZ 4.01Å; I172-F283 PolarHBondContact N-O 2.94Å; I172-F283 WeakPolarHBondContact O-CA 3.47Å; I172-F283 WeakPolarHBondContact O-CB 3.43Å; I172-F283 PolarHBondContact O-N 2.61Å
173	T	98.8	Very high	77.3	Confident	29 Å²	29	66 Å²	66	18%	0.178	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.2	169.7	-56.6	0	0	0	0	108.4	C201 E280 Y281 V282	T173-C201 PolarHBondContact N-O 3.46Å; T173-C201 PolarHBondContact O-N 3.48Å; T173-E280 HydrophobicContact CG2-CB 3.95Å; T173-E280 HydrophobicContact CG2-CG 4.34Å; T173-Y281 WeakPolarHBondContact CA-O 3.28Å; T173-V282 HydrophobicContact CG2-CG2 4.23Å
174	V	98.4	Very high	77.9	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	142.3	170.3	-63	0	0	0	0	109.6	I172 I198 T199 V200 F211 F243 L246 E280 Y281 F283	I172-V174 HydrophobicContact CG2-CG1 4.19Å; V174-I198 HydrophobicContact CB-CG2 4.14Å; V174-T199 VanDerWaalsContact CA-O 3.3Å; V174-T199 WeakPolarHBondContact CA-O 3.42Å; V174-V200 HydrophobicContact CG1-CG2 4.34Å; V174-F211 HydrophobicContact CG1-CZ 4.05Å; V174-F243 HydrophobicContact CG2-CD1 4.23Å; V174-F243 HydrophobicContact CG2-CE1 3.79Å; V174-L246 HydrophobicContact CG1-CD1 3.99Å; V174-L246 HydrophobicContact CG2-CD1 4.33Å; V174-E280 WeakPolarHBondContact O-CA 3.39Å; V174-Y281 HydrophobicContact CG2-CD2 4.36Å; V174-Y281 PolarHBondContact N-O 3.45Å; V174-Y281 PolarHBondContact O-N 3.13Å; V174-F283 HydrophobicContact CG2-CD2 4.28Å; V174-F283 HydrophobicContact CG2-CE2 3.87Å
175	G	97.4	Very high	77.9	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.01	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	171.1	-177.4	0	0	0	0	0	113.3	I198 T199 T279	G175-I198 CarbonylContact O-C 3.57Å; G175-I198 VanDerWaalsContact O-CA 3.28Å; G175-I198 WeakPolarHBondContact O-CA 3.44Å; G175-T199 VanDerWaalsContact C-OG1 3.32Å; G175-T199 PolarHBondContact N-O 2.84Å; G175-T199 PolarHBondContact O-N 2.75Å; G175-T199 PolarHBondContact O-OG1 2.8Å; G175-T199 VanDerWaalsContact O-OG1 3.1Å; G175-T279 CarbonylContact C-O 3.54Å; G175-T279 WeakPolarHBondContact CA-O 3.4Å
176	Y	95.6	Very high	78	Confident	12 Å²	12	73.7 Å²	73.7	5%	0.047	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	157.4	171	77.3	-72.5	0	0	0	111.6	R193 V195 R197 L239 Y278 T279 Y281	Y176-R193 HydrophobicContact CE2-CG 4.29Å; Y176-R193 WeakPolarHBondContact OH-CD 3.42Å; Y176-R193 WeakPolarHBondContact OH-CG 3.47Å; Y176-V195 HydrophobicContact CD2-CB 4.27Å; Y176-V195 HydrophobicContact CD2-CG1 4.18Å; Y176-V195 HydrophobicContact CD2-CG2 3.9Å; Y176-V195 HydrophobicContact CE2-CG2 4Å; Y176-V195 HydrophobicContact CG-CG1 4.14Å; Y176-V195 HydrophobicContact CG-CG2 4.26Å; Y176-R197 WeakPolarHBondContact CB-O 3.39Å; Y176-L239 HydrophobicContact CD1-CD1 3.62Å; Y176-L239 HydrophobicContact CE1-CD1 3.63Å; Y176-L239 HydrophobicContact CG-CD1 4.31Å; Y176-Y278 WeakPolarHBondContact O-CA 3.34Å; Y176-Y278 WeakPolarHBondContact O-CD2 3.32Å; Y176-T279 HydrophobicContact CE1-CG2 4.14Å; Y176-T279 PolarHBondContact N-O 3.09Å; Y176-T279 PolarHBondContact O-N 3.18Å; Y176-Y281 HydrophobicContact CD1-CE2 4.29Å; Y176-Y281 HydrophobicContact CE1-CE2 4.18Å
177	R	90.9	Very high	77.7	Confident	156 Å²	156	76.3 Å²	76.3	59%	0.589	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.8	171	-169.7	174.8	177.3	136.9	2.2	109.2	T276 S277 Y278	R177-T276 HydrophobicContact CG-CG2 3.73Å; R177-T276 VanDerWaalsContact CZ-CG2 3.48Å; R177-T276 PolarHBondContact NH2-OG1 2.59Å; R177-T276 VanDerWaalsContact NH2-OG1 3.09Å; R177-S277 CarbonylContact C-O 3.27Å; R177-S277 WeakPolarHBondContact CA-O 3.42Å; R177-Y278 HydrophobicContact CB-CD2 4.41Å
178	G	86.3	Confident	77.1	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.01	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	147.3	168.7	0	0	0	0	0	110.6	T276 S277	G178-T276 WeakPolarHBondContact O-CA 3.12Å; G178-S277 WeakPolarHBondContact CA-OG 3.47Å; G178-S277 PolarHBondContact N-O 3.06Å; G178-S277 PolarHBondContact O-N 3.35Å
179	S	76.8	Confident	75.5	Confident	51 Å²	51	78.1 Å²	78.1	36%	0.357	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	123.5	172.9	-61.6	0	0	0	0	109.9	R194 W275	S179-R194 PolarHBondContact O-NH2 2.97Å; S179-R194 VanDerWaalsContact O-NH2 3.13Å; S179-W275 WeakPolarHBondContact CA-O 3.19Å
180	Y	73.3	Confident	73.6	Confident	90 Å²	90	79.3 Å²	79.3	35%	0.353	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	126.3	179.6	-53.6	-87.5	0	0	0	109.5	W275	Y180-W275 PolarHBondContact N-O 2.86Å; Y180-W275 PolarHBondContact O-N 3.38Å
181	T	67.1	Low	71.9	Confident	82 Å²	82	85.5 Å²	85.5	50%	0.503	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	134.6	163.7	48.1	0	0	0	0	108.6	K191 I274	T181-K191 PolarHBondContact O-NZ 2.9Å; T181-I274 HydrophobicContact CG2-CG1 4.3Å
182	I	63.4	Low	70.4	Confident	111 Å²	111	88.2 Å²	88.2	57%	0.569	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	83.1	174	-145.5	167.4	0	0	0	108.2	K273	I182-K273 HydrophobicContact CG2-CB 4.5Å; I182-K273 PolarHBondContact N-O 2.81Å
183	G	57.8	Low	69.3	Low	30 Å²	30	92.8 Å²	92.8	31%	0.309	47%	0.465	S	S	.	.			trans	-82.2	162.8	169.2	0	0	0	0	0	111.5	D185 D272	G183-D185 PolarHBondContact O-N 2.91Å; G183-D185 VanDerWaalsContact O-N 3.1Å; G183-D272 WeakPolarHBondContact CA-OD1 3.24Å; G183-D272 VanDerWaalsContact CA-OD2 3.27Å; G183-D272 WeakPolarHBondContact CA-OD2 3.2Å
184	R	55.3	Low	68.5	Low	178 Å²	178	99.6 Å²	99.6	67%	0.672	49%	0.488	S	S	*	.	S	Bend	trans	-71.9	2.6	-170.5	-62.7	-175.1	-164.5	-168.6	1.9	116.2	I186 N270	R184-I186 PolarHBondContact O-N 2.9Å; R184-N270 PolarHBondContact NH2-O 3.49Å; R184-N270 PolarHBondContact NH2-OD1 3.06Å
185	D	49	Very low	67.9	Low	151 Å²	151	100.4 Å²	100.4	81%	0.807	49%	0.493	S	S	*	.			trans	-75	111.4	177.9	-90.5	-43.7	0	0	0	112.1	G183 Q187	G183-D185 PolarHBondContact O-N 2.91Å; G183-D185 VanDerWaalsContact O-N 3.1Å; D185-Q187 PolarHBondContact O-N 3.34Å
186	I	51.4	Low	67.4	Low	165 Å²	165	103.8 Å²	103.8	85%	0.846	52%	0.521	S	S	*	.			trans	-79.1	69	173.1	-55.7	166.2	0	0	0	108	R184	R184-I186 PolarHBondContact O-N 2.9Å
187	Q	46.2	Very low	67.4	Low	138 Å²	138	107.7 Å²	107.7	65%	0.645	54%	0.535	S	S	*	.			trans	-110.9	113.8	162.2	-154.5	86	30.2	0	0	106.4	D185 D189	D185-Q187 PolarHBondContact O-N 3.34Å; Q187-D189 HydrophobicContact CG-CB 4.44Å; Q187-D189 VanDerWaalsContact CG-OD2 3.26Å; Q187-D189 WeakPolarHBondContact CG-OD2 3.21Å; Q187-D189 PolarHBondContact O-N 3.09Å
188	T	46.5	Very low	67.7	Low	144 Å²	144	100.2 Å²	100.2	88%	0.883	51%	0.507	S	S	*	.			trans	-72.6	30.6	-178.6	45.1	0	0	0	0	113.2
189	D	45.6	Very low	68.3	Low	114 Å²	114	101.8 Å²	101.8	61%	0.61	52%	0.516	S	S	*	.			trans	-71.9	137.9	-174.8	-80.7	-22	0	0	0	111.6	Q187 K191	Q187-D189 HydrophobicContact CG-CB 4.44Å; Q187-D189 VanDerWaalsContact CG-OD2 3.26Å; Q187-D189 WeakPolarHBondContact CG-OD2 3.21Å; Q187-D189 PolarHBondContact O-N 3.09Å; D189-K191 PolarHBondContact O-N 2.86Å
190	A	53	Low	69.3	Low	72 Å²	72	99.3 Å²	99.3	60%	0.595	50%	0.499	S	S	*	.			trans	-59.3	93.7	178.1	0	0	0	0	0	110.8	F192	A190-F192 HydrophobicContact CB-CD2 4.46Å; A190-F192 HydrophobicContact CB-CE2 4.07Å; A190-F192 HydrophobicContact CB-CZ 4.26Å; A190-F192 WeakPolarHBondContact O-CD2 3.35Å; A190-F192 PolarHBondContact O-N 3.3Å
191	K	61	Low	70.5	Confident	144 Å²	144	96.2 Å²	96.2	63%	0.626	49%	0.49	S	S	*	.			trans	-69	81.4	170.2	-70.5	-174.8	179.9	176.9	0	109.2	T181 D189	T181-K191 PolarHBondContact O-NZ 2.9Å; D189-K191 PolarHBondContact O-N 2.86Å
192	F	66.3	Low	72	Confident	183 Å²	183	92.8 Å²	92.8	80%	0.803	47%	0.472	S	S	*	.			trans	-51.5	144.9	174.8	-68.7	-81.5	0	0	0	111.2	A190 R194	A190-F192 HydrophobicContact CB-CD2 4.46Å; A190-F192 HydrophobicContact CB-CE2 4.07Å; A190-F192 HydrophobicContact CB-CZ 4.26Å; A190-F192 WeakPolarHBondContact O-CD2 3.35Å; A190-F192 PolarHBondContact O-N 3.3Å; F192-R194 PolarHBondContact O-N 3.15Å
193	R	75.8	Confident	73.6	Confident	96 Å²	96	88.9 Å²	88.9	36%	0.362	45%	0.45	S	S	.	.			trans	-60.7	100.7	-176.4	-175	-166.5	64.3	-162.9	-6.7	111.2	Y176 V195 E240	Y176-R193 HydrophobicContact CE2-CG 4.29Å; Y176-R193 WeakPolarHBondContact OH-CD 3.42Å; Y176-R193 WeakPolarHBondContact OH-CG 3.47Å; R193-V195 HydrophobicContact CG-CG2 4.22Å; R193-V195 PolarHBondContact O-N 2.8Å; R193-E240 IonicContact CZ-OE1 3.57Å; R193-E240 IonicContact CZ-OE2 3.45Å; R193-E240 IonicContact NH1-OE1 3.45Å; R193-E240 PolarHBondContact NH1-OE1 3.22Å; R193-E240 IonicContact NH2-OE1 2.73Å; R193-E240 PolarHBondContact NH2-OE1 2.64Å; R193-E240 IonicContact NH2-OE2 3.9Å; R193-E240 PolarHBondContact NH2-OE2 2.71Å
194	R	81.4	Confident	75.5	Confident	173 Å²	173	87.4 Å²	87.4	65%	0.653	44%	0.436	S	S	*	.			trans	-82.5	104	177.3	-174.6	176.5	63.5	176.2	-4	111.3	S179 F192	S179-R194 PolarHBondContact O-NH2 2.97Å; S179-R194 VanDerWaalsContact O-NH2 3.13Å; F192-R194 PolarHBondContact O-N 3.15Å
