A0A087WPC4_MOUSE Loading...

Regulator of G-protein signaling 6

AlphaFold DB , UniProt , Accession A0A087WPC4, Species MOUSE (Mus musculus, Mouse), Gene Rgs6, Length 502 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33	Very low	28.9	Very low	248 Å²	248	148.9 Å²	148.9	100%	1.222	88%	0.876	S	S	*	*				0	142.9	0	-74.6	-165.5	-138.5	0	0	108.7
2	A	29	Very low	29	Very low	96 Å²	96	141.9 Å²	141.9	79%	0.793	86%	0.859	S	S	*	*			trans	66.1	87.2	178.7	0	0	0	0	0	115.5
3	Q	30.3	Very low	29.3	Very low	207 Å²	207	143.6 Å²	143.6	97%	0.967	86%	0.857	S	S	*	*				56.9	95.9	88.7	-76	-171.6	-9.8	0	0	113.9
4	G	26.6	Very low	30	Very low	80 Å²	80	138.5 Å²	138.5	83%	0.825	84%	0.838	S	S	*	*			trans	-114	116.6	160	0	0	0	0	0	108.5	G6	G4-G6 PolarHBondContact O-N 3.48Å
5	S	27.2	Very low	31	Very low	120 Å²	120	134.3 Å²	134.3	84%	0.839	81%	0.809	S	S	*	*			trans	-57.4	117.9	177.6	46.9	0	0	0	0	112	D7	S5-D7 PolarHBondContact O-N 3.02Å
6	G	27.5	Very low	32	Very low	75 Å²	75	132.6 Å²	132.6	77%	0.773	80%	0.803	S	S	*	*			trans	-84.8	102.3	167.2	0	0	0	0	0	110.3	G4 Q8	G4-G6 PolarHBondContact O-N 3.48Å; G6-Q8 PolarHBondContact O-N 3.27Å; G6-Q8 VanDerWaalsContact O-N 3.14Å
7	D	26.5	Very low	32.9	Very low	157 Å²	157	132.1 Å²	132.1	84%	0.84	79%	0.789	S	S	*	*			trans	-75.6	94	163.1	-90.7	-20.6	0	0	0	108.8	S5 R9	S5-D7 PolarHBondContact O-N 3.02Å; D7-R9 PolarHBondContact O-N 3.01Å; D7-R9 VanDerWaalsContact O-N 3.17Å
8	Q	28.7	Very low	33.9	Very low	187 Å²	187	131.5 Å²	131.5	87%	0.874	78%	0.777	S	S	*	*			trans	-64.8	107.3	156.8	-74.7	178	7.4	0	0	107.3	G6 A10	G6-Q8 PolarHBondContact O-N 3.27Å; G6-Q8 VanDerWaalsContact O-N 3.14Å; Q8-A10 VanDerWaalsContact C-N 3.27Å; Q8-A10 PolarHBondContact O-N 3.05Å
9	R	29.1	Very low	35.3	Very low	239 Å²	239	126.9 Å²	126.9	90%	0.902	75%	0.753	S	S	*	*			trans	-61.2	94.9	162.8	-79.5	-178.1	175.7	176.9	-1.8	107.9	D7 V11	D7-R9 PolarHBondContact O-N 3.01Å; D7-R9 VanDerWaalsContact O-N 3.17Å; R9-V11 PolarHBondContact O-N 3.47Å
10	A	26.4	Very low	37.1	Very low	95 Å²	95	121.6 Å²	121.6	79%	0.785	72%	0.722	S	S	*	*			trans	-59.3	108.9	161.8	0	0	0	0	0	107.2	Q8 G12	Q8-A10 VanDerWaalsContact C-N 3.27Å; Q8-A10 PolarHBondContact O-N 3.05Å; A10-G12 PolarHBondContact O-N 3.49Å
11	V	33.6	Very low	38.8	Very low	134 Å²	134	117.5 Å²	117.5	81%	0.812	70%	0.699	S	S	*	*			trans	-60	108.9	166.9	176.6	0	0	0	0	105.7	R9 I13	R9-V11 PolarHBondContact O-N 3.47Å; V11-I13 PolarHBondContact O-N 3.44Å; V11-I13 VanDerWaalsContact O-N 3.12Å
12	G	30.5	Very low	41.1	Very low	65 Å²	65	107 Å²	107	67%	0.67	65%	0.647	S	S	*	*			trans	-55.9	119.1	176.3	0	0	0	0	0	108.8	A10 A14	A10-G12 PolarHBondContact O-N 3.49Å; G12-A14 VanDerWaalsContact C-N 3.31Å; G12-A14 PolarHBondContact O-N 3.24Å
13	I	32.9	Very low	43.8	Very low	164 Å²	164	104.4 Å²	104.4	84%	0.841	62%	0.619	S	S	*	*			trans	-65.7	98.8	170	-61	172.3	0	0	0	105.4	V11	V11-I13 PolarHBondContact O-N 3.44Å; V11-I13 VanDerWaalsContact O-N 3.12Å
14	A	39.4	Very low	46.6	Very low	72 Å²	72	99.9 Å²	99.9	60%	0.595	60%	0.601	S	S	*	*			trans	-58	139.6	169.7	0	0	0	0	0	108.6	G12 P16	G12-A14 VanDerWaalsContact C-N 3.31Å; G12-A14 PolarHBondContact O-N 3.24Å; A14-P16 WeakPolarHBondContact O-CD 3.36Å
15	D	44.5	Very low	49.8	Very low	75 Å²	75	99.6 Å²	99.6	40%	0.401	58%	0.583	S	S	.	*			trans	-53.9	123.6	177.6	-167.3	-23.5	0	0	0	109.1	E17 E18	D15-E17 PolarHBondContact O-N 3Å; D15-E17 PolarHBondContact OD1-N 3.47Å; D15-E18 HydrophobicContact CB-CB 4.43Å; D15-E18 HydrophobicContact CB-CG 4.2Å; D15-E18 PolarHBondContact O-N 3.42Å
16	P	47	Very low	52.9	Low	108 Å²	108	94.9 Å²	94.9	70%	0.701	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-21.5	-179.5	7.9	-17.3	0	0	0	113.4	A14 E18	A14-P16 WeakPolarHBondContact O-CD 3.36Å; P16-E18 VanDerWaalsContact C-N 3.35Å
17	E	47	Very low	56.1	Low	123 Å²	123	94 Å²	94	58%	0.575	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-13.3	174.1	-66.8	-153.8	172.8	0	0	114.9	D15 K224	D15-E17 PolarHBondContact O-N 3Å; D15-E17 PolarHBondContact OD1-N 3.47Å; E17-K224 IonicContact OE2-NZ 3.21Å; E17-K224 PolarHBondContact OE2-NZ 3.22Å
18	E	51.6	Low	59.4	Low	122 Å²	122	92.9 Å²	92.9	57%	0.57	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-8.9	-176.9	-67.1	-165.3	148.4	0	0	114.2	D15 P16	D15-E18 HydrophobicContact CB-CB 4.43Å; D15-E18 HydrophobicContact CB-CG 4.2Å; D15-E18 PolarHBondContact O-N 3.42Å; P16-E18 VanDerWaalsContact C-N 3.35Å
19	S	60.8	Low	62.7	Low	45 Å²	45	84.9 Å²	84.9	32%	0.315	48%	0.478	S	S	.	.	S	Bend	trans	-86.6	150.8	-177.4	72.2	0	0	0	0	113.4
20	S	69.6	Low	65.9	Low	19 Å²	19	74.9 Å²	74.9	13%	0.133	44%	0.442	C	S	.	.			trans	-51.8	137.1	171.6	171.3	0	0	0	0	110.1	N22 M23	S20-N22 PolarHBondContact O-N 3.41Å; S20-N22 PolarHBondContact OG-N 3.4Å; S20-M23 WeakPolarHBondContact O-CB 3.14Å; S20-M23 PolarHBondContact O-N 3.27Å
21	P	72.8	Confident	69.2	Low	37 Å²	37	75 Å²	75	24%	0.24	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-15.6	176	-26.9	36.6	0	0	0	114.4	M215 K219 L223	P21-M215 HydrophobicContact CG-SD 4.26Å; P21-K219 HydrophobicContact CB-CB 3.96Å; P21-K219 HydrophobicContact CB-CD 3.94Å; P21-K219 HydrophobicContact CB-CG 3.83Å; P21-K219 HydrophobicContact CG-CB 3.92Å; P21-K219 HydrophobicContact CG-CG 4.31Å; P21-L223 HydrophobicContact CG-CD1 4.31Å
22	N	81.9	Confident	72.3	Confident	27 Å²	27	70 Å²	70	14%	0.144	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-3.4	176.9	-62.4	-19.7	0	0	0	113	S20 I24 V25 Y26 K219	S20-N22 PolarHBondContact O-N 3.41Å; S20-N22 PolarHBondContact OG-N 3.4Å; N22-I24 VanDerWaalsContact C-N 3.31Å; N22-I24 PolarHBondContact O-N 2.89Å; N22-V25 WeakPolarHBondContact O-CB 3.37Å; N22-V25 PolarHBondContact O-N 3.4Å; N22-Y26 HydrophobicContact CB-CE1 4.31Å; N22-Y26 HydrophobicContact CB-CE2 3.88Å; N22-Y26 PolarHBondContact O-N 3.44Å; N22-Y26 VanDerWaalsContact O-N 3.16Å; N22-K219 PolarHBondContact OD1-NZ 3.4Å
23	M	86.5	Confident	75.5	Confident	41 Å²	41	67 Å²	67	20%	0.202	37%	0.366	C	S	.	.	H	α-helix	trans	-57.3	-41.9	-174	-172.4	59.8	70	0	0	112.7	S20 V25 Y26 C27 S121	S20-M23 WeakPolarHBondContact O-CB 3.14Å; S20-M23 PolarHBondContact O-N 3.27Å; M23-V25 PolarHBondContact O-N 3.26Å; M23-Y26 PolarHBondContact O-N 3.45Å; M23-Y26 VanDerWaalsContact O-N 3.12Å; M23-Y26 HydrophobicContact SD-CD2 4.38Å; M23-C27 PolarHBondContact O-N 2.81Å; M23-C27 PolarHBondContact O-SG 2.75Å; M23-S121 WeakPolarHBondContact CE-O 3.26Å
24	I	88.9	Confident	78.5	Confident	113 Å²	113	63.1 Å²	63.1	58%	0.579	35%	0.351	S	S	*	.	H	α-helix	trans	-59.6	-32.7	177.6	-168.5	169.2	0	0	0	112.6	N22 K28	N22-I24 VanDerWaalsContact C-N 3.31Å; N22-I24 PolarHBondContact O-N 2.89Å; I24-K28 VanDerWaalsContact O-CG 3.31Å; I24-K28 WeakPolarHBondContact O-CG 3.45Å; I24-K28 PolarHBondContact O-N 2.92Å
25	V	92.6	Very high	81.2	Confident	73 Å²	73	65.7 Å²	65.7	44%	0.442	35%	0.348	S	S	.	.	H	α-helix	trans	-73.1	-44.5	177.3	-179.5	0	0	0	0	109.6	N22 M23 C27 K28 I29	N22-V25 WeakPolarHBondContact O-CB 3.37Å; N22-V25 PolarHBondContact O-N 3.4Å; M23-V25 PolarHBondContact O-N 3.26Å; V25-C27 PolarHBondContact O-N 3.1Å; V25-K28 PolarHBondContact O-N 2.79Å; V25-I29 HydrophobicContact CG1-CD1 4.03Å; V25-I29 WeakPolarHBondContact O-CG1 3.42Å; V25-I29 PolarHBondContact O-N 2.74Å
26	Y	93.1	Very high	83.7	Confident	22 Å²	22	62.1 Å²	62.1	9%	0.086	33%	0.329	C	S	.	.	H	α-helix	trans	-58.3	-48.5	176.2	-58.6	-31.3	0	0	0	111.9	N22 M23 K28 I29 E30 Y93 P120	N22-Y26 HydrophobicContact CB-CE1 4.31Å; N22-Y26 HydrophobicContact CB-CE2 3.88Å; N22-Y26 PolarHBondContact O-N 3.44Å; N22-Y26 VanDerWaalsContact O-N 3.16Å; M23-Y26 PolarHBondContact O-N 3.45Å; M23-Y26 VanDerWaalsContact O-N 3.12Å; M23-Y26 HydrophobicContact SD-CD2 4.38Å; Y26-K28 VanDerWaalsContact C-N 3.31Å; Y26-K28 PolarHBondContact O-N 3.48Å; Y26-I29 PolarHBondContact O-N 3.37Å; Y26-I29 VanDerWaalsContact O-N 3.11Å; Y26-E30 WeakPolarHBondContact O-CB 3.3Å; Y26-E30 VanDerWaalsContact O-CG 3.25Å; Y26-E30 WeakPolarHBondContact O-CG 3.27Å; Y26-E30 PolarHBondContact O-N 3.45Å; Y26-Y93 WeakPolarHBondContact CB-OH 3.45Å; Y26-P120 HydrophobicContact CD1-CB 4.38Å; Y26-P120 HydrophobicContact CD1-CG 3.95Å; Y26-P120 HydrophobicContact CE1-CB 4.05Å; Y26-P120 HydrophobicContact CE1-CG 4.01Å; Y26-P120 HydrophobicContact CE2-CB 4.36Å; Y26-P120 HydrophobicContact CG-CG 4.4Å
27	C	93.9	Very high	86	Confident	55 Å²	55	60.5 Å²	60.5	37%	0.372	31%	0.312	S	S	.	.	H	α-helix	trans	-57.7	-42.6	177.1	-62.9	0	0	0	0	112.2	M23 V25 I29 E30 D31	M23-C27 PolarHBondContact O-N 2.81Å; M23-C27 PolarHBondContact O-SG 2.75Å; V25-C27 PolarHBondContact O-N 3.1Å; C27-I29 PolarHBondContact O-N 3.1Å; C27-E30 PolarHBondContact O-N 3.41Å; C27-D31 VanDerWaalsContact O-CG 3.3Å; C27-D31 PolarHBondContact O-N 3.26Å
28	K	96.3	Very high	88.1	Confident	134 Å²	134	57.3 Å²	57.3	58%	0.583	30%	0.299	S	S	*	.	H	α-helix	trans	-63.7	-39.5	177.1	-74.4	178.3	178.2	-169	0	112.7	I24 V25 Y26 I32	I24-K28 VanDerWaalsContact O-CG 3.31Å; I24-K28 WeakPolarHBondContact O-CG 3.45Å; I24-K28 PolarHBondContact O-N 2.92Å; V25-K28 PolarHBondContact O-N 2.79Å; Y26-K28 VanDerWaalsContact C-N 3.31Å; Y26-K28 PolarHBondContact O-N 3.48Å; K28-I32 WeakPolarHBondContact O-CG1 3.5Å; K28-I32 PolarHBondContact O-N 2.98Å
29	I	97.6	Very high	89.5	Confident	19 Å²	19	57.8 Å²	57.8	10%	0.097	31%	0.306	C	S	.	.	H	α-helix	trans	-67	-43.2	175.7	-64.8	167.7	0	0	0	109.9	V25 Y26 C27 D31 I32 I33 I88 Q91 Y93	V25-I29 HydrophobicContact CG1-CD1 4.03Å; V25-I29 WeakPolarHBondContact O-CG1 3.42Å; V25-I29 PolarHBondContact O-N 2.74Å; Y26-I29 PolarHBondContact O-N 3.37Å; Y26-I29 VanDerWaalsContact O-N 3.11Å; C27-I29 PolarHBondContact O-N 3.1Å; I29-D31 VanDerWaalsContact C-N 3.31Å; I29-D31 PolarHBondContact O-N 3.4Å; I29-I32 WeakPolarHBondContact O-CA 3.49Å; I29-I32 WeakPolarHBondContact O-CB 3.11Å; I29-I32 PolarHBondContact O-N 2.91Å; I29-I33 HydrophobicContact CG2-CG1 4.07Å; I29-I33 VanDerWaalsContact O-CG1 3.28Å; I29-I33 WeakPolarHBondContact O-CG1 3.48Å; I29-I33 PolarHBondContact O-N 3.2Å; I29-I88 HydrophobicContact CG2-CB 4.45Å; I29-I88 HydrophobicContact CG2-CG1 4Å; I29-I88 HydrophobicContact CG2-CG2 4.02Å; I29-Q91 HydrophobicContact CD1-CG 4.22Å; I29-Y93 HydrophobicContact CB-CD2 4.28Å; I29-Y93 HydrophobicContact CB-CE2 3.97Å; I29-Y93 HydrophobicContact CD1-CE2 4.16Å; I29-Y93 HydrophobicContact CG2-CD1 4.33Å; I29-Y93 HydrophobicContact CG2-CD2 3.32Å; I29-Y93 HydrophobicContact CG2-CE2 3.52Å; I29-Y93 HydrophobicContact CG2-CG 3.75Å
30	E	96.9	Very high	90.5	Very high	29 Å²	29	65 Å²	65	14%	0.136	33%	0.332	C	S	.	.	H	α-helix	trans	-62.8	-36.6	179.6	-72.4	171.3	-162	0	0	112.8	Y26 C27 I32 I33 T34 Y93 W119 S121	Y26-E30 WeakPolarHBondContact O-CB 3.3Å; Y26-E30 VanDerWaalsContact O-CG 3.25Å; Y26-E30 WeakPolarHBondContact O-CG 3.27Å; Y26-E30 PolarHBondContact O-N 3.45Å; C27-E30 PolarHBondContact O-N 3.41Å; E30-I32 VanDerWaalsContact C-N 3.33Å; E30-I32 PolarHBondContact O-N 3.06Å; E30-I33 PolarHBondContact O-N 3.36Å; E30-T34 WeakPolarHBondContact O-CB 3.38Å; E30-T34 PolarHBondContact O-N 3.02Å; E30-T34 PolarHBondContact O-OG1 2.94Å; E30-Y93 HydrophobicContact CG-CD1 4.23Å; E30-Y93 HydrophobicContact CG-CE1 3.3Å; E30-Y93 WeakPolarHBondContact OE1-CE1 3.11Å; E30-Y93 PolarHBondContact OE1-OH 3.09Å; E30-W119 HydrophobicContact CB-CE3 4.31Å; E30-W119 HydrophobicContact CB-CH2 4.29Å; E30-W119 HydrophobicContact CB-CZ3 3.81Å; E30-W119 HydrophobicContact CG-CD2 4.1Å; E30-W119 HydrophobicContact CG-CE3 3.44Å; E30-W119 VanDerWaalsContact CG-CE3 3.44Å; E30-W119 HydrophobicContact CG-CH2 4.12Å; E30-W119 HydrophobicContact CG-CZ3 3.44Å; E30-W119 VanDerWaalsContact CG-CZ3 3.44Å; E30-S121 WeakPolarHBondContact OE1-CB 3.45Å; E30-S121 PolarHBondContact OE1-OG 3.27Å
31	D	96.7	Very high	90.9	Very high	99 Å²	99	68.7 Å²	68.7	53%	0.529	35%	0.353	S	S	.	.	H	α-helix	trans	-61.9	-41.5	172	-72.9	-19.7	0	0	0	111.5	C27 I29 K35	C27-D31 VanDerWaalsContact O-CG 3.3Å; C27-D31 PolarHBondContact O-N 3.26Å; I29-D31 VanDerWaalsContact C-N 3.31Å; I29-D31 PolarHBondContact O-N 3.4Å; D31-K35 WeakPolarHBondContact O-CG 3.43Å; D31-K35 PolarHBondContact O-N 3.31Å; D31-K35 VanDerWaalsContact O-N 3.16Å
32	I	97.5	Very high	91.6	Very high	29 Å²	29	69.2 Å²	69.2	15%	0.149	37%	0.365	C	S	.	.	H	α-helix	trans	-64	-48.1	174.9	-65.8	167.9	0	0	0	110	K28 I29 E30 T34 K35 M36 W68 L69 L73 I88	K28-I32 WeakPolarHBondContact O-CG1 3.5Å; K28-I32 PolarHBondContact O-N 2.98Å; I29-I32 WeakPolarHBondContact O-CA 3.49Å; I29-I32 WeakPolarHBondContact O-CB 3.11Å; I29-I32 PolarHBondContact O-N 2.91Å; E30-I32 VanDerWaalsContact C-N 3.33Å; E30-I32 PolarHBondContact O-N 3.06Å; I32-T34 VanDerWaalsContact C-N 3.28Å; I32-T34 PolarHBondContact O-N 2.84Å; I32-K35 PolarHBondContact O-N 3.13Å; I32-M36 HydrophobicContact CG2-CE 4.07Å; I32-M36 HydrophobicContact CG2-CG 4.38Å; I32-M36 HydrophobicContact CG2-SD 4.25Å; I32-M36 WeakPolarHBondContact O-CG 3.34Å; I32-M36 PolarHBondContact O-N 3.42Å; I32-W68 HydrophobicContact CG2-CH2 4.46Å; I32-W68 HydrophobicContact CG2-CZ3 3.99Å; I32-L69 HydrophobicContact CG2-CD2 4.23Å; I32-L73 HydrophobicContact CD1-CD1 4.25Å; I32-I88 HydrophobicContact CG2-CD1 4.29Å
33	I	97.9	Very high	92.1	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-62	-36.7	-179.3	-68.4	-67.7	0	0	0	112.1	I29 E30 M36 Q37 I88 Y93 I94 F113 W119	I29-I33 HydrophobicContact CG2-CG1 4.07Å; I29-I33 VanDerWaalsContact O-CG1 3.28Å; I29-I33 WeakPolarHBondContact O-CG1 3.48Å; I29-I33 PolarHBondContact O-N 3.2Å; E30-I33 PolarHBondContact O-N 3.36Å; I33-M36 HydrophobicContact CD1-SD 4.26Å; I33-M36 PolarHBondContact O-N 3.24Å; I33-Q37 WeakPolarHBondContact O-CG 3.32Å; I33-Q37 PolarHBondContact O-N 3.29Å; I33-Q37 PolarHBondContact O-NE2 3.18Å; I33-I88 HydrophobicContact CD1-CG2 3.72Å; I33-I88 HydrophobicContact CG1-CG2 4.39Å; I33-Y93 HydrophobicContact CG1-CD1 4.2Å; I33-Y93 HydrophobicContact CG1-CG 4.16Å; I33-I94 HydrophobicContact CD1-CD1 3.63Å; I33-I94 HydrophobicContact CD1-CG1 3.59Å; I33-F113 HydrophobicContact CD1-CD1 4.28Å; I33-F113 HydrophobicContact CD1-CE1 4.3Å; I33-F113 HydrophobicContact CG2-CD1 4.35Å; I33-W119 HydrophobicContact CG2-CH2 4.41Å; I33-W119 HydrophobicContact CG2-CZ2 3.83Å
34	T	95.7	Very high	92.5	Very high	84 Å²	84	66.8 Å²	66.8	52%	0.515	36%	0.357	S	S	.	.	H	α-helix	trans	-66.2	-44.3	176.4	-59.5	0	0	0	0	110.6	E30 I32 Q37 D38	E30-T34 WeakPolarHBondContact O-CB 3.38Å; E30-T34 PolarHBondContact O-N 3.02Å; E30-T34 PolarHBondContact O-OG1 2.94Å; I32-T34 VanDerWaalsContact C-N 3.28Å; I32-T34 PolarHBondContact O-N 2.84Å; T34-Q37 PolarHBondContact O-N 3.28Å; T34-D38 PolarHBondContact O-N 2.95Å
35	K	96.4	Very high	92.7	Very high	125 Å²	125	63.9 Å²	63.9	54%	0.543	35%	0.345	S	S	.	.	H	α-helix	trans	-66.1	-37.3	175.5	-68.9	172.2	-176.2	177.2	0	112.6	D31 I32 Q37 D38 W68	D31-K35 WeakPolarHBondContact O-CG 3.43Å; D31-K35 PolarHBondContact O-N 3.31Å; D31-K35 VanDerWaalsContact O-N 3.16Å; I32-K35 PolarHBondContact O-N 3.13Å; K35-Q37 PolarHBondContact O-N 3.43Å; K35-D38 PolarHBondContact O-N 3.44Å; K35-W68 HydrophobicContact CB-CH2 3.74Å; K35-W68 HydrophobicContact CB-CZ2 3.78Å
36	M	97.2	Very high	92.8	Very high	0 Å²	0	64 Å²	64	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-61.7	-30.1	175.4	-77.8	-177.2	163.3	0	0	112.8	I32 I33 G43 V44 I65 W68 L69 I94 F113	I32-M36 HydrophobicContact CG2-CE 4.07Å; I32-M36 HydrophobicContact CG2-CG 4.38Å; I32-M36 HydrophobicContact CG2-SD 4.25Å; I32-M36 WeakPolarHBondContact O-CG 3.34Å; I32-M36 PolarHBondContact O-N 3.42Å; I33-M36 HydrophobicContact CD1-SD 4.26Å; I33-M36 PolarHBondContact O-N 3.24Å; M36-G43 CarbonylContact O-C 3.41Å; M36-G43 VanDerWaalsContact O-CA 3.31Å; M36-G43 WeakPolarHBondContact O-CA 3.3Å; M36-V44 HydrophobicContact CB-CG2 4.1Å; M36-V44 HydrophobicContact CG-CG2 4.08Å; M36-V44 PolarHBondContact O-N 3.33Å; M36-I65 HydrophobicContact CE-CG2 3.76Å; M36-I65 HydrophobicContact SD-CG2 4.48Å; M36-W68 HydrophobicContact CE-CD2 4.35Å; M36-W68 HydrophobicContact CE-CE3 3.41Å; M36-W68 VanDerWaalsContact CE-CE3 3.41Å; M36-W68 HydrophobicContact CE-CZ3 3.68Å; M36-W68 HydrophobicContact CG-CD2 3.83Å; M36-W68 HydrophobicContact CG-CE3 3.48Å; M36-W68 VanDerWaalsContact CG-CE3 3.48Å; M36-W68 HydrophobicContact CG-CH2 3.66Å; M36-W68 HydrophobicContact CG-CZ2 3.99Å; M36-W68 HydrophobicContact CG-CZ3 3.4Å; M36-W68 HydrophobicContact SD-CE3 4.34Å; M36-W68 HydrophobicContact SD-CZ3 4.39Å; M36-L69 HydrophobicContact CE-CD1 4.12Å; M36-L69 HydrophobicContact CE-CD2 3.32Å; M36-L69 HydrophobicContact CE-CG 3.47Å; M36-L69 VanDerWaalsContact CE-CG 3.47Å; M36-I94 HydrophobicContact SD-CD1 3.94Å; M36-F113 HydrophobicContact CB-CE1 3.95Å; M36-F113 HydrophobicContact CB-CZ 3.91Å; M36-F113 HydrophobicContact SD-CE1 4.15Å
37	Q	94.6	Very high	92.8	Very high	75 Å²	75	69.7 Å²	69.7	35%	0.35	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	1.3	-179.7	-71.4	175.9	88.3	0	0	113.5	I33 T34 K35 D39 F113	I33-Q37 WeakPolarHBondContact O-CG 3.32Å; I33-Q37 PolarHBondContact O-N 3.29Å; I33-Q37 PolarHBondContact O-NE2 3.18Å; T34-Q37 PolarHBondContact O-N 3.28Å; K35-Q37 PolarHBondContact O-N 3.43Å; Q37-D39 PolarHBondContact O-N 2.92Å; Q37-F113 HydrophobicContact CG-CD1 4.02Å; Q37-F113 HydrophobicContact CG-CD2 3.63Å; Q37-F113 HydrophobicContact CG-CE1 4.08Å; Q37-F113 HydrophobicContact CG-CE2 3.69Å; Q37-F113 HydrophobicContact CG-CG 3.81Å; Q37-F113 HydrophobicContact CG-CZ 3.93Å
38	D	92	Very high	92.7	Very high	56 Å²	56	70.5 Å²	70.5	30%	0.299	37%	0.367	S	S	.	.			trans	-86.2	100.2	-178.8	-177.8	10.6	0	0	0	111.7	T34 K35 K40 T41 G43	T34-D38 PolarHBondContact O-N 2.95Å; K35-D38 PolarHBondContact O-N 3.44Å; D38-K40 PolarHBondContact O-N 3.09Å; D38-K40 VanDerWaalsContact O-N 3.13Å; D38-K40 WeakPolarHBondContact OD1-CB 3.44Å; D38-K40 PolarHBondContact OD1-N 3.15Å; D38-T41 WeakPolarHBondContact CB-OG1 3.43Å; D38-T41 PolarHBondContact O-N 3.07Å; D38-T41 WeakPolarHBondContact OD2-CB 3.4Å; D38-T41 WeakPolarHBondContact OD2-CG2 3.45Å; D38-T41 PolarHBondContact OD2-OG1 3.43Å; D38-G43 WeakPolarHBondContact O-CA 3.26Å; D38-G43 PolarHBondContact O-N 2.85Å
39	D	81.1	Confident	92.4	Very high	131 Å²	131	66.4 Å²	66.4	70%	0.701	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.3	177.7	-68.4	-23.7	0	0	0	113.3	Q37	Q37-D39 PolarHBondContact O-N 2.92Å
40	K	81.6	Confident	92	Very high	198 Å²	198	73.1 Å²	73.1	86%	0.861	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-31.2	-177	-63.2	179.7	-179.4	175.8	0	113.1	D38	D38-K40 PolarHBondContact O-N 3.09Å; D38-K40 VanDerWaalsContact O-N 3.13Å; D38-K40 WeakPolarHBondContact OD1-CB 3.44Å; D38-K40 PolarHBondContact OD1-N 3.15Å
41	T	77.9	Confident	91.4	Very high	96 Å²	96	74.9 Å²	74.9	59%	0.589	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	10.3	-176.3	54.5	0	0	0	0	113	D38	D38-T41 WeakPolarHBondContact CB-OG1 3.43Å; D38-T41 PolarHBondContact O-N 3.07Å; D38-T41 WeakPolarHBondContact OD2-CB 3.4Å; D38-T41 WeakPolarHBondContact OD2-CG2 3.45Å; D38-T41 PolarHBondContact OD2-OG1 3.43Å
42	G	86.3	Confident	90.6	Very high	48 Å²	48	80 Å²	80	50%	0.495	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	43.5	-179.3	0	0	0	0	0	112.6	W68	G42-W68 PolarHBondContact O-NE1 3.39Å; G42-W68 VanDerWaalsContact O-NE1 3.1Å
43	G	93.2	Very high	89.6	Confident	16 Å²	16	86.2 Å²	86.2	17%	0.165	45%	0.448	C	S	.	.			trans	-55.1	176.8	167.9	0	0	0	0	0	114	M36 D38	M36-G43 CarbonylContact O-C 3.41Å; M36-G43 VanDerWaalsContact O-CA 3.31Å; M36-G43 WeakPolarHBondContact O-CA 3.3Å; D38-G43 WeakPolarHBondContact O-CA 3.26Å; D38-G43 PolarHBondContact O-N 2.85Å
44	V	96	Very high	88.7	Confident	0 Å²	0	88.6 Å²	88.6	0%	0	47%	0.465	C	S	.	.			trans	-70.2	129.6	179	-175.1	0	0	0	0	109.1	M36 I46 V60 D64 I65 W68 F113	M36-V44 HydrophobicContact CB-CG2 4.1Å; M36-V44 HydrophobicContact CG-CG2 4.08Å; M36-V44 PolarHBondContact O-N 3.33Å; V44-I46 PolarHBondContact O-N 3.4Å; V44-V60 HydrophobicContact CB-CG1 4.34Å; V44-V60 HydrophobicContact CG1-CB 3.77Å; V44-V60 HydrophobicContact CG1-CG1 3.67Å; V44-V60 HydrophobicContact CG1-CG2 4.49Å; V44-D64 HydrophobicContact CG1-CB 3.8Å; V44-I65 HydrophobicContact CG1-CG1 4.07Å; V44-W68 HydrophobicContact CG2-CB 3.7Å; V44-W68 HydrophobicContact CG2-CD2 4.15Å; V44-W68 HydrophobicContact CG2-CG 3.6Å; V44-F113 HydrophobicContact CB-CZ 4.47Å
45	P	92.8	Very high	88.3	Confident	52 Å²	52	90.8 Å²	90.8	34%	0.338	47%	0.467	S	S	.	.			trans	-67.7	107.4	-174.7	26.9	-35.5	0	0	0	112.2	D64	P45-D64 HydrophobicContact CG-CB 4.28Å
46	I	94.3	Very high	87.9	Confident	75 Å²	75	86.9 Å²	86.9	39%	0.385	45%	0.451	S	S	.	.			trans	-79.9	122.3	175.8	-56.2	175.6	0	0	0	109.9	V44 V60 F113	V44-I46 PolarHBondContact O-N 3.4Å; I46-V60 HydrophobicContact CB-CG1 4.35Å; I46-V60 HydrophobicContact CG1-CG1 3.78Å; I46-F113 HydrophobicContact CD1-CD2 4.13Å; I46-F113 HydrophobicContact CD1-CE2 4.05Å; I46-F113 HydrophobicContact CG1-CE2 4.15Å
47	R	91.9	Very high	87.6	Confident	142 Å²	142	87.6 Å²	87.6	54%	0.536	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	157.8	-173.6	-60.7	-179.3	-170.7	171.4	7.6	112.8	S58 V59	R47-S58 PolarHBondContact O-N 3.11Å; R47-S58 VanDerWaalsContact O-N 3.13Å; R47-V59 PolarHBondContact N-O 2.87Å; R47-V59 WeakPolarHBondContact O-CG2 3.34Å; R47-V59 PolarHBondContact O-N 3.35Å
48	T	92.5	Very high	87.4	Confident	72 Å²	72	86.8 Å²	86.8	44%	0.442	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	112.7	164.6	-66.3	0	0	0	0	109	K55 I56 P57	T48-K55 HydrophobicContact CG2-CD 4.3Å; T48-K55 HydrophobicContact CG2-CG 3.81Å; T48-I56 CarbonylContact C-O 3.58Å; T48-I56 WeakPolarHBondContact CA-O 3.4Å; T48-P57 HydrophobicContact CG2-CB 4.47Å
49	V	90	Very high	87.6	Confident	48 Å²	48	84.2 Å²	84.2	29%	0.291	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.9	-179.1	-178.1	0	0	0	0	109.5	K55 I56 V59 F110	V49-K55 WeakPolarHBondContact O-CA 3.23Å; V49-I56 PolarHBondContact N-O 3.24Å; V49-I56 PolarHBondContact O-N 3.08Å; V49-V59 HydrophobicContact CG2-CG2 3.74Å; V49-F110 HydrophobicContact CB-CZ 4.32Å; V49-F110 HydrophobicContact CG1-CE2 4.43Å; V49-F110 HydrophobicContact CG1-CZ 4.03Å; V49-F110 HydrophobicContact CG2-CD1 4.5Å; V49-F110 HydrophobicContact CG2-CE1 3.74Å; V49-F110 HydrophobicContact CG2-CZ 3.78Å
50	K	88.8	Confident	88.3	Confident	160 Å²	160	78.1 Å²	78.1	70%	0.696	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.7	176	-67.5	178.7	-176	174.8	0	109.1	K55	K50-K55 HydrophobicContact CG-CD 4.4Å; K50-K55 HydrophobicContact CG-CG 4.04Å
51	S	84.4	Confident	89.1	Confident	66 Å²	66	70 Å²	70	46%	0.462	38%	0.38	S	S	.	.			trans	-122.2	172.7	168.8	73	0	0	0	0	109.5	L53 S54	S51-L53 PolarHBondContact O-N 3.28Å; S51-S54 PolarHBondContact N-O 3.19Å; S51-S54 PolarHBondContact OG-N 3.26Å; S51-S54 PolarHBondContact OG-O 3.13Å; S51-S54 VanDerWaalsContact OG-O 3.08Å; S51-S54 PolarHBondContact OG-OG 3.21Å
52	F	80.3	Confident	90	Very high	207 Å²	207	65.4 Å²	65.4	91%	0.908	35%	0.351	S	S	*	.	S	Bend	trans	-57.4	-34.4	177.6	-176.6	-107.1	0	0	0	112.9
53	L	76.4	Confident	90.6	Very high	160 Å²	160	65.5 Å²	65.5	84%	0.838	34%	0.343	S	S	*	.	S	Bend	trans	-104.8	-15.7	-175.3	-64.5	174.6	0	0	0	114	S51	S51-L53 PolarHBondContact O-N 3.28Å
54	S	79.9	Confident	90.8	Very high	49 Å²	49	66.7 Å²	66.7	34%	0.343	35%	0.345	S	S	.	.			trans	-151.6	145.8	-172	72.8	0	0	0	0	114	S51	S51-S54 PolarHBondContact N-O 3.19Å; S51-S54 PolarHBondContact OG-N 3.26Å; S51-S54 PolarHBondContact OG-O 3.13Å; S51-S54 VanDerWaalsContact OG-O 3.08Å; S51-S54 PolarHBondContact OG-OG 3.21Å
55	K	86.4	Confident	90.9	Very high	131 Å²	131	66.7 Å²	66.7	57%	0.57	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	118.7	166.2	-179.9	178.9	178.4	-169.4	0	107.9	T48 V49 K50	T48-K55 HydrophobicContact CG2-CD 4.3Å; T48-K55 HydrophobicContact CG2-CG 3.81Å; V49-K55 WeakPolarHBondContact O-CA 3.23Å; K50-K55 HydrophobicContact CG-CD 4.4Å; K50-K55 HydrophobicContact CG-CG 4.04Å
56	I	87.4	Confident	91.2	Very high	42 Å²	42	64.2 Å²	64.2	22%	0.215	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	102.7	-177.9	-52.6	179.1	0	0	0	107.8	T48 V49 V59 I97	T48-I56 CarbonylContact C-O 3.58Å; T48-I56 WeakPolarHBondContact CA-O 3.4Å; V49-I56 PolarHBondContact N-O 3.24Å; V49-I56 PolarHBondContact O-N 3.08Å; I56-V59 HydrophobicContact CG2-CG1 3.6Å; I56-I97 HydrophobicContact CD1-CD1 4.13Å; I56-I97 HydrophobicContact CG2-CD1 3.76Å
57	P	91.4	Very high	91.3	Very high	15 Å²	15	65.7 Å²	65.7	10%	0.097	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	161.9	-179.1	36	-40.9	0	0	0	111.7	T48 V59 R112 T187 I191	T48-P57 HydrophobicContact CG2-CB 4.47Å; P57-V59 PolarHBondContact O-N 3.47Å; P57-R112 PolarHBondContact O-NH1 3.28Å; P57-R112 PolarHBondContact O-NH2 2.94Å; P57-T187 HydrophobicContact CB-CG2 4.18Å; P57-T187 HydrophobicContact CG-CG2 3.6Å; P57-I191 HydrophobicContact CG-CD1 3.9Å; P57-I191 HydrophobicContact CG-CG1 4.2Å
58	S	90.9	Very high	91.6	Very high	59 Å²	59	59.9 Å²	59.9	41%	0.413	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.4	57.2	165	-45.8	0	0	0	0	114.7	R47 R112	R47-S58 PolarHBondContact O-N 3.11Å; R47-S58 VanDerWaalsContact O-N 3.13Å; S58-R112 PolarHBondContact O-NH1 3.12Å
59	V	95	Very high	91.9	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.012	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153.1	176	-68.6	0	0	0	0	111.3	R47 V49 I56 P57 I97 F110 Y111 R112	R47-V59 PolarHBondContact N-O 2.87Å; R47-V59 WeakPolarHBondContact O-CG2 3.34Å; R47-V59 PolarHBondContact O-N 3.35Å; V49-V59 HydrophobicContact CG2-CG2 3.74Å; I56-V59 HydrophobicContact CG2-CG1 3.6Å; P57-V59 PolarHBondContact O-N 3.47Å; V59-I97 HydrophobicContact CG1-CD1 4.17Å; V59-I97 HydrophobicContact CG1-CG2 4.19Å; V59-F110 HydrophobicContact CB-CB 4.16Å; V59-F110 HydrophobicContact CB-CD1 4.19Å; V59-F110 HydrophobicContact CB-CG 4.38Å; V59-F110 HydrophobicContact CG1-CB 4.23Å; V59-F110 HydrophobicContact CG2-CD1 3.88Å; V59-F110 HydrophobicContact CG2-CE1 4.37Å; V59-F110 HydrophobicContact CG2-CG 4.28Å; V59-Y111 WeakPolarHBondContact CA-O 3.38Å; V59-R112 HydrophobicContact CG1-CG 4.22Å
60	V	97	Very high	92.3	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	154.7	170.8	-64.8	0	0	0	0	108.7	V44 I46 I65 F110 Y111 F113	V44-V60 HydrophobicContact CB-CG1 4.34Å; V44-V60 HydrophobicContact CG1-CB 3.77Å; V44-V60 HydrophobicContact CG1-CG1 3.67Å; V44-V60 HydrophobicContact CG1-CG2 4.49Å; I46-V60 HydrophobicContact CB-CG1 4.35Å; I46-V60 HydrophobicContact CG1-CG1 3.78Å; V60-I65 HydrophobicContact CB-CG1 4.44Å; V60-I65 HydrophobicContact CG2-CD1 3.56Å; V60-I65 HydrophobicContact CG2-CG1 3.9Å; V60-F110 WeakPolarHBondContact O-CA 3.47Å; V60-Y111 PolarHBondContact N-O 3.42Å; V60-Y111 PolarHBondContact O-N 3.1Å; V60-F113 HydrophobicContact CG1-CE2 3.95Å; V60-F113 HydrophobicContact CG2-CE2 4.41Å
61	T	97.5	Very high	92.7	Very high	26 Å²	26	56.3 Å²	56.3	16%	0.16	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	153.4	175.5	70.1	0	0	0	0	110.9	T63 D64 I65 T109 F110	T61-T63 VanDerWaalsContact C-N 3.32Å; T61-T63 PolarHBondContact O-N 3.19Å; T61-D64 PolarHBondContact O-N 3.21Å; T61-D64 WeakPolarHBondContact OG1-CB 3.38Å; T61-D64 PolarHBondContact OG1-N 3.46Å; T61-D64 VanDerWaalsContact OG1-N 3.09Å; T61-D64 PolarHBondContact OG1-OD2 3.26Å; T61-I65 WeakPolarHBondContact O-CG1 3.44Å; T61-I65 PolarHBondContact O-N 3.02Å; T61-I65 VanDerWaalsContact O-N 3.17Å; T61-T109 CarbonylContact C-O 3.45Å; T61-T109 WeakPolarHBondContact CA-O 3.24Å; T61-F110 HydrophobicContact CG2-CD1 4.18Å; T61-F110 HydrophobicContact CG2-CE1 3.95Å
62	G	97.9	Very high	93.3	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.7	-45.6	174.3	0	0	0	0	0	112	D64 I65 V66 K105 D107 T109	G62-D64 PolarHBondContact O-N 2.83Å; G62-I65 PolarHBondContact O-N 2.88Å; G62-I65 VanDerWaalsContact O-N 3.16Å; G62-V66 WeakPolarHBondContact O-CG2 3.44Å; G62-V66 PolarHBondContact O-N 3.19Å; G62-K105 CarbonylContact C-O 3.6Å; G62-K105 VanDerWaalsContact CA-O 3.24Å; G62-K105 WeakPolarHBondContact CA-O 3.37Å; G62-D107 PolarHBondContact N-O 2.71Å; G62-T109 PolarHBondContact N-O 2.8Å
63	T	98	Very high	94.1	Very high	51 Å²	51	50 Å²	50	31%	0.313	26%	0.258	S	S	.	.	H	α-helix	trans	-58	-43.6	174.6	-60.2	0	0	0	0	113.1	T61 I65 V66 Q67 D106 D107	T61-T63 VanDerWaalsContact C-N 3.32Å; T61-T63 PolarHBondContact O-N 3.19Å; T63-I65 VanDerWaalsContact C-N 3.3Å; T63-I65 PolarHBondContact O-N 3.36Å; T63-V66 PolarHBondContact O-N 2.89Å; T63-Q67 HydrophobicContact CG2-CG 4.15Å; T63-Q67 WeakPolarHBondContact O-CB 3.42Å; T63-Q67 VanDerWaalsContact O-CG 3.25Å; T63-Q67 WeakPolarHBondContact O-CG 3.49Å; T63-Q67 PolarHBondContact O-N 3.04Å; T63-D106 VanDerWaalsContact CA-OD1 3.24Å; T63-D106 WeakPolarHBondContact CA-OD1 3.45Å; T63-D106 WeakPolarHBondContact CB-OD1 3.49Å; T63-D106 PolarHBondContact OG1-OD1 3.49Å; T63-D107 PolarHBondContact N-O 2.85Å; T63-D107 VanDerWaalsContact N-O 3.09Å; T63-D107 WeakPolarHBondContact OG1-CA 3.2Å; T63-D107 PolarHBondContact OG1-N 3Å; T63-D107 PolarHBondContact OG1-O 2.91Å
64	D	97.8	Very high	95.1	Very high	41 Å²	41	47.3 Å²	47.3	22%	0.219	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-38.7	177.8	-67.8	-43.6	0	0	0	111.7	V44 P45 T61 G62 W68	V44-D64 HydrophobicContact CG1-CB 3.8Å; P45-D64 HydrophobicContact CG-CB 4.28Å; T61-D64 PolarHBondContact O-N 3.21Å; T61-D64 WeakPolarHBondContact OG1-CB 3.38Å; T61-D64 PolarHBondContact OG1-N 3.46Å; T61-D64 VanDerWaalsContact OG1-N 3.09Å; T61-D64 PolarHBondContact OG1-OD2 3.26Å; G62-D64 PolarHBondContact O-N 2.83Å; D64-W68 VanDerWaalsContact O-CB 3.28Å; D64-W68 WeakPolarHBondContact O-CB 3.39Å; D64-W68 PolarHBondContact O-N 3.49Å
65	I	98.3	Very high	95.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67.1	-47.5	177	-63.7	162.8	0	0	0	110.9	M36 V44 V60 T61 G62 T63 W68 L69 I94 M104 Y111	M36-I65 HydrophobicContact CE-CG2 3.76Å; M36-I65 HydrophobicContact SD-CG2 4.48Å; V44-I65 HydrophobicContact CG1-CG1 4.07Å; V60-I65 HydrophobicContact CB-CG1 4.44Å; V60-I65 HydrophobicContact CG2-CD1 3.56Å; V60-I65 HydrophobicContact CG2-CG1 3.9Å; T61-I65 WeakPolarHBondContact O-CG1 3.44Å; T61-I65 PolarHBondContact O-N 3.02Å; T61-I65 VanDerWaalsContact O-N 3.17Å; G62-I65 PolarHBondContact O-N 2.88Å; G62-I65 VanDerWaalsContact O-N 3.16Å; T63-I65 VanDerWaalsContact C-N 3.3Å; T63-I65 PolarHBondContact O-N 3.36Å; I65-W68 PolarHBondContact O-N 2.85Å; I65-L69 HydrophobicContact CG2-CD1 4.08Å; I65-L69 HydrophobicContact CG2-CG 4.44Å; I65-L69 WeakPolarHBondContact O-CG 3.48Å; I65-L69 PolarHBondContact O-N 2.92Å; I65-I94 HydrophobicContact CD1-CD1 4.41Å; I65-I94 HydrophobicContact CD1-CG2 4.05Å; I65-I94 HydrophobicContact CG2-CD1 4.5Å; I65-M104 HydrophobicContact CB-CE 4.35Å; I65-M104 HydrophobicContact CB-SD 4.19Å; I65-M104 HydrophobicContact CD1-CE 4.09Å; I65-M104 HydrophobicContact CD1-SD 3.86Å; I65-M104 HydrophobicContact CG2-CE 3.62Å; I65-M104 HydrophobicContact CG2-SD 4.09Å; I65-Y111 HydrophobicContact CD1-CD2 4.22Å; I65-Y111 HydrophobicContact CD1-CG 4.1Å
66	V	98.4	Very high	96.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-46.6	-178.5	172	0	0	0	0	110.6	G62 T63 W68 L69 M70 A81 I82 M104 D106	G62-V66 WeakPolarHBondContact O-CG2 3.44Å; G62-V66 PolarHBondContact O-N 3.19Å; T63-V66 PolarHBondContact O-N 2.89Å; V66-W68 VanDerWaalsContact C-N 3.3Å; V66-W68 PolarHBondContact O-N 3.08Å; V66-L69 PolarHBondContact O-N 3.29Å; V66-M70 HydrophobicContact CG1-SD 4.34Å; V66-M70 WeakPolarHBondContact O-CG 3.43Å; V66-M70 PolarHBondContact O-N 3.23Å; V66-A81 HydrophobicContact CG1-CB 4.18Å; V66-I82 HydrophobicContact CG1-CG1 4.03Å; V66-I82 HydrophobicContact CG2-CG1 3.88Å; V66-M104 HydrophobicContact CG2-CG 4.1Å; V66-D106 HydrophobicContact CG1-CB 4.49Å; V66-D106 HydrophobicContact CG2-CB 4.16Å
67	Q	97.9	Very high	96.9	Very high	105 Å²	105	50.2 Å²	50.2	49%	0.491	27%	0.265	S	S	.	.	H	α-helix	trans	-63	-37.7	176.8	-68.1	-58.9	-42.9	0	0	112.2	T63 K71	T63-Q67 HydrophobicContact CG2-CG 4.15Å; T63-Q67 WeakPolarHBondContact O-CB 3.42Å; T63-Q67 VanDerWaalsContact O-CG 3.25Å; T63-Q67 WeakPolarHBondContact O-CG 3.49Å; T63-Q67 PolarHBondContact O-N 3.04Å; Q67-K71 WeakPolarHBondContact O-CB 3.33Å; Q67-K71 PolarHBondContact O-N 3.15Å
68	W	97.9	Very high	97.2	Very high	21 Å²	21	52.2 Å²	52.2	8%	0.08	28%	0.278	C	S	.	.	H	α-helix	trans	-64.4	-43	174.8	-172.2	99.1	0	0	0	111.7	I32 K35 M36 G42 V44 D64 I65 V66 K71 N72	I32-W68 HydrophobicContact CG2-CH2 4.46Å; I32-W68 HydrophobicContact CG2-CZ3 3.99Å; K35-W68 HydrophobicContact CB-CH2 3.74Å; K35-W68 HydrophobicContact CB-CZ2 3.78Å; M36-W68 HydrophobicContact CE-CD2 4.35Å; M36-W68 HydrophobicContact CE-CE3 3.41Å; M36-W68 VanDerWaalsContact CE-CE3 3.41Å; M36-W68 HydrophobicContact CE-CZ3 3.68Å; M36-W68 HydrophobicContact CG-CD2 3.83Å; M36-W68 HydrophobicContact CG-CE3 3.48Å; M36-W68 VanDerWaalsContact CG-CE3 3.48Å; M36-W68 HydrophobicContact CG-CH2 3.66Å; M36-W68 HydrophobicContact CG-CZ2 3.99Å; M36-W68 HydrophobicContact CG-CZ3 3.4Å; M36-W68 HydrophobicContact SD-CE3 4.34Å; M36-W68 HydrophobicContact SD-CZ3 4.39Å; G42-W68 PolarHBondContact O-NE1 3.39Å; G42-W68 VanDerWaalsContact O-NE1 3.1Å; V44-W68 HydrophobicContact CG2-CB 3.7Å; V44-W68 HydrophobicContact CG2-CD2 4.15Å; V44-W68 HydrophobicContact CG2-CG 3.6Å; D64-W68 VanDerWaalsContact O-CB 3.28Å; D64-W68 WeakPolarHBondContact O-CB 3.39Å; D64-W68 PolarHBondContact O-N 3.49Å; I65-W68 PolarHBondContact O-N 2.85Å; V66-W68 VanDerWaalsContact C-N 3.3Å; V66-W68 PolarHBondContact O-N 3.08Å; W68-K71 PolarHBondContact O-N 3.41Å; W68-N72 VanDerWaalsContact CD1-ND2 3.35Å; W68-N72 HydrophobicContact CD2-CB 4.24Å; W68-N72 VanDerWaalsContact CE2-ND2 3.27Å; W68-N72 HydrophobicContact CE3-CB 4.21Å; W68-N72 HydrophobicContact CH2-CB 4.02Å; W68-N72 HydrophobicContact CZ2-CB 4.04Å; W68-N72 HydrophobicContact CZ3-CB 4.09Å; W68-N72 PolarHBondContact NE1-ND2 3.43Å; W68-N72 WeakPolarHBondContact O-CB 3.47Å; W68-N72 PolarHBondContact O-N 3.38Å; W68-N72 PolarHBondContact O-ND2 3.5Å
69	L	98.3	Very high	97.6	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-49.9	177	-75.3	169.4	0	0	0	111.2	I32 M36 I65 V66 K71 N72 L73 A81 L84 I88	I32-L69 HydrophobicContact CG2-CD2 4.23Å; M36-L69 HydrophobicContact CE-CD1 4.12Å; M36-L69 HydrophobicContact CE-CD2 3.32Å; M36-L69 HydrophobicContact CE-CG 3.47Å; M36-L69 VanDerWaalsContact CE-CG 3.47Å; I65-L69 HydrophobicContact CG2-CD1 4.08Å; I65-L69 HydrophobicContact CG2-CG 4.44Å; I65-L69 WeakPolarHBondContact O-CG 3.48Å; I65-L69 PolarHBondContact O-N 2.92Å; V66-L69 PolarHBondContact O-N 3.29Å; L69-K71 VanDerWaalsContact C-N 3.33Å; L69-K71 PolarHBondContact O-N 2.77Å; L69-N72 PolarHBondContact O-N 3.2Å; L69-L73 HydrophobicContact CD2-CD1 3.64Å; L69-L73 HydrophobicContact CD2-CG 4.49Å; L69-L73 VanDerWaalsContact O-CB 3.29Å; L69-L73 WeakPolarHBondContact O-CB 3.36Å; L69-L73 PolarHBondContact O-N 3.17Å; L69-A81 HydrophobicContact CB-CB 4.27Å; L69-L84 HydrophobicContact CD2-CD2 4.25Å; L69-I88 HydrophobicContact CD2-CD1 4.48Å