195	V	86.9	Confident	77.4	Confident	16 Å²	16	80.5 Å²	80.5	10%	0.097	42%	0.415	C	S	.	.			trans	-94	111	173.7	-179.9	0	0	0	0	108.8	Y176 R193 I198 N237 L239	Y176-V195 HydrophobicContact CD2-CB 4.27Å; Y176-V195 HydrophobicContact CD2-CG1 4.18Å; Y176-V195 HydrophobicContact CD2-CG2 3.9Å; Y176-V195 HydrophobicContact CE2-CG2 4Å; Y176-V195 HydrophobicContact CG-CG1 4.14Å; Y176-V195 HydrophobicContact CG-CG2 4.26Å; R193-V195 HydrophobicContact CG-CG2 4.22Å; R193-V195 PolarHBondContact O-N 2.8Å; V195-I198 HydrophobicContact CG1-CD1 4.42Å; V195-I198 HydrophobicContact CG1-CG1 3.65Å; V195-N237 WeakPolarHBondContact CB-O 3.42Å; V195-N237 WeakPolarHBondContact CG1-O 3.39Å; V195-N237 WeakPolarHBondContact O-CB 3.27Å; V195-L239 HydrophobicContact CG1-CG 4.41Å; V195-L239 HydrophobicContact CG2-CD1 3.7Å; V195-L239 HydrophobicContact CG2-CG 4.11Å
196	A	86.8	Confident	79.7	Confident	72 Å²	72	73.3 Å²	73.3	60%	0.595	38%	0.376	S	S	*	.	S	Bend	trans	-82.9	-28.6	-178.8	0	0	0	0	0	113.5	N237	A196-N237 PolarHBondContact O-ND2 3.02Å; A196-N237 VanDerWaalsContact O-ND2 3.16Å; A196-N237 PolarHBondContact O-OD1 2.84Å
197	R	94.4	Very high	81.9	Confident	94 Å²	94	65.5 Å²	65.5	36%	0.355	34%	0.336	S	S	.	.			trans	-166.2	136.1	-179.7	-175.4	178.3	-59.4	-149.5	2.6	109.1	Y176 Y233 N237	Y176-R197 WeakPolarHBondContact CB-O 3.39Å; R197-Y233 HydrophobicContact CG-CD2 3.91Å; R197-Y233 HydrophobicContact CG-CG 4.06Å; R197-N237 WeakPolarHBondContact CA-OD1 3.43Å
198	I	97.9	Very high	84.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	117.1	170.6	-56.8	166.8	0	0	0	108.4	V174 G175 V195 Y233 L234 Y236 F238 L239 A242	V174-I198 HydrophobicContact CB-CG2 4.14Å; G175-I198 CarbonylContact O-C 3.57Å; G175-I198 VanDerWaalsContact O-CA 3.28Å; G175-I198 WeakPolarHBondContact O-CA 3.44Å; V195-I198 HydrophobicContact CG1-CD1 4.42Å; V195-I198 HydrophobicContact CG1-CG1 3.65Å; I198-Y233 CarbonylContact O-C 3.51Å; I198-Y233 WeakPolarHBondContact O-CA 3.34Å; I198-Y233 WeakPolarHBondContact O-CB 3.15Å; I198-L234 HydrophobicContact CB-CB 4.28Å; I198-L234 HydrophobicContact CB-CD1 3.93Å; I198-L234 HydrophobicContact CB-CG 4.22Å; I198-L234 HydrophobicContact CD1-CD1 4.12Å; I198-L234 HydrophobicContact CG2-CD1 3.67Å; I198-L234 HydrophobicContact CG2-CG 4.22Å; I198-L234 PolarHBondContact O-N 2.88Å; I198-Y236 HydrophobicContact CD1-CE2 4.44Å; I198-F238 WeakPolarHBondContact CD1-O 3.31Å; I198-L239 HydrophobicContact CD1-CD2 3.99Å; I198-L239 HydrophobicContact CD1-CG 4.13Å; I198-L239 HydrophobicContact CG1-CD2 3.91Å; I198-L239 HydrophobicContact CG1-CG 4.24Å; I198-L239 HydrophobicContact CG2-CD2 4.11Å; I198-A242 HydrophobicContact CD1-CB 4.43Å
199	T	98.3	Very high	86.7	Confident	33 Å²	33	60.3 Å²	60.3	20%	0.202	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	150.2	170.6	47.1	0	0	0	0	110.7	V174 G175	V174-T199 VanDerWaalsContact CA-O 3.3Å; V174-T199 WeakPolarHBondContact CA-O 3.42Å; G175-T199 VanDerWaalsContact C-OG1 3.32Å; G175-T199 PolarHBondContact N-O 2.84Å; G175-T199 PolarHBondContact O-N 2.75Å; G175-T199 PolarHBondContact O-OG1 2.8Å; G175-T199 VanDerWaalsContact O-OG1 3.1Å
200	V	98.6	Very high	89.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	124.2	176.8	-175.7	0	0	0	0	109.1	I172 V174 A207 F211 L215 Y232 L234	I172-V200 HydrophobicContact CG2-CG1 4.12Å; V174-V200 HydrophobicContact CG1-CG2 4.34Å; V200-A207 HydrophobicContact CG1-CB 4.18Å; V200-F211 HydrophobicContact CG1-CD2 4.06Å; V200-F211 HydrophobicContact CG1-CE2 3.72Å; V200-F211 HydrophobicContact CG2-CD2 4.41Å; V200-F211 HydrophobicContact CG2-CE2 4.17Å; V200-L215 HydrophobicContact CB-CD1 4.19Å; V200-L215 HydrophobicContact CG1-CD1 4.32Å; V200-L215 HydrophobicContact CG2-CD1 4.07Å; V200-Y232 PolarHBondContact N-O 3.06Å; V200-L234 HydrophobicContact CG2-CD1 4.32Å; V200-L234 HydrophobicContact CG2-CD2 3.66Å; V200-L234 HydrophobicContact CG2-CG 3.71Å
201	C	98.6	Very high	91.4	Very high	24 Å²	24	52.2 Å²	52.2	16%	0.162	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	138.9	179.6	-57.2	0	0	0	0	109.3	I172 T173 T229 S230	I172-C201 WeakPolarHBondContact CA-O 3.45Å; T173-C201 PolarHBondContact N-O 3.46Å; T173-C201 PolarHBondContact O-N 3.48Å; C201-T229 CarbonylContact C-O 3.47Å; C201-T229 VanDerWaalsContact CA-O 3.31Å; C201-T229 WeakPolarHBondContact CA-O 3.33Å; C201-S230 VanDerWaalsContact SG-CA 3.57Å
202	G	97.8	Very high	93.1	Very high	11 Å²	11	47.3 Å²	47.3	11%	0.113	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.1	-166	-179.9	0	0	0	0	0	113.2	Y228 T229	G202-Y228 VanDerWaalsContact C-CD1 3.45Å; G202-Y228 WeakPolarHBondContact O-CA 3.37Å; G202-T229 PolarHBondContact N-O 3.29Å; G202-T229 PolarHBondContact O-N 2.9Å
203	K	97.1	Very high	94.5	Very high	28 Å²	28	47 Å²	47	12%	0.122	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	133.6	175.3	-167.6	179.7	178.3	-176.8	0	110.1	S205 L206 A207 E226 Y228	K203-S205 VanDerWaalsContact C-N 3.34Å; K203-S205 WeakPolarHBondContact CE-OG 3.29Å; K203-S205 PolarHBondContact O-N 2.93Å; K203-L206 HydrophobicContact CB-CB 4.44Å; K203-L206 HydrophobicContact CB-CD1 3.99Å; K203-L206 HydrophobicContact CB-CG 4.12Å; K203-L206 HydrophobicContact CD-CD1 4.48Å; K203-L206 HydrophobicContact CD-CG 4.44Å; K203-L206 PolarHBondContact O-N 3.04Å; K203-L206 VanDerWaalsContact O-N 3.14Å; K203-A207 PolarHBondContact O-N 3.03Å; K203-E226 WeakPolarHBondContact CE-OE2 3.42Å; K203-E226 IonicContact NZ-OE2 3.9Å; K203-E226 PolarHBondContact NZ-OE2 3.01Å; K203-Y228 HydrophobicContact CB-CD1 4.22Å; K203-Y228 HydrophobicContact CB-CE1 3.9Å; K203-Y228 HydrophobicContact CB-CE2 4.49Å; K203-Y228 HydrophobicContact CG-CE2 4.44Å
204	T	97	Very high	95.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-41.3	-172.2	-60.8	0	0	0	0	112.5	L206 A207 K208 R227 Y232	T204-L206 PolarHBondContact O-N 2.73Å; T204-A207 PolarHBondContact O-N 2.9Å; T204-K208 HydrophobicContact CG2-CD 4.18Å; T204-K208 WeakPolarHBondContact O-CG 3.47Å; T204-K208 PolarHBondContact O-N 2.96Å; T204-R227 VanDerWaalsContact CB-O 3.26Å; T204-R227 WeakPolarHBondContact CB-O 3.23Å; T204-R227 PolarHBondContact N-O 3.08Å; T204-R227 PolarHBondContact OG1-O 2.88Å; T204-Y232 HydrophobicContact CG2-CE2 4.16Å; T204-Y232 WeakPolarHBondContact CG2-OH 3.43Å
205	S	96.2	Very high	96.4	Very high	33 Å²	33	36.3 Å²	36.3	23%	0.231	20%	0.203	C	C	.	.	H	α-helix	trans	-57.8	-47	174.9	56.8	0	0	0	0	112.6	K203 K208 E209 P225	K203-S205 VanDerWaalsContact C-N 3.34Å; K203-S205 WeakPolarHBondContact CE-OG 3.29Å; K203-S205 PolarHBondContact O-N 2.93Å; S205-K208 PolarHBondContact O-N 3.08Å; S205-E209 WeakPolarHBondContact O-CB 3.48Å; S205-E209 PolarHBondContact O-N 2.96Å; S205-P225 WeakPolarHBondContact CB-O 3.46Å; S205-P225 PolarHBondContact N-O 2.91Å; S205-P225 PolarHBondContact OG-O 2.82Å
206	L	97.3	Very high	96.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.9	-42.8	-178.9	-59.9	177.7	0	0	0	111.5	K168 I172 K203 T204 K208 E209 V210 F251	K168-L206 WeakPolarHBondContact O-CD2 3.43Å; I172-L206 HydrophobicContact CD1-CB 4.08Å; I172-L206 HydrophobicContact CG1-CB 4.32Å; K203-L206 HydrophobicContact CB-CB 4.44Å; K203-L206 HydrophobicContact CB-CD1 3.99Å; K203-L206 HydrophobicContact CB-CG 4.12Å; K203-L206 HydrophobicContact CD-CD1 4.48Å; K203-L206 HydrophobicContact CD-CG 4.44Å; K203-L206 PolarHBondContact O-N 3.04Å; K203-L206 VanDerWaalsContact O-N 3.14Å; T204-L206 PolarHBondContact O-N 2.73Å; L206-K208 VanDerWaalsContact C-N 3.32Å; L206-K208 PolarHBondContact O-N 2.95Å; L206-E209 WeakPolarHBondContact O-CB 3.38Å; L206-E209 PolarHBondContact O-N 2.81Å; L206-V210 WeakPolarHBondContact O-CG2 3.39Å; L206-V210 PolarHBondContact O-N 2.72Å; L206-F251 HydrophobicContact CB-CZ 4.33Å; L206-F251 HydrophobicContact CD1-CZ 4.31Å; L206-F251 HydrophobicContact CD2-CZ 4.46Å
207	A	97.6	Very high	97.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.5	-40.3	177	0	0	0	0	0	112	V200 K203 T204 F211 L215 Y232	V200-A207 HydrophobicContact CG1-CB 4.18Å; K203-A207 PolarHBondContact O-N 3.03Å; T204-A207 PolarHBondContact O-N 2.9Å; A207-F211 WeakPolarHBondContact O-CB 3.46Å; A207-F211 WeakPolarHBondContact O-CD2 3.27Å; A207-F211 PolarHBondContact O-N 2.81Å; A207-L215 HydrophobicContact CB-CD2 4.08Å; A207-Y232 HydrophobicContact CB-CD2 4.27Å
208	K	96.9	Very high	97.6	Very high	75 Å²	75	35.7 Å²	35.7	33%	0.326	20%	0.201	S	C	.	.	H	α-helix	trans	-70.4	-37.2	175.8	-69.1	-176	-172	-135	0	112.6	T204 S205 L206 G212 L215 E217	T204-K208 HydrophobicContact CG2-CD 4.18Å; T204-K208 WeakPolarHBondContact O-CG 3.47Å; T204-K208 PolarHBondContact O-N 2.96Å; S205-K208 PolarHBondContact O-N 3.08Å; L206-K208 VanDerWaalsContact C-N 3.32Å; L206-K208 PolarHBondContact O-N 2.95Å; K208-G212 VanDerWaalsContact O-CA 3.27Å; K208-G212 WeakPolarHBondContact O-CA 3.38Å; K208-G212 PolarHBondContact O-N 2.81Å; K208-L215 HydrophobicContact CG-CD2 4.02Å; K208-E217 VanDerWaalsContact CE-CD 3.43Å; K208-E217 WeakPolarHBondContact CE-OE1 3.43Å; K208-E217 WeakPolarHBondContact CE-OE2 3.4Å; K208-E217 IonicContact NZ-OE1 2.66Å; K208-E217 PolarHBondContact NZ-OE1 3.41Å; K208-E217 IonicContact NZ-OE2 2.66Å; K208-E217 PolarHBondContact NZ-OE2 2.96Å