70	M	98.1	Very high	97.7	Very high	35 Å²	35	59.4 Å²	59.4	17%	0.172	31%	0.311	C	S	.	.	H	α-helix	trans	-55.5	-48.9	178.2	-70.1	-177.4	75.3	0	0	112	V66 S74 I75 E76 P78 A81	V66-M70 HydrophobicContact CG1-SD 4.34Å; V66-M70 WeakPolarHBondContact O-CG 3.43Å; V66-M70 PolarHBondContact O-N 3.23Å; M70-S74 CarbonylContact O-C 3.55Å; M70-S74 WeakPolarHBondContact O-CA 3.24Å; M70-S74 PolarHBondContact O-N 2.96Å; M70-S74 VanDerWaalsContact O-N 3.12Å; M70-I75 PolarHBondContact O-N 3.08Å; M70-E76 WeakPolarHBondContact CE-O 3.49Å; M70-P78 HydrophobicContact CE-CB 4.33Å; M70-P78 HydrophobicContact CE-CG 3.75Å; M70-P78 HydrophobicContact SD-CB 4.09Å; M70-P78 HydrophobicContact SD-CG 4.09Å; M70-A81 HydrophobicContact CG-CB 3.51Å
71	K	97.1	Very high	97.8	Very high	170 Å²	170	59.3 Å²	59.3	74%	0.739	31%	0.311	S	S	*	.	H	α-helix	trans	-68.3	-47.1	-178	-176.8	-177.4	175.8	-173.4	0	113.2	Q67 W68 L69	Q67-K71 WeakPolarHBondContact O-CB 3.33Å; Q67-K71 PolarHBondContact O-N 3.15Å; W68-K71 PolarHBondContact O-N 3.41Å; L69-K71 VanDerWaalsContact C-N 3.33Å; L69-K71 PolarHBondContact O-N 2.77Å
72	N	96.8	Very high	97.8	Very high	72 Å²	72	60.3 Å²	60.3	39%	0.385	31%	0.314	S	S	.	.	H	α-helix	trans	-88.1	-18.9	-169.3	-69.7	-84.9	0	0	0	113.6	W68 L69	W68-N72 VanDerWaalsContact CD1-ND2 3.35Å; W68-N72 HydrophobicContact CD2-CB 4.24Å; W68-N72 VanDerWaalsContact CE2-ND2 3.27Å; W68-N72 HydrophobicContact CE3-CB 4.21Å; W68-N72 HydrophobicContact CH2-CB 4.02Å; W68-N72 HydrophobicContact CZ2-CB 4.04Å; W68-N72 HydrophobicContact CZ3-CB 4.09Å; W68-N72 PolarHBondContact NE1-ND2 3.43Å; W68-N72 WeakPolarHBondContact O-CB 3.47Å; W68-N72 PolarHBondContact O-N 3.38Å; W68-N72 PolarHBondContact O-ND2 3.5Å; L69-N72 PolarHBondContact O-N 3.2Å
73	L	96.8	Very high	97.9	Very high	67 Å²	67	65.8 Å²	65.8	35%	0.351	34%	0.34	S	S	.	.	H	α-helix	trans	-108	4.6	175.3	-54.8	-178.2	0	0	0	112.8	I32 L69 I75 L84	I32-L73 HydrophobicContact CD1-CD1 4.25Å; L69-L73 HydrophobicContact CD2-CD1 3.64Å; L69-L73 HydrophobicContact CD2-CG 4.49Å; L69-L73 VanDerWaalsContact O-CB 3.29Å; L69-L73 WeakPolarHBondContact O-CB 3.36Å; L69-L73 PolarHBondContact O-N 3.17Å; L73-I75 VanDerWaalsContact C-N 3.29Å; L73-I75 HydrophobicContact CB-CD1 3.99Å; L73-I75 HydrophobicContact CB-CG1 3.97Å; L73-I75 HydrophobicContact CD1-CD1 4.24Å; L73-I75 PolarHBondContact O-N 3.09Å; L73-L84 HydrophobicContact CD1-CD2 3.57Å
74	S	97.4	Very high	97.9	Very high	104 Å²	104	65.8 Å²	65.8	73%	0.727	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	42.6	-178.2	-55.4	0	0	0	0	113.1	M70	M70-S74 CarbonylContact O-C 3.55Å; M70-S74 WeakPolarHBondContact O-CA 3.24Å; M70-S74 PolarHBondContact O-N 2.96Å; M70-S74 VanDerWaalsContact O-N 3.12Å
75	I	98.2	Very high	97.9	Very high	18 Å²	18	63.8 Å²	63.8	9%	0.092	33%	0.327	C	S	.	.			trans	-86.7	119	177.3	-58	167.8	0	0	0	108.4	M70 L73 D77 E80 A81 L84	M70-I75 PolarHBondContact O-N 3.08Å; L73-I75 VanDerWaalsContact C-N 3.29Å; L73-I75 HydrophobicContact CB-CD1 3.99Å; L73-I75 HydrophobicContact CB-CG1 3.97Å; L73-I75 HydrophobicContact CD1-CD1 4.24Å; L73-I75 PolarHBondContact O-N 3.09Å; I75-D77 VanDerWaalsContact CG2-O 3.28Å; I75-D77 WeakPolarHBondContact CG2-O 3.49Å; I75-E80 HydrophobicContact CG2-CB 3.72Å; I75-E80 HydrophobicContact CG2-CG 3.86Å; I75-A81 HydrophobicContact CB-CB 4.47Å; I75-A81 HydrophobicContact CD1-CB 4.19Å; I75-A81 HydrophobicContact CG2-CB 4.09Å; I75-L84 HydrophobicContact CD1-CD2 3.97Å
76	E	97.4	Very high	97.9	Very high	184 Å²	184	65 Å²	65	86%	0.86	34%	0.335	S	S	*	.			trans	-80.6	-39.9	-178	-63.8	-174.9	176.2	0	0	112.4	M70 P78	M70-E76 WeakPolarHBondContact CE-O 3.49Å; E76-P78 WeakPolarHBondContact O-CD 3.46Å
77	D	97.6	Very high	97.9	Very high	82 Å²	82	69.1 Å²	69.1	44%	0.439	36%	0.357	S	S	.	.			trans	-88.5	117.8	-179.9	-175.9	-0.3	0	0	0	111.3	I75 V79 E80 A81	I75-D77 VanDerWaalsContact CG2-O 3.28Å; I75-D77 WeakPolarHBondContact CG2-O 3.49Å; D77-V79 PolarHBondContact O-N 3.15Å; D77-V79 VanDerWaalsContact O-N 3.15Å; D77-V79 WeakPolarHBondContact OD1-CB 3.47Å; D77-V79 WeakPolarHBondContact OD1-CG2 3.45Å; D77-V79 PolarHBondContact OD1-N 3.22Å; D77-E80 HydrophobicContact CB-CB 4.33Å; D77-E80 PolarHBondContact O-N 3.38Å; D77-E80 VanDerWaalsContact O-N 3.11Å; D77-A81 PolarHBondContact O-N 3.41Å
78	P	97.3	Very high	98	Very high	56 Å²	56	64.1 Å²	64.1	36%	0.364	33%	0.334	S	S	.	.	H	α-helix	trans	-54.4	-32.1	174.3	-23.6	32.1	0	0	0	113.7	M70 E76 E80 A81 I82	M70-P78 HydrophobicContact CE-CB 4.33Å; M70-P78 HydrophobicContact CE-CG 3.75Å; M70-P78 HydrophobicContact SD-CB 4.09Å; M70-P78 HydrophobicContact SD-CG 4.09Å; E76-P78 WeakPolarHBondContact O-CD 3.46Å; P78-E80 VanDerWaalsContact C-N 3.33Å; P78-E80 PolarHBondContact O-N 2.84Å; P78-A81 PolarHBondContact O-N 3.32Å; P78-I82 WeakPolarHBondContact O-CD1 3.48Å; P78-I82 VanDerWaalsContact O-CG1 3.25Å; P78-I82 WeakPolarHBondContact O-CG1 3.25Å; P78-I82 PolarHBondContact O-N 3.42Å
79	V	98.1	Very high	98	Very high	98 Å²	98	63.1 Å²	63.1	59%	0.594	33%	0.33	S	S	*	.	H	α-helix	trans	-64.6	-39.1	-179.9	-178.8	0	0	0	0	110.9	D77 I82 H83	D77-V79 PolarHBondContact O-N 3.15Å; D77-V79 VanDerWaalsContact O-N 3.15Å; D77-V79 WeakPolarHBondContact OD1-CB 3.47Å; D77-V79 WeakPolarHBondContact OD1-CG2 3.45Å; D77-V79 PolarHBondContact OD1-N 3.22Å; V79-I82 PolarHBondContact O-N 3.42Å; V79-H83 VanDerWaalsContact O-CB 3.32Å; V79-H83 WeakPolarHBondContact O-CB 3.27Å; V79-H83 PolarHBondContact O-N 3.13Å
80	E	98.5	Very high	97.9	Very high	115 Å²	115	64.3 Å²	64.3	54%	0.537	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-42.5	174.8	-179.9	177.9	-169.5	0	0	111.2	I75 D77 P78 H83 L84	I75-E80 HydrophobicContact CG2-CB 3.72Å; I75-E80 HydrophobicContact CG2-CG 3.86Å; D77-E80 HydrophobicContact CB-CB 4.33Å; D77-E80 PolarHBondContact O-N 3.38Å; D77-E80 VanDerWaalsContact O-N 3.11Å; P78-E80 VanDerWaalsContact C-N 3.33Å; P78-E80 PolarHBondContact O-N 2.84Å; E80-H83 PolarHBondContact O-N 3.33Å; E80-L84 WeakPolarHBondContact O-CB 3.44Å; E80-L84 PolarHBondContact O-N 3.33Å
81	A	98.4	Very high	97.8	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.1	-41.8	178.2	0	0	0	0	0	112.3	V66 L69 M70 I75 D77 P78 H83 L84 G85	V66-A81 HydrophobicContact CG1-CB 4.18Å; L69-A81 HydrophobicContact CB-CB 4.27Å; M70-A81 HydrophobicContact CG-CB 3.51Å; I75-A81 HydrophobicContact CB-CB 4.47Å; I75-A81 HydrophobicContact CD1-CB 4.19Å; I75-A81 HydrophobicContact CG2-CB 4.09Å; D77-A81 PolarHBondContact O-N 3.41Å; P78-A81 PolarHBondContact O-N 3.32Å; A81-H83 VanDerWaalsContact C-N 3.34Å; A81-L84 PolarHBondContact O-N 2.97Å; A81-G85 PolarHBondContact O-N 3.49Å
82	I	98.5	Very high	97.9	Very high	47 Å²	47	56.5 Å²	56.5	24%	0.241	31%	0.306	C	S	.	.	H	α-helix	trans	-63.7	-41.4	174.2	-66.6	162.8	0	0	0	110.6	V66 P78 V79 G85 S86 D106	V66-I82 HydrophobicContact CG1-CG1 4.03Å; V66-I82 HydrophobicContact CG2-CG1 3.88Å; P78-I82 WeakPolarHBondContact O-CD1 3.48Å; P78-I82 VanDerWaalsContact O-CG1 3.25Å; P78-I82 WeakPolarHBondContact O-CG1 3.25Å; P78-I82 PolarHBondContact O-N 3.42Å; V79-I82 PolarHBondContact O-N 3.42Å; I82-G85 PolarHBondContact O-N 2.86Å; I82-S86 WeakPolarHBondContact O-CB 3.5Å; I82-S86 PolarHBondContact O-N 2.71Å; I82-S86 PolarHBondContact O-OG 3.08Å; I82-D106 HydrophobicContact CD1-CB 3.7Å; I82-D106 HydrophobicContact CG1-CB 3.99Å
83	H	98.6	Very high	97.9	Very high	115 Å²	115	53.1 Å²	53.1	53%	0.532	29%	0.288	S	S	.	.	H	α-helix	trans	-62.9	-50	177.4	-177	65	0	0	0	111.4	V79 E80 A81 G85 S86 L87	V79-H83 VanDerWaalsContact O-CB 3.32Å; V79-H83 WeakPolarHBondContact O-CB 3.27Å; V79-H83 PolarHBondContact O-N 3.13Å; E80-H83 PolarHBondContact O-N 3.33Å; A81-H83 VanDerWaalsContact C-N 3.34Å; H83-G85 PolarHBondContact O-N 3.42Å; H83-S86 WeakPolarHBondContact O-CB 3.35Å; H83-S86 PolarHBondContact O-N 2.99Å; H83-S86 VanDerWaalsContact O-N 3.13Å; H83-L87 WeakPolarHBondContact O-CG 3.26Å; H83-L87 PolarHBondContact O-N 2.84Å
84	L	98.6	Very high	98	Very high	51 Å²	51	49.9 Å²	49.9	27%	0.267	27%	0.271	S	S	.	.	H	α-helix	trans	-59.1	-46	175.8	177.8	60.2	0	0	0	111.5	L69 L73 I75 E80 A81 S86 L87 I88	L69-L84 HydrophobicContact CD2-CD2 4.25Å; L73-L84 HydrophobicContact CD1-CD2 3.57Å; I75-L84 HydrophobicContact CD1-CD2 3.97Å; E80-L84 WeakPolarHBondContact O-CB 3.44Å; E80-L84 PolarHBondContact O-N 3.33Å; A81-L84 PolarHBondContact O-N 2.97Å; L84-S86 VanDerWaalsContact C-N 3.28Å; L84-S86 PolarHBondContact O-N 3.38Å; L84-L87 PolarHBondContact O-N 3.03Å; L84-I88 HydrophobicContact CD1-CD1 4.35Å; L84-I88 HydrophobicContact CD1-CG1 4.47Å; L84-I88 HydrophobicContact CG-CD1 4.16Å; L84-I88 WeakPolarHBondContact O-CG1 3.31Å; L84-I88 PolarHBondContact O-N 3.45Å
85	G	98.4	Very high	98	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.1	-40.9	174.9	0	0	0	0	0	112.5	A81 I82 H83 I88 A89 M104	A81-G85 PolarHBondContact O-N 3.49Å; I82-G85 PolarHBondContact O-N 2.86Å; H83-G85 PolarHBondContact O-N 3.42Å; G85-I88 PolarHBondContact O-N 3.08Å; G85-A89 WeakPolarHBondContact O-CB 3.27Å; G85-A89 PolarHBondContact O-N 3.24Å; G85-M104 WeakPolarHBondContact O-CE 3.42Å
86	S	98.4	Very high	98	Very high	24 Å²	24	44.2 Å²	44.2	17%	0.168	23%	0.233	C	C	.	.	H	α-helix	trans	-66.6	-38	176.7	-63.1	0	0	0	0	112.2	I82 H83 L84 A89 A90 M104	I82-S86 WeakPolarHBondContact O-CB 3.5Å; I82-S86 PolarHBondContact O-N 2.71Å; I82-S86 PolarHBondContact O-OG 3.08Å; H83-S86 WeakPolarHBondContact O-CB 3.35Å; H83-S86 PolarHBondContact O-N 2.99Å; H83-S86 VanDerWaalsContact O-N 3.13Å; L84-S86 VanDerWaalsContact C-N 3.28Å; L84-S86 PolarHBondContact O-N 3.38Å; S86-A89 PolarHBondContact O-N 3.46Å; S86-A90 WeakPolarHBondContact O-CB 3.44Å; S86-A90 PolarHBondContact O-N 2.91Å; S86-M104 WeakPolarHBondContact OG-CB 3.39Å; S86-M104 PolarHBondContact OG-N 3.3Å
87	L	98.3	Very high	97.9	Very high	87 Å²	87	37.3 Å²	37.3	46%	0.455	20%	0.202	S	C	.	.	H	α-helix	trans	-65.1	-42.6	173.7	-69	176	0	0	0	111.7	H83 L84 A89 A90 Q91	H83-L87 WeakPolarHBondContact O-CG 3.26Å; H83-L87 PolarHBondContact O-N 2.84Å; L84-L87 PolarHBondContact O-N 3.03Å; L87-A89 VanDerWaalsContact C-N 3.27Å; L87-A89 PolarHBondContact O-N 3.45Å; L87-A90 PolarHBondContact O-N 3.39Å; L87-Q91 VanDerWaalsContact O-CG 3.26Å; L87-Q91 WeakPolarHBondContact O-CG 3.44Å; L87-Q91 PolarHBondContact O-N 3.47Å
88	I	98.3	Very high	97.5	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-60.3	-41.2	174.6	-68.4	171.4	0	0	0	110.5	I29 I32 I33 L69 L84 G85 Q91 G92 Y93 I94	I29-I88 HydrophobicContact CG2-CB 4.45Å; I29-I88 HydrophobicContact CG2-CG1 4Å; I29-I88 HydrophobicContact CG2-CG2 4.02Å; I32-I88 HydrophobicContact CG2-CD1 4.29Å; I33-I88 HydrophobicContact CD1-CG2 3.72Å; I33-I88 HydrophobicContact CG1-CG2 4.39Å; L69-I88 HydrophobicContact CD2-CD1 4.48Å; L84-I88 HydrophobicContact CD1-CD1 4.35Å; L84-I88 HydrophobicContact CD1-CG1 4.47Å; L84-I88 HydrophobicContact CG-CD1 4.16Å; L84-I88 WeakPolarHBondContact O-CG1 3.31Å; L84-I88 PolarHBondContact O-N 3.45Å; G85-I88 PolarHBondContact O-N 3.08Å; I88-Q91 PolarHBondContact O-N 3.06Å; I88-G92 PolarHBondContact O-N 2.82Å; I88-Y93 PolarHBondContact O-N 2.92Å; I88-I94 HydrophobicContact CG2-CD1 4.05Å; I88-I94 HydrophobicContact CG2-CG1 4.16Å
89	A	98.2	Very high	97.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.9	-45	177.2	0	0	0	0	0	112.4	G85 S86 L87 Q91 G92 I94	G85-A89 WeakPolarHBondContact O-CB 3.27Å; G85-A89 PolarHBondContact O-N 3.24Å; S86-A89 PolarHBondContact O-N 3.46Å; L87-A89 VanDerWaalsContact C-N 3.27Å; L87-A89 PolarHBondContact O-N 3.45Å; A89-Q91 PolarHBondContact O-N 3.49Å; A89-G92 WeakPolarHBondContact O-CA 3.33Å; A89-G92 PolarHBondContact O-N 3.35Å; A89-I94 WeakPolarHBondContact CA-O 3.3Å; A89-I94 WeakPolarHBondContact CB-O 3.42Å
90	A	97.6	Very high	97.3	Very high	25 Å²	25	35.5 Å²	35.5	21%	0.207	19%	0.192	C	C	.	.	H	α-helix	trans	-63.7	-24.2	178	0	0	0	0	0	113.4	S86 L87 G92 L102 T212	S86-A90 WeakPolarHBondContact O-CB 3.44Å; S86-A90 PolarHBondContact O-N 2.91Å; L87-A90 PolarHBondContact O-N 3.39Å; A90-G92 VanDerWaalsContact C-N 3.27Å; A90-L102 PolarHBondContact N-O 3.04Å; A90-T212 HydrophobicContact CB-CG2 3.87Å; A90-T212 WeakPolarHBondContact O-CG2 3.33Å; A90-T212 PolarHBondContact O-OG1 2.87Å
91	Q	96.4	Very high	97.2	Very high	38 Å²	38	32 Å²	32	18%	0.178	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-2.7	171.1	-65.7	-66.8	-17.2	0	0	113.1	I29 L87 I88 A89 Y93	I29-Q91 HydrophobicContact CD1-CG 4.22Å; L87-Q91 VanDerWaalsContact O-CG 3.26Å; L87-Q91 WeakPolarHBondContact O-CG 3.44Å; L87-Q91 PolarHBondContact O-N 3.47Å; I88-Q91 PolarHBondContact O-N 3.06Å; A89-Q91 PolarHBondContact O-N 3.49Å; Q91-Y93 HydrophobicContact CB-CD2 3.79Å; Q91-Y93 HydrophobicContact CB-CE2 3.91Å
92	G	97.2	Very high	97.2	Very high	3 Å²	3	32.7 Å²	32.7	3%	0.031	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	11.1	172.7	0	0	0	0	0	115.8	I88 A89 A90 Q114 V202	I88-G92 PolarHBondContact O-N 2.82Å; A89-G92 WeakPolarHBondContact O-CA 3.33Å; A89-G92 PolarHBondContact O-N 3.35Å; A90-G92 VanDerWaalsContact C-N 3.27Å; G92-Q114 WeakPolarHBondContact O-CB 3.31Å; G92-Q114 WeakPolarHBondContact O-CG 3.43Å; G92-V202 VanDerWaalsContact CA-CG2 3.46Å
93	Y	98.4	Very high	97.1	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	-80.4	-29	179.7	-70.2	-80.1	0	0	0	113.2	Y26 I29 E30 I33 I88 Q91 Q114 W119 P120	Y26-Y93 WeakPolarHBondContact CB-OH 3.45Å; I29-Y93 HydrophobicContact CB-CD2 4.28Å; I29-Y93 HydrophobicContact CB-CE2 3.97Å; I29-Y93 HydrophobicContact CD1-CE2 4.16Å; I29-Y93 HydrophobicContact CG2-CD1 4.33Å; I29-Y93 HydrophobicContact CG2-CD2 3.32Å; I29-Y93 HydrophobicContact CG2-CE2 3.52Å; I29-Y93 HydrophobicContact CG2-CG 3.75Å; E30-Y93 HydrophobicContact CG-CD1 4.23Å; E30-Y93 HydrophobicContact CG-CE1 3.3Å; E30-Y93 WeakPolarHBondContact OE1-CE1 3.11Å; E30-Y93 PolarHBondContact OE1-OH 3.09Å; I33-Y93 HydrophobicContact CG1-CD1 4.2Å; I33-Y93 HydrophobicContact CG1-CG 4.16Å; I88-Y93 PolarHBondContact O-N 2.92Å; Q91-Y93 HydrophobicContact CB-CD2 3.79Å; Q91-Y93 HydrophobicContact CB-CE2 3.91Å; Y93-Q114 WeakPolarHBondContact O-CB 3.47Å; Y93-Q114 PolarHBondContact O-N 2.63Å; Y93-W119 AromaticContact CD1-CD1 3.71Å; Y93-W119 AromaticContact CD1-CD2 3.97Å; Y93-W119 HydrophobicContact CD1-CD2 3.97Å; Y93-W119 AromaticContact CD1-CE2 3.85Å; Y93-W119 AromaticContact CD1-CG 3.87Å; Y93-W119 HydrophobicContact CD1-CG 3.87Å; Y93-W119 AromaticContact CD1-NE1 3.71Å; Y93-W119 HydrophobicContact CE1-CB 3.9Å; Y93-W119 AromaticContact CE1-CD1 3.86Å; Y93-W119 AromaticContact CE1-CD2 3.63Å; Y93-W119 HydrophobicContact CE1-CD2 3.63Å; Y93-W119 HydrophobicContact CE1-CE3 4.15Å; Y93-W119 AromaticContact CE1-CG 3.53Å; Y93-W119 HydrophobicContact CE1-CG 3.53Å; Y93-P120 HydrophobicContact CE1-CG 4.48Å; Y93-P120 HydrophobicContact CE2-CG 3.63Å; Y93-P120 WeakPolarHBondContact OH-CG 3.28Å
94	I	98.1	Very high	97.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	141.3	175.9	-57	176.5	0	0	0	107.2	I33 M36 I65 I88 A89 Y111 R112 F113	I33-I94 HydrophobicContact CD1-CD1 3.63Å; I33-I94 HydrophobicContact CD1-CG1 3.59Å; M36-I94 HydrophobicContact SD-CD1 3.94Å; I65-I94 HydrophobicContact CD1-CD1 4.41Å; I65-I94 HydrophobicContact CD1-CG2 4.05Å; I65-I94 HydrophobicContact CG2-CD1 4.5Å; I88-I94 HydrophobicContact CG2-CD1 4.05Å; I88-I94 HydrophobicContact CG2-CG1 4.16Å; A89-I94 WeakPolarHBondContact CA-O 3.3Å; A89-I94 WeakPolarHBondContact CB-O 3.42Å; I94-Y111 HydrophobicContact CG2-CD1 3.92Å; I94-Y111 HydrophobicContact CG2-CG 4.13Å; I94-R112 CarbonylContact C-O 3.5Å; I94-R112 VanDerWaalsContact CA-O 3.29Å; I94-R112 WeakPolarHBondContact CA-O 3.49Å; I94-F113 HydrophobicContact CD1-CD1 4.12Å; I94-F113 HydrophobicContact CD1-CE1 3.73Å; I94-F113 HydrophobicContact CG1-CD1 3.76Å; I94-F113 HydrophobicContact CG1-CE1 3.92Å
95	F	98.4	Very high	97	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	143.7	-179.2	58.3	-89.8	0	0	0	112.7	L102 Y111 R112 Q114 S194 Q195 A198	F95-L102 HydrophobicContact CB-CD2 3.75Å; F95-Y111 CarbonylContact O-C 3.59Å; F95-Y111 VanDerWaalsContact O-CA 3.28Å; F95-Y111 WeakPolarHBondContact O-CA 3.35Å; F95-R112 WeakPolarHBondContact CD1-O 3.36Å; F95-R112 HydrophobicContact CD2-CB 4.39Å; F95-R112 HydrophobicContact CE1-CB 3.95Å; F95-R112 HydrophobicContact CE2-CB 3.82Å; F95-R112 HydrophobicContact CE2-CG 4.43Å; F95-R112 HydrophobicContact CZ-CB 3.58Å; F95-R112 HydrophobicContact CZ-CG 4.43Å; F95-R112 PolarHBondContact N-O 2.99Å; F95-R112 PolarHBondContact O-N 3.5Å; F95-Q114 HydrophobicContact CD1-CB 4.28Å; F95-Q114 HydrophobicContact CE1-CB 4.17Å; F95-S194 WeakPolarHBondContact CE2-O 3.37Å; F95-Q195 HydrophobicContact CE1-CG 4.17Å; F95-Q195 HydrophobicContact CZ-CB 4.45Å; F95-Q195 HydrophobicContact CZ-CG 3.84Å; F95-A198 HydrophobicContact CB-CB 3.62Å; F95-A198 HydrophobicContact CD1-CB 3.38Å; F95-A198 HydrophobicContact CD2-CB 3.57Å; F95-A198 HydrophobicContact CE1-CB 3.83Å; F95-A198 HydrophobicContact CE2-CB 4Å; F95-A198 HydrophobicContact CG-CB 3.23Å; F95-A198 HydrophobicContact CZ-CB 4.12Å