209	E	96.8	Very high	97.4	Very high	99 Å²	99	42.1 Å²	42.1	46%	0.463	23%	0.225	S	C	.	.	H	α-helix	trans	-59.3	-48.9	174.5	-173.6	-168.8	154.6	0	0	111.8	S205 L206 R285	S205-E209 WeakPolarHBondContact O-CB 3.48Å; S205-E209 PolarHBondContact O-N 2.96Å; L206-E209 WeakPolarHBondContact O-CB 3.38Å; L206-E209 PolarHBondContact O-N 2.81Å; E209-R285 VanDerWaalsContact CD-NH2 3.28Å; E209-R285 IonicContact OE1-CZ 3.14Å; E209-R285 IonicContact OE1-NH1 3.42Å; E209-R285 PolarHBondContact OE1-NH1 2.85Å; E209-R285 IonicContact OE1-NH2 3.5Å; E209-R285 PolarHBondContact OE1-NH2 3.37Å; E209-R285 IonicContact OE2-CZ 2.64Å; E209-R285 IonicContact OE2-NH1 2.71Å; E209-R285 IonicContact OE2-NH2 3.26Å; E209-R285 PolarHBondContact OE2-NH2 3.19Å
210	V	97.9	Very high	97.3	Very high	12 Å²	12	41.2 Å²	41.2	7%	0.073	22%	0.219	C	C	.	.	H	α-helix	trans	-75.6	-47.7	-176	177.6	0	0	0	0	112.5	I172 L206 K245 L246 A249 F251	I172-V210 HydrophobicContact CD1-CB 4.39Å; I172-V210 HydrophobicContact CD1-CG2 3.78Å; L206-V210 WeakPolarHBondContact O-CG2 3.39Å; L206-V210 PolarHBondContact O-N 2.72Å; V210-K245 HydrophobicContact CG1-CB 4.27Å; V210-L246 HydrophobicContact CG1-CD2 3.9Å; V210-L246 HydrophobicContact CG1-CG 4.04Å; V210-L246 HydrophobicContact CG2-CD2 4.36Å; V210-A249 HydrophobicContact CB-CB 4.45Å; V210-A249 HydrophobicContact CG1-CB 4.35Å; V210-A249 HydrophobicContact CG2-CB 3.72Å; V210-F251 HydrophobicContact CG2-CD2 4.04Å; V210-F251 HydrophobicContact CG2-CE2 3.59Å; V210-F251 HydrophobicContact CG2-CZ 4.43Å
211	F	98.1	Very high	97.1	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.018	24%	0.242	C	C	.	.	H	α-helix	trans	-98.7	-22	-168.4	-61.4	-65.6	0	0	0	113.7	I172 V174 V200 A207 E213 T214 L215 L234 A242 K245 L246	I172-F211 HydrophobicContact CG2-CE2 4.24Å; V174-F211 HydrophobicContact CG1-CZ 4.05Å; V200-F211 HydrophobicContact CG1-CD2 4.06Å; V200-F211 HydrophobicContact CG1-CE2 3.72Å; V200-F211 HydrophobicContact CG2-CD2 4.41Å; V200-F211 HydrophobicContact CG2-CE2 4.17Å; A207-F211 WeakPolarHBondContact O-CB 3.46Å; A207-F211 WeakPolarHBondContact O-CD2 3.27Å; A207-F211 PolarHBondContact O-N 2.81Å; F211-E213 PolarHBondContact O-N 2.8Å; F211-T214 WeakPolarHBondContact O-CB 3.38Å; F211-T214 PolarHBondContact O-N 2.84Å; F211-T214 PolarHBondContact O-OG1 2.72Å; F211-L215 HydrophobicContact CB-CB 3.93Å; F211-L215 HydrophobicContact CB-CD1 4.12Å; F211-L215 HydrophobicContact CB-CG 4.48Å; F211-L215 HydrophobicContact CD2-CD1 4.2Å; F211-L215 HydrophobicContact CG-CD1 4.44Å; F211-L234 HydrophobicContact CB-CD2 3.99Å; F211-L234 HydrophobicContact CD1-CD1 4.29Å; F211-L234 HydrophobicContact CD1-CD2 3.54Å; F211-L234 HydrophobicContact CD2-CD2 4.15Å; F211-L234 HydrophobicContact CE1-CD1 4.04Å; F211-L234 HydrophobicContact CE1-CD2 4.03Å; F211-L234 HydrophobicContact CG-CD2 3.61Å; F211-A242 HydrophobicContact CE1-CB 4.18Å; F211-K245 HydrophobicContact CD1-CD 4.38Å; F211-K245 HydrophobicContact CE1-CB 4.47Å; F211-L246 HydrophobicContact CE1-CG 4.45Å; F211-L246 HydrophobicContact CE2-CD2 4.49Å; F211-L246 HydrophobicContact CZ-CD1 3.99Å; F211-L246 HydrophobicContact CZ-CD2 4.13Å; F211-L246 HydrophobicContact CZ-CG 3.87Å
212	G	96.8	Very high	96.7	Very high	41 Å²	41	51 Å²	51	42%	0.423	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	46.7	-129.7	178	0	0	0	0	0	112.8	K208 T214 L215	K208-G212 VanDerWaalsContact O-CA 3.27Å; K208-G212 WeakPolarHBondContact O-CA 3.38Å; K208-G212 PolarHBondContact O-N 2.81Å; G212-T214 PolarHBondContact O-N 2.87Å; G212-T214 VanDerWaalsContact O-N 3.1Å; G212-L215 VanDerWaalsContact O-CB 3.3Å; G212-L215 WeakPolarHBondContact O-CB 3.26Å; G212-L215 PolarHBondContact O-N 2.94Å; G212-L215 VanDerWaalsContact O-N 3.11Å
213	E	96.9	Very high	96.5	Very high	175 Å²	175	54.5 Å²	54.5	82%	0.818	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-61.9	-16.7	178.9	-59.3	-172.4	168.7	0	0	114.7	F211 L215 K235	F211-E213 PolarHBondContact O-N 2.8Å; E213-L215 VanDerWaalsContact C-N 3.29Å; E213-K235 WeakPolarHBondContact O-CD 3.46Å; E213-K235 VanDerWaalsContact O-CE 3.24Å; E213-K235 WeakPolarHBondContact O-CE 3.32Å; E213-K235 PolarHBondContact O-NZ 3.34Å
214	T	98.1	Very high	96.2	Very high	37 Å²	37	56.7 Å²	56.7	23%	0.227	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-81.3	-10.9	178.3	71.7	0	0	0	0	113.2	F211 G212 K235 Y236	F211-T214 WeakPolarHBondContact O-CB 3.38Å; F211-T214 PolarHBondContact O-N 2.84Å; F211-T214 PolarHBondContact O-OG1 2.72Å; G212-T214 PolarHBondContact O-N 2.87Å; G212-T214 VanDerWaalsContact O-N 3.1Å; T214-K235 WeakPolarHBondContact O-CG 3.45Å; T214-K235 PolarHBondContact O-N 3.44Å; T214-Y236 HydrophobicContact CG2-CD1 4.43Å; T214-Y236 HydrophobicContact CG2-CE1 4.19Å
215	L	98.3	Very high	96	Very high	8 Å²	8	60.3 Å²	60.3	4%	0.042	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	141.8	172.2	-161.6	62.6	0	0	0	110.7	V200 A207 K208 F211 G212 E213 E217 Y232 L234 K235	V200-L215 HydrophobicContact CB-CD1 4.19Å; V200-L215 HydrophobicContact CG1-CD1 4.32Å; V200-L215 HydrophobicContact CG2-CD1 4.07Å; A207-L215 HydrophobicContact CB-CD2 4.08Å; K208-L215 HydrophobicContact CG-CD2 4.02Å; F211-L215 HydrophobicContact CB-CB 3.93Å; F211-L215 HydrophobicContact CB-CD1 4.12Å; F211-L215 HydrophobicContact CB-CG 4.48Å; F211-L215 HydrophobicContact CD2-CD1 4.2Å; F211-L215 HydrophobicContact CG-CD1 4.44Å; G212-L215 VanDerWaalsContact O-CB 3.3Å; G212-L215 WeakPolarHBondContact O-CB 3.26Å; G212-L215 PolarHBondContact O-N 2.94Å; G212-L215 VanDerWaalsContact O-N 3.11Å; E213-L215 VanDerWaalsContact C-N 3.29Å; L215-E217 HydrophobicContact CD2-CG 4.5Å; L215-Y232 HydrophobicContact CD1-CD2 4.15Å; L215-Y232 HydrophobicContact CD1-CG 4.33Å; L215-Y232 HydrophobicContact CD2-CD2 3.66Å; L215-Y232 HydrophobicContact CD2-CE2 3.89Å; L215-Y232 HydrophobicContact CD2-CG 4.39Å; L215-Y232 HydrophobicContact CG-CD2 4.09Å; L215-Y232 HydrophobicContact CG-CG 4.35Å; L215-L234 HydrophobicContact CD1-CD2 4.08Å; L215-K235 VanDerWaalsContact O-CE 3.28Å; L215-K235 WeakPolarHBondContact O-CE 3.37Å
216	N	98.2	Very high	95.7	Very high	36 Å²	36	63.7 Å²	63.7	19%	0.193	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	114.1	172.9	-167	-45.4	0	0	0	110	S218 Y233 K235	N216-S218 VanDerWaalsContact OD1-CB 3.23Å; N216-S218 WeakPolarHBondContact OD1-CB 3.42Å; N216-S218 PolarHBondContact OD1-N 2.67Å; N216-S218 PolarHBondContact OD1-OG 2.93Å; N216-Y233 WeakPolarHBondContact CA-O 3.32Å; N216-Y233 HydrophobicContact CB-CD1 4.34Å; N216-Y233 HydrophobicContact CB-CD2 3.91Å; N216-Y233 HydrophobicContact CB-CE1 4.14Å; N216-Y233 HydrophobicContact CB-CE2 3.69Å; N216-Y233 HydrophobicContact CB-CG 4.23Å; N216-Y233 VanDerWaalsContact CB-O 3.24Å; N216-Y233 WeakPolarHBondContact CB-O 3.08Å; N216-Y233 PolarHBondContact N-O 2.61Å; N216-Y233 PolarHBondContact ND2-OH 3.27Å; N216-Y233 PolarHBondContact O-N 3.1Å; N216-Y233 PolarHBondContact OD1-OH 3.42Å; N216-K235 HydrophobicContact CB-CG 4.13Å
217	E	97.7	Very high	95.6	Very high	56 Å²	56	71.6 Å²	71.6	26%	0.262	37%	0.366	S	S	.	.			trans	-95.6	-1.7	-175.2	-57	-171	-137.5	0	0	113.9	K208 L215 R219 D220 P221 Y232	K208-E217 VanDerWaalsContact CE-CD 3.43Å; K208-E217 WeakPolarHBondContact CE-OE1 3.43Å; K208-E217 WeakPolarHBondContact CE-OE2 3.4Å; K208-E217 IonicContact NZ-OE1 2.66Å; K208-E217 PolarHBondContact NZ-OE1 3.41Å; K208-E217 IonicContact NZ-OE2 2.66Å; K208-E217 PolarHBondContact NZ-OE2 2.96Å; L215-E217 HydrophobicContact CD2-CG 4.5Å; E217-R219 PolarHBondContact O-N 3.33Å; E217-D220 CarbonylContact O-C 3.56Å; E217-D220 VanDerWaalsContact O-C 3.27Å; E217-D220 PolarHBondContact O-N 2.88Å; E217-P221 VanDerWaalsContact O-N 3.16Å; E217-Y232 HydrophobicContact CB-CD1 4.19Å; E217-Y232 HydrophobicContact CB-CE1 3.69Å; E217-Y232 HydrophobicContact CG-CD1 4.2Å; E217-Y232 HydrophobicContact CG-CE1 3.7Å; E217-Y232 HydrophobicContact CG-CE2 4.42Å; E217-Y232 PolarHBondContact OE2-OH 2.94Å
218	S	96.9	Very high	95.6	Very high	77 Å²	77	78.7 Å²	78.7	54%	0.538	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-16.8	-168.7	59.5	0	0	0	0	116.3	N216 Y233	N216-S218 VanDerWaalsContact OD1-CB 3.23Å; N216-S218 WeakPolarHBondContact OD1-CB 3.42Å; N216-S218 PolarHBondContact OD1-N 2.67Å; N216-S218 PolarHBondContact OD1-OG 2.93Å; S218-Y233 PolarHBondContact OG-OH 3.31Å; S218-Y233 VanDerWaalsContact OG-OH 3.13Å
219	R	95.4	Very high	95.6	Very high	135 Å²	135	75.5 Å²	75.5	51%	0.509	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-11.2	177.5	-76.3	-178.8	165.4	-163.3	-6.7	114.4	E217 R231 Y233	E217-R219 PolarHBondContact O-N 3.33Å; R219-R231 HydrophobicContact CB-CB 4.28Å; R219-R231 WeakPolarHBondContact CB-O 3.46Å; R219-R231 PolarHBondContact O-NE 2.92Å; R219-R231 PolarHBondContact O-NH1 3.1Å; R219-R231 VanDerWaalsContact O-NH1 3.07Å; R219-R231 PolarHBondContact O-NH2 3.34Å; R219-Y233 HydrophobicContact CG-CE1 4.1Å
220	D	95.3	Very high	95.7	Very high	15 Å²	15	74.8 Å²	74.8	8%	0.08	39%	0.387	C	S	.	.	S	Bend	trans	-157.7	56.2	-177.7	-156.3	37.9	0	0	0	110.4	E217 R223 T229 R231 Y232	E217-D220 CarbonylContact O-C 3.56Å; E217-D220 VanDerWaalsContact O-C 3.27Å; E217-D220 PolarHBondContact O-N 2.88Å; D220-R223 IonicContact OD1-CZ 3.9Å; D220-R223 IonicContact OD1-NE 2.73Å; D220-R223 IonicContact OD1-NH1 3.88Å; D220-R223 IonicContact OD1-NH2 3.04Å; D220-R223 PolarHBondContact OD1-NH2 3.06Å; D220-R223 WeakPolarHBondContact OD2-CD 3.34Å; D220-R223 IonicContact OD2-CZ 3.44Å; D220-R223 IonicContact OD2-NE 3.34Å; D220-R223 PolarHBondContact OD2-NE 3.04Å; D220-R223 IonicContact OD2-NH1 3.81Å; D220-R223 PolarHBondContact OD2-NH1 3.4Å; D220-R223 IonicContact OD2-NH2 2.82Å; D220-T229 VanDerWaalsContact OD2-CB 3.28Å; D220-T229 WeakPolarHBondContact OD2-CB 3.41Å; D220-T229 PolarHBondContact OD2-OG1 2.96Å; D220-R231 HydrophobicContact CB-CB 3.75Å; D220-R231 HydrophobicContact CB-CG 4.46Å; D220-R231 IonicContact OD1-NH1 3.96Å; D220-Y232 HydrophobicContact CB-CD1 4.44Å; D220-Y232 HydrophobicContact CB-CE1 4.17Å; D220-Y232 WeakPolarHBondContact O-CE1 3.47Å
221	P	94	Very high	95.6	Very high	75 Å²	75	80.7 Å²	80.7	49%	0.487	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	165.9	-176.9	30.9	-37.1	0	0	0	111.9	E217 R223	E217-P221 VanDerWaalsContact O-N 3.16Å; P221-R223 PolarHBondContact O-N 2.63Å
222	D	91.6	Very high	95.7	Very high	155 Å²	155	80.5 Å²	80.5	83%	0.829	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	16.1	172.2	-51	-48.6	0	0	0	115.8
223	R	91.7	Very high	95.7	Very high	84 Å²	84	80.3 Å²	80.3	32%	0.317	39%	0.394	S	S	.	.			trans	-68.1	128.6	178.1	-178.3	144.9	-80.3	177.9	3.6	111.2	D220 P221 R227 Y228	D220-R223 IonicContact OD1-CZ 3.9Å; D220-R223 IonicContact OD1-NE 2.73Å; D220-R223 IonicContact OD1-NH1 3.88Å; D220-R223 IonicContact OD1-NH2 3.04Å; D220-R223 PolarHBondContact OD1-NH2 3.06Å; D220-R223 WeakPolarHBondContact OD2-CD 3.34Å; D220-R223 IonicContact OD2-CZ 3.44Å; D220-R223 IonicContact OD2-NE 3.34Å; D220-R223 PolarHBondContact OD2-NE 3.04Å; D220-R223 IonicContact OD2-NH1 3.81Å; D220-R223 PolarHBondContact OD2-NH1 3.4Å; D220-R223 IonicContact OD2-NH2 2.82Å; P221-R223 PolarHBondContact O-N 2.63Å; R223-R227 HydrophobicContact CG-CB 3.96Å; R223-Y228 WeakPolarHBondContact CD-O 3.34Å; R223-Y228 PolarHBondContact NH1-O 2.84Å; R223-Y228 VanDerWaalsContact NH1-O 3.16Å
224	P	92.3	Very high	95.8	Very high	73 Å²	73	72.1 Å²	72.1	47%	0.474	36%	0.355	S	S	.	.			trans	-60.1	144.1	-179.6	-26.8	34.7	0	0	0	113.2	E226 R227	P224-E226 PolarHBondContact O-N 3.47Å; P224-E226 VanDerWaalsContact O-N 3.1Å; P224-R227 HydrophobicContact CB-CG 4.07Å; P224-R227 HydrophobicContact CG-CG 4.29Å; P224-R227 WeakPolarHBondContact O-CB 3.28Å; P224-R227 PolarHBondContact O-N 3.49Å
225	P	91.4	Very high	95.8	Very high	77 Å²	77	76.9 Å²	76.9	50%	0.5	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-33.1	-174.2	-27.7	35.1	0	0	0	115.1	S205 R227	S205-P225 WeakPolarHBondContact CB-O 3.46Å; S205-P225 PolarHBondContact N-O 2.91Å; S205-P225 PolarHBondContact OG-O 2.82Å; P225-R227 VanDerWaalsContact C-N 3.3Å; P225-R227 PolarHBondContact O-N 3.14Å
226	E	90.6	Very high	95.8	Very high	104 Å²	104	77.8 Å²	77.8	49%	0.486	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-9.6	-179.4	-60.4	-60	153	0	0	113.9	K203 P224	K203-E226 WeakPolarHBondContact CE-OE2 3.42Å; K203-E226 IonicContact NZ-OE2 3.9Å; K203-E226 PolarHBondContact NZ-OE2 3.01Å; P224-E226 PolarHBondContact O-N 3.47Å; P224-E226 VanDerWaalsContact O-N 3.1Å
227	R	95.3	Very high	95.6	Very high	166 Å²	166	79.4 Å²	79.4	63%	0.626	39%	0.385	S	S	*	.	S	Bend	trans	-90.9	156.9	-178.5	-62	-68.7	-76.6	-116.9	1.9	111.8	T204 R223 P224 P225	T204-R227 VanDerWaalsContact CB-O 3.26Å; T204-R227 WeakPolarHBondContact CB-O 3.23Å; T204-R227 PolarHBondContact N-O 3.08Å; T204-R227 PolarHBondContact OG1-O 2.88Å; R223-R227 HydrophobicContact CG-CB 3.96Å; P224-R227 HydrophobicContact CB-CG 4.07Å; P224-R227 HydrophobicContact CG-CG 4.29Å; P224-R227 WeakPolarHBondContact O-CB 3.28Å; P224-R227 PolarHBondContact O-N 3.49Å; P225-R227 VanDerWaalsContact C-N 3.3Å; P225-R227 PolarHBondContact O-N 3.14Å
228	Y	97.6	Very high	95.5	Very high	148 Å²	148	83.5 Å²	83.5	58%	0.58	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	153.1	175.6	-72.9	-101.2	0	0	0	112.3	G202 K203 R223	G202-Y228 VanDerWaalsContact C-CD1 3.45Å; G202-Y228 WeakPolarHBondContact O-CA 3.37Å; K203-Y228 HydrophobicContact CB-CD1 4.22Å; K203-Y228 HydrophobicContact CB-CE1 3.9Å; K203-Y228 HydrophobicContact CB-CE2 4.49Å; K203-Y228 HydrophobicContact CG-CE2 4.44Å; R223-Y228 WeakPolarHBondContact CD-O 3.34Å; R223-Y228 PolarHBondContact NH1-O 2.84Å; R223-Y228 VanDerWaalsContact NH1-O 3.16Å
229	T	97.6	Very high	95.5	Very high	9 Å²	9	79.9 Å²	79.9	6%	0.055	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	158.5	171.2	-174.2	0	0	0	0	111.5	C201 G202 D220 R231 Y232	C201-T229 CarbonylContact C-O 3.47Å; C201-T229 VanDerWaalsContact CA-O 3.31Å; C201-T229 WeakPolarHBondContact CA-O 3.33Å; G202-T229 PolarHBondContact N-O 3.29Å; G202-T229 PolarHBondContact O-N 2.9Å; D220-T229 VanDerWaalsContact OD2-CB 3.28Å; D220-T229 WeakPolarHBondContact OD2-CB 3.41Å; D220-T229 PolarHBondContact OD2-OG1 2.96Å; T229-R231 PolarHBondContact OG1-N 2.84Å; T229-Y232 HydrophobicContact CG2-CD1 4.2Å; T229-Y232 HydrophobicContact CG2-CD2 3.46Å; T229-Y232 VanDerWaalsContact CG2-CD2 3.46Å; T229-Y232 HydrophobicContact CG2-CE1 4.27Å; T229-Y232 HydrophobicContact CG2-CE2 3.53Å; T229-Y232 HydrophobicContact CG2-CG 3.83Å
230	S	97.6	Very high	95.6	Very high	83 Å²	83	77.5 Å²	77.5	58%	0.58	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	15.6	173.1	55.9	0	0	0	0	112.2	C201	C201-S230 VanDerWaalsContact SG-CA 3.57Å
231	R	97.4	Very high	95.7	Very high	136 Å²	136	80.4 Å²	80.4	51%	0.513	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	-8.8	-165.7	-60.7	-173.1	77.4	-168.4	4.6	114.3	R219 D220 T229	R219-R231 HydrophobicContact CB-CB 4.28Å; R219-R231 WeakPolarHBondContact CB-O 3.46Å; R219-R231 PolarHBondContact O-NE 2.92Å; R219-R231 PolarHBondContact O-NH1 3.1Å; R219-R231 VanDerWaalsContact O-NH1 3.07Å; R219-R231 PolarHBondContact O-NH2 3.34Å; D220-R231 HydrophobicContact CB-CB 3.75Å; D220-R231 HydrophobicContact CB-CG 4.46Å; D220-R231 IonicContact OD1-NH1 3.96Å; T229-R231 PolarHBondContact OG1-N 2.84Å
232	Y	98.5	Very high	95.9	Very high	1 Å²	1	76.9 Å²	76.9	0%	0.004	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	158.5	174.6	-67	-17.1	0	0	0	111.7	V200 T204 A207 L215 E217 D220 T229	V200-Y232 PolarHBondContact N-O 3.06Å; T204-Y232 HydrophobicContact CG2-CE2 4.16Å; T204-Y232 WeakPolarHBondContact CG2-OH 3.43Å; A207-Y232 HydrophobicContact CB-CD2 4.27Å; L215-Y232 HydrophobicContact CD1-CD2 4.15Å; L215-Y232 HydrophobicContact CD1-CG 4.33Å; L215-Y232 HydrophobicContact CD2-CD2 3.66Å; L215-Y232 HydrophobicContact CD2-CE2 3.89Å; L215-Y232 HydrophobicContact CD2-CG 4.39Å; L215-Y232 HydrophobicContact CG-CD2 4.09Å; L215-Y232 HydrophobicContact CG-CG 4.35Å; E217-Y232 HydrophobicContact CB-CD1 4.19Å; E217-Y232 HydrophobicContact CB-CE1 3.69Å; E217-Y232 HydrophobicContact CG-CD1 4.2Å; E217-Y232 HydrophobicContact CG-CE1 3.7Å; E217-Y232 HydrophobicContact CG-CE2 4.42Å; E217-Y232 PolarHBondContact OE2-OH 2.94Å; D220-Y232 HydrophobicContact CB-CD1 4.44Å; D220-Y232 HydrophobicContact CB-CE1 4.17Å; D220-Y232 WeakPolarHBondContact O-CE1 3.47Å; T229-Y232 HydrophobicContact CG2-CD1 4.2Å; T229-Y232 HydrophobicContact CG2-CD2 3.46Å; T229-Y232 VanDerWaalsContact CG2-CD2 3.46Å; T229-Y232 HydrophobicContact CG2-CE1 4.27Å; T229-Y232 HydrophobicContact CG2-CE2 3.53Å; T229-Y232 HydrophobicContact CG2-CG 3.83Å
233	Y	98.5	Very high	96.2	Very high	37 Å²	37	71 Å²	71	15%	0.145	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	160.8	173.9	61.1	-85	0	0	0	110.6	R197 I198 N216 S218 R219	R197-Y233 HydrophobicContact CG-CD2 3.91Å; R197-Y233 HydrophobicContact CG-CG 4.06Å; I198-Y233 CarbonylContact O-C 3.51Å; I198-Y233 WeakPolarHBondContact O-CA 3.34Å; I198-Y233 WeakPolarHBondContact O-CB 3.15Å; N216-Y233 WeakPolarHBondContact CA-O 3.32Å; N216-Y233 HydrophobicContact CB-CD1 4.34Å; N216-Y233 HydrophobicContact CB-CD2 3.91Å; N216-Y233 HydrophobicContact CB-CE1 4.14Å; N216-Y233 HydrophobicContact CB-CE2 3.69Å; N216-Y233 HydrophobicContact CB-CG 4.23Å; N216-Y233 VanDerWaalsContact CB-O 3.24Å; N216-Y233 WeakPolarHBondContact CB-O 3.08Å; N216-Y233 PolarHBondContact N-O 2.61Å; N216-Y233 PolarHBondContact ND2-OH 3.27Å; N216-Y233 PolarHBondContact O-N 3.1Å; N216-Y233 PolarHBondContact OD1-OH 3.42Å; S218-Y233 PolarHBondContact OG-OH 3.31Å; S218-Y233 VanDerWaalsContact OG-OH 3.13Å; R219-Y233 HydrophobicContact CG-CE1 4.1Å