96	P	97.6	Very high	97	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.019	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	137.3	174	27.7	-31.7	0	0	0	109.8	S98 D99 V101 T109 Y111 R197	P96-S98 VanDerWaalsContact C-N 3.31Å; P96-S98 PolarHBondContact O-N 2.97Å; P96-D99 HydrophobicContact CB-CB 4.23Å; P96-D99 HydrophobicContact CG-CB 4.04Å; P96-V101 WeakPolarHBondContact CG-O 3.4Å; P96-T109 HydrophobicContact CB-CG2 4.45Å; P96-Y111 HydrophobicContact CB-CD1 4.09Å; P96-Y111 HydrophobicContact CB-CE1 3.73Å; P96-Y111 HydrophobicContact CG-CE1 4.19Å; P96-R197 PolarHBondContact O-NH2 3.12Å
97	I	94.4	Very high	96.9	Very high	38 Å²	38	34.9 Å²	34.9	20%	0.195	20%	0.195	C	C	.	.	S	Bend	trans	-75	-23.1	-174.8	65.8	175.6	0	0	0	113.5	I56 V59 F110 R112 R197	I56-I97 HydrophobicContact CD1-CD1 4.13Å; I56-I97 HydrophobicContact CG2-CD1 3.76Å; V59-I97 HydrophobicContact CG1-CD1 4.17Å; V59-I97 HydrophobicContact CG1-CG2 4.19Å; I97-F110 HydrophobicContact CD1-CB 3.52Å; I97-F110 HydrophobicContact CD1-CD2 4.24Å; I97-F110 HydrophobicContact CD1-CG 4.28Å; I97-F110 HydrophobicContact CG1-CB 3.87Å; I97-F110 PolarHBondContact N-O 3.36Å; I97-R112 HydrophobicContact CG2-CB 4.39Å; I97-R112 HydrophobicContact CG2-CG 3.57Å; I97-R197 VanDerWaalsContact C-NH2 3.34Å; I97-R197 PolarHBondContact O-NH2 2.86Å
98	S	90.4	Very high	96.8	Very high	104 Å²	104	33.3 Å²	33.3	73%	0.727	20%	0.199	S	C	*	.	S	Bend	trans	-112.9	2.4	-169.9	53.8	0	0	0	0	114.4	P96	P96-S98 VanDerWaalsContact C-N 3.31Å; P96-S98 PolarHBondContact O-N 2.97Å
99	D	93.8	Very high	96.7	Very high	57 Å²	57	34.7 Å²	34.7	31%	0.305	21%	0.208	S	C	.	.			trans	-136.9	148	-175.6	-158	-24	0	0	0	110.1	P96 V101 R197	P96-D99 HydrophobicContact CB-CB 4.23Å; P96-D99 HydrophobicContact CG-CB 4.04Å; D99-V101 PolarHBondContact OD1-N 3.24Å; D99-R197 PolarHBondContact O-NH1 3.17Å; D99-R197 PolarHBondContact O-NH2 3.35Å
100	H	95.9	Very high	96.7	Very high	37 Å²	37	37.5 Å²	37.5	17%	0.171	22%	0.22	C	C	.	.	S	Bend	trans	-85.9	-19.3	172.7	-77.4	-86.8	0	0	0	112	L102 Y151 E152 D201 V206	H100-L102 PolarHBondContact O-N 2.64Å; H100-Y151 PolarHBondContact ND1-OH 2.96Å; H100-E152 IonicContact CE1-OE1 2.67Å; H100-E152 IonicContact CE1-OE2 2.8Å; H100-E152 IonicContact NE2-OE2 3.8Å; H100-D201 IonicContact CE1-OD1 2.66Å; H100-D201 IonicContact CG-OD1 3.13Å; H100-D201 IonicContact ND1-OD1 2.96Å; H100-D201 PolarHBondContact ND1-OD1 3.45Å; H100-D201 IonicContact ND1-OD2 3.41Å; H100-V206 HydrophobicContact CB-CG2 3.55Å
101	V	97.4	Very high	96.7	Very high	43 Å²	43	36.4 Å²	36.4	26%	0.261	21%	0.211	S	C	.	.	S	Bend	trans	-80.8	111.4	177.6	-179.5	0	0	0	0	110	P96 D99 T103 V206	P96-V101 WeakPolarHBondContact CG-O 3.4Å; D99-V101 PolarHBondContact OD1-N 3.24Å; V101-T103 HydrophobicContact CG1-CG2 3.78Å; V101-T103 PolarHBondContact O-N 2.66Å; V101-V206 HydrophobicContact CG2-CB 4.48Å; V101-V206 HydrophobicContact CG2-CG2 4.24Å
102	L	97.9	Very high	96.8	Very high	14 Å²	14	35.5 Å²	35.5	7%	0.073	21%	0.206	C	C	.	.			trans	-77.7	78.5	-176.4	-59.7	-177.6	0	0	0	112.1	A90 F95 H100 D201 V202	A90-L102 PolarHBondContact N-O 3.04Å; F95-L102 HydrophobicContact CB-CD2 3.75Å; H100-L102 PolarHBondContact O-N 2.64Å; L102-D201 HydrophobicContact CD1-CB 3.88Å; L102-D201 HydrophobicContact CD2-CB 4.01Å; L102-D201 HydrophobicContact CG-CB 3.91Å; L102-V202 HydrophobicContact CD1-CB 4.46Å; L102-V202 HydrophobicContact CD1-CG2 3.48Å; L102-V202 VanDerWaalsContact CD1-CG2 3.48Å
103	T	97.4	Very high	96.8	Very high	52 Å²	52	36.4 Å²	36.4	32%	0.319	21%	0.209	S	C	.	.			trans	-135	153.9	-180	54.5	0	0	0	0	111.9	V101 Y111	V101-T103 HydrophobicContact CG1-CG2 3.78Å; V101-T103 PolarHBondContact O-N 2.66Å; T103-Y111 VanDerWaalsContact O-CE1 3.22Å; T103-Y111 WeakPolarHBondContact O-CE1 3.11Å; T103-Y111 PolarHBondContact O-OH 2.89Å
104	M	97.4	Very high	96.8	Very high	9 Å²	9	36.6 Å²	36.6	4%	0.044	21%	0.21	C	C	.	.			trans	-92.9	137.7	176.5	-164.6	75	67.4	0	0	110.3	I65 V66 G85 S86 Y111	I65-M104 HydrophobicContact CB-CE 4.35Å; I65-M104 HydrophobicContact CB-SD 4.19Å; I65-M104 HydrophobicContact CD1-CE 4.09Å; I65-M104 HydrophobicContact CD1-SD 3.86Å; I65-M104 HydrophobicContact CG2-CE 3.62Å; I65-M104 HydrophobicContact CG2-SD 4.09Å; V66-M104 HydrophobicContact CG2-CG 4.1Å; G85-M104 WeakPolarHBondContact O-CE 3.42Å; S86-M104 WeakPolarHBondContact OG-CB 3.39Å; S86-M104 PolarHBondContact OG-N 3.3Å; M104-Y111 WeakPolarHBondContact CA-OH 3.44Å; M104-Y111 HydrophobicContact SD-CD1 4.41Å; M104-Y111 HydrophobicContact SD-CD2 4.36Å; M104-Y111 HydrophobicContact SD-CE1 4.15Å; M104-Y111 HydrophobicContact SD-CE2 4.09Å
105	K	97.3	Very high	96.7	Very high	87 Å²	87	37.7 Å²	37.7	38%	0.378	22%	0.219	S	C	.	.			trans	-121.2	133.9	171.5	-63.6	177.9	-177.6	171.3	0	108.4	G62 D107 Y111	G62-K105 CarbonylContact C-O 3.6Å; G62-K105 VanDerWaalsContact CA-O 3.24Å; G62-K105 WeakPolarHBondContact CA-O 3.37Å; K105-D107 PolarHBondContact O-N 3.4Å; K105-Y111 PolarHBondContact N-OH 3.2Å
106	D	97.3	Very high	96.6	Very high	68 Å²	68	41.4 Å²	41.4	36%	0.364	24%	0.243	S	C	.	.	S	Bend	trans	-82.6	68.5	172.9	-174	15.1	0	0	0	110.4	T63 V66 I82	T63-D106 VanDerWaalsContact CA-OD1 3.24Å; T63-D106 WeakPolarHBondContact CA-OD1 3.45Å; T63-D106 WeakPolarHBondContact CB-OD1 3.49Å; T63-D106 PolarHBondContact OG1-OD1 3.49Å; V66-D106 HydrophobicContact CG1-CB 4.49Å; V66-D106 HydrophobicContact CG2-CB 4.16Å; I82-D106 HydrophobicContact CD1-CB 3.7Å; I82-D106 HydrophobicContact CG1-CB 3.99Å
107	D	96.9	Very high	96.4	Very high	66 Å²	66	47.1 Å²	47.1	35%	0.353	27%	0.265	S	S	.	.	S	Bend	trans	-151.5	-168	177.5	65	19.6	0	0	0	111.2	G62 T63 K105 T109	G62-D107 PolarHBondContact N-O 2.71Å; T63-D107 PolarHBondContact N-O 2.85Å; T63-D107 VanDerWaalsContact N-O 3.09Å; T63-D107 WeakPolarHBondContact OG1-CA 3.2Å; T63-D107 PolarHBondContact OG1-N 3Å; T63-D107 PolarHBondContact OG1-O 2.91Å; K105-D107 PolarHBondContact O-N 3.4Å; D107-T109 PolarHBondContact O-N 3.32Å; D107-T109 VanDerWaalsContact O-N 3.14Å; D107-T109 WeakPolarHBondContact OD1-CA 3.41Å; D107-T109 WeakPolarHBondContact OD1-CB 3.31Å; D107-T109 PolarHBondContact OD1-N 3.02Å; D107-T109 PolarHBondContact OD1-OG1 3.43Å; D107-T109 PolarHBondContact OD2-OG1 3.48Å
108	G	96.2	Very high	96.5	Very high	54 Å²	54	46.7 Å²	46.7	56%	0.557	26%	0.262	S	S	*	.	S	Bend	trans	-72	8.1	177.1	0	0	0	0	0	115.5	F110	G108-F110 PolarHBondContact O-N 2.94Å
109	T	97.1	Very high	96.6	Very high	30 Å²	30	43 Å²	43	18%	0.184	23%	0.232	C	C	.	.			trans	-59.1	136.2	176.3	-63.2	0	0	0	0	110.2	T61 G62 P96 D107 Y111	T61-T109 CarbonylContact C-O 3.45Å; T61-T109 WeakPolarHBondContact CA-O 3.24Å; G62-T109 PolarHBondContact N-O 2.8Å; P96-T109 HydrophobicContact CB-CG2 4.45Å; D107-T109 PolarHBondContact O-N 3.32Å; D107-T109 VanDerWaalsContact O-N 3.14Å; D107-T109 WeakPolarHBondContact OD1-CA 3.41Å; D107-T109 WeakPolarHBondContact OD1-CB 3.31Å; D107-T109 PolarHBondContact OD1-N 3.02Å; D107-T109 PolarHBondContact OD1-OG1 3.43Å; D107-T109 PolarHBondContact OD2-OG1 3.48Å; T109-Y111 HydrophobicContact CG2-CD2 4.37Å; T109-Y111 HydrophobicContact CG2-CE2 3.67Å; T109-Y111 WeakPolarHBondContact O-CD2 3.33Å
110	F	97.5	Very high	96.5	Very high	60 Å²	60	41 Å²	41	26%	0.263	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131.8	-177.9	-65.2	-55.3	0	0	0	112.4	V49 V59 V60 T61 I97 G108	V49-F110 HydrophobicContact CB-CZ 4.32Å; V49-F110 HydrophobicContact CG1-CE2 4.43Å; V49-F110 HydrophobicContact CG1-CZ 4.03Å; V49-F110 HydrophobicContact CG2-CD1 4.5Å; V49-F110 HydrophobicContact CG2-CE1 3.74Å; V49-F110 HydrophobicContact CG2-CZ 3.78Å; V59-F110 HydrophobicContact CB-CB 4.16Å; V59-F110 HydrophobicContact CB-CD1 4.19Å; V59-F110 HydrophobicContact CB-CG 4.38Å; V59-F110 HydrophobicContact CG1-CB 4.23Å; V59-F110 HydrophobicContact CG2-CD1 3.88Å; V59-F110 HydrophobicContact CG2-CE1 4.37Å; V59-F110 HydrophobicContact CG2-CG 4.28Å; V60-F110 WeakPolarHBondContact O-CA 3.47Å; T61-F110 HydrophobicContact CG2-CD1 4.18Å; T61-F110 HydrophobicContact CG2-CE1 3.95Å; I97-F110 HydrophobicContact CD1-CB 3.52Å; I97-F110 HydrophobicContact CD1-CD2 4.24Å; I97-F110 HydrophobicContact CD1-CG 4.28Å; I97-F110 HydrophobicContact CG1-CB 3.87Å; I97-F110 PolarHBondContact N-O 3.36Å; G108-F110 PolarHBondContact O-N 2.94Å
111	Y	98.3	Very high	96.2	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	161.8	177.8	-66.3	-94	0	0	0	111.7	V59 V60 I65 I94 F95 P96 T103 M104 K105 T109	V59-Y111 WeakPolarHBondContact CA-O 3.38Å; V60-Y111 PolarHBondContact N-O 3.42Å; V60-Y111 PolarHBondContact O-N 3.1Å; I65-Y111 HydrophobicContact CD1-CD2 4.22Å; I65-Y111 HydrophobicContact CD1-CG 4.1Å; I94-Y111 HydrophobicContact CG2-CD1 3.92Å; I94-Y111 HydrophobicContact CG2-CG 4.13Å; F95-Y111 CarbonylContact O-C 3.59Å; F95-Y111 VanDerWaalsContact O-CA 3.28Å; F95-Y111 WeakPolarHBondContact O-CA 3.35Å; P96-Y111 HydrophobicContact CB-CD1 4.09Å; P96-Y111 HydrophobicContact CB-CE1 3.73Å; P96-Y111 HydrophobicContact CG-CE1 4.19Å; T103-Y111 VanDerWaalsContact O-CE1 3.22Å; T103-Y111 WeakPolarHBondContact O-CE1 3.11Å; T103-Y111 PolarHBondContact O-OH 2.89Å; M104-Y111 WeakPolarHBondContact CA-OH 3.44Å; M104-Y111 HydrophobicContact SD-CD1 4.41Å; M104-Y111 HydrophobicContact SD-CD2 4.36Å; M104-Y111 HydrophobicContact SD-CE1 4.15Å; M104-Y111 HydrophobicContact SD-CE2 4.09Å; K105-Y111 PolarHBondContact N-OH 3.2Å; T109-Y111 HydrophobicContact CG2-CD2 4.37Å; T109-Y111 HydrophobicContact CG2-CE2 3.67Å; T109-Y111 WeakPolarHBondContact O-CD2 3.33Å
112	R	97.8	Very high	95.7	Very high	20 Å²	20	40.6 Å²	40.6	8%	0.075	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	147.1	171.5	-74.8	177.7	-171.7	-74.7	-9.6	110.6	P57 S58 V59 I94 F95 I97	P57-R112 PolarHBondContact O-NH1 3.28Å; P57-R112 PolarHBondContact O-NH2 2.94Å; S58-R112 PolarHBondContact O-NH1 3.12Å; V59-R112 HydrophobicContact CG1-CG 4.22Å; I94-R112 CarbonylContact C-O 3.5Å; I94-R112 VanDerWaalsContact CA-O 3.29Å; I94-R112 WeakPolarHBondContact CA-O 3.49Å; F95-R112 WeakPolarHBondContact CD1-O 3.36Å; F95-R112 HydrophobicContact CD2-CB 4.39Å; F95-R112 HydrophobicContact CE1-CB 3.95Å; F95-R112 HydrophobicContact CE2-CB 3.82Å; F95-R112 HydrophobicContact CE2-CG 4.43Å; F95-R112 HydrophobicContact CZ-CB 3.58Å; F95-R112 HydrophobicContact CZ-CG 4.43Å; F95-R112 PolarHBondContact N-O 2.99Å; F95-R112 PolarHBondContact O-N 3.5Å; I97-R112 HydrophobicContact CG2-CB 4.39Å; I97-R112 HydrophobicContact CG2-CG 3.57Å
113	F	98.1	Very high	94.8	Very high	22 Å²	22	41.3 Å²	41.3	10%	0.096	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	138.7	165.2	-63.5	-72.4	0	0	0	110.6	I33 M36 Q37 V44 I46 V60 I94	I33-F113 HydrophobicContact CD1-CD1 4.28Å; I33-F113 HydrophobicContact CD1-CE1 4.3Å; I33-F113 HydrophobicContact CG2-CD1 4.35Å; M36-F113 HydrophobicContact CB-CE1 3.95Å; M36-F113 HydrophobicContact CB-CZ 3.91Å; M36-F113 HydrophobicContact SD-CE1 4.15Å; Q37-F113 HydrophobicContact CG-CD1 4.02Å; Q37-F113 HydrophobicContact CG-CD2 3.63Å; Q37-F113 HydrophobicContact CG-CE1 4.08Å; Q37-F113 HydrophobicContact CG-CE2 3.69Å; Q37-F113 HydrophobicContact CG-CG 3.81Å; Q37-F113 HydrophobicContact CG-CZ 3.93Å; V44-F113 HydrophobicContact CB-CZ 4.47Å; I46-F113 HydrophobicContact CD1-CD2 4.13Å; I46-F113 HydrophobicContact CD1-CE2 4.05Å; I46-F113 HydrophobicContact CG1-CE2 4.15Å; V60-F113 HydrophobicContact CG1-CE2 3.95Å; V60-F113 HydrophobicContact CG2-CE2 4.41Å; I94-F113 HydrophobicContact CD1-CD1 4.12Å; I94-F113 HydrophobicContact CD1-CE1 3.73Å; I94-F113 HydrophobicContact CG1-CD1 3.76Å; I94-F113 HydrophobicContact CG1-CE1 3.92Å
114	Q	98	Very high	94	Very high	3 Å²	3	39.9 Å²	39.9	1%	0.014	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-78.8	144.3	175.1	-177.5	61.2	-80	0	0	111.4	G92 Y93 F95 F118 W119 Q195	G92-Q114 WeakPolarHBondContact O-CB 3.31Å; G92-Q114 WeakPolarHBondContact O-CG 3.43Å; Y93-Q114 WeakPolarHBondContact O-CB 3.47Å; Y93-Q114 PolarHBondContact O-N 2.63Å; F95-Q114 HydrophobicContact CD1-CB 4.28Å; F95-Q114 HydrophobicContact CE1-CB 4.17Å; Q114-F118 HydrophobicContact CG-CB 3.72Å; Q114-W119 PolarHBondContact O-NE1 2.78Å; Q114-W119 VanDerWaalsContact O-NE1 3.14Å; Q114-Q195 PolarHBondContact NE2-O 3.1Å; Q114-Q195 VanDerWaalsContact OE1-CB 3.29Å
115	A	96.3	Very high	93.3	Very high	23 Å²	23	44.7 Å²	44.7	19%	0.19	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-65.6	138.9	175.2	0	0	0	0	0	110.8	Y117 F118	A115-Y117 PolarHBondContact O-N 2.91Å; A115-F118 HydrophobicContact CB-CD2 4.3Å; A115-F118 PolarHBondContact O-N 3.08Å
116	P	95.6	Very high	92.9	Very high	79 Å²	79	41.1 Å²	41.1	51%	0.513	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-54	-26.6	179.2	-29.2	35.5	0	0	0	115.3	F118 W119 N122	P116-F118 VanDerWaalsContact C-N 3.26Å; P116-F118 PolarHBondContact O-N 3.23Å; P116-W119 HydrophobicContact CB-CD2 4.04Å; P116-W119 HydrophobicContact CB-CE3 4.14Å; P116-W119 HydrophobicContact CB-CH2 4.44Å; P116-W119 HydrophobicContact CB-CZ2 4.3Å; P116-W119 HydrophobicContact CB-CZ3 4.35Å; P116-W119 HydrophobicContact CG-CH2 4.2Å; P116-W119 HydrophobicContact CG-CZ2 3.9Å; P116-W119 WeakPolarHBondContact O-CB 3.49Å; P116-W119 PolarHBondContact O-N 3.02Å; P116-N122 PolarHBondContact O-ND2 3.48Å
117	Y	93.4	Very high	92.6	Very high	122 Å²	122	43 Å²	43	48%	0.478	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-56.8	-39.1	172.8	175.4	-102.1	0	0	0	112.7	A115 N122 W124	A115-Y117 PolarHBondContact O-N 2.91Å; Y117-N122 PolarHBondContact O-ND2 3.5Å; Y117-N122 VanDerWaalsContact O-ND2 3.11Å; Y117-W124 HydrophobicContact CD1-CZ2 4.36Å; Y117-W124 HydrophobicContact CD2-CZ2 4.25Å; Y117-W124 HydrophobicContact CE1-CH2 4.15Å; Y117-W124 AromaticContact CE1-CZ2 3.95Å; Y117-W124 HydrophobicContact CE1-CZ2 3.95Å; Y117-W124 AromaticContact CE2-CH2 3.89Å; Y117-W124 HydrophobicContact CE2-CH2 3.89Å; Y117-W124 AromaticContact CE2-CZ2 3.83Å; Y117-W124 HydrophobicContact CE2-CZ2 3.83Å; Y117-W124 AromaticContact CZ-CH2 3.55Å; Y117-W124 AromaticContact CZ-CZ2 3.67Å; Y117-W124 VanDerWaalsContact O-CZ2 3.3Å; Y117-W124 WeakPolarHBondContact O-CZ2 3.29Å; Y117-W124 PolarHBondContact O-NE1 2.83Å; Y117-W124 WeakPolarHBondContact OH-CH2 3.47Å
118	F	95.7	Very high	92.5	Very high	29 Å²	29	43.6 Å²	43.6	13%	0.127	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-90.4	4.6	-178.3	-67.7	-57.5	0	0	0	113.6	Q114 A115 P116 Q195 E196 F199	Q114-F118 HydrophobicContact CG-CB 3.72Å; A115-F118 HydrophobicContact CB-CD2 4.3Å; A115-F118 PolarHBondContact O-N 3.08Å; P116-F118 VanDerWaalsContact C-N 3.26Å; P116-F118 PolarHBondContact O-N 3.23Å; F118-Q195 HydrophobicContact CD2-CB 4.26Å; F118-Q195 HydrophobicContact CE2-CB 4.13Å; F118-E196 HydrophobicContact CZ-CB 4.46Å; F118-F199 HydrophobicContact CB-CB 4.31Å; F118-F199 HydrophobicContact CB-CD2 4.04Å; F118-F199 HydrophobicContact CD1-CB 3.78Å; F118-F199 HydrophobicContact CD1-CD1 4.49Å; F118-F199 AromaticContact CD1-CD2 3.47Å; F118-F199 HydrophobicContact CD1-CD2 3.47Å; F118-F199 VanDerWaalsContact CD1-CD2 3.47Å; F118-F199 HydrophobicContact CD1-CE2 4.16Å; F118-F199 AromaticContact CD1-CG 3.65Å; F118-F199 HydrophobicContact CD1-CG 3.65Å; F118-F199 HydrophobicContact CE1-CB 4.24Å; F118-F199 HydrophobicContact CE1-CD2 4.3Å; F118-F199 HydrophobicContact CE1-CG 4.13Å; F118-F199 HydrophobicContact CG-CB 4.06Å; F118-F199 HydrophobicContact CG-CD2 4.12Å; F118-F199 HydrophobicContact CG-CG 4.34Å
119	W	94.4	Very high	92.5	Very high	27 Å²	27	43.2 Å²	43.2	10%	0.102	22%	0.221	C	C	.	.			trans	-66.7	143.4	179.5	-70.6	-1.2	0	0	0	112	E30 I33 Y93 Q114 P116 S121 N122	E30-W119 HydrophobicContact CB-CE3 4.31Å; E30-W119 HydrophobicContact CB-CH2 4.29Å; E30-W119 HydrophobicContact CB-CZ3 3.81Å; E30-W119 HydrophobicContact CG-CD2 4.1Å; E30-W119 HydrophobicContact CG-CE3 3.44Å; E30-W119 VanDerWaalsContact CG-CE3 3.44Å; E30-W119 HydrophobicContact CG-CH2 4.12Å; E30-W119 HydrophobicContact CG-CZ3 3.44Å; E30-W119 VanDerWaalsContact CG-CZ3 3.44Å; I33-W119 HydrophobicContact CG2-CH2 4.41Å; I33-W119 HydrophobicContact CG2-CZ2 3.83Å; Y93-W119 AromaticContact CD1-CD1 3.71Å; Y93-W119 AromaticContact CD1-CD2 3.97Å; Y93-W119 HydrophobicContact CD1-CD2 3.97Å; Y93-W119 AromaticContact CD1-CE2 3.85Å; Y93-W119 AromaticContact CD1-CG 3.87Å; Y93-W119 HydrophobicContact CD1-CG 3.87Å; Y93-W119 AromaticContact CD1-NE1 3.71Å; Y93-W119 HydrophobicContact CE1-CB 3.9Å; Y93-W119 AromaticContact CE1-CD1 3.86Å; Y93-W119 AromaticContact CE1-CD2 3.63Å; Y93-W119 HydrophobicContact CE1-CD2 3.63Å; Y93-W119 HydrophobicContact CE1-CE3 4.15Å; Y93-W119 AromaticContact CE1-CG 3.53Å; Y93-W119 HydrophobicContact CE1-CG 3.53Å; Q114-W119 PolarHBondContact O-NE1 2.78Å; Q114-W119 VanDerWaalsContact O-NE1 3.14Å; P116-W119 HydrophobicContact CB-CD2 4.04Å; P116-W119 HydrophobicContact CB-CE3 4.14Å; P116-W119 HydrophobicContact CB-CH2 4.44Å; P116-W119 HydrophobicContact CB-CZ2 4.3Å; P116-W119 HydrophobicContact CB-CZ3 4.35Å; P116-W119 HydrophobicContact CG-CH2 4.2Å; P116-W119 HydrophobicContact CG-CZ2 3.9Å; P116-W119 WeakPolarHBondContact O-CB 3.49Å; P116-W119 PolarHBondContact O-N 3.02Å; W119-S121 PolarHBondContact O-N 2.86Å; W119-N122 WeakPolarHBondContact O-CB 3.22Å; W119-N122 PolarHBondContact O-N 3.27Å; W119-N122 VanDerWaalsContact O-N 3.09Å; W119-N122 PolarHBondContact O-ND2 3.27Å