234	L	98.5	Very high	96.5	Very high	3 Å²	3	71.4 Å²	71.4	2%	0.016	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	150.3	-179.4	-57.1	176.7	0	0	0	111.5	I198 V200 F211 L215 Y236 A242	I198-L234 HydrophobicContact CB-CB 4.28Å; I198-L234 HydrophobicContact CB-CD1 3.93Å; I198-L234 HydrophobicContact CB-CG 4.22Å; I198-L234 HydrophobicContact CD1-CD1 4.12Å; I198-L234 HydrophobicContact CG2-CD1 3.67Å; I198-L234 HydrophobicContact CG2-CG 4.22Å; I198-L234 PolarHBondContact O-N 2.88Å; V200-L234 HydrophobicContact CG2-CD1 4.32Å; V200-L234 HydrophobicContact CG2-CD2 3.66Å; V200-L234 HydrophobicContact CG2-CG 3.71Å; F211-L234 HydrophobicContact CB-CD2 3.99Å; F211-L234 HydrophobicContact CD1-CD1 4.29Å; F211-L234 HydrophobicContact CD1-CD2 3.54Å; F211-L234 HydrophobicContact CD2-CD2 4.15Å; F211-L234 HydrophobicContact CE1-CD1 4.04Å; F211-L234 HydrophobicContact CE1-CD2 4.03Å; F211-L234 HydrophobicContact CG-CD2 3.61Å; L215-L234 HydrophobicContact CD1-CD2 4.08Å; L234-Y236 HydrophobicContact CB-CD1 4.21Å; L234-Y236 HydrophobicContact CB-CE1 4.08Å; L234-Y236 HydrophobicContact CD1-CE1 4.15Å; L234-Y236 HydrophobicContact CD1-CE2 4.04Å; L234-Y236 HydrophobicContact CD2-CE1 4.44Å; L234-Y236 HydrophobicContact CG-CE1 4.45Å; L234-Y236 PolarHBondContact O-N 2.88Å; L234-A242 HydrophobicContact CD1-CB 3.59Å
235	K	97.8	Very high	96.8	Very high	136 Å²	136	70.8 Å²	70.8	59%	0.591	33%	0.327	S	S	*	.	S	Bend	trans	-75.3	-8.7	174.8	-65.8	177.8	-175.2	168.2	0	113.2	E213 T214 L215 N216	E213-K235 WeakPolarHBondContact O-CD 3.46Å; E213-K235 VanDerWaalsContact O-CE 3.24Å; E213-K235 WeakPolarHBondContact O-CE 3.32Å; E213-K235 PolarHBondContact O-NZ 3.34Å; T214-K235 WeakPolarHBondContact O-CG 3.45Å; T214-K235 PolarHBondContact O-N 3.44Å; L215-K235 VanDerWaalsContact O-CE 3.28Å; L215-K235 WeakPolarHBondContact O-CE 3.37Å; N216-K235 HydrophobicContact CB-CG 4.13Å
236	Y	97.1	Very high	97.2	Very high	27 Å²	27	67.1 Å²	67.1	11%	0.106	30%	0.303	C	S	.	.	S	Bend	trans	-124.1	164.5	177.3	63.6	-88.7	0	0	0	110.8	I198 T214 L234 F238 Q241 A242	I198-Y236 HydrophobicContact CD1-CE2 4.44Å; T214-Y236 HydrophobicContact CG2-CD1 4.43Å; T214-Y236 HydrophobicContact CG2-CE1 4.19Å; L234-Y236 HydrophobicContact CB-CD1 4.21Å; L234-Y236 HydrophobicContact CB-CE1 4.08Å; L234-Y236 HydrophobicContact CD1-CE1 4.15Å; L234-Y236 HydrophobicContact CD1-CE2 4.04Å; L234-Y236 HydrophobicContact CD2-CE1 4.44Å; L234-Y236 HydrophobicContact CG-CE1 4.45Å; L234-Y236 PolarHBondContact O-N 2.88Å; Y236-F238 HydrophobicContact CD2-CB 4.46Å; Y236-F238 VanDerWaalsContact CE2-O 3.32Å; Y236-F238 WeakPolarHBondContact CE2-O 3.3Å; Y236-Q241 HydrophobicContact CD2-CB 4.2Å; Y236-Q241 HydrophobicContact CD2-CG 4.14Å; Y236-Q241 HydrophobicContact CE2-CB 3.72Å; Y236-Q241 HydrophobicContact CE2-CG 3.67Å; Y236-A242 HydrophobicContact CE2-CB 4.12Å; Y236-A242 VanDerWaalsContact OH-CA 3.28Å; Y236-A242 WeakPolarHBondContact OH-CA 3.34Å
237	N	95.8	Very high	97.5	Very high	71 Å²	71	66.3 Å²	66.3	38%	0.38	31%	0.305	S	S	.	.			trans	-120.1	9.9	-169.2	-75.4	-17.7	0	0	0	114.6	V195 A196 R197	V195-N237 WeakPolarHBondContact CB-O 3.42Å; V195-N237 WeakPolarHBondContact CG1-O 3.39Å; V195-N237 WeakPolarHBondContact O-CB 3.27Å; A196-N237 PolarHBondContact O-ND2 3.02Å; A196-N237 VanDerWaalsContact O-ND2 3.16Å; A196-N237 PolarHBondContact O-OD1 2.84Å; R197-N237 WeakPolarHBondContact CA-OD1 3.43Å
238	F	95.4	Very high	97.6	Very high	142 Å²	142	66 Å²	66	62%	0.623	31%	0.311	S	S	*	.			trans	-89.7	115.8	175.1	-55	-70.5	0	0	0	109.8	I198 Y236 Q241	I198-F238 WeakPolarHBondContact CD1-O 3.31Å; Y236-F238 HydrophobicContact CD2-CB 4.46Å; Y236-F238 VanDerWaalsContact CE2-O 3.32Å; Y236-F238 WeakPolarHBondContact CE2-O 3.3Å; F238-Q241 HydrophobicContact CB-CB 3.96Å
239	L	96.1	Very high	97.5	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-68.4	-39.8	-177.4	-86.5	166.2	0	0	0	111.9	Y176 V195 I198 Q241 A242 F243 Y281	Y176-L239 HydrophobicContact CD1-CD1 3.62Å; Y176-L239 HydrophobicContact CE1-CD1 3.63Å; Y176-L239 HydrophobicContact CG-CD1 4.31Å; V195-L239 HydrophobicContact CG1-CG 4.41Å; V195-L239 HydrophobicContact CG2-CD1 3.7Å; V195-L239 HydrophobicContact CG2-CG 4.11Å; I198-L239 HydrophobicContact CD1-CD2 3.99Å; I198-L239 HydrophobicContact CD1-CG 4.13Å; I198-L239 HydrophobicContact CG1-CD2 3.91Å; I198-L239 HydrophobicContact CG1-CG 4.24Å; I198-L239 HydrophobicContact CG2-CD2 4.11Å; L239-Q241 VanDerWaalsContact C-N 3.32Å; L239-Q241 PolarHBondContact O-N 3.44Å; L239-A242 WeakPolarHBondContact O-CA 3.1Å; L239-A242 WeakPolarHBondContact O-CB 3.28Å; L239-A242 PolarHBondContact O-N 2.96Å; L239-F243 HydrophobicContact CB-CE1 4.46Å; L239-F243 HydrophobicContact CB-CE2 4.11Å; L239-F243 HydrophobicContact CB-CZ 3.96Å; L239-F243 HydrophobicContact CD2-CE1 4.13Å; L239-F243 HydrophobicContact CD2-CZ 4.1Å; L239-F243 HydrophobicContact CG-CZ 4.47Å; L239-F243 WeakPolarHBondContact O-CD1 3.47Å; L239-F243 VanDerWaalsContact O-CG 3.29Å; L239-F243 WeakPolarHBondContact O-CG 3.2Å; L239-F243 PolarHBondContact O-N 3.1Å; L239-Y281 HydrophobicContact CD1-CE2 4.1Å; L239-Y281 HydrophobicContact CD2-CD2 4.47Å; L239-Y281 HydrophobicContact CD2-CE2 4.21Å
240	E	96.8	Very high	97.5	Very high	86 Å²	86	61.9 Å²	61.9	40%	0.402	31%	0.313	S	S	.	.	H	α-helix	trans	-60.2	-43.7	-179.5	-67	65.6	-146.2	0	0	110.3	R193 A242 F243 D244	R193-E240 IonicContact CZ-OE1 3.57Å; R193-E240 IonicContact CZ-OE2 3.45Å; R193-E240 IonicContact NH1-OE1 3.45Å; R193-E240 PolarHBondContact NH1-OE1 3.22Å; R193-E240 IonicContact NH2-OE1 2.73Å; R193-E240 PolarHBondContact NH2-OE1 2.64Å; R193-E240 IonicContact NH2-OE2 3.9Å; R193-E240 PolarHBondContact NH2-OE2 2.71Å; E240-A242 PolarHBondContact O-N 2.92Å; E240-A242 VanDerWaalsContact O-N 3.15Å; E240-F243 CarbonylContact O-C 3.55Å; E240-F243 WeakPolarHBondContact O-CA 3.36Å; E240-F243 WeakPolarHBondContact O-CB 3.44Å; E240-F243 PolarHBondContact O-N 2.82Å; E240-D244 PolarHBondContact O-N 2.96Å
241	Q	97.8	Very high	97.5	Very high	76 Å²	76	58.1 Å²	58.1	36%	0.355	29%	0.286	S	S	.	.	H	α-helix	trans	-58.6	-29.4	173.2	-176.3	-178	10.9	0	0	113.5	Y236 F238 L239 K245	Y236-Q241 HydrophobicContact CD2-CB 4.2Å; Y236-Q241 HydrophobicContact CD2-CG 4.14Å; Y236-Q241 HydrophobicContact CE2-CB 3.72Å; Y236-Q241 HydrophobicContact CE2-CG 3.67Å; F238-Q241 HydrophobicContact CB-CB 3.96Å; L239-Q241 VanDerWaalsContact C-N 3.32Å; L239-Q241 PolarHBondContact O-N 3.44Å; Q241-K245 WeakPolarHBondContact O-CG 3.39Å; Q241-K245 PolarHBondContact O-N 2.7Å
242	A	98.4	Very high	97.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-78.5	-36.7	173.9	0	0	0	0	0	112	I198 F211 L234 Y236 L239 E240 L246	I198-A242 HydrophobicContact CD1-CB 4.43Å; F211-A242 HydrophobicContact CE1-CB 4.18Å; L234-A242 HydrophobicContact CD1-CB 3.59Å; Y236-A242 HydrophobicContact CE2-CB 4.12Å; Y236-A242 VanDerWaalsContact OH-CA 3.28Å; Y236-A242 WeakPolarHBondContact OH-CA 3.34Å; L239-A242 WeakPolarHBondContact O-CA 3.1Å; L239-A242 WeakPolarHBondContact O-CB 3.28Å; L239-A242 PolarHBondContact O-N 2.96Å; E240-A242 PolarHBondContact O-N 2.92Å; E240-A242 VanDerWaalsContact O-N 3.15Å; A242-L246 WeakPolarHBondContact O-CD1 3.46Å; A242-L246 WeakPolarHBondContact O-CG 3.4Å; A242-L246 PolarHBondContact O-N 3.11Å; A242-L246 VanDerWaalsContact O-N 3.09Å
243	F	98.5	Very high	97.5	Very high	31 Å²	31	58.7 Å²	58.7	14%	0.136	30%	0.296	C	S	.	.	H	α-helix	trans	-66.9	-41.4	175	-55.8	-23	0	0	0	111.7	V174 L239 E240 L246 T247 M253 Y281 F283	V174-F243 HydrophobicContact CG2-CD1 4.23Å; V174-F243 HydrophobicContact CG2-CE1 3.79Å; L239-F243 HydrophobicContact CB-CE1 4.46Å; L239-F243 HydrophobicContact CB-CE2 4.11Å; L239-F243 HydrophobicContact CB-CZ 3.96Å; L239-F243 HydrophobicContact CD2-CE1 4.13Å; L239-F243 HydrophobicContact CD2-CZ 4.1Å; L239-F243 HydrophobicContact CG-CZ 4.47Å; L239-F243 WeakPolarHBondContact O-CD1 3.47Å; L239-F243 VanDerWaalsContact O-CG 3.29Å; L239-F243 WeakPolarHBondContact O-CG 3.2Å; L239-F243 PolarHBondContact O-N 3.1Å; E240-F243 CarbonylContact O-C 3.55Å; E240-F243 WeakPolarHBondContact O-CA 3.36Å; E240-F243 WeakPolarHBondContact O-CB 3.44Å; E240-F243 PolarHBondContact O-N 2.82Å; F243-L246 PolarHBondContact O-N 3.03Å; F243-T247 WeakPolarHBondContact O-CB 3.26Å; F243-T247 PolarHBondContact O-N 2.74Å; F243-T247 PolarHBondContact O-OG1 2.75Å; F243-M253 HydrophobicContact CD1-CE 4.35Å; F243-M253 HydrophobicContact CD2-CE 4.35Å; F243-M253 HydrophobicContact CE1-CE 4.21Å; F243-M253 HydrophobicContact CE2-CE 4.23Å; F243-M253 HydrophobicContact CG-CE 4.41Å; F243-M253 HydrophobicContact CZ-CE 4.15Å; F243-Y281 HydrophobicContact CE1-CD1 4.44Å; F243-Y281 AromaticContact CE1-CD2 3.89Å; F243-Y281 HydrophobicContact CE1-CD2 3.89Å; F243-Y281 HydrophobicContact CE1-CE2 4.42Å; F243-Y281 AromaticContact CE1-CG 3.9Å; F243-Y281 HydrophobicContact CE1-CG 3.9Å; F243-Y281 AromaticContact CZ-CD1 3.95Å; F243-Y281 HydrophobicContact CZ-CD1 3.95Å; F243-Y281 AromaticContact CZ-CD2 3.74Å; F243-Y281 HydrophobicContact CZ-CD2 3.74Å; F243-Y281 HydrophobicContact CZ-CE1 4.06Å; F243-Y281 AromaticContact CZ-CE2 3.86Å; F243-Y281 HydrophobicContact CZ-CE2 3.86Å; F243-Y281 AromaticContact CZ-CG 3.79Å; F243-Y281 HydrophobicContact CZ-CG 3.79Å; F243-F283 HydrophobicContact CB-CZ 4.13Å; F243-F283 AromaticContact CD1-CE2 3.75Å; F243-F283 HydrophobicContact CD1-CE2 3.75Å; F243-F283 AromaticContact CD1-CZ 3.41Å; F243-F283 HydrophobicContact CD1-CZ 3.41Å; F243-F283 VanDerWaalsContact CD1-CZ 3.41Å; F243-F283 AromaticContact CE1-CE2 3.98Å; F243-F283 HydrophobicContact CE1-CE2 3.98Å; F243-F283 HydrophobicContact CE1-CZ 4.03Å; F243-F283 AromaticContact CG-CZ 3.95Å; F243-F283 HydrophobicContact CG-CZ 3.95Å
244	D	98.3	Very high	97.4	Very high	94 Å²	94	59 Å²	59	50%	0.503	30%	0.301	S	S	.	.	H	α-helix	trans	-59.3	-51.2	176.1	-63.2	-28	0	0	0	109.9	E240 L246 T247 E248	E240-D244 PolarHBondContact O-N 2.96Å; D244-L246 VanDerWaalsContact C-N 3.34Å; D244-L246 PolarHBondContact O-N 2.92Å; D244-T247 CarbonylContact O-C 3.59Å; D244-T247 WeakPolarHBondContact O-CB 3.35Å; D244-T247 PolarHBondContact O-N 2.86Å; D244-E248 WeakPolarHBondContact O-CG 3.18Å; D244-E248 PolarHBondContact O-N 3.34Å
245	K	98.4	Very high	97.4	Very high	59 Å²	59	61.2 Å²	61.2	26%	0.257	32%	0.32	S	S	.	.	H	α-helix	trans	-58	-40.3	176	-79.5	-178.7	159.1	-62	0	114.1	V210 F211 Q241 A249	V210-K245 HydrophobicContact CG1-CB 4.27Å; F211-K245 HydrophobicContact CD1-CD 4.38Å; F211-K245 HydrophobicContact CE1-CB 4.47Å; Q241-K245 WeakPolarHBondContact O-CG 3.39Å; Q241-K245 PolarHBondContact O-N 2.7Å; K245-A249 WeakPolarHBondContact O-CB 3.17Å; K245-A249 PolarHBondContact O-N 3.44Å; K245-A249 VanDerWaalsContact O-N 3.15Å
246	L	98.4	Very high	97.4	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.1	-43.6	174.9	-80.1	160.4	0	0	0	110.9	I172 V174 V210 F211 A242 F243 D244 A249 G250 F251 F283	I172-L246 HydrophobicContact CB-CD2 4.06Å; I172-L246 HydrophobicContact CD1-CD2 3.77Å; I172-L246 HydrophobicContact CG1-CD2 4.49Å; I172-L246 HydrophobicContact CG2-CD2 4.04Å; V174-L246 HydrophobicContact CG1-CD1 3.99Å; V174-L246 HydrophobicContact CG2-CD1 4.33Å; V210-L246 HydrophobicContact CG1-CD2 3.9Å; V210-L246 HydrophobicContact CG1-CG 4.04Å; V210-L246 HydrophobicContact CG2-CD2 4.36Å; F211-L246 HydrophobicContact CE1-CG 4.45Å; F211-L246 HydrophobicContact CE2-CD2 4.49Å; F211-L246 HydrophobicContact CZ-CD1 3.99Å; F211-L246 HydrophobicContact CZ-CD2 4.13Å; F211-L246 HydrophobicContact CZ-CG 3.87Å; A242-L246 WeakPolarHBondContact O-CD1 3.46Å; A242-L246 WeakPolarHBondContact O-CG 3.4Å; A242-L246 PolarHBondContact O-N 3.11Å; A242-L246 VanDerWaalsContact O-N 3.09Å; F243-L246 PolarHBondContact O-N 3.03Å; D244-L246 VanDerWaalsContact C-N 3.34Å; D244-L246 PolarHBondContact O-N 2.92Å; L246-A249 CarbonylContact O-C 3.49Å; L246-A249 PolarHBondContact O-N 2.92Å; L246-G250 PolarHBondContact O-N 2.91Å; L246-F251 HydrophobicContact CB-CB 4.18Å; L246-F251 HydrophobicContact CD2-CB 4.17Å; L246-F251 HydrophobicContact CD2-CD1 4.45Å; L246-F251 HydrophobicContact CD2-CD2 4.16Å; L246-F251 HydrophobicContact CD2-CG 4.01Å; L246-F251 WeakPolarHBondContact O-CB 3.49Å; L246-F251 PolarHBondContact O-N 3.16Å; L246-F283 HydrophobicContact CB-CD1 3.86Å; L246-F283 HydrophobicContact CB-CE1 3.98Å; L246-F283 HydrophobicContact CB-CG 4.41Å; L246-F283 HydrophobicContact CD1-CB 4.47Å; L246-F283 HydrophobicContact CD1-CD1 3.99Å; L246-F283 HydrophobicContact CD1-CD2 3.68Å; L246-F283 HydrophobicContact CD1-CE1 4.06Å; L246-F283 HydrophobicContact CD1-CE2 3.76Å; L246-F283 HydrophobicContact CD1-CG 3.8Å; L246-F283 HydrophobicContact CD1-CZ 3.96Å; L246-F283 HydrophobicContact CD2-CB 4.36Å; L246-F283 HydrophobicContact CD2-CG 4.46Å; L246-F283 HydrophobicContact CG-CD1 4.39Å; L246-F283 HydrophobicContact CG-CG 4.46Å
247	T	97.7	Very high	97.3	Very high	88 Å²	88	60.5 Å²	60.5	54%	0.54	34%	0.335	S	S	.	.	H	α-helix	trans	-66.7	-44.1	179.9	-51.9	0	0	0	0	111.9	F243 D244 A249 G250 F251	F243-T247 WeakPolarHBondContact O-CB 3.26Å; F243-T247 PolarHBondContact O-N 2.74Å; F243-T247 PolarHBondContact O-OG1 2.75Å; D244-T247 CarbonylContact O-C 3.59Å; D244-T247 WeakPolarHBondContact O-CB 3.35Å; D244-T247 PolarHBondContact O-N 2.86Å; T247-A249 PolarHBondContact O-N 2.8Å; T247-G250 PolarHBondContact O-N 3.32Å; T247-F251 WeakPolarHBondContact CA-O 3.41Å
248	E	96.8	Very high	97.2	Very high	159 Å²	159	60.7 Å²	60.7	74%	0.743	34%	0.342	S	S	*	.	H	α-helix	trans	-57.6	-35.4	172.5	-72.8	174	168.9	0	0	112.2	D244 G250	D244-E248 WeakPolarHBondContact O-CG 3.18Å; D244-E248 PolarHBondContact O-N 3.34Å; E248-G250 PolarHBondContact O-N 3.16Å
249	A	96.3	Very high	96.9	Very high	26 Å²	26	58 Å²	58	22%	0.215	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	5.7	175.3	0	0	0	0	0	114.1	V210 K245 L246 T247 F251 R285	V210-A249 HydrophobicContact CB-CB 4.45Å; V210-A249 HydrophobicContact CG1-CB 4.35Å; V210-A249 HydrophobicContact CG2-CB 3.72Å; K245-A249 WeakPolarHBondContact O-CB 3.17Å; K245-A249 PolarHBondContact O-N 3.44Å; K245-A249 VanDerWaalsContact O-N 3.15Å; L246-A249 CarbonylContact O-C 3.49Å; L246-A249 PolarHBondContact O-N 2.92Å; T247-A249 PolarHBondContact O-N 2.8Å; A249-F251 HydrophobicContact CB-CD2 4.16Å; A249-F251 HydrophobicContact CB-CE2 4.49Å; A249-R285 WeakPolarHBondContact O-CD 3.39Å; A249-R285 PolarHBondContact O-NH1 2.88Å
250	G	96.9	Very high	96.5	Very high	45 Å²	45	60.7 Å²	60.7	46%	0.464	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	13.6	177	0	0	0	0	0	115.2	L246 T247 E248 R285	L246-G250 PolarHBondContact O-N 2.91Å; T247-G250 PolarHBondContact O-N 3.32Å; E248-G250 PolarHBondContact O-N 3.16Å; G250-R285 WeakPolarHBondContact O-CG 3.42Å
251	F	98.1	Very high	95.7	Very high	3 Å²	3	60.3 Å²	60.3	1%	0.013	37%	0.369	C	S	.	.			trans	-85.2	144.3	170.6	-70.7	-102.4	0	0	0	111.3	I172 L206 V210 L246 T247 A249 F283 C284 R285	I172-F251 HydrophobicContact CB-CE1 4.36Å; I172-F251 HydrophobicContact CD1-CE1 3.89Å; I172-F251 HydrophobicContact CD1-CE2 4.01Å; I172-F251 HydrophobicContact CD1-CZ 3.61Å; I172-F251 HydrophobicContact CG1-CE1 3.85Å; I172-F251 HydrophobicContact CG1-CZ 4.01Å; L206-F251 HydrophobicContact CB-CZ 4.33Å; L206-F251 HydrophobicContact CD1-CZ 4.31Å; L206-F251 HydrophobicContact CD2-CZ 4.46Å; V210-F251 HydrophobicContact CG2-CD2 4.04Å; V210-F251 HydrophobicContact CG2-CE2 3.59Å; V210-F251 HydrophobicContact CG2-CZ 4.43Å; L246-F251 HydrophobicContact CB-CB 4.18Å; L246-F251 HydrophobicContact CD2-CB 4.17Å; L246-F251 HydrophobicContact CD2-CD1 4.45Å; L246-F251 HydrophobicContact CD2-CD2 4.16Å; L246-F251 HydrophobicContact CD2-CG 4.01Å; L246-F251 WeakPolarHBondContact O-CB 3.49Å; L246-F251 PolarHBondContact O-N 3.16Å; T247-F251 WeakPolarHBondContact CA-O 3.41Å; A249-F251 HydrophobicContact CB-CD2 4.16Å; A249-F251 HydrophobicContact CB-CE2 4.49Å; F251-F283 HydrophobicContact CB-CB 4.1Å; F251-F283 HydrophobicContact CB-CD1 4.24Å; F251-F283 HydrophobicContact CD1-CB 4.19Å; F251-C284 CarbonylContact C-O 3.56Å; F251-C284 VanDerWaalsContact CA-O 3.23Å; F251-C284 WeakPolarHBondContact CA-O 3.49Å; F251-R285 HydrophobicContact CD1-CB 3.64Å; F251-R285 HydrophobicContact CD2-CB 4.08Å; F251-R285 HydrophobicContact CE1-CB 3.66Å; F251-R285 HydrophobicContact CE2-CB 4.11Å; F251-R285 HydrophobicContact CG-CB 3.85Å; F251-R285 HydrophobicContact CZ-CB 3.89Å
252	H	97.6	Very high	94.8	Very high	62 Å²	62	58.7 Å²	58.7	29%	0.287	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	143.7	173.3	53.7	-89.3	0	0	0	110.3	Y94 V254 F283 C284	Y94-H252 PolarHBondContact OH-CD2 2.83Å; Y94-H252 PolarHBondContact OH-NE2 2.83Å; H252-V254 WeakPolarHBondContact CD2-CG1 3.28Å; H252-V254 PolarHBondContact O-N 2.84Å; H252-F283 CarbonylContact O-C 3.48Å; H252-F283 VanDerWaalsContact O-CA 3.27Å; H252-F283 WeakPolarHBondContact O-CA 3.27Å; H252-C284 PolarHBondContact CE1-O 2.84Å; H252-C284 PolarHBondContact N-O 2.84Å; H252-C284 PolarHBondContact ND1-O 3.13Å; H252-C284 VanDerWaalsContact ND1-O 3.1Å; H252-C284 PolarHBondContact O-N 3.38Å
253	M	97.8	Very high	93.4	Very high	88 Å²	88	61.1 Å²	61.1	43%	0.433	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	124.8	177.2	-169.2	-173.7	-65.7	0	0	109.8	F243 Y281 V282 F283	F243-M253 HydrophobicContact CD1-CE 4.35Å; F243-M253 HydrophobicContact CD2-CE 4.35Å; F243-M253 HydrophobicContact CE1-CE 4.21Å; F243-M253 HydrophobicContact CE2-CE 4.23Å; F243-M253 HydrophobicContact CG-CE 4.41Å; F243-M253 HydrophobicContact CZ-CE 4.15Å; M253-Y281 HydrophobicContact CE-CD1 3.93Å; M253-Y281 HydrophobicContact CE-CG 4.38Å; M253-Y281 HydrophobicContact SD-CD1 4.09Å; M253-V282 CarbonylContact C-O 3.59Å; M253-V282 WeakPolarHBondContact CA-O 3.24Å; M253-F283 HydrophobicContact CB-CD1 4.13Å; M253-F283 HydrophobicContact CB-CE1 3.82Å; M253-F283 HydrophobicContact CB-CE2 4.49Å; M253-F283 HydrophobicContact CB-CZ 4.01Å; M253-F283 HydrophobicContact CE-CE1 4.31Å; M253-F283 HydrophobicContact CE-CE2 3.91Å; M253-F283 HydrophobicContact CE-CZ 3.47Å; M253-F283 VanDerWaalsContact CE-CZ 3.47Å; M253-F283 HydrophobicContact CG-CE1 4.48Å; M253-F283 HydrophobicContact CG-CE2 4.3Å; M253-F283 HydrophobicContact CG-CZ 4.21Å