120	P	90.8	Very high	92.4	Very high	14 Å²	14	42.1 Å²	42.1	9%	0.091	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-66.9	-19.1	-177.5	27.7	-36.3	0	0	0	113.7	Y26 Y93 N122 C123	Y26-P120 HydrophobicContact CD1-CB 4.38Å; Y26-P120 HydrophobicContact CD1-CG 3.95Å; Y26-P120 HydrophobicContact CE1-CB 4.05Å; Y26-P120 HydrophobicContact CE1-CG 4.01Å; Y26-P120 HydrophobicContact CE2-CB 4.36Å; Y26-P120 HydrophobicContact CG-CG 4.4Å; Y93-P120 HydrophobicContact CE1-CG 4.48Å; Y93-P120 HydrophobicContact CE2-CG 3.63Å; Y93-P120 WeakPolarHBondContact OH-CG 3.28Å; P120-N122 PolarHBondContact O-N 2.75Å; P120-C123 WeakPolarHBondContact O-CA 3.43Å; P120-C123 PolarHBondContact O-N 2.76Å
121	S	89.1	Confident	92.3	Very high	24 Å²	24	39.5 Å²	39.5	17%	0.168	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-62.4	-18.5	170.6	53.8	0	0	0	0	113.8	M23 E30 W119 C123	M23-S121 WeakPolarHBondContact CE-O 3.26Å; E30-S121 WeakPolarHBondContact OE1-CB 3.45Å; E30-S121 PolarHBondContact OE1-OG 3.27Å; W119-S121 PolarHBondContact O-N 2.86Å; S121-C123 PolarHBondContact O-N 2.98Å
122	N	86.5	Confident	92.3	Very high	48 Å²	48	39.4 Å²	39.4	26%	0.257	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-72.1	-3.5	169	-68.7	-62.9	0	0	0	113.3	P116 Y117 W119 P120	P116-N122 PolarHBondContact O-ND2 3.48Å; Y117-N122 PolarHBondContact O-ND2 3.5Å; Y117-N122 VanDerWaalsContact O-ND2 3.11Å; W119-N122 WeakPolarHBondContact O-CB 3.22Å; W119-N122 PolarHBondContact O-N 3.27Å; W119-N122 VanDerWaalsContact O-N 3.09Å; W119-N122 PolarHBondContact O-ND2 3.27Å; P120-N122 PolarHBondContact O-N 2.75Å
123	C	79.2	Confident	92.2	Very high	29 Å²	29	38.7 Å²	38.7	20%	0.196	20%	0.199	C	C	.	.			trans	53.9	53	178.1	-60.2	0	0	0	0	112.6	P120 S121 V229	P120-C123 WeakPolarHBondContact O-CA 3.43Å; P120-C123 PolarHBondContact O-N 2.76Å; S121-C123 PolarHBondContact O-N 2.98Å; C123-V229 HydrophobicContact CB-CG1 3.1Å
124	W	81.8	Confident	92.2	Very high	22 Å²	22	37.8 Å²	37.8	8%	0.083	20%	0.195	C	C	.	.			trans	-63.1	134.4	178	-70.4	108.8	0	0	0	112.1	Y117 F199 K231 V233	Y117-W124 HydrophobicContact CD1-CZ2 4.36Å; Y117-W124 HydrophobicContact CD2-CZ2 4.25Å; Y117-W124 HydrophobicContact CE1-CH2 4.15Å; Y117-W124 AromaticContact CE1-CZ2 3.95Å; Y117-W124 HydrophobicContact CE1-CZ2 3.95Å; Y117-W124 AromaticContact CE2-CH2 3.89Å; Y117-W124 HydrophobicContact CE2-CH2 3.89Å; Y117-W124 AromaticContact CE2-CZ2 3.83Å; Y117-W124 HydrophobicContact CE2-CZ2 3.83Å; Y117-W124 AromaticContact CZ-CH2 3.55Å; Y117-W124 AromaticContact CZ-CZ2 3.67Å; Y117-W124 VanDerWaalsContact O-CZ2 3.3Å; Y117-W124 WeakPolarHBondContact O-CZ2 3.29Å; Y117-W124 PolarHBondContact O-NE1 2.83Å; Y117-W124 WeakPolarHBondContact OH-CH2 3.47Å; W124-F199 HydrophobicContact CB-CE2 4Å; W124-F199 HydrophobicContact CB-CZ 4.24Å; W124-F199 AromaticContact CD1-CE2 3.79Å; W124-F199 HydrophobicContact CD2-CE2 4.01Å; W124-F199 HydrophobicContact CD2-CZ 4.33Å; W124-F199 AromaticContact CG-CE2 3.67Å; W124-F199 HydrophobicContact CG-CE2 3.67Å; W124-F199 HydrophobicContact CG-CZ 4.19Å; W124-K231 HydrophobicContact CE3-CB 3.81Å; W124-K231 HydrophobicContact CH2-CB 4.2Å; W124-K231 HydrophobicContact CZ3-CB 3.57Å; W124-K231 WeakPolarHBondContact CZ3-O 3.39Å; W124-V233 HydrophobicContact CE3-CG2 3.96Å; W124-V233 HydrophobicContact CZ3-CG2 3.95Å
125	E	81.8	Confident	92.1	Very high	111 Å²	111	37.6 Å²	37.6	52%	0.519	20%	0.195	S	C	.	.			trans	-126.7	69.8	168.4	-71.4	-170.4	166.3	0	0	109.2	E127	E125-E127 PolarHBondContact O-N 3.5Å
126	P	88.8	Confident	92.1	Very high	11 Å²	11	36.7 Å²	36.7	7%	0.071	19%	0.187	C	C	.	.			trans	-68.8	132.9	-171.7	27.5	-33.6	0	0	0	112	F199 W200 H203 R204 V233	P126-F199 HydrophobicContact CB-CE1 4.15Å; P126-F199 HydrophobicContact CB-CZ 4.04Å; P126-F199 HydrophobicContact CG-CE1 4.21Å; P126-F199 HydrophobicContact CG-CZ 3.94Å; P126-W200 HydrophobicContact CB-CH2 3.61Å; P126-W200 HydrophobicContact CB-CZ3 3.78Å; P126-W200 HydrophobicContact CG-CH2 4.37Å; P126-W200 HydrophobicContact CG-CZ3 4.05Å; P126-H203 VanDerWaalsContact CD-CD2 3.44Å; P126-H203 WeakPolarHBondContact CD-CD2 3.49Å; P126-H203 HydrophobicContact CG-CB 3.64Å; P126-H203 VanDerWaalsContact CG-CD2 3.45Å; P126-H203 WeakPolarHBondContact CG-CD2 3.28Å; P126-R204 PolarHBondContact O-NH2 2.73Å; P126-V233 HydrophobicContact CB-CG2 4.03Å
127	E	91.9	Very high	92.1	Very high	108 Å²	108	33 Å²	33	51%	0.505	16%	0.163	S	C	.	.			trans	-80.8	164	-175.7	-63.3	-168.8	174.4	0	0	112.3	E125 T129 D130 Y131	E125-E127 PolarHBondContact O-N 3.5Å; E127-T129 PolarHBondContact O-N 3.23Å; E127-D130 PolarHBondContact N-OD2 3.26Å; E127-D130 WeakPolarHBondContact O-CB 3.41Å; E127-D130 PolarHBondContact O-N 3.37Å; E127-Y131 PolarHBondContact O-N 3.26Å
128	N	94.6	Very high	92.2	Very high	79 Å²	79	27.8 Å²	27.8	42%	0.422	14%	0.142	S	C	.	.	H	α-helix	trans	-65.3	-26.9	173.9	-74.5	-19.1	0	0	0	112.7	A132 L159 F163 R204	N128-A132 WeakPolarHBondContact O-CB 3.47Å; N128-A132 PolarHBondContact O-N 3.04Å; N128-L159 HydrophobicContact CB-CD2 3.82Å; N128-F163 HydrophobicContact CB-CE2 3.9Å; N128-F163 HydrophobicContact CB-CZ 3.8Å; N128-R204 PolarHBondContact OD1-NH2 3.05Å
129	T	95.1	Very high	92.1	Very high	46 Å²	46	29.3 Å²	29.3	28%	0.282	15%	0.154	S	C	.	.	H	α-helix	trans	-65.2	-44.4	173.1	-47.9	0	0	0	0	110.6	E127 Y131 A132 I133 I170	E127-T129 PolarHBondContact O-N 3.23Å; T129-Y131 VanDerWaalsContact C-N 3.33Å; T129-Y131 PolarHBondContact O-N 3.45Å; T129-A132 WeakPolarHBondContact O-CB 3.46Å; T129-A132 PolarHBondContact O-N 2.88Å; T129-I133 HydrophobicContact CG2-CD1 4.42Å; T129-I133 WeakPolarHBondContact O-CG1 3.26Å; T129-I133 PolarHBondContact O-N 3.36Å; T129-I170 HydrophobicContact CG2-CD1 4.45Å; T129-I170 HydrophobicContact CG2-CG1 4.25Å
130	D	94.9	Very high	91.9	Very high	7 Å²	7	30 Å²	30	4%	0.037	16%	0.159	C	C	.	.	H	α-helix	trans	-59.5	-45.9	177.2	-64.4	-50.2	0	0	0	110.6	E127 A132 I133 Y134 W200 S232 Y234	E127-D130 PolarHBondContact N-OD2 3.26Å; E127-D130 WeakPolarHBondContact O-CB 3.41Å; E127-D130 PolarHBondContact O-N 3.37Å; D130-A132 VanDerWaalsContact C-N 3.32Å; D130-A132 PolarHBondContact O-N 3.36Å; D130-I133 WeakPolarHBondContact O-CB 3.25Å; D130-I133 PolarHBondContact O-N 2.65Å; D130-Y134 PolarHBondContact O-N 3.31Å; D130-W200 HydrophobicContact CB-CH2 3.74Å; D130-W200 HydrophobicContact CB-CZ2 3.91Å; D130-S232 PolarHBondContact OD1-OG 3.26Å; D130-S232 VanDerWaalsContact OD1-OG 3.09Å; D130-Y234 HydrophobicContact CB-CD2 3.72Å; D130-Y234 HydrophobicContact CB-CE2 4.02Å; D130-Y234 WeakPolarHBondContact O-CE2 3.49Å
131	Y	97.2	Very high	91.6	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.016	16%	0.159	C	C	.	.	H	α-helix	trans	-65.1	-36.1	179	-169.6	-137.4	0	0	0	112.5	E127 T129 Y134 L135 N155 L159 W200 R204	E127-Y131 PolarHBondContact O-N 3.26Å; T129-Y131 VanDerWaalsContact C-N 3.33Å; T129-Y131 PolarHBondContact O-N 3.45Å; Y131-Y134 AromaticContact CD2-CD1 3.92Å; Y131-Y134 HydrophobicContact CD2-CD1 3.92Å; Y131-Y134 AromaticContact CE2-CD1 3.86Å; Y131-Y134 HydrophobicContact CE2-CD1 3.86Å; Y131-Y134 HydrophobicContact CE2-CE1 4.28Å; Y131-Y134 WeakPolarHBondContact O-CB 3.3Å; Y131-Y134 PolarHBondContact O-N 2.85Å; Y131-L135 HydrophobicContact CD1-CD1 4.05Å; Y131-L135 HydrophobicContact CD2-CD1 4.43Å; Y131-L135 HydrophobicContact CD2-CG 4.17Å; Y131-L135 HydrophobicContact CE1-CD1 3.65Å; Y131-L135 HydrophobicContact CE1-CG 4.36Å; Y131-L135 HydrophobicContact CE2-CD1 4.07Å; Y131-L135 HydrophobicContact CE2-CD2 3.93Å; Y131-L135 HydrophobicContact CE2-CG 3.86Å; Y131-L135 HydrophobicContact CG-CD1 4.41Å; Y131-L135 WeakPolarHBondContact O-CG 3.48Å; Y131-L135 PolarHBondContact O-N 3.4Å; Y131-N155 HydrophobicContact CE1-CB 3.95Å; Y131-L159 HydrophobicContact CD1-CD1 3.77Å; Y131-L159 HydrophobicContact CE1-CD1 4.39Å; Y131-L159 HydrophobicContact CG-CD1 4.47Å; Y131-W200 AromaticContact CD2-CD2 3.58Å; Y131-W200 HydrophobicContact CD2-CD2 3.58Å; Y131-W200 AromaticContact CD2-CE3 3.4Å; Y131-W200 HydrophobicContact CD2-CE3 3.4Å; Y131-W200 VanDerWaalsContact CD2-CE3 3.4Å; Y131-W200 HydrophobicContact CD2-CG 4.12Å; Y131-W200 HydrophobicContact CD2-CH2 4.25Å; Y131-W200 HydrophobicContact CD2-CZ2 4.42Å; Y131-W200 AromaticContact CD2-CZ3 3.77Å; Y131-W200 HydrophobicContact CD2-CZ3 3.77Å; Y131-W200 HydrophobicContact CE2-CB 4.3Å; Y131-W200 HydrophobicContact CE2-CD2 4.16Å; Y131-W200 HydrophobicContact CE2-CE3 4.08Å; Y131-W200 HydrophobicContact CE2-CG 4.27Å; Y131-W200 HydrophobicContact CG-CE3 4.03Å; Y131-W200 HydrophobicContact CG-CH2 4.36Å; Y131-W200 AromaticContact CG-CZ3 3.94Å; Y131-W200 HydrophobicContact CG-CZ3 3.94Å; Y131-W200 VanDerWaalsContact N-CH2 3.32Å; Y131-R204 HydrophobicContact CD1-CG 3.8Å; Y131-R204 HydrophobicContact CD2-CG 4.03Å; Y131-R204 HydrophobicContact CE1-CB 4.02Å; Y131-R204 HydrophobicContact CE1-CG 3.81Å; Y131-R204 HydrophobicContact CE2-CB 4.05Å; Y131-R204 HydrophobicContact CE2-CG 4.04Å; Y131-R204 HydrophobicContact CG-CG 3.93Å
132	A	97.3	Very high	91.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-40.9	175	0	0	0	0	0	112	N128 T129 D130 C136 L159 F163 W167 I170	N128-A132 WeakPolarHBondContact O-CB 3.47Å; N128-A132 PolarHBondContact O-N 3.04Å; T129-A132 WeakPolarHBondContact O-CB 3.46Å; T129-A132 PolarHBondContact O-N 2.88Å; D130-A132 VanDerWaalsContact C-N 3.32Å; D130-A132 PolarHBondContact O-N 3.36Å; A132-C136 WeakPolarHBondContact O-CB 3.5Å; A132-C136 PolarHBondContact O-N 3.4Å; A132-L159 HydrophobicContact CB-CB 4.19Å; A132-L159 HydrophobicContact CB-CD1 4.1Å; A132-F163 HydrophobicContact CB-CD2 4.39Å; A132-W167 HydrophobicContact CB-CZ3 4.32Å; A132-I170 HydrophobicContact CB-CD1 4.06Å; A132-I170 HydrophobicContact CB-CG2 4.01Å
133	I	96.6	Very high	91.1	Very high	4 Å²	4	37 Å²	37	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-61.2	-47.1	174.5	-64.1	162.3	0	0	0	109.9	T129 D130 C136 K137 I170 Q173 A174 Y234	T129-I133 HydrophobicContact CG2-CD1 4.42Å; T129-I133 WeakPolarHBondContact O-CG1 3.26Å; T129-I133 PolarHBondContact O-N 3.36Å; D130-I133 WeakPolarHBondContact O-CB 3.25Å; D130-I133 PolarHBondContact O-N 2.65Å; I133-C136 PolarHBondContact O-N 3.14Å; I133-K137 WeakPolarHBondContact O-CB 3.44Å; I133-K137 PolarHBondContact O-N 2.81Å; I133-I170 HydrophobicContact CG1-CG2 3.96Å; I133-Q173 HydrophobicContact CD1-CB 4.27Å; I133-Q173 HydrophobicContact CG1-CB 4.36Å; I133-Q173 HydrophobicContact CG2-CB 4.46Å; I133-A174 HydrophobicContact CG2-CB 4.23Å; I133-Y234 HydrophobicContact CB-CD2 4.28Å; I133-Y234 HydrophobicContact CB-CE2 4.45Å; I133-Y234 HydrophobicContact CD1-CD2 4.3Å; I133-Y234 HydrophobicContact CG2-CD2 4.33Å; I133-Y234 HydrophobicContact CG2-CG 4.39Å
134	Y	97	Very high	91.3	Very high	3 Å²	3	39.2 Å²	39.2	1%	0.012	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-52.4	177.9	170.4	-107.5	0	0	0	112.8	D130 Y131 K137 R138 E196 R197 W200 Y234	D130-Y134 PolarHBondContact O-N 3.31Å; Y131-Y134 AromaticContact CD2-CD1 3.92Å; Y131-Y134 HydrophobicContact CD2-CD1 3.92Å; Y131-Y134 AromaticContact CE2-CD1 3.86Å; Y131-Y134 HydrophobicContact CE2-CD1 3.86Å; Y131-Y134 HydrophobicContact CE2-CE1 4.28Å; Y131-Y134 WeakPolarHBondContact O-CB 3.3Å; Y131-Y134 PolarHBondContact O-N 2.85Å; Y134-K137 WeakPolarHBondContact O-CB 3.37Å; Y134-K137 PolarHBondContact O-N 3.01Å; Y134-R138 HydrophobicContact CE2-CG 4.3Å; Y134-R138 PolarHBondContact O-N 3.07Å; Y134-R138 VanDerWaalsContact OH-CD 3.27Å; Y134-R138 WeakPolarHBondContact OH-CD 3.24Å; Y134-R138 PolarHBondContact OH-NH1 3.35Å; Y134-R138 VanDerWaalsContact OH-NH1 3.12Å; Y134-E196 HydrophobicContact CD2-CG 3.86Å; Y134-E196 HydrophobicContact CE2-CB 4.48Å; Y134-E196 HydrophobicContact CE2-CG 3.84Å; Y134-R197 VanDerWaalsContact OH-CA 3.28Å; Y134-R197 WeakPolarHBondContact OH-CA 3.28Å; Y134-R197 WeakPolarHBondContact OH-CB 3.47Å; Y134-W200 HydrophobicContact CD1-CB 4.39Å; Y134-W200 AromaticContact CD1-CD1 3.43Å; Y134-W200 VanDerWaalsContact CD1-CD1 3.43Å; Y134-W200 HydrophobicContact CD1-CD2 4.37Å; Y134-W200 AromaticContact CD1-CG 3.81Å; Y134-W200 HydrophobicContact CD1-CG 3.81Å; Y134-W200 AromaticContact CD1-NE1 3.77Å; Y134-W200 AromaticContact CD2-CD1 3.42Å; Y134-W200 VanDerWaalsContact CD2-CD1 3.42Å; Y134-W200 AromaticContact CD2-NE1 3.51Å; Y134-W200 HydrophobicContact CE1-CB 4.07Å; Y134-W200 AromaticContact CE1-CD1 3.63Å; Y134-W200 AromaticContact CE1-CG 3.94Å; Y134-W200 HydrophobicContact CE1-CG 3.94Å; Y134-W200 AromaticContact CE2-CD1 3.61Å; Y134-W200 AromaticContact CG-CD1 3.31Å; Y134-W200 HydrophobicContact CG-CG 4.11Å; Y134-W200 AromaticContact CG-NE1 3.26Å; Y134-W200 VanDerWaalsContact CG-NE1 3.26Å; Y134-W200 AromaticContact CZ-CD1 3.71Å; Y134-Y234 WeakPolarHBondContact CB-OH 3.45Å
135	L	97.1	Very high	91.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.7	-43.4	-179.6	-68.4	179.4	0	0	0	111.3	Y131 K137 R138 T139 L148 E152 N155 L156 L159	Y131-L135 HydrophobicContact CD1-CD1 4.05Å; Y131-L135 HydrophobicContact CD2-CD1 4.43Å; Y131-L135 HydrophobicContact CD2-CG 4.17Å; Y131-L135 HydrophobicContact CE1-CD1 3.65Å; Y131-L135 HydrophobicContact CE1-CG 4.36Å; Y131-L135 HydrophobicContact CE2-CD1 4.07Å; Y131-L135 HydrophobicContact CE2-CD2 3.93Å; Y131-L135 HydrophobicContact CE2-CG 3.86Å; Y131-L135 HydrophobicContact CG-CD1 4.41Å; Y131-L135 WeakPolarHBondContact O-CG 3.48Å; Y131-L135 PolarHBondContact O-N 3.4Å; L135-K137 PolarHBondContact O-N 2.68Å; L135-R138 PolarHBondContact O-N 2.94Å; L135-T139 WeakPolarHBondContact O-CG2 3.47Å; L135-T139 PolarHBondContact O-N 3.4Å; L135-T139 VanDerWaalsContact O-N 3.14Å; L135-L148 HydrophobicContact CD2-CD2 3.83Å; L135-E152 HydrophobicContact CD2-CB 3.95Å; L135-E152 HydrophobicContact CD2-CG 4.4Å; L135-N155 HydrophobicContact CD1-CB 4.22Å; L135-L156 HydrophobicContact CB-CB 4.42Å; L135-L156 HydrophobicContact CB-CD1 3.88Å; L135-L156 HydrophobicContact CD1-CB 4.02Å; L135-L159 HydrophobicContact CD1-CD1 4.12Å
136	C	96.2	Very high	91.5	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.02	21%	0.205	C	C	.	.	H	α-helix	trans	-58.5	-48.4	174.7	-171.4	0	0	0	0	110.7	A132 I133 R138 T139 M140 W167 I170 A174	A132-C136 WeakPolarHBondContact O-CB 3.5Å; A132-C136 PolarHBondContact O-N 3.4Å; I133-C136 PolarHBondContact O-N 3.14Å; C136-R138 VanDerWaalsContact C-N 3.27Å; C136-R138 PolarHBondContact O-N 2.83Å; C136-T139 PolarHBondContact O-N 2.91Å; C136-T139 VanDerWaalsContact O-N 3.15Å; C136-T139 PolarHBondContact O-OG1 3.2Å; C136-M140 WeakPolarHBondContact O-CG 3.46Å; C136-M140 PolarHBondContact O-N 3.22Å; C136-W167 HydrophobicContact CB-CH2 4.33Å; C136-W167 HydrophobicContact CB-CZ2 4.4Å; C136-I170 HydrophobicContact CB-CG2 4.5Å; C136-A174 HydrophobicContact CB-CB 3.94Å
137	K	95.2	Very high	91.6	Very high	3 Å²	3	45 Å²	45	1%	0.013	23%	0.233	C	C	.	.	H	α-helix	trans	-54.3	-43	177	-171.3	-178.5	73.1	164.1	0	111.7	I133 Y134 L135 M140 Q141 A174 Q177 V178 D181 E196	I133-K137 WeakPolarHBondContact O-CB 3.44Å; I133-K137 PolarHBondContact O-N 2.81Å; Y134-K137 WeakPolarHBondContact O-CB 3.37Å; Y134-K137 PolarHBondContact O-N 3.01Å; L135-K137 PolarHBondContact O-N 2.68Å; K137-M140 PolarHBondContact O-N 3.08Å; K137-Q141 WeakPolarHBondContact O-CG 3.29Å; K137-A174 HydrophobicContact CB-CB 4.14Å; K137-Q177 HydrophobicContact CD-CB 3.94Å; K137-Q177 HydrophobicContact CD-CG 3.78Å; K137-V178 HydrophobicContact CG-CG2 3.57Å; K137-D181 IonicContact NZ-OD2 2.9Å; K137-D181 PolarHBondContact NZ-OD2 3.3Å; K137-D181 VanDerWaalsContact NZ-OD2 3.13Å; K137-E196 WeakPolarHBondContact CE-OE2 3.28Å; K137-E196 IonicContact NZ-OE1 3.3Å; K137-E196 PolarHBondContact NZ-OE1 3.36Å; K137-E196 IonicContact NZ-OE2 3.55Å; K137-E196 PolarHBondContact NZ-OE2 2.95Å
138	R	94.7	Very high	91.7	Very high	11 Å²	11	41.7 Å²	41.7	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-63.4	-44.5	178.2	-83	-176.1	59.5	-167.2	-7.6	113	Y134 L135 C136 M140 Q141 L146 E147 L148 E152	Y134-R138 HydrophobicContact CE2-CG 4.3Å; Y134-R138 PolarHBondContact O-N 3.07Å; Y134-R138 VanDerWaalsContact OH-CD 3.27Å; Y134-R138 WeakPolarHBondContact OH-CD 3.24Å; Y134-R138 PolarHBondContact OH-NH1 3.35Å; Y134-R138 VanDerWaalsContact OH-NH1 3.12Å; L135-R138 PolarHBondContact O-N 2.94Å; C136-R138 VanDerWaalsContact C-N 3.27Å; C136-R138 PolarHBondContact O-N 2.83Å; R138-M140 PolarHBondContact O-N 3.39Å; R138-Q141 PolarHBondContact O-N 3.49Å; R138-L146 PolarHBondContact NE-O 2.96Å; R138-L146 PolarHBondContact NH2-O 3.47Å; R138-E147 PolarHBondContact NH2-O 3.39Å; R138-L148 HydrophobicContact CB-CD2 3.92Å; R138-E152 IonicContact CZ-OE1 3.63Å; R138-E152 IonicContact CZ-OE2 3.97Å; R138-E152 VanDerWaalsContact CZ-OE2 3.28Å; R138-E152 IonicContact NH1-OE1 3.7Å; R138-E152 PolarHBondContact NH1-OE1 3.44Å; R138-E152 IonicContact NH1-OE2 3.71Å; R138-E152 PolarHBondContact NH1-OE2 2.59Å; R138-E152 IonicContact NH2-OE1 3.77Å; R138-E152 IonicContact NH2-OE2 3.63Å; R138-E152 PolarHBondContact NH2-OE2 2.95Å
139	T	93.4	Very high	91.7	Very high	62 Å²	62	39.4 Å²	39.4	38%	0.38	21%	0.211	S	C	.	.	H	α-helix	trans	-61.5	-30	178.2	63.6	0	0	0	0	112.9	L135 C136 Q141 N142 L148 L156	L135-T139 WeakPolarHBondContact O-CG2 3.47Å; L135-T139 PolarHBondContact O-N 3.4Å; L135-T139 VanDerWaalsContact O-N 3.14Å; C136-T139 PolarHBondContact O-N 2.91Å; C136-T139 VanDerWaalsContact O-N 3.15Å; C136-T139 PolarHBondContact O-OG1 3.2Å; T139-Q141 VanDerWaalsContact C-N 3.3Å; T139-Q141 PolarHBondContact O-N 2.89Å; T139-N142 PolarHBondContact O-OD1 3.43Å; T139-L148 HydrophobicContact CG2-CD1 3.55Å; T139-L148 HydrophobicContact CG2-CG 3.97Å; T139-L156 HydrophobicContact CG2-CD2 3.79Å
140	M	91.8	Very high	91.8	Very high	41 Å²	41	44.3 Å²	44.3	20%	0.202	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-12.8	-178.8	-62.5	173.2	80.9	0	0	114.2	C136 K137 R138 F171 A174 E175 V178	C136-M140 WeakPolarHBondContact O-CG 3.46Å; C136-M140 PolarHBondContact O-N 3.22Å; K137-M140 PolarHBondContact O-N 3.08Å; R138-M140 PolarHBondContact O-N 3.39Å; M140-F171 HydrophobicContact CE-CE1 4.15Å; M140-F171 HydrophobicContact CE-CE2 3.84Å; M140-F171 HydrophobicContact CE-CZ 3.61Å; M140-F171 HydrophobicContact CG-CE2 4.48Å; M140-F171 HydrophobicContact SD-CD2 4.45Å; M140-F171 HydrophobicContact SD-CE2 4.09Å; M140-F171 HydrophobicContact SD-CZ 4.45Å; M140-A174 HydrophobicContact SD-CB 4.04Å; M140-E175 HydrophobicContact CE-CB 3.73Å; M140-E175 HydrophobicContact CE-CG 3.74Å; M140-V178 HydrophobicContact CB-CG2 4.22Å; M140-V178 HydrophobicContact SD-CG2 4.49Å
141	Q	84.2	Confident	91.8	Very high	21 Å²	21	45.3 Å²	45.3	10%	0.098	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-14	-174	-66.8	-156.9	36.7	0	0	114.4	K137 R138 T139 K143 L146 V178	K137-Q141 WeakPolarHBondContact O-CG 3.29Å; R138-Q141 PolarHBondContact O-N 3.49Å; T139-Q141 VanDerWaalsContact C-N 3.3Å; T139-Q141 PolarHBondContact O-N 2.89Å; Q141-K143 VanDerWaalsContact C-N 3.33Å; Q141-K143 WeakPolarHBondContact O-CG 3.27Å; Q141-K143 PolarHBondContact O-N 2.97Å; Q141-L146 HydrophobicContact CB-CD1 3.66Å; Q141-L146 HydrophobicContact CG-CD1 3.99Å; Q141-V178 HydrophobicContact CG-CG2 4.49Å
142	N	80.9	Confident	91.8	Very high	152 Å²	152	45.2 Å²	45.2	81%	0.813	24%	0.239	S	C	*	.			trans	45.8	50.3	178.3	-64.4	-14.9	0	0	0	113.6	T139	T139-N142 PolarHBondContact O-OD1 3.43Å
143	K	84.4	Confident	91.8	Very high	60 Å²	60	47.3 Å²	47.3	26%	0.261	26%	0.256	S	S	.	.			trans	-127.7	129.8	176.9	-70.1	170.2	-162.3	149	0	109.2	Q141 R145 L146 E147	Q141-K143 VanDerWaalsContact C-N 3.33Å; Q141-K143 WeakPolarHBondContact O-CG 3.27Å; Q141-K143 PolarHBondContact O-N 2.97Å; K143-R145 VanDerWaalsContact C-N 3.26Å; K143-R145 HydrophobicContact CB-CG 4.38Å; K143-R145 PolarHBondContact O-N 3.23Å; K143-R145 VanDerWaalsContact O-N 3.14Å; K143-L146 HydrophobicContact CB-CB 4.43Å; K143-L146 HydrophobicContact CB-CD1 4.35Å; K143-L146 HydrophobicContact CB-CG 4.38Å; K143-L146 HydrophobicContact CD-CD1 4.08Å; K143-L146 WeakPolarHBondContact O-CA 3.36Å; K143-L146 PolarHBondContact O-N 3.41Å; K143-E147 PolarHBondContact O-N 3.41Å
144	A	83.1	Confident	91.9	Very high	76 Å²	76	53.9 Å²	53.9	63%	0.628	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-49.3	-43.8	178.6	0	0	0	0	0	113.6	L146 E147	A144-L146 PolarHBondContact O-N 3.31Å; A144-E147 WeakPolarHBondContact CA-OE1 3.46Å; A144-E147 WeakPolarHBondContact O-CB 3.49Å; A144-E147 PolarHBondContact O-N 2.9Å; A144-E147 VanDerWaalsContact O-N 3.13Å
145	R	81.7	Confident	91.9	Very high	112 Å²	112	55 Å²	55	42%	0.423	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-64	-11.3	177.9	77	178.3	176.7	87	3.1	115.6	K143 D193	K143-R145 VanDerWaalsContact C-N 3.26Å; K143-R145 HydrophobicContact CB-CG 4.38Å; K143-R145 PolarHBondContact O-N 3.23Å; K143-R145 VanDerWaalsContact O-N 3.14Å; R145-D193 IonicContact CZ-OD2 2.72Å; R145-D193 VanDerWaalsContact CZ-OD2 3.3Å; R145-D193 IonicContact NH1-OD2 2.69Å; R145-D193 PolarHBondContact NH1-OD2 3.5Å; R145-D193 IonicContact NH2-OD2 2.93Å; R145-D193 PolarHBondContact NH2-OD2 3.45Å
146	L	85.9	Confident	91.9	Very high	13 Å²	13	55.7 Å²	55.7	7%	0.068	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-115.9	1.3	-178.9	-64.9	179.8	0	0	0	111.8	R138 Q141 K143 A144 D193	R138-L146 PolarHBondContact NE-O 2.96Å; R138-L146 PolarHBondContact NH2-O 3.47Å; Q141-L146 HydrophobicContact CB-CD1 3.66Å; Q141-L146 HydrophobicContact CG-CD1 3.99Å; K143-L146 HydrophobicContact CB-CB 4.43Å; K143-L146 HydrophobicContact CB-CD1 4.35Å; K143-L146 HydrophobicContact CB-CG 4.38Å; K143-L146 HydrophobicContact CD-CD1 4.08Å; K143-L146 WeakPolarHBondContact O-CA 3.36Å; K143-L146 PolarHBondContact O-N 3.41Å; A144-L146 PolarHBondContact O-N 3.31Å; L146-D193 HydrophobicContact CD2-CB 4.27Å
147	E	91	Very high	92	Very high	140 Å²	140	57.3 Å²	57.3	65%	0.654	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-54.3	141.5	173.4	-76.1	172.2	-173.6	0	0	109.6	R138 K143 A144	R138-E147 PolarHBondContact NH2-O 3.39Å; K143-E147 PolarHBondContact O-N 3.41Å; A144-E147 WeakPolarHBondContact CA-OE1 3.46Å; A144-E147 WeakPolarHBondContact O-CB 3.49Å; A144-E147 PolarHBondContact O-N 2.9Å; A144-E147 VanDerWaalsContact O-N 3.13Å
148	L	94.2	Very high	92.1	Very high	38 Å²	38	63.8 Å²	63.8	20%	0.199	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-72	135.9	179.7	-62.3	-171.6	0	0	0	108.9	L135 R138 T139 E152 A153 L156	L135-L148 HydrophobicContact CD2-CD2 3.83Å; R138-L148 HydrophobicContact CB-CD2 3.92Å; T139-L148 HydrophobicContact CG2-CD1 3.55Å; T139-L148 HydrophobicContact CG2-CG 3.97Å; L148-E152 HydrophobicContact CB-CB 4.03Å; L148-E152 HydrophobicContact CD2-CB 4.29Å; L148-A153 HydrophobicContact CB-CB 4.35Å; L148-L156 HydrophobicContact CD1-CB 4.33Å; L148-L156 HydrophobicContact CD1-CD2 3.63Å
149	A	94.7	Very high	92.2	Very high	32 Å²	32	63.6 Å²	63.6	26%	0.264	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-66.5	161.3	164.3	0	0	0	0	0	110.2	Y151 E152 A153	A149-Y151 VanDerWaalsContact C-N 3.3Å; A149-Y151 HydrophobicContact CB-CD1 3.69Å; A149-Y151 HydrophobicContact CB-CE1 3.56Å; A149-Y151 PolarHBondContact O-N 2.68Å; A149-E152 HydrophobicContact CB-CG 4.22Å; A149-E152 PolarHBondContact N-OE2 3.43Å; A149-E152 WeakPolarHBondContact O-CA 3.16Å; A149-E152 WeakPolarHBondContact O-CB 3.45Å; A149-E152 PolarHBondContact O-N 2.96Å; A149-A153 PolarHBondContact O-N 3.03Å
150	D	95.9	Very high	92.4	Very high	149 Å²	149	64.4 Å²	64.4	80%	0.797	33%	0.334	S	S	*	.	H	α-helix	trans	-55	-44	-176.3	-64.8	-29.5	0	0	0	112.8	E152 A153 E154	D150-E152 VanDerWaalsContact C-N 3.31Å; D150-E152 PolarHBondContact O-N 2.98Å; D150-A153 PolarHBondContact O-N 3.21Å; D150-E154 PolarHBondContact O-N 3.21Å
151	Y	96.3	Very high	92.7	Very high	28 Å²	28	70.9 Å²	70.9	11%	0.11	36%	0.356	C	S	.	.	H	α-helix	trans	-66.3	-32.2	177.7	80.5	-85.3	0	0	0	112.7	H100 A149 N155 V206 P207	H100-Y151 PolarHBondContact ND1-OH 2.96Å; A149-Y151 VanDerWaalsContact C-N 3.3Å; A149-Y151 HydrophobicContact CB-CD1 3.69Å; A149-Y151 HydrophobicContact CB-CE1 3.56Å; A149-Y151 PolarHBondContact O-N 2.68Å; Y151-N155 WeakPolarHBondContact O-CB 3.27Å; Y151-N155 VanDerWaalsContact O-CG 3.29Å; Y151-N155 PolarHBondContact O-N 2.94Å; Y151-N155 PolarHBondContact O-ND2 3.13Å; Y151-N155 VanDerWaalsContact O-ND2 3.07Å; Y151-V206 HydrophobicContact CE1-CG1 4.43Å; Y151-V206 HydrophobicContact CE1-CG2 4Å; Y151-P207 HydrophobicContact CD2-CG 4.45Å; Y151-P207 HydrophobicContact CG-CG 4.31Å
152	E	97.3	Very high	93.3	Very high	1 Å²	1	73.3 Å²	73.3	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-71.8	-39.2	175.6	-62.2	-173.3	117.4	0	0	110.9	H100 L135 R138 L148 A149 D150 N155 L156	H100-E152 IonicContact CE1-OE1 2.67Å; H100-E152 IonicContact CE1-OE2 2.8Å; H100-E152 IonicContact NE2-OE2 3.8Å; L135-E152 HydrophobicContact CD2-CB 3.95Å; L135-E152 HydrophobicContact CD2-CG 4.4Å; R138-E152 IonicContact CZ-OE1 3.63Å; R138-E152 IonicContact CZ-OE2 3.97Å; R138-E152 VanDerWaalsContact CZ-OE2 3.28Å; R138-E152 IonicContact NH1-OE1 3.7Å; R138-E152 PolarHBondContact NH1-OE1 3.44Å; R138-E152 IonicContact NH1-OE2 3.71Å; R138-E152 PolarHBondContact NH1-OE2 2.59Å; R138-E152 IonicContact NH2-OE1 3.77Å; R138-E152 IonicContact NH2-OE2 3.63Å; R138-E152 PolarHBondContact NH2-OE2 2.95Å; L148-E152 HydrophobicContact CB-CB 4.03Å; L148-E152 HydrophobicContact CD2-CB 4.29Å; A149-E152 HydrophobicContact CB-CG 4.22Å; A149-E152 PolarHBondContact N-OE2 3.43Å; A149-E152 WeakPolarHBondContact O-CA 3.16Å; A149-E152 WeakPolarHBondContact O-CB 3.45Å; A149-E152 PolarHBondContact O-N 2.96Å; D150-E152 VanDerWaalsContact C-N 3.31Å; D150-E152 PolarHBondContact O-N 2.98Å; E152-N155 WeakPolarHBondContact O-CB 3.2Å; E152-N155 PolarHBondContact O-N 3Å; E152-L156 WeakPolarHBondContact O-CB 3.13Å; E152-L156 PolarHBondContact O-N 2.95Å
153	A	96.8	Very high	94	Very high	44 Å²	44	68.2 Å²	68.2	36%	0.364	35%	0.35	S	S	.	.	H	α-helix	trans	-65.1	-41.7	175	0	0	0	0	0	111.6	L148 A149 D150 L156 A157	L148-A153 HydrophobicContact CB-CB 4.35Å; A149-A153 PolarHBondContact O-N 3.03Å; D150-A153 PolarHBondContact O-N 3.21Å; A153-L156 PolarHBondContact O-N 3.35Å; A153-A157 PolarHBondContact O-N 3.2Å
154	E	97.2	Very high	94.6	Very high	142 Å²	142	68.7 Å²	68.7	66%	0.664	37%	0.365	S	S	*	.	H	α-helix	trans	-62.1	-44.7	173.1	-172.2	-176.2	170.1	0	0	111.5	D150 L156 A157 R158	D150-E154 PolarHBondContact O-N 3.21Å; E154-L156 PolarHBondContact O-N 3.08Å; E154-A157 PolarHBondContact O-N 3.4Å; E154-R158 PolarHBondContact O-N 3.21Å
155	N	97.1	Very high	95.2	Very high	27 Å²	27	76.8 Å²	76.8	14%	0.144	38%	0.379	C	S	.	.	H	α-helix	trans	-59.4	-45.2	174.5	-84.1	-40.7	0	0	0	111.9	Y131 L135 Y151 E152 A157 R158 L159	Y131-N155 HydrophobicContact CE1-CB 3.95Å; L135-N155 HydrophobicContact CD1-CB 4.22Å; Y151-N155 WeakPolarHBondContact O-CB 3.27Å; Y151-N155 VanDerWaalsContact O-CG 3.29Å; Y151-N155 PolarHBondContact O-N 2.94Å; Y151-N155 PolarHBondContact O-ND2 3.13Å; Y151-N155 VanDerWaalsContact O-ND2 3.07Å; E152-N155 WeakPolarHBondContact O-CB 3.2Å; E152-N155 PolarHBondContact O-N 3Å; N155-A157 PolarHBondContact O-N 3.39Å; N155-R158 WeakPolarHBondContact O-CB 3.08Å; N155-R158 PolarHBondContact O-N 2.74Å; N155-R158 PolarHBondContact OD1-NH2 3.46Å; N155-L159 WeakPolarHBondContact O-CG 3.4Å; N155-L159 PolarHBondContact O-N 2.93Å
156	L	97.6	Very high	95.8	Very high	15 Å²	15	78.1 Å²	78.1	8%	0.079	39%	0.388	C	S	.	.	H	α-helix	trans	-59	-47.4	176.1	-178.8	59.2	0	0	0	111.1	L135 T139 L148 E152 A153 E154 R158 L159 Q160 W167	L135-L156 HydrophobicContact CB-CB 4.42Å; L135-L156 HydrophobicContact CB-CD1 3.88Å; L135-L156 HydrophobicContact CD1-CB 4.02Å; T139-L156 HydrophobicContact CG2-CD2 3.79Å; L148-L156 HydrophobicContact CD1-CB 4.33Å; L148-L156 HydrophobicContact CD1-CD2 3.63Å; E152-L156 WeakPolarHBondContact O-CB 3.13Å; E152-L156 PolarHBondContact O-N 2.95Å; A153-L156 PolarHBondContact O-N 3.35Å; E154-L156 PolarHBondContact O-N 3.08Å; L156-R158 VanDerWaalsContact C-N 3.29Å; L156-R158 PolarHBondContact O-N 2.89Å; L156-L159 PolarHBondContact O-N 3.45Å; L156-L159 VanDerWaalsContact O-N 3.16Å; L156-Q160 HydrophobicContact CD1-CG 4.38Å; L156-Q160 WeakPolarHBondContact O-CB 3.2Å; L156-Q160 WeakPolarHBondContact O-CG 3.32Å; L156-Q160 PolarHBondContact O-N 3.29Å; L156-W167 HydrophobicContact CD1-CH2 3.57Å; L156-W167 HydrophobicContact CD1-CZ2 4.35Å; L156-W167 HydrophobicContact CD1-CZ3 4.43Å
157	A	97.9	Very high	96.3	Very high	37 Å²	37	80 Å²	80	31%	0.306	39%	0.394	S	S	.	.	H	α-helix	trans	-61.2	-37.3	178	0	0	0	0	0	112.3	A153 E154 N155 R161	A153-A157 PolarHBondContact O-N 3.2Å; E154-A157 PolarHBondContact O-N 3.4Å; N155-A157 PolarHBondContact O-N 3.39Å; A157-R161 PolarHBondContact O-N 3.11Å; A157-R161 PolarHBondContact O-NE 3.26Å
158	R	97.7	Very high	96.5	Very high	138 Å²	138	81 Å²	81	52%	0.521	40%	0.399	S	S	.	.	H	α-helix	trans	-66.2	-43.4	173.9	-177.7	176.8	62.9	167.7	-1.9	111.8	E154 N155 L156 R161 A162	E154-R158 PolarHBondContact O-N 3.21Å; N155-R158 WeakPolarHBondContact O-CB 3.08Å; N155-R158 PolarHBondContact O-N 2.74Å; N155-R158 PolarHBondContact OD1-NH2 3.46Å; L156-R158 VanDerWaalsContact C-N 3.29Å; L156-R158 PolarHBondContact O-N 2.89Å; R158-R161 PolarHBondContact O-N 2.97Å; R158-A162 WeakPolarHBondContact O-CB 3.44Å; R158-A162 PolarHBondContact O-N 3.25Å
159	L	97.8	Very high	96.6	Very high	7 Å²	7	85.8 Å²	85.8	4%	0.037	42%	0.419	C	S	.	.	H	α-helix	trans	-68.5	-38.7	179.5	-67.6	164.6	0	0	0	111.9	N128 Y131 A132 L135 N155 L156 R161 A162 F163	N128-L159 HydrophobicContact CB-CD2 3.82Å; Y131-L159 HydrophobicContact CD1-CD1 3.77Å; Y131-L159 HydrophobicContact CE1-CD1 4.39Å; Y131-L159 HydrophobicContact CG-CD1 4.47Å; A132-L159 HydrophobicContact CB-CB 4.19Å; A132-L159 HydrophobicContact CB-CD1 4.1Å; L135-L159 HydrophobicContact CD1-CD1 4.12Å; N155-L159 WeakPolarHBondContact O-CG 3.4Å; N155-L159 PolarHBondContact O-N 2.93Å; L156-L159 PolarHBondContact O-N 3.45Å; L156-L159 VanDerWaalsContact O-N 3.16Å; L159-R161 VanDerWaalsContact C-N 3.31Å; L159-R161 PolarHBondContact O-N 3.37Å; L159-A162 PolarHBondContact O-N 2.93Å; L159-F163 HydrophobicContact CB-CD2 4.31Å; L159-F163 HydrophobicContact CD2-CD2 4.24Å; L159-F163 HydrophobicContact CD2-CE2 3.71Å; L159-F163 WeakPolarHBondContact O-CB 3.39Å; L159-F163 WeakPolarHBondContact O-CD2 3.42Å; L159-F163 PolarHBondContact O-N 3.24Å
160	Q	97.4	Very high	96.6	Very high	79 Å²	79	84.4 Å²	84.4	37%	0.369	41%	0.407	S	S	.	.	H	α-helix	trans	-58.2	-43.6	172.7	-78.4	176.4	-20.9	0	0	111.8	L156 A164 W167	L156-Q160 HydrophobicContact CD1-CG 4.38Å; L156-Q160 WeakPolarHBondContact O-CB 3.2Å; L156-Q160 WeakPolarHBondContact O-CG 3.32Å; L156-Q160 PolarHBondContact O-N 3.29Å; Q160-A164 VanDerWaalsContact O-CA 3.28Å; Q160-A164 WeakPolarHBondContact O-CA 3.21Å; Q160-A164 PolarHBondContact O-N 2.87Å; Q160-W167 HydrophobicContact CB-CE3 4.34Å; Q160-W167 HydrophobicContact CB-CZ3 4.29Å; Q160-W167 HydrophobicContact CG-CD2 3.96Å; Q160-W167 HydrophobicContact CG-CE3 3.74Å; Q160-W167 HydrophobicContact CG-CH2 3.35Å; Q160-W167 HydrophobicContact CG-CZ2 3.53Å; Q160-W167 HydrophobicContact CG-CZ3 3.43Å; Q160-W167 VanDerWaalsContact CG-CZ3 3.43Å; Q160-W167 VanDerWaalsContact NE2-CZ2 3.3Å
161	R	97.5	Very high	96.6	Very high	177 Å²	177	81.7 Å²	81.7	67%	0.668	39%	0.388	S	S	*	.	H	α-helix	trans	-64.1	-46	173.8	-76.5	-178.8	-82.3	122.1	-9.8	111.9	A157 R158 L159 F163	A157-R161 PolarHBondContact O-N 3.11Å; A157-R161 PolarHBondContact O-NE 3.26Å; R158-R161 PolarHBondContact O-N 2.97Å; L159-R161 VanDerWaalsContact C-N 3.31Å; L159-R161 PolarHBondContact O-N 3.37Å; R161-F163 PolarHBondContact O-N 2.91Å
162	A	96.8	Very high	96.6	Very high	72 Å²	72	86.1 Å²	86.1	60%	0.595	41%	0.411	S	S	*	.	H	α-helix	trans	-66.4	-35.5	-178.8	0	0	0	0	0	113.2	R158 L159	R158-A162 WeakPolarHBondContact O-CB 3.44Å; R158-A162 PolarHBondContact O-N 3.25Å; L159-A162 PolarHBondContact O-N 2.93Å
163	F	96.9	Very high	96.5	Very high	46 Å²	46	90.2 Å²	90.2	20%	0.202	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	23.4	-175.5	-59.4	-53.3	0	0	0	113.7	N128 A132 L159 R161 R165 K166 W167 I170	N128-F163 HydrophobicContact CB-CE2 3.9Å; N128-F163 HydrophobicContact CB-CZ 3.8Å; A132-F163 HydrophobicContact CB-CD2 4.39Å; L159-F163 HydrophobicContact CB-CD2 4.31Å; L159-F163 HydrophobicContact CD2-CD2 4.24Å; L159-F163 HydrophobicContact CD2-CE2 3.71Å; L159-F163 WeakPolarHBondContact O-CB 3.39Å; L159-F163 WeakPolarHBondContact O-CD2 3.42Å; L159-F163 PolarHBondContact O-N 3.24Å; R161-F163 PolarHBondContact O-N 2.91Å; F163-R165 PolarHBondContact O-N 3.42Å; F163-K166 CarbonylContact O-C 3.51Å; F163-K166 WeakPolarHBondContact O-CA 3.35Å; F163-K166 PolarHBondContact O-N 2.82Å; F163-W167 PolarHBondContact O-N 2.72Å; F163-I170 HydrophobicContact CB-CD1 3.73Å; F163-I170 HydrophobicContact CD2-CD1 4Å; F163-I170 HydrophobicContact CG-CD1 4.05Å
164	A	96.4	Very high	96.4	Very high	69 Å²	69	88.1 Å²	88.1	57%	0.57	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-49.4	-40.7	-174	0	0	0	0	0	113.7	Q160 K166	Q160-A164 VanDerWaalsContact O-CA 3.28Å; Q160-A164 WeakPolarHBondContact O-CA 3.21Å; Q160-A164 PolarHBondContact O-N 2.87Å; A164-K166 PolarHBondContact O-N 3.39Å
165	R	95.4	Very high	96.3	Very high	246 Å²	246	84.9 Å²	84.9	93%	0.928	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-74.4	-20.7	179.1	-65.7	-177.5	177.2	172.3	-1	114.8	F163	F163-R165 PolarHBondContact O-N 3.42Å
166	K	94.4	Very high	96.2	Very high	140 Å²	140	85.8 Å²	85.8	61%	0.609	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-108.5	4	-179.9	-64.7	-175.1	178.5	-176.7	0	112.2	F163 A164 E168 F169 I170	F163-K166 CarbonylContact O-C 3.51Å; F163-K166 WeakPolarHBondContact O-CA 3.35Å; F163-K166 PolarHBondContact O-N 2.82Å; A164-K166 PolarHBondContact O-N 3.39Å; K166-E168 VanDerWaalsContact C-N 3.31Å; K166-E168 PolarHBondContact O-N 3.39Å; K166-F169 WeakPolarHBondContact O-CB 3.44Å; K166-F169 PolarHBondContact O-N 3.45Å; K166-F169 VanDerWaalsContact O-N 3.11Å; K166-I170 PolarHBondContact O-N 3.31Å