254	V	98.1	Very high	91.9	Very high	42 Å²	42	67.7 Å²	67.7	26%	0.255	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-25.8	-177.8	-63.9	0	0	0	0	113.7	Y94 Y171 H252 V282 C284	Y94-V254 HydrophobicContact CD1-CG1 4.47Å; Y94-V254 HydrophobicContact CE1-CB 4.23Å; Y94-V254 HydrophobicContact CE1-CG1 3.59Å; Y171-V254 HydrophobicContact CE1-CG2 4.27Å; H252-V254 WeakPolarHBondContact CD2-CG1 3.28Å; H252-V254 PolarHBondContact O-N 2.84Å; V254-V282 HydrophobicContact CG2-CB 3.93Å; V254-V282 HydrophobicContact CG2-CG1 3.68Å; V254-V282 WeakPolarHBondContact CG2-O 3.23Å; V254-V282 PolarHBondContact N-O 3.36Å; V254-C284 HydrophobicContact CG1-CB 3.57Å; V254-C284 HydrophobicContact CG2-CB 4.32Å
255	A	97.3	Very high	90.2	Very high	50 Å²	50	67 Å²	67	41%	0.413	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	156.4	-179.9	0	0	0	0	0	112.2	V282	A255-V282 HydrophobicContact CB-CB 4.17Å; A255-V282 HydrophobicContact CB-CG2 4.24Å; A255-V282 PolarHBondContact N-O 2.66Å; A255-V282 PolarHBondContact O-N 3.07Å
256	C	97.3	Very high	88.5	Confident	78 Å²	78	66.3 Å²	66.3	53%	0.527	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139.6	171.2	177.2	0	0	0	0	108.7	E280 Y281	C256-E280 WeakPolarHBondContact CA-O 3.44Å; C256-Y281 HydrophobicContact CB-CD1 4.11Å; C256-Y281 HydrophobicContact CB-CE1 4.48Å; C256-Y281 VanDerWaalsContact SG-CE1 3.51Å
257	S	95.2	Very high	86.8	Confident	71 Å²	71	74.6 Å²	74.6	50%	0.497	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	148.3	173.9	-173.6	0	0	0	0	110.4	T279 E280	S257-T279 CarbonylContact O-C 3.58Å; S257-T279 WeakPolarHBondContact O-CA 3.36Å; S257-T279 WeakPolarHBondContact O-CG2 3.45Å; S257-E280 PolarHBondContact N-O 3.4Å; S257-E280 PolarHBondContact O-N 3.47Å
258	S	93.3	Very high	85.2	Confident	74 Å²	74	74.6 Å²	74.6	52%	0.517	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	120.9	177.8	-164.9	0	0	0	0	111.1	Y278 T279	S258-Y278 CarbonylContact C-O 3.52Å; S258-Y278 WeakPolarHBondContact CA-O 3.48Å; S258-T279 PolarHBondContact OG-OG1 2.94Å
259	T	90.4	Very high	83.6	Confident	86 Å²	86	73.2 Å²	73.2	53%	0.528	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.1	-179.3	-58.9	0	0	0	0	109.5	S277 Y278	T259-S277 CarbonylContact O-C 3.6Å; T259-S277 WeakPolarHBondContact O-CA 3.3Å; T259-Y278 PolarHBondContact N-O 3.41Å; T259-Y278 PolarHBondContact O-N 2.67Å
260	G	86.3	Confident	82	Confident	56 Å²	56	76.9 Å²	76.9	58%	0.577	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	137.1	175.4	0	0	0	0	0	112.2	T276	G260-T276 CarbonylContact C-O 3.51Å; G260-T276 WeakPolarHBondContact CA-O 3.26Å
261	T	80.3	Confident	80.6	Confident	79 Å²	79	79.3 Å²	79.3	49%	0.485	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	137.1	170.1	58.3	0	0	0	0	110.6	T276	T261-T276 PolarHBondContact N-O 3.45Å; T261-T276 PolarHBondContact O-N 2.73Å
262	C	79.7	Confident	78.9	Confident	42 Å²	42	82.9 Å²	82.9	28%	0.284	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	128.3	172.6	-176	0	0	0	0	108.7	W275	C262-W275 HydrophobicContact CB-CD2 4Å; C262-W275 HydrophobicContact CB-CE3 3.85Å; C262-W275 HydrophobicContact CB-CH2 4.03Å; C262-W275 HydrophobicContact CB-CZ2 4.15Å; C262-W275 HydrophobicContact CB-CZ3 3.87Å
263	A	69	Low	77.6	Confident	50 Å²	50	84.1 Å²	84.1	41%	0.413	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	137.4	171.6	0	0	0	0	0	109.9	I274	A263-I274 PolarHBondContact N-O 3.45Å
264	Y	65.9	Low	76.4	Confident	169 Å²	169	82.8 Å²	82.8	66%	0.663	49%	0.491	S	S	*	.			trans	-88.4	126.3	169.2	-61.8	-84.9	0	0	0	108.2
265	T	63.4	Low	75.5	Confident	81 Å²	81	86.3 Å²	86.3	50%	0.497	50%	0.5	S	S	.	.	S	Bend	trans	-77.8	-27	176	41.6	0	0	0	0	112.3	E271 I274	T265-E271 WeakPolarHBondContact CB-OE2 3.47Å; T265-E271 PolarHBondContact OG1-OE2 2.95Å; T265-I274 HydrophobicContact CG2-CD1 3.51Å; T265-I274 HydrophobicContact CG2-CG1 3.93Å
266	S	63.6	Low	74.8	Confident	43 Å²	43	84.7 Å²	84.7	30%	0.301	49%	0.485	S	S	.	.	S	Bend	trans	-151.4	175.9	177.9	68.3	0	0	0	0	111.2	D268 E271	S266-D268 PolarHBondContact OG-N 2.88Å; S266-E271 VanDerWaalsContact CB-OE2 3.24Å; S266-E271 WeakPolarHBondContact CB-OE2 3.41Å; S266-E271 PolarHBondContact OG-OE2 3.14Å
267	N	62.2	Low	74.3	Confident	174 Å²	174	81.7 Å²	81.7	93%	0.93	47%	0.465	S	S	*	.	S	Bend	trans	-81.4	3.1	168.9	-80.5	-7.1	0	0	0	113.1	P269	N267-P269 WeakPolarHBondContact O-CD 3.39Å
268	D	64.6	Low	74.2	Confident	89 Å²	89	82.1 Å²	82.1	48%	0.476	46%	0.456	S	S	.	.			trans	-79.2	118.7	178.4	-168.3	-27.9	0	0	0	110.1	S266 N270 E271	S266-D268 PolarHBondContact OG-N 2.88Å; D268-N270 PolarHBondContact O-N 2.85Å; D268-N270 VanDerWaalsContact O-N 3.11Å; D268-N270 WeakPolarHBondContact OD1-CB 3.33Å; D268-N270 PolarHBondContact OD1-N 3.35Å; D268-E271 HydrophobicContact CB-CG 4.46Å; D268-E271 PolarHBondContact O-N 3.1Å
269	P	61.6	Low	74.2	Confident	129 Å²	129	79 Å²	79	84%	0.838	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-9.4	178.5	28.3	-36.1	0	0	0	114.4	N267	N267-P269 WeakPolarHBondContact O-CD 3.39Å
270	N	63.3	Low	74.6	Confident	104 Å²	104	77.9 Å²	77.9	56%	0.556	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-14.3	178.4	-95.7	-32.2	0	0	0	115.4	R184 D268	R184-N270 PolarHBondContact NH2-O 3.49Å; R184-N270 PolarHBondContact NH2-OD1 3.06Å; D268-N270 PolarHBondContact O-N 2.85Å; D268-N270 VanDerWaalsContact O-N 3.11Å; D268-N270 WeakPolarHBondContact OD1-CB 3.33Å; D268-N270 PolarHBondContact OD1-N 3.35Å
271	E	67	Low	75.2	Confident	96 Å²	96	76.6 Å²	76.6	45%	0.449	40%	0.401	S	S	.	.	S	Bend	trans	-75.2	155.2	-173.9	-87.9	-160.5	157.4	0	0	115.3	T265 S266 D268 K273	T265-E271 WeakPolarHBondContact CB-OE2 3.47Å; T265-E271 PolarHBondContact OG1-OE2 2.95Å; S266-E271 VanDerWaalsContact CB-OE2 3.24Å; S266-E271 WeakPolarHBondContact CB-OE2 3.41Å; S266-E271 PolarHBondContact OG-OE2 3.14Å; D268-E271 HydrophobicContact CB-CG 4.46Å; D268-E271 PolarHBondContact O-N 3.1Å; E271-K273 PolarHBondContact O-N 2.86Å
272	D	63.9	Low	76	Confident	78 Å²	78	74.7 Å²	74.7	42%	0.417	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-67.3	120.9	179.1	-77.4	0.5	0	0	0	112	G183 I274	G183-D272 WeakPolarHBondContact CA-OD1 3.24Å; G183-D272 VanDerWaalsContact CA-OD2 3.27Å; G183-D272 WeakPolarHBondContact CA-OD2 3.2Å; D272-I274 PolarHBondContact O-N 2.88Å
273	K	68.9	Low	76.9	Confident	87 Å²	87	72.8 Å²	72.8	38%	0.378	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	127.4	179.8	-66	-179	-176.1	-177.1	0	111.4	I182 E271	I182-K273 HydrophobicContact CG2-CB 4.5Å; I182-K273 PolarHBondContact N-O 2.81Å; E271-K273 PolarHBondContact O-N 2.86Å
274	I	73.8	Confident	78.3	Confident	61 Å²	61	70.8 Å²	70.8	31%	0.313	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	112.1	172.9	-54.1	-176.3	0	0	0	109.2	T181 A263 T265 D272	T181-I274 HydrophobicContact CG2-CG1 4.3Å; A263-I274 PolarHBondContact N-O 3.45Å; T265-I274 HydrophobicContact CG2-CD1 3.51Å; T265-I274 HydrophobicContact CG2-CG1 3.93Å; D272-I274 PolarHBondContact O-N 2.88Å
275	W	78.3	Confident	79.8	Confident	115 Å²	115	64 Å²	64	44%	0.436	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	118.7	172.9	-65.4	81.1	0	0	0	109.5	S179 Y180 C262	S179-W275 WeakPolarHBondContact CA-O 3.19Å; Y180-W275 PolarHBondContact N-O 2.86Å; Y180-W275 PolarHBondContact O-N 3.38Å; C262-W275 HydrophobicContact CB-CD2 4Å; C262-W275 HydrophobicContact CB-CE3 3.85Å; C262-W275 HydrophobicContact CB-CH2 4.03Å; C262-W275 HydrophobicContact CB-CZ2 4.15Å; C262-W275 HydrophobicContact CB-CZ3 3.87Å
276	T	82.5	Confident	81	Confident	17 Å²	17	69.9 Å²	69.9	10%	0.104	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	136.6	164.6	-66.5	0	0	0	0	108.9	R177 G178 G260 T261	R177-T276 HydrophobicContact CG-CG2 3.73Å; R177-T276 VanDerWaalsContact CZ-CG2 3.48Å; R177-T276 PolarHBondContact NH2-OG1 2.59Å; R177-T276 VanDerWaalsContact NH2-OG1 3.09Å; G178-T276 WeakPolarHBondContact O-CA 3.12Å; G260-T276 CarbonylContact C-O 3.51Å; G260-T276 WeakPolarHBondContact CA-O 3.26Å; T261-T276 PolarHBondContact N-O 3.45Å; T261-T276 PolarHBondContact O-N 2.73Å
277	S	87.8	Confident	81.8	Confident	15 Å²	15	71.2 Å²	71.2	11%	0.105	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	147	159.4	65.9	0	0	0	0	110.2	R177 G178 T259	R177-S277 CarbonylContact C-O 3.27Å; R177-S277 WeakPolarHBondContact CA-O 3.42Å; G178-S277 WeakPolarHBondContact CA-OG 3.47Å; G178-S277 PolarHBondContact N-O 3.06Å; G178-S277 PolarHBondContact O-N 3.35Å; T259-S277 CarbonylContact O-C 3.6Å; T259-S277 WeakPolarHBondContact O-CA 3.3Å