167	W	96.3	Very high	96	Very high	52 Å²	52	87.7 Å²	87.7	20%	0.197	42%	0.418	C	S	.	.	H	α-helix	trans	-62.3	-37.3	-170.8	-171.6	-103.2	0	0	0	112.9	A132 C136 L156 Q160 F163 F169 I170 F171	A132-W167 HydrophobicContact CB-CZ3 4.32Å; C136-W167 HydrophobicContact CB-CH2 4.33Å; C136-W167 HydrophobicContact CB-CZ2 4.4Å; L156-W167 HydrophobicContact CD1-CH2 3.57Å; L156-W167 HydrophobicContact CD1-CZ2 4.35Å; L156-W167 HydrophobicContact CD1-CZ3 4.43Å; Q160-W167 HydrophobicContact CB-CE3 4.34Å; Q160-W167 HydrophobicContact CB-CZ3 4.29Å; Q160-W167 HydrophobicContact CG-CD2 3.96Å; Q160-W167 HydrophobicContact CG-CE3 3.74Å; Q160-W167 HydrophobicContact CG-CH2 3.35Å; Q160-W167 HydrophobicContact CG-CZ2 3.53Å; Q160-W167 HydrophobicContact CG-CZ3 3.43Å; Q160-W167 VanDerWaalsContact CG-CZ3 3.43Å; Q160-W167 VanDerWaalsContact NE2-CZ2 3.3Å; F163-W167 PolarHBondContact O-N 2.72Å; W167-F169 VanDerWaalsContact C-N 3.28Å; W167-F169 PolarHBondContact O-N 3.37Å; W167-I170 HydrophobicContact CE3-CB 4.48Å; W167-I170 HydrophobicContact CE3-CD1 4.1Å; W167-I170 HydrophobicContact CE3-CG2 4.39Å; W167-I170 HydrophobicContact CH2-CG2 4.34Å; W167-I170 HydrophobicContact CZ3-CD1 4.33Å; W167-I170 HydrophobicContact CZ3-CG2 4.11Å; W167-I170 PolarHBondContact O-N 3.24Å; W167-F171 WeakPolarHBondContact O-CB 3.35Å; W167-F171 PolarHBondContact O-N 3.04Å
168	E	95.7	Very high	95.7	Very high	162 Å²	162	86.2 Å²	86.2	76%	0.757	41%	0.405	S	S	*	.	H	α-helix	trans	-59.4	-38.7	176.2	-66.5	-173.5	165.8	0	0	112.4	K166 F171 M172	K166-E168 VanDerWaalsContact C-N 3.31Å; K166-E168 PolarHBondContact O-N 3.39Å; E168-F171 PolarHBondContact O-N 3.01Å; E168-M172 WeakPolarHBondContact O-CB 3.43Å; E168-M172 PolarHBondContact O-N 3.09Å
169	F	95.1	Very high	95.5	Very high	138 Å²	138	85 Å²	85	61%	0.605	40%	0.403	S	S	*	.	H	α-helix	trans	-68	-42.3	176	-63.4	-73	0	0	0	111.9	K166 W167 F171 M172 Q173	K166-F169 WeakPolarHBondContact O-CB 3.44Å; K166-F169 PolarHBondContact O-N 3.45Å; K166-F169 VanDerWaalsContact O-N 3.11Å; W167-F169 VanDerWaalsContact C-N 3.28Å; W167-F169 PolarHBondContact O-N 3.37Å; F169-F171 VanDerWaalsContact C-N 3.32Å; F169-F171 PolarHBondContact O-N 2.99Å; F169-M172 PolarHBondContact O-N 3.39Å; F169-Q173 WeakPolarHBondContact O-CG 3.34Å; F169-Q173 PolarHBondContact O-N 3.47Å
170	I	95.3	Very high	95.2	Very high	3 Å²	3	88.6 Å²	88.6	2%	0.015	42%	0.422	C	S	.	.	H	α-helix	trans	-60.1	-45.5	175.6	-67.4	171.2	0	0	0	110.1	T129 A132 I133 C136 F163 K166 W167 Q173 A174	T129-I170 HydrophobicContact CG2-CD1 4.45Å; T129-I170 HydrophobicContact CG2-CG1 4.25Å; A132-I170 HydrophobicContact CB-CD1 4.06Å; A132-I170 HydrophobicContact CB-CG2 4.01Å; I133-I170 HydrophobicContact CG1-CG2 3.96Å; C136-I170 HydrophobicContact CB-CG2 4.5Å; F163-I170 HydrophobicContact CB-CD1 3.73Å; F163-I170 HydrophobicContact CD2-CD1 4Å; F163-I170 HydrophobicContact CG-CD1 4.05Å; K166-I170 PolarHBondContact O-N 3.31Å; W167-I170 HydrophobicContact CE3-CB 4.48Å; W167-I170 HydrophobicContact CE3-CD1 4.1Å; W167-I170 HydrophobicContact CE3-CG2 4.39Å; W167-I170 HydrophobicContact CH2-CG2 4.34Å; W167-I170 HydrophobicContact CZ3-CD1 4.33Å; W167-I170 HydrophobicContact CZ3-CG2 4.11Å; W167-I170 PolarHBondContact O-N 3.24Å; I170-Q173 PolarHBondContact O-N 3.3Å; I170-A174 WeakPolarHBondContact O-CB 3.32Å; I170-A174 PolarHBondContact O-N 2.8Å
171	F	96.4	Very high	94.8	Very high	93 Å²	93	85.4 Å²	85.4	41%	0.408	41%	0.407	S	S	.	.	H	α-helix	trans	-62.5	-45	177.7	-175.8	-90.4	0	0	0	111.8	M140 W167 E168 F169 Q173 A174 E175	M140-F171 HydrophobicContact CE-CE1 4.15Å; M140-F171 HydrophobicContact CE-CE2 3.84Å; M140-F171 HydrophobicContact CE-CZ 3.61Å; M140-F171 HydrophobicContact CG-CE2 4.48Å; M140-F171 HydrophobicContact SD-CD2 4.45Å; M140-F171 HydrophobicContact SD-CE2 4.09Å; M140-F171 HydrophobicContact SD-CZ 4.45Å; W167-F171 WeakPolarHBondContact O-CB 3.35Å; W167-F171 PolarHBondContact O-N 3.04Å; E168-F171 PolarHBondContact O-N 3.01Å; F169-F171 VanDerWaalsContact C-N 3.32Å; F169-F171 PolarHBondContact O-N 2.99Å; F171-Q173 PolarHBondContact O-N 3.48Å; F171-A174 PolarHBondContact O-N 3.16Å; F171-E175 WeakPolarHBondContact O-CB 3.47Å; F171-E175 PolarHBondContact O-N 3.48Å
172	M	94.8	Very high	94.4	Very high	121 Å²	121	84.9 Å²	84.9	60%	0.596	41%	0.406	S	S	*	.	H	α-helix	trans	-62.2	-42.3	178.2	-170.6	-177.9	-61.5	0	0	112	E168 F169 E175 A176	E168-M172 WeakPolarHBondContact O-CB 3.43Å; E168-M172 PolarHBondContact O-N 3.09Å; F169-M172 PolarHBondContact O-N 3.39Å; M172-E175 PolarHBondContact O-N 3.32Å; M172-A176 WeakPolarHBondContact O-CB 3.31Å; M172-A176 PolarHBondContact O-N 3.03Å
173	Q	95.6	Very high	94.2	Very high	87 Å²	87	89.9 Å²	89.9	41%	0.407	41%	0.414	S	S	.	.	H	α-helix	trans	-64.9	-44.2	175.2	-75.9	-174.6	-34	0	0	111.9	I133 F169 I170 F171 E175 A176 Q177	I133-Q173 HydrophobicContact CD1-CB 4.27Å; I133-Q173 HydrophobicContact CG1-CB 4.36Å; I133-Q173 HydrophobicContact CG2-CB 4.46Å; F169-Q173 WeakPolarHBondContact O-CG 3.34Å; F169-Q173 PolarHBondContact O-N 3.47Å; I170-Q173 PolarHBondContact O-N 3.3Å; F171-Q173 PolarHBondContact O-N 3.48Å; Q173-E175 VanDerWaalsContact C-N 3.33Å; Q173-E175 PolarHBondContact O-N 3.3Å; Q173-A176 PolarHBondContact O-N 3.2Å; Q173-Q177 PolarHBondContact O-N 3.13Å
174	A	95.1	Very high	94	Very high	0 Å²	0	91 Å²	91	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-59.6	-44	175.1	0	0	0	0	0	111.5	I133 C136 K137 M140 I170 F171 Q177 V178	I133-A174 HydrophobicContact CG2-CB 4.23Å; C136-A174 HydrophobicContact CB-CB 3.94Å; K137-A174 HydrophobicContact CB-CB 4.14Å; M140-A174 HydrophobicContact SD-CB 4.04Å; I170-A174 WeakPolarHBondContact O-CB 3.32Å; I170-A174 PolarHBondContact O-N 2.8Å; F171-A174 PolarHBondContact O-N 3.16Å; A174-Q177 PolarHBondContact O-N 3.39Å; A174-V178 WeakPolarHBondContact O-CG2 3.36Å; A174-V178 PolarHBondContact O-N 3.49Å
175	E	95.1	Very high	93.9	Very high	73 Å²	73	91.9 Å²	91.9	34%	0.341	41%	0.414	S	S	.	.	H	α-helix	trans	-62.4	-45.6	177.6	-162.2	-163	-152.8	0	0	112.2	M140 F171 M172 Q173 Q177 V178 K179	M140-E175 HydrophobicContact CE-CB 3.73Å; M140-E175 HydrophobicContact CE-CG 3.74Å; F171-E175 WeakPolarHBondContact O-CB 3.47Å; F171-E175 PolarHBondContact O-N 3.48Å; M172-E175 PolarHBondContact O-N 3.32Å; Q173-E175 VanDerWaalsContact C-N 3.33Å; Q173-E175 PolarHBondContact O-N 3.3Å; E175-Q177 PolarHBondContact O-N 3.07Å; E175-V178 PolarHBondContact O-N 2.97Å; E175-K179 WeakPolarHBondContact O-CG 3.49Å; E175-K179 PolarHBondContact O-N 2.85Å; E175-K179 IonicContact OE1-NZ 2.84Å; E175-K179 IonicContact OE2-NZ 2.66Å; E175-K179 PolarHBondContact OE2-NZ 3.49Å
176	A	95	Very high	93.6	Very high	47 Å²	47	87.1 Å²	87.1	39%	0.388	40%	0.4	S	S	.	.	H	α-helix	trans	-56.8	-41.7	175.7	0	0	0	0	0	110.9	M172 Q173 K179 I180	M172-A176 WeakPolarHBondContact O-CB 3.31Å; M172-A176 PolarHBondContact O-N 3.03Å; Q173-A176 PolarHBondContact O-N 3.2Å; A176-K179 WeakPolarHBondContact O-CB 3.14Å; A176-K179 PolarHBondContact O-N 2.74Å; A176-I180 WeakPolarHBondContact O-CG1 3.49Å; A176-I180 PolarHBondContact O-N 3.41Å; A176-I180 VanDerWaalsContact O-N 3.1Å
177	Q	92.4	Very high	93.2	Very high	54 Å²	54	83.9 Å²	83.9	25%	0.252	39%	0.392	S	S	.	.	H	α-helix	trans	-71.6	-37	178.8	-163	50.4	28.2	0	0	113	K137 Q173 A174 E175 K179 I180 D181	K137-Q177 HydrophobicContact CD-CB 3.94Å; K137-Q177 HydrophobicContact CD-CG 3.78Å; Q173-Q177 PolarHBondContact O-N 3.13Å; A174-Q177 PolarHBondContact O-N 3.39Å; E175-Q177 PolarHBondContact O-N 3.07Å; Q177-K179 VanDerWaalsContact C-N 3.27Å; Q177-K179 PolarHBondContact O-N 2.94Å; Q177-I180 PolarHBondContact O-N 3.16Å; Q177-I180 VanDerWaalsContact OE1-CD1 3.31Å; Q177-D181 PolarHBondContact NE2-OD1 3.21Å; Q177-D181 VanDerWaalsContact NE2-OD1 3.13Å; Q177-D181 WeakPolarHBondContact O-CB 3.39Å; Q177-D181 VanDerWaalsContact O-CG 3.22Å; Q177-D181 PolarHBondContact O-N 3.11Å
178	V	92.6	Very high	92.9	Very high	7 Å²	7	84.9 Å²	84.9	4%	0.042	40%	0.399	C	S	.	.	H	α-helix	trans	-58.4	-40.7	169.5	174.5	0	0	0	0	111.2	K137 M140 Q141 A174 E175 I180 D181 R182	K137-V178 HydrophobicContact CG-CG2 3.57Å; M140-V178 HydrophobicContact CB-CG2 4.22Å; M140-V178 HydrophobicContact SD-CG2 4.49Å; Q141-V178 HydrophobicContact CG-CG2 4.49Å; A174-V178 WeakPolarHBondContact O-CG2 3.36Å; A174-V178 PolarHBondContact O-N 3.49Å; E175-V178 PolarHBondContact O-N 2.97Å; V178-I180 VanDerWaalsContact C-N 3.33Å; V178-I180 PolarHBondContact O-N 3.07Å; V178-D181 PolarHBondContact O-N 2.64Å; V178-R182 HydrophobicContact CG1-CG 4.31Å; V178-R182 WeakPolarHBondContact O-CB 3.5Å; V178-R182 VanDerWaalsContact O-CG 3.27Å; V178-R182 WeakPolarHBondContact O-CG 3.45Å; V178-R182 PolarHBondContact O-N 2.82Å
179	K	93.4	Very high	92.7	Very high	111 Å²	111	79.5 Å²	79.5	48%	0.483	37%	0.371	S	S	.	.	H	α-helix	trans	-63.3	-39.5	178.1	-71.6	168.7	-176.3	161.3	0	111.4	E175 A176 Q177	E175-K179 WeakPolarHBondContact O-CG 3.49Å; E175-K179 PolarHBondContact O-N 2.85Å; E175-K179 IonicContact OE1-NZ 2.84Å; E175-K179 IonicContact OE2-NZ 2.66Å; E175-K179 PolarHBondContact OE2-NZ 3.49Å; A176-K179 WeakPolarHBondContact O-CB 3.14Å; A176-K179 PolarHBondContact O-N 2.74Å; Q177-K179 VanDerWaalsContact C-N 3.27Å; Q177-K179 PolarHBondContact O-N 2.94Å
180	I	91.1	Very high	92.5	Very high	83 Å²	83	76.5 Å²	76.5	43%	0.426	36%	0.358	S	S	.	.	H	α-helix	trans	-66.2	-49.4	174.6	-68.2	164.1	0	0	0	110.3	A176 Q177 V178 R182 K183	A176-I180 WeakPolarHBondContact O-CG1 3.49Å; A176-I180 PolarHBondContact O-N 3.41Å; A176-I180 VanDerWaalsContact O-N 3.1Å; Q177-I180 PolarHBondContact O-N 3.16Å; Q177-I180 VanDerWaalsContact OE1-CD1 3.31Å; V178-I180 VanDerWaalsContact C-N 3.33Å; V178-I180 PolarHBondContact O-N 3.07Å; I180-R182 PolarHBondContact O-N 3.41Å; I180-K183 WeakPolarHBondContact O-CB 3.5Å; I180-K183 PolarHBondContact O-N 2.96Å
181	D	89.3	Confident	92.3	Very high	12 Å²	12	78 Å²	78	6%	0.064	37%	0.365	C	S	.	.	H	α-helix	trans	-62.2	-30.6	-178.3	-66.3	-14.2	0	0	0	111.8	K137 Q177 V178 K183 K184 R189	K137-D181 IonicContact NZ-OD2 2.9Å; K137-D181 PolarHBondContact NZ-OD2 3.3Å; K137-D181 VanDerWaalsContact NZ-OD2 3.13Å; Q177-D181 PolarHBondContact NE2-OD1 3.21Å; Q177-D181 VanDerWaalsContact NE2-OD1 3.13Å; Q177-D181 WeakPolarHBondContact O-CB 3.39Å; Q177-D181 VanDerWaalsContact O-CG 3.22Å; Q177-D181 PolarHBondContact O-N 3.11Å; V178-D181 PolarHBondContact O-N 2.64Å; D181-K183 VanDerWaalsContact C-N 3.28Å; D181-K183 PolarHBondContact O-N 3.43Å; D181-K184 PolarHBondContact O-N 2.69Å; D181-R189 WeakPolarHBondContact O-CD 3.31Å
182	R	89.8	Confident	92.1	Very high	167 Å²	167	76.3 Å²	76.3	63%	0.63	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-21.1	175.3	-78.4	176.6	-177.4	-170.2	3.3	114.2	V178 I180 K184	V178-R182 HydrophobicContact CG1-CG 4.31Å; V178-R182 WeakPolarHBondContact O-CB 3.5Å; V178-R182 VanDerWaalsContact O-CG 3.27Å; V178-R182 WeakPolarHBondContact O-CG 3.45Å; V178-R182 PolarHBondContact O-N 2.82Å; I180-R182 PolarHBondContact O-N 3.41Å; R182-K184 VanDerWaalsContact C-N 3.32Å
183	K	92.8	Very high	92	Very high	177 Å²	177	71 Å²	71	77%	0.77	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-20.5	176.6	-64.4	178.3	-179.1	-180	0	112.7	I180 D181	I180-K183 WeakPolarHBondContact O-CB 3.5Å; I180-K183 PolarHBondContact O-N 2.96Å; D181-K183 VanDerWaalsContact C-N 3.28Å; D181-K183 PolarHBondContact O-N 3.43Å
184	K	91.9	Very high	92	Very high	68 Å²	68	67.6 Å²	67.6	30%	0.296	32%	0.32	S	S	.	.	S	Bend	trans	-77.5	153.8	178	-65.3	176.6	169.3	-85.2	0	111.2	D181 R182 E188 R189 L192	D181-K184 PolarHBondContact O-N 2.69Å; R182-K184 VanDerWaalsContact C-N 3.32Å; K184-E188 IonicContact NZ-OE1 3.46Å; K184-E188 PolarHBondContact NZ-OE1 3.03Å; K184-R189 HydrophobicContact CB-CB 4.38Å; K184-L192 HydrophobicContact CD-CD1 3.46Å; K184-L192 VanDerWaalsContact CD-CD1 3.46Å
185	D	93.4	Very high	92.1	Very high	88 Å²	88	68.9 Å²	68.9	47%	0.471	33%	0.327	S	S	.	.			trans	-67	160.8	176.6	83.1	76.8	0	0	0	111.5	T187 E188 R189	D185-T187 PolarHBondContact O-N 3.39Å; D185-T187 VanDerWaalsContact OD1-CA 3.32Å; D185-T187 WeakPolarHBondContact OD1-CA 3.3Å; D185-T187 WeakPolarHBondContact OD1-CB 3.32Å; D185-T187 PolarHBondContact OD1-N 3.32Å; D185-E188 PolarHBondContact O-N 2.8Å; D185-E188 PolarHBondContact OD1-N 3.03Å; D185-E188 WeakPolarHBondContact OD2-CB 3.38Å; D185-R189 VanDerWaalsContact O-CB 3.27Å; D185-R189 WeakPolarHBondContact O-CB 3.37Å; D185-R189 PolarHBondContact O-N 3.1Å
186	K	88.9	Confident	92.1	Very high	147 Å²	147	66.2 Å²	66.2	64%	0.639	31%	0.314	S	S	*	.	H	α-helix	trans	-61.3	-32.8	-173.9	-176.2	178	179.6	178.5	0	112.9	K190	K186-K190 WeakPolarHBondContact O-CG 3.32Å; K186-K190 PolarHBondContact O-N 3.24Å
187	T	87.9	Confident	92.2	Very high	71 Å²	71	65.2 Å²	65.2	44%	0.436	30%	0.3	S	S	.	.	H	α-helix	trans	-78.4	-51.1	-177	-50.9	0	0	0	0	110	P57 D185 R189 K190 I191	P57-T187 HydrophobicContact CB-CG2 4.18Å; P57-T187 HydrophobicContact CG-CG2 3.6Å; D185-T187 PolarHBondContact O-N 3.39Å; D185-T187 VanDerWaalsContact OD1-CA 3.32Å; D185-T187 WeakPolarHBondContact OD1-CA 3.3Å; D185-T187 WeakPolarHBondContact OD1-CB 3.32Å; D185-T187 PolarHBondContact OD1-N 3.32Å; T187-R189 PolarHBondContact O-N 3.19Å; T187-K190 WeakPolarHBondContact O-CB 3.34Å; T187-K190 PolarHBondContact O-N 2.86Å; T187-K190 VanDerWaalsContact O-N 3.17Å; T187-I191 PolarHBondContact O-N 2.9Å
188	E	89.8	Confident	92.5	Very high	74 Å²	74	62.7 Å²	62.7	35%	0.346	29%	0.288	S	S	.	.	H	α-helix	trans	-57.5	-48.2	176.8	-173.4	-164.4	172.5	0	0	111.1	K184 D185 K190 I191 L192	K184-E188 IonicContact NZ-OE1 3.46Å; K184-E188 PolarHBondContact NZ-OE1 3.03Å; D185-E188 PolarHBondContact O-N 2.8Å; D185-E188 PolarHBondContact OD1-N 3.03Å; D185-E188 WeakPolarHBondContact OD2-CB 3.38Å; E188-K190 VanDerWaalsContact C-N 3.29Å; E188-K190 PolarHBondContact O-N 2.83Å; E188-I191 PolarHBondContact O-N 2.66Å; E188-I191 VanDerWaalsContact O-N 3.09Å; E188-L192 HydrophobicContact CG-CD1 3.94Å; E188-L192 PolarHBondContact O-N 3.19Å
189	R	91.5	Very high	92.7	Very high	48 Å²	48	62.4 Å²	62.4	18%	0.181	29%	0.287	C	S	.	.	H	α-helix	trans	-57.3	-40.8	177.1	179.1	176.6	52.7	-170.1	-9.7	112.5	D181 K184 D185 T187 I191 L192 D193	D181-R189 WeakPolarHBondContact O-CD 3.31Å; K184-R189 HydrophobicContact CB-CB 4.38Å; D185-R189 VanDerWaalsContact O-CB 3.27Å; D185-R189 WeakPolarHBondContact O-CB 3.37Å; D185-R189 PolarHBondContact O-N 3.1Å; T187-R189 PolarHBondContact O-N 3.19Å; R189-I191 VanDerWaalsContact C-N 3.31Å; R189-I191 PolarHBondContact O-N 3.42Å; R189-L192 PolarHBondContact O-N 3.15Å; R189-D193 WeakPolarHBondContact O-CB 3.47Å; R189-D193 PolarHBondContact O-N 2.84Å
190	K	89.7	Confident	92.9	Very high	75 Å²	75	57.2 Å²	57.2	33%	0.326	26%	0.264	S	S	.	.	H	α-helix	trans	-63.4	-37.7	178.2	-84.1	-178.9	174.1	-165.6	0	112.3	K186 T187 E188 S194	K186-K190 WeakPolarHBondContact O-CG 3.32Å; K186-K190 PolarHBondContact O-N 3.24Å; T187-K190 WeakPolarHBondContact O-CB 3.34Å; T187-K190 PolarHBondContact O-N 2.86Å; T187-K190 VanDerWaalsContact O-N 3.17Å; E188-K190 VanDerWaalsContact C-N 3.29Å; E188-K190 PolarHBondContact O-N 2.83Å; K190-S194 PolarHBondContact O-N 3.28Å; K190-S194 PolarHBondContact O-OG 3.06Å
191	I	91.3	Very high	93.3	Very high	34 Å²	34	53.5 Å²	53.5	17%	0.174	25%	0.245	C	C	.	.	H	α-helix	trans	-69.3	-49	178.6	-62.9	173.7	0	0	0	109.3	P57 T187 E188 R189 D193 S194 Q195	P57-I191 HydrophobicContact CG-CD1 3.9Å; P57-I191 HydrophobicContact CG-CG1 4.2Å; T187-I191 PolarHBondContact O-N 2.9Å; E188-I191 PolarHBondContact O-N 2.66Å; E188-I191 VanDerWaalsContact O-N 3.09Å; R189-I191 VanDerWaalsContact C-N 3.31Å; R189-I191 PolarHBondContact O-N 3.42Å; I191-D193 PolarHBondContact O-N 3.04Å; I191-S194 PolarHBondContact O-N 3.15Å; I191-S194 VanDerWaalsContact O-N 3.07Å; I191-S194 PolarHBondContact O-OG 3.39Å; I191-Q195 HydrophobicContact CG2-CG 4.39Å; I191-Q195 WeakPolarHBondContact O-CG 3.21Å; I191-Q195 PolarHBondContact O-N 3.39Å
192	L	92.8	Very high	93.6	Very high	58 Å²	58	53.3 Å²	53.3	30%	0.304	24%	0.244	S	C	.	.	H	α-helix	trans	-60.6	-44.7	179	-70.3	168.4	0	0	0	112.3	K184 E188 R189 S194 Q195 E196	K184-L192 HydrophobicContact CD-CD1 3.46Å; K184-L192 VanDerWaalsContact CD-CD1 3.46Å; E188-L192 HydrophobicContact CG-CD1 3.94Å; E188-L192 PolarHBondContact O-N 3.19Å; R189-L192 PolarHBondContact O-N 3.15Å; L192-S194 PolarHBondContact O-N 3.39Å; L192-Q195 PolarHBondContact O-N 2.86Å; L192-E196 WeakPolarHBondContact O-CB 3.46Å; L192-E196 PolarHBondContact O-N 3.37Å
193	D	93	Very high	93.9	Very high	10 Å²	10	46.1 Å²	46.1	5%	0.053	22%	0.218	C	C	.	.	H	α-helix	trans	-55.9	-40.6	174.5	-67.9	-23	0	0	0	111.1	R145 L146 R189 I191 R197	R145-D193 IonicContact CZ-OD2 2.72Å; R145-D193 VanDerWaalsContact CZ-OD2 3.3Å; R145-D193 IonicContact NH1-OD2 2.69Å; R145-D193 PolarHBondContact NH1-OD2 3.5Å; R145-D193 IonicContact NH2-OD2 2.93Å; R145-D193 PolarHBondContact NH2-OD2 3.45Å; L146-D193 HydrophobicContact CD2-CB 4.27Å; R189-D193 WeakPolarHBondContact O-CB 3.47Å; R189-D193 PolarHBondContact O-N 2.84Å; I191-D193 PolarHBondContact O-N 3.04Å; D193-R197 WeakPolarHBondContact O-CB 3.33Å; D193-R197 PolarHBondContact O-N 3.22Å