278	Y	91.7	Very high	82.9	Confident	79 Å²	79	65.8 Å²	65.8	31%	0.31	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	121.4	166.5	-176.8	-114	0	0	0	108.1	Y176 R177 S258 T259 E280	Y176-Y278 WeakPolarHBondContact O-CA 3.34Å; Y176-Y278 WeakPolarHBondContact O-CD2 3.32Å; R177-Y278 HydrophobicContact CB-CD2 4.41Å; S258-Y278 CarbonylContact C-O 3.52Å; S258-Y278 WeakPolarHBondContact CA-O 3.48Å; T259-Y278 PolarHBondContact N-O 3.41Å; T259-Y278 PolarHBondContact O-N 2.67Å; Y278-E280 HydrophobicContact CD1-CG 4.12Å; Y278-E280 HydrophobicContact CE1-CG 3.38Å; Y278-E280 WeakPolarHBondContact CE1-OE1 3.43Å; Y278-E280 VanDerWaalsContact CZ-OE1 3.27Å; Y278-E280 PolarHBondContact OH-OE1 2.75Å
279	T	94.9	Very high	83.9	Confident	8 Å²	8	64.5 Å²	64.5	5%	0.049	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.4	-174.6	-50.1	0	0	0	0	109.3	G175 Y176 S257 S258 Y281	G175-T279 CarbonylContact C-O 3.54Å; G175-T279 WeakPolarHBondContact CA-O 3.4Å; Y176-T279 HydrophobicContact CE1-CG2 4.14Å; Y176-T279 PolarHBondContact N-O 3.09Å; Y176-T279 PolarHBondContact O-N 3.18Å; S257-T279 CarbonylContact O-C 3.58Å; S257-T279 WeakPolarHBondContact O-CA 3.36Å; S257-T279 WeakPolarHBondContact O-CG2 3.45Å; S258-T279 PolarHBondContact OG-OG1 2.94Å; T279-Y281 HydrophobicContact CG2-CE1 4.3Å; T279-Y281 HydrophobicContact CG2-CE2 3.92Å
280	E	97.3	Very high	85.2	Confident	64 Å²	64	60.7 Å²	60.7	30%	0.299	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	143.8	-178.3	-66.7	-172.2	133.2	0	0	111.3	T173 V174 C256 S257 Y278	T173-E280 HydrophobicContact CG2-CB 3.95Å; T173-E280 HydrophobicContact CG2-CG 4.34Å; V174-E280 WeakPolarHBondContact O-CA 3.39Å; C256-E280 WeakPolarHBondContact CA-O 3.44Å; S257-E280 PolarHBondContact N-O 3.4Å; S257-E280 PolarHBondContact O-N 3.47Å; Y278-E280 HydrophobicContact CD1-CG 4.12Å; Y278-E280 HydrophobicContact CE1-CG 3.38Å; Y278-E280 WeakPolarHBondContact CE1-OE1 3.43Å; Y278-E280 VanDerWaalsContact CZ-OE1 3.27Å; Y278-E280 PolarHBondContact OH-OE1 2.75Å
281	Y	98.6	Very high	86.6	Confident	29 Å²	29	58 Å²	58	11%	0.114	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.7	179.3	-51.8	-88.2	0	0	0	107.9	T173 V174 Y176 L239 F243 M253 C256 T279	T173-Y281 WeakPolarHBondContact CA-O 3.28Å; V174-Y281 HydrophobicContact CG2-CD2 4.36Å; V174-Y281 PolarHBondContact N-O 3.45Å; V174-Y281 PolarHBondContact O-N 3.13Å; Y176-Y281 HydrophobicContact CD1-CE2 4.29Å; Y176-Y281 HydrophobicContact CE1-CE2 4.18Å; L239-Y281 HydrophobicContact CD1-CE2 4.1Å; L239-Y281 HydrophobicContact CD2-CD2 4.47Å; L239-Y281 HydrophobicContact CD2-CE2 4.21Å; F243-Y281 HydrophobicContact CE1-CD1 4.44Å; F243-Y281 AromaticContact CE1-CD2 3.89Å; F243-Y281 HydrophobicContact CE1-CD2 3.89Å; F243-Y281 HydrophobicContact CE1-CE2 4.42Å; F243-Y281 AromaticContact CE1-CG 3.9Å; F243-Y281 HydrophobicContact CE1-CG 3.9Å; F243-Y281 AromaticContact CZ-CD1 3.95Å; F243-Y281 HydrophobicContact CZ-CD1 3.95Å; F243-Y281 AromaticContact CZ-CD2 3.74Å; F243-Y281 HydrophobicContact CZ-CD2 3.74Å; F243-Y281 HydrophobicContact CZ-CE1 4.06Å; F243-Y281 AromaticContact CZ-CE2 3.86Å; F243-Y281 HydrophobicContact CZ-CE2 3.86Å; F243-Y281 AromaticContact CZ-CG 3.79Å; F243-Y281 HydrophobicContact CZ-CG 3.79Å; M253-Y281 HydrophobicContact CE-CD1 3.93Å; M253-Y281 HydrophobicContact CE-CG 4.38Å; M253-Y281 HydrophobicContact SD-CD1 4.09Å; C256-Y281 HydrophobicContact CB-CD1 4.11Å; C256-Y281 HydrophobicContact CB-CE1 4.48Å; C256-Y281 VanDerWaalsContact SG-CE1 3.51Å; T279-Y281 HydrophobicContact CG2-CE1 4.3Å; T279-Y281 HydrophobicContact CG2-CE2 3.92Å
282	V	98.6	Very high	87.9	Confident	38 Å²	38	55.5 Å²	55.5	23%	0.23	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.2	-177.8	-172.6	0	0	0	0	109	Y171 T173 M253 V254 A255	Y171-V282 HydrophobicContact CD1-CG1 3.93Å; T173-V282 HydrophobicContact CG2-CG2 4.23Å; M253-V282 CarbonylContact C-O 3.59Å; M253-V282 WeakPolarHBondContact CA-O 3.24Å; V254-V282 HydrophobicContact CG2-CB 3.93Å; V254-V282 HydrophobicContact CG2-CG1 3.68Å; V254-V282 WeakPolarHBondContact CG2-O 3.23Å; V254-V282 PolarHBondContact N-O 3.36Å; A255-V282 HydrophobicContact CB-CB 4.17Å; A255-V282 HydrophobicContact CB-CG2 4.24Å; A255-V282 PolarHBondContact N-O 2.66Å; A255-V282 PolarHBondContact O-N 3.07Å
283	F	98.6	Very high	89.6	Confident	3 Å²	3	53.9 Å²	53.9	1%	0.013	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	140.2	178.9	-74.2	-101.8	0	0	0	110.3	Y171 I172 V174 F243 L246 F251 H252 M253	Y171-F283 VanDerWaalsContact CA-O 3.26Å; Y171-F283 WeakPolarHBondContact CA-O 3.47Å; I172-F283 PolarHBondContact N-O 2.94Å; I172-F283 WeakPolarHBondContact O-CA 3.47Å; I172-F283 WeakPolarHBondContact O-CB 3.43Å; I172-F283 PolarHBondContact O-N 2.61Å; V174-F283 HydrophobicContact CG2-CD2 4.28Å; V174-F283 HydrophobicContact CG2-CE2 3.87Å; F243-F283 HydrophobicContact CB-CZ 4.13Å; F243-F283 AromaticContact CD1-CE2 3.75Å; F243-F283 HydrophobicContact CD1-CE2 3.75Å; F243-F283 AromaticContact CD1-CZ 3.41Å; F243-F283 HydrophobicContact CD1-CZ 3.41Å; F243-F283 VanDerWaalsContact CD1-CZ 3.41Å; F243-F283 AromaticContact CE1-CE2 3.98Å; F243-F283 HydrophobicContact CE1-CE2 3.98Å; F243-F283 HydrophobicContact CE1-CZ 4.03Å; F243-F283 AromaticContact CG-CZ 3.95Å; F243-F283 HydrophobicContact CG-CZ 3.95Å; L246-F283 HydrophobicContact CB-CD1 3.86Å; L246-F283 HydrophobicContact CB-CE1 3.98Å; L246-F283 HydrophobicContact CB-CG 4.41Å; L246-F283 HydrophobicContact CD1-CB 4.47Å; L246-F283 HydrophobicContact CD1-CD1 3.99Å; L246-F283 HydrophobicContact CD1-CD2 3.68Å; L246-F283 HydrophobicContact CD1-CE1 4.06Å; L246-F283 HydrophobicContact CD1-CE2 3.76Å; L246-F283 HydrophobicContact CD1-CG 3.8Å; L246-F283 HydrophobicContact CD1-CZ 3.96Å; L246-F283 HydrophobicContact CD2-CB 4.36Å; L246-F283 HydrophobicContact CD2-CG 4.46Å; L246-F283 HydrophobicContact CG-CD1 4.39Å; L246-F283 HydrophobicContact CG-CG 4.46Å; F251-F283 HydrophobicContact CB-CB 4.1Å; F251-F283 HydrophobicContact CB-CD1 4.24Å; F251-F283 HydrophobicContact CD1-CB 4.19Å; H252-F283 CarbonylContact O-C 3.48Å; H252-F283 VanDerWaalsContact O-CA 3.27Å; H252-F283 WeakPolarHBondContact O-CA 3.27Å; M253-F283 HydrophobicContact CB-CD1 4.13Å; M253-F283 HydrophobicContact CB-CE1 3.82Å; M253-F283 HydrophobicContact CB-CE2 4.49Å; M253-F283 HydrophobicContact CB-CZ 4.01Å; M253-F283 HydrophobicContact CE-CE1 4.31Å; M253-F283 HydrophobicContact CE-CE2 3.91Å; M253-F283 HydrophobicContact CE-CZ 3.47Å; M253-F283 VanDerWaalsContact CE-CZ 3.47Å; M253-F283 HydrophobicContact CG-CE1 4.48Å; M253-F283 HydrophobicContact CG-CE2 4.3Å; M253-F283 HydrophobicContact CG-CZ 4.21Å
284	C	97.9	Very high	91.2	Very high	8 Å²	8	51.3 Å²	51.3	5%	0.054	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	146.7	179.5	-176.3	0	0	0	0	110.5	Y171 F251 H252 V254	Y171-C284 HydrophobicContact CD1-CB 3.9Å; Y171-C284 HydrophobicContact CE1-CB 3.61Å; Y171-C284 VanDerWaalsContact CZ-SG 3.53Å; F251-C284 CarbonylContact C-O 3.56Å; F251-C284 VanDerWaalsContact CA-O 3.23Å; F251-C284 WeakPolarHBondContact CA-O 3.49Å; H252-C284 PolarHBondContact CE1-O 2.84Å; H252-C284 PolarHBondContact N-O 2.84Å; H252-C284 PolarHBondContact ND1-O 3.13Å; H252-C284 VanDerWaalsContact ND1-O 3.1Å; H252-C284 PolarHBondContact O-N 3.38Å; V254-C284 HydrophobicContact CG1-CB 3.57Å; V254-C284 HydrophobicContact CG2-CB 4.32Å
285	R	96.6	Very high	92.6	Very high	26 Å²	26	50.5 Å²	50.5	10%	0.098	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	128.1	165.8	-174.9	165.8	71.8	173.6	4.7	107.7	K168 S169 G170 E209 A249 G250 F251	K168-R285 VanDerWaalsContact O-CZ 3.22Å; K168-R285 PolarHBondContact O-NE 3.24Å; K168-R285 PolarHBondContact O-NH2 3.15Å; S169-R285 CarbonylContact C-O 3.54Å; S169-R285 WeakPolarHBondContact CA-O 3.24Å; S169-R285 WeakPolarHBondContact CB-O 3.46Å; G170-R285 PolarHBondContact N-O 3.11Å; G170-R285 PolarHBondContact O-N 3.31Å; E209-R285 VanDerWaalsContact CD-NH2 3.28Å; E209-R285 IonicContact OE1-CZ 3.14Å; E209-R285 IonicContact OE1-NH1 3.42Å; E209-R285 PolarHBondContact OE1-NH1 2.85Å; E209-R285 IonicContact OE1-NH2 3.5Å; E209-R285 PolarHBondContact OE1-NH2 3.37Å; E209-R285 IonicContact OE2-CZ 2.64Å; E209-R285 IonicContact OE2-NH1 2.71Å; E209-R285 IonicContact OE2-NH2 3.26Å; E209-R285 PolarHBondContact OE2-NH2 3.19Å; A249-R285 WeakPolarHBondContact O-CD 3.39Å; A249-R285 PolarHBondContact O-NH1 2.88Å; G250-R285 WeakPolarHBondContact O-CG 3.42Å; F251-R285 HydrophobicContact CD1-CB 3.64Å; F251-R285 HydrophobicContact CD2-CB 4.08Å; F251-R285 HydrophobicContact CE1-CB 3.66Å; F251-R285 HydrophobicContact CE2-CB 4.11Å; F251-R285 HydrophobicContact CG-CB 3.85Å; F251-R285 HydrophobicContact CZ-CB 3.89Å
286	E	88.6	Confident	93.9	Very high	204 Å²	204	44.6 Å²	44.6	95%	0.953	21%	0.212	S	C	*	.			trans	-78.1	0	-179.4	-62.1	-160.2	149.7	0	0	113.7	S169	S169-E286 WeakPolarHBondContact CB-O 3.19Å; S169-E286 WeakPolarHBondContact CB-OXT 3.4Å

Retrieved 286 of 286 residues in 95.5 ms (Link to these results)

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