194	S	94.9	Very high	94.1	Very high	15 Å²	15	40.2 Å²	40.2	11%	0.105	19%	0.191	C	C	.	.	H	α-helix	trans	-74.5	-34.1	-179.6	70.7	0	0	0	0	113.5	F95 K190 I191 L192 A198	F95-S194 WeakPolarHBondContact CE2-O 3.37Å; K190-S194 PolarHBondContact O-N 3.28Å; K190-S194 PolarHBondContact O-OG 3.06Å; I191-S194 PolarHBondContact O-N 3.15Å; I191-S194 VanDerWaalsContact O-N 3.07Å; I191-S194 PolarHBondContact O-OG 3.39Å; L192-S194 PolarHBondContact O-N 3.39Å; S194-A198 WeakPolarHBondContact O-CB 3.43Å; S194-A198 PolarHBondContact O-N 3.09Å
195	Q	96.6	Very high	94.3	Very high	28 Å²	28	38.5 Å²	38.5	13%	0.131	19%	0.186	C	C	.	.	H	α-helix	trans	-68.8	-43.5	175.6	-77	179.1	-28	0	0	111.6	F95 Q114 F118 I191 L192 A198 F199	F95-Q195 HydrophobicContact CE1-CG 4.17Å; F95-Q195 HydrophobicContact CZ-CB 4.45Å; F95-Q195 HydrophobicContact CZ-CG 3.84Å; Q114-Q195 PolarHBondContact NE2-O 3.1Å; Q114-Q195 VanDerWaalsContact OE1-CB 3.29Å; F118-Q195 HydrophobicContact CD2-CB 4.26Å; F118-Q195 HydrophobicContact CE2-CB 4.13Å; I191-Q195 HydrophobicContact CG2-CG 4.39Å; I191-Q195 WeakPolarHBondContact O-CG 3.21Å; I191-Q195 PolarHBondContact O-N 3.39Å; L192-Q195 PolarHBondContact O-N 2.86Å; Q195-A198 PolarHBondContact O-N 3.24Å; Q195-F199 PolarHBondContact O-N 3.43Å
196	E	96.3	Very high	94.5	Very high	17 Å²	17	35.7 Å²	35.7	8%	0.079	17%	0.173	C	C	.	.	H	α-helix	trans	-66.1	-38.8	175.2	-170.8	-175.9	-144.9	0	0	111.4	F118 Y134 K137 L192 F199 W200 Y234	F118-E196 HydrophobicContact CZ-CB 4.46Å; Y134-E196 HydrophobicContact CD2-CG 3.86Å; Y134-E196 HydrophobicContact CE2-CB 4.48Å; Y134-E196 HydrophobicContact CE2-CG 3.84Å; K137-E196 WeakPolarHBondContact CE-OE2 3.28Å; K137-E196 IonicContact NZ-OE1 3.3Å; K137-E196 PolarHBondContact NZ-OE1 3.36Å; K137-E196 IonicContact NZ-OE2 3.55Å; K137-E196 PolarHBondContact NZ-OE2 2.95Å; L192-E196 WeakPolarHBondContact O-CB 3.46Å; L192-E196 PolarHBondContact O-N 3.37Å; E196-F199 WeakPolarHBondContact O-CB 3.43Å; E196-F199 PolarHBondContact O-N 3.48Å; E196-W200 PolarHBondContact O-N 3Å; E196-W200 VanDerWaalsContact O-N 3.16Å; E196-Y234 WeakPolarHBondContact OE1-CE1 3.45Å; E196-Y234 PolarHBondContact OE1-OH 2.69Å
197	R	97.1	Very high	94.8	Very high	26 Å²	26	33.4 Å²	33.4	10%	0.098	17%	0.172	C	C	.	.	H	α-helix	trans	-57	-51.7	170.3	-179	-174.9	62.4	81.6	-14.7	111.4	P96 I97 D99 Y134 D193 F199 W200 D201	P96-R197 PolarHBondContact O-NH2 3.12Å; I97-R197 VanDerWaalsContact C-NH2 3.34Å; I97-R197 PolarHBondContact O-NH2 2.86Å; D99-R197 PolarHBondContact O-NH1 3.17Å; D99-R197 PolarHBondContact O-NH2 3.35Å; Y134-R197 VanDerWaalsContact OH-CA 3.28Å; Y134-R197 WeakPolarHBondContact OH-CA 3.28Å; Y134-R197 WeakPolarHBondContact OH-CB 3.47Å; D193-R197 WeakPolarHBondContact O-CB 3.33Å; D193-R197 PolarHBondContact O-N 3.22Å; R197-F199 VanDerWaalsContact C-N 3.27Å; R197-F199 PolarHBondContact O-N 3.43Å; R197-W200 CarbonylContact O-C 3.45Å; R197-W200 WeakPolarHBondContact O-CA 3.47Å; R197-W200 PolarHBondContact O-N 3.17Å; R197-D201 IonicContact CZ-OD2 3.2Å; R197-D201 IonicContact NH1-OD2 2.7Å; R197-D201 PolarHBondContact NH1-OD2 2.91Å; R197-D201 VanDerWaalsContact O-CG 3.3Å; R197-D201 PolarHBondContact O-N 2.95Å
198	A	97.9	Very high	95.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-33.6	-179.4	0	0	0	0	0	113.2	F95 S194 Q195 W200 D201 V202	F95-A198 HydrophobicContact CB-CB 3.62Å; F95-A198 HydrophobicContact CD1-CB 3.38Å; F95-A198 HydrophobicContact CD2-CB 3.57Å; F95-A198 HydrophobicContact CE1-CB 3.83Å; F95-A198 HydrophobicContact CE2-CB 4Å; F95-A198 HydrophobicContact CG-CB 3.23Å; F95-A198 HydrophobicContact CZ-CB 4.12Å; S194-A198 WeakPolarHBondContact O-CB 3.43Å; S194-A198 PolarHBondContact O-N 3.09Å; Q195-A198 PolarHBondContact O-N 3.24Å; A198-W200 VanDerWaalsContact C-N 3.34Å; A198-D201 PolarHBondContact O-N 2.98Å; A198-V202 PolarHBondContact O-N 3.27Å
199	F	97.9	Very high	95.4	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.009	20%	0.195	C	C	.	.	H	α-helix	trans	-59.9	-45.2	171	169.7	-91.9	0	0	0	111.5	F118 W124 P126 Q195 E196 R197 V202 H203 V233	F118-F199 HydrophobicContact CB-CB 4.31Å; F118-F199 HydrophobicContact CB-CD2 4.04Å; F118-F199 HydrophobicContact CD1-CB 3.78Å; F118-F199 HydrophobicContact CD1-CD1 4.49Å; F118-F199 AromaticContact CD1-CD2 3.47Å; F118-F199 HydrophobicContact CD1-CD2 3.47Å; F118-F199 VanDerWaalsContact CD1-CD2 3.47Å; F118-F199 HydrophobicContact CD1-CE2 4.16Å; F118-F199 AromaticContact CD1-CG 3.65Å; F118-F199 HydrophobicContact CD1-CG 3.65Å; F118-F199 HydrophobicContact CE1-CB 4.24Å; F118-F199 HydrophobicContact CE1-CD2 4.3Å; F118-F199 HydrophobicContact CE1-CG 4.13Å; F118-F199 HydrophobicContact CG-CB 4.06Å; F118-F199 HydrophobicContact CG-CD2 4.12Å; F118-F199 HydrophobicContact CG-CG 4.34Å; W124-F199 HydrophobicContact CB-CE2 4Å; W124-F199 HydrophobicContact CB-CZ 4.24Å; W124-F199 AromaticContact CD1-CE2 3.79Å; W124-F199 HydrophobicContact CD2-CE2 4.01Å; W124-F199 HydrophobicContact CD2-CZ 4.33Å; W124-F199 AromaticContact CG-CE2 3.67Å; W124-F199 HydrophobicContact CG-CE2 3.67Å; W124-F199 HydrophobicContact CG-CZ 4.19Å; P126-F199 HydrophobicContact CB-CE1 4.15Å; P126-F199 HydrophobicContact CB-CZ 4.04Å; P126-F199 HydrophobicContact CG-CE1 4.21Å; P126-F199 HydrophobicContact CG-CZ 3.94Å; Q195-F199 PolarHBondContact O-N 3.43Å; E196-F199 WeakPolarHBondContact O-CB 3.43Å; E196-F199 PolarHBondContact O-N 3.48Å; R197-F199 VanDerWaalsContact C-N 3.27Å; R197-F199 PolarHBondContact O-N 3.43Å; F199-V202 PolarHBondContact O-N 2.97Å; F199-H203 AromaticContact CD2-CE1 3.55Å; F199-H203 AromaticContact CD2-ND1 3.7Å; F199-H203 AromaticContact CE1-ND1 3.9Å; F199-H203 AromaticContact CE2-CE1 3.14Å; F199-H203 WeakPolarHBondContact CE2-CE1 3.18Å; F199-H203 AromaticContact CE2-ND1 3.49Å; F199-H203 WeakPolarHBondContact CE2-ND1 3.37Å; F199-H203 AromaticContact CE2-NE2 3.95Å; F199-H203 AromaticContact CZ-CE1 3.59Å; F199-H203 AromaticContact CZ-ND1 3.59Å; F199-H203 PolarHBondContact O-N 3.03Å; F199-H203 PolarHBondContact O-ND1 3.17Å; F199-V233 HydrophobicContact CE1-CG2 3.65Å; F199-V233 HydrophobicContact CZ-CG2 3.53Å
200	W	97.7	Very high	95.6	Very high	1 Å²	1	36.7 Å²	36.7	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-71.8	-31.1	177.7	-73.8	113.8	0	0	0	113.1	P126 D130 Y131 Y134 E196 R197 A198 V202 H203 R204 Y234	P126-W200 HydrophobicContact CB-CH2 3.61Å; P126-W200 HydrophobicContact CB-CZ3 3.78Å; P126-W200 HydrophobicContact CG-CH2 4.37Å; P126-W200 HydrophobicContact CG-CZ3 4.05Å; D130-W200 HydrophobicContact CB-CH2 3.74Å; D130-W200 HydrophobicContact CB-CZ2 3.91Å; Y131-W200 AromaticContact CD2-CD2 3.58Å; Y131-W200 HydrophobicContact CD2-CD2 3.58Å; Y131-W200 AromaticContact CD2-CE3 3.4Å; Y131-W200 HydrophobicContact CD2-CE3 3.4Å; Y131-W200 VanDerWaalsContact CD2-CE3 3.4Å; Y131-W200 HydrophobicContact CD2-CG 4.12Å; Y131-W200 HydrophobicContact CD2-CH2 4.25Å; Y131-W200 HydrophobicContact CD2-CZ2 4.42Å; Y131-W200 AromaticContact CD2-CZ3 3.77Å; Y131-W200 HydrophobicContact CD2-CZ3 3.77Å; Y131-W200 HydrophobicContact CE2-CB 4.3Å; Y131-W200 HydrophobicContact CE2-CD2 4.16Å; Y131-W200 HydrophobicContact CE2-CE3 4.08Å; Y131-W200 HydrophobicContact CE2-CG 4.27Å; Y131-W200 HydrophobicContact CG-CE3 4.03Å; Y131-W200 HydrophobicContact CG-CH2 4.36Å; Y131-W200 AromaticContact CG-CZ3 3.94Å; Y131-W200 HydrophobicContact CG-CZ3 3.94Å; Y131-W200 VanDerWaalsContact N-CH2 3.32Å; Y134-W200 HydrophobicContact CD1-CB 4.39Å; Y134-W200 AromaticContact CD1-CD1 3.43Å; Y134-W200 VanDerWaalsContact CD1-CD1 3.43Å; Y134-W200 HydrophobicContact CD1-CD2 4.37Å; Y134-W200 AromaticContact CD1-CG 3.81Å; Y134-W200 HydrophobicContact CD1-CG 3.81Å; Y134-W200 AromaticContact CD1-NE1 3.77Å; Y134-W200 AromaticContact CD2-CD1 3.42Å; Y134-W200 VanDerWaalsContact CD2-CD1 3.42Å; Y134-W200 AromaticContact CD2-NE1 3.51Å; Y134-W200 HydrophobicContact CE1-CB 4.07Å; Y134-W200 AromaticContact CE1-CD1 3.63Å; Y134-W200 AromaticContact CE1-CG 3.94Å; Y134-W200 HydrophobicContact CE1-CG 3.94Å; Y134-W200 AromaticContact CE2-CD1 3.61Å; Y134-W200 AromaticContact CG-CD1 3.31Å; Y134-W200 HydrophobicContact CG-CG 4.11Å; Y134-W200 AromaticContact CG-NE1 3.26Å; Y134-W200 VanDerWaalsContact CG-NE1 3.26Å; Y134-W200 AromaticContact CZ-CD1 3.71Å; E196-W200 PolarHBondContact O-N 3Å; E196-W200 VanDerWaalsContact O-N 3.16Å; R197-W200 CarbonylContact O-C 3.45Å; R197-W200 WeakPolarHBondContact O-CA 3.47Å; R197-W200 PolarHBondContact O-N 3.17Å; A198-W200 VanDerWaalsContact C-N 3.34Å; W200-V202 PolarHBondContact O-N 3.39Å; W200-H203 HydrophobicContact CE3-CB 4.38Å; W200-H203 PolarHBondContact O-N 2.94Å; W200-R204 HydrophobicContact CE3-CG 3.82Å; W200-R204 HydrophobicContact CZ3-CG 4.07Å; W200-R204 CarbonylContact O-C 3.58Å; W200-R204 WeakPolarHBondContact O-CA 3.28Å; W200-R204 PolarHBondContact O-N 3.06Å; W200-Y234 HydrophobicContact CZ2-CE2 4.02Å; W200-Y234 PolarHBondContact NE1-OH 3.02Å
201	D	97.9	Very high	95.9	Very high	5 Å²	5	35 Å²	35	3%	0.027	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-25.1	174.1	-65.5	-27.2	0	0	0	112.3	H100 L102 R197 A198 P205	H100-D201 IonicContact CE1-OD1 2.66Å; H100-D201 IonicContact CG-OD1 3.13Å; H100-D201 IonicContact ND1-OD1 2.96Å; H100-D201 PolarHBondContact ND1-OD1 3.45Å; H100-D201 IonicContact ND1-OD2 3.41Å; L102-D201 HydrophobicContact CD1-CB 3.88Å; L102-D201 HydrophobicContact CD2-CB 4.01Å; L102-D201 HydrophobicContact CG-CB 3.91Å; R197-D201 IonicContact CZ-OD2 3.2Å; R197-D201 IonicContact NH1-OD2 2.7Å; R197-D201 PolarHBondContact NH1-OD2 2.91Å; R197-D201 VanDerWaalsContact O-CG 3.3Å; R197-D201 PolarHBondContact O-N 2.95Å; A198-D201 PolarHBondContact O-N 2.98Å; D201-P205 VanDerWaalsContact O-CA 3.25Å; D201-P205 WeakPolarHBondContact O-CA 3.36Å; D201-P205 WeakPolarHBondContact O-CB 3.2Å
202	V	97.1	Very high	96	Very high	8 Å²	8	34.7 Å²	34.7	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-76.7	-49.6	170.5	175.1	0	0	0	0	111.7	G92 L102 A198 F199 W200 T213	G92-V202 VanDerWaalsContact CA-CG2 3.46Å; L102-V202 HydrophobicContact CD1-CB 4.46Å; L102-V202 HydrophobicContact CD1-CG2 3.48Å; L102-V202 VanDerWaalsContact CD1-CG2 3.48Å; A198-V202 PolarHBondContact O-N 3.27Å; F199-V202 PolarHBondContact O-N 2.97Å; W200-V202 PolarHBondContact O-N 3.39Å; V202-T213 HydrophobicContact CG1-CG2 3.89Å
203	H	95.9	Very high	95.8	Very high	16 Å²	16	34.9 Å²	34.9	7%	0.074	22%	0.22	C	C	.	.	H	α-helix	trans	-87.6	-17.3	-169.2	-63.3	89	0	0	0	114	P126 F199 W200	P126-H203 VanDerWaalsContact CD-CD2 3.44Å; P126-H203 WeakPolarHBondContact CD-CD2 3.49Å; P126-H203 HydrophobicContact CG-CB 3.64Å; P126-H203 VanDerWaalsContact CG-CD2 3.45Å; P126-H203 WeakPolarHBondContact CG-CD2 3.28Å; F199-H203 AromaticContact CD2-CE1 3.55Å; F199-H203 AromaticContact CD2-ND1 3.7Å; F199-H203 AromaticContact CE1-ND1 3.9Å; F199-H203 AromaticContact CE2-CE1 3.14Å; F199-H203 WeakPolarHBondContact CE2-CE1 3.18Å; F199-H203 AromaticContact CE2-ND1 3.49Å; F199-H203 WeakPolarHBondContact CE2-ND1 3.37Å; F199-H203 AromaticContact CE2-NE2 3.95Å; F199-H203 AromaticContact CZ-CE1 3.59Å; F199-H203 AromaticContact CZ-ND1 3.59Å; F199-H203 PolarHBondContact O-N 3.03Å; F199-H203 PolarHBondContact O-ND1 3.17Å; W200-H203 HydrophobicContact CE3-CB 4.38Å; W200-H203 PolarHBondContact O-N 2.94Å
204	R	96.5	Very high	95.7	Very high	53 Å²	53	41.3 Å²	41.3	20%	0.2	25%	0.25	C	C	.	.	S	Bend	trans	-139.1	64.4	177.3	-62.8	-64	-176.8	-74.8	-3.6	108.1	P126 N128 Y131 W200	P126-R204 PolarHBondContact O-NH2 2.73Å; N128-R204 PolarHBondContact OD1-NH2 3.05Å; Y131-R204 HydrophobicContact CD1-CG 3.8Å; Y131-R204 HydrophobicContact CD2-CG 4.03Å; Y131-R204 HydrophobicContact CE1-CB 4.02Å; Y131-R204 HydrophobicContact CE1-CG 3.81Å; Y131-R204 HydrophobicContact CE2-CB 4.05Å; Y131-R204 HydrophobicContact CE2-CG 4.04Å; Y131-R204 HydrophobicContact CG-CG 3.93Å; W200-R204 HydrophobicContact CE3-CG 3.82Å; W200-R204 HydrophobicContact CZ3-CG 4.07Å; W200-R204 CarbonylContact O-C 3.58Å; W200-R204 WeakPolarHBondContact O-CA 3.28Å; W200-R204 PolarHBondContact O-N 3.06Å
205	P	96.6	Very high	95.1	Very high	32 Å²	32	43.6 Å²	43.6	21%	0.208	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-64.5	157.4	-170.5	28.3	-36.2	0	0	0	112.4	D201 C209 N211	D201-P205 VanDerWaalsContact O-CA 3.25Å; D201-P205 WeakPolarHBondContact O-CA 3.36Å; D201-P205 WeakPolarHBondContact O-CB 3.2Å; P205-C209 HydrophobicContact CB-CB 4.17Å; P205-N211 HydrophobicContact CG-CB 4.1Å
206	V	96.7	Very high	94.7	Very high	30 Å²	30	45.3 Å²	45.3	18%	0.182	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-54.4	134.6	172.3	-176.9	0	0	0	0	109.3	H100 V101 Y151 G208 C209	H100-V206 HydrophobicContact CB-CG2 3.55Å; V101-V206 HydrophobicContact CG2-CB 4.48Å; V101-V206 HydrophobicContact CG2-CG2 4.24Å; Y151-V206 HydrophobicContact CE1-CG1 4.43Å; Y151-V206 HydrophobicContact CE1-CG2 4Å; V206-G208 PolarHBondContact O-N 3.22Å; V206-C209 VanDerWaalsContact O-CB 3.25Å; V206-C209 WeakPolarHBondContact O-CB 3.46Å; V206-C209 PolarHBondContact O-N 2.92Å
207	P	96.6	Very high	94.2	Very high	98 Å²	98	50 Å²	50	64%	0.636	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	131.7	177.4	-28.6	35.4	0	0	0	112.5	Y151	Y151-P207 HydrophobicContact CD2-CG 4.45Å; Y151-P207 HydrophobicContact CG-CG 4.31Å
208	G	94.8	Very high	93.6	Very high	89 Å²	89	57.2 Å²	57.2	92%	0.918	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.4	-14.5	-175.1	0	0	0	0	0	114.7	V206	V206-G208 PolarHBondContact O-N 3.22Å
209	C	95.8	Very high	92.8	Very high	50 Å²	50	60.3 Å²	60.3	34%	0.338	34%	0.335	S	S	.	.	S	Bend	trans	-79.2	149.8	169.9	-65.6	0	0	0	0	111.3	P205 V206 N211	P205-C209 HydrophobicContact CB-CB 4.17Å; V206-C209 VanDerWaalsContact O-CB 3.25Å; V206-C209 WeakPolarHBondContact O-CB 3.46Å; V206-C209 PolarHBondContact O-N 2.92Å; C209-N211 PolarHBondContact O-N 3.07Å
210	V	95.2	Very high	91.7	Very high	124 Å²	124	62.6 Å²	62.6	75%	0.752	35%	0.35	S	S	*	.			trans	-67.8	129.1	174.1	178.3	0	0	0	0	109.5	T212	V210-T212 PolarHBondContact O-N 3.08Å
211	N	94.6	Very high	90.3	Very high	40 Å²	40	72.8 Å²	72.8	21%	0.214	39%	0.388	C	S	.	.			trans	-81.2	100.6	172.6	-176.8	-0.2	0	0	0	110.2	P205 C209 T213 E214	P205-N211 HydrophobicContact CG-CB 4.1Å; C209-N211 PolarHBondContact O-N 3.07Å; N211-T213 PolarHBondContact O-N 3.23Å; N211-T213 WeakPolarHBondContact OD1-CB 3.33Å; N211-T213 PolarHBondContact OD1-N 3.26Å; N211-T213 VanDerWaalsContact OD1-N 3.15Å; N211-T213 PolarHBondContact OD1-OG1 3.26Å; N211-E214 HydrophobicContact CB-CG 3.98Å; N211-E214 WeakPolarHBondContact CB-OE1 3.3Å; N211-E214 PolarHBondContact ND2-OE1 2.82Å; N211-E214 PolarHBondContact O-N 3.37Å
212	T	93.4	Very high	88.9	Confident	26 Å²	26	80.2 Å²	80.2	16%	0.16	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-11.7	-177.1	52.2	0	0	0	0	113.9	A90 V210	A90-T212 HydrophobicContact CB-CG2 3.87Å; A90-T212 WeakPolarHBondContact O-CG2 3.33Å; A90-T212 PolarHBondContact O-OG1 2.87Å; V210-T212 PolarHBondContact O-N 3.08Å
213	T	90.1	Very high	87.3	Confident	63 Å²	63	82.1 Å²	82.1	39%	0.387	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-11.7	176.3	72.2	0	0	0	0	113.3	V202 N211	V202-T213 HydrophobicContact CG1-CG2 3.89Å; N211-T213 PolarHBondContact O-N 3.23Å; N211-T213 WeakPolarHBondContact OD1-CB 3.33Å; N211-T213 PolarHBondContact OD1-N 3.26Å; N211-T213 VanDerWaalsContact OD1-N 3.15Å; N211-T213 PolarHBondContact OD1-OG1 3.26Å
214	E	89.4	Confident	85.4	Confident	145 Å²	145	88.2 Å²	88.2	68%	0.678	45%	0.452	S	S	*	.			trans	-69.8	135.6	177	-71.5	177.6	-165	0	0	111.6	N211	N211-E214 HydrophobicContact CB-CG 3.98Å; N211-E214 WeakPolarHBondContact CB-OE1 3.3Å; N211-E214 PolarHBondContact ND2-OE1 2.82Å; N211-E214 PolarHBondContact O-N 3.37Å
215	M	84.3	Confident	83.4	Confident	63 Å²	63	89.3 Å²	89.3	31%	0.31	46%	0.462	S	S	.	.			trans	-122.4	139.3	-176.4	-178.5	164.9	51.7	0	0	111.4	P21 I217 K219 C220 L223	P21-M215 HydrophobicContact CG-SD 4.26Å; M215-I217 PolarHBondContact O-N 3.44Å; M215-K219 HydrophobicContact CG-CB 3.57Å; M215-K219 HydrophobicContact CG-CD 4.23Å; M215-K219 HydrophobicContact SD-CB 3.76Å; M215-C220 HydrophobicContact CE-CB 4.34Å; M215-C220 VanDerWaalsContact CE-SG 3.51Å; M215-L223 HydrophobicContact CE-CD1 3.29Å; M215-L223 HydrophobicContact SD-CD1 3.99Å
216	D	86.9	Confident	81.1	Confident	64 Å²	64	91.8 Å²	91.8	34%	0.342	48%	0.478	S	S	.	.			trans	-55	132.5	174.2	-176.2	-53.6	0	0	0	110.5	R218 K219 C220	D216-R218 PolarHBondContact O-N 3.48Å; D216-R218 WeakPolarHBondContact OD1-CA 3.49Å; D216-R218 WeakPolarHBondContact OD1-CB 3.36Å; D216-R218 WeakPolarHBondContact OD1-CG 3.48Å; D216-R218 PolarHBondContact OD1-N 3.36Å; D216-R218 IonicContact OD1-NE 3.97Å; D216-R218 PolarHBondContact OD1-NE 3.22Å; D216-R218 VanDerWaalsContact OD1-NE 3.15Å; D216-R218 IonicContact OD2-CZ 2.64Å; D216-R218 IonicContact OD2-NE 3.3Å; D216-R218 PolarHBondContact OD2-NE 3.4Å; D216-R218 IonicContact OD2-NH2 3.95Å; D216-R218 PolarHBondContact OD2-NH2 3.23Å; D216-K219 HydrophobicContact CB-CB 4.46Å; D216-K219 HydrophobicContact CB-CD 4.3Å; D216-K219 HydrophobicContact CB-CG 4.36Å; D216-K219 WeakPolarHBondContact O-CA 3.46Å; D216-K219 VanDerWaalsContact O-CB 3.28Å; D216-K219 WeakPolarHBondContact O-CB 3.49Å; D216-K219 PolarHBondContact O-N 3.27Å; D216-C220 PolarHBondContact O-N 3.01Å; D216-C220 PolarHBondContact O-SG 3.04Å; D216-C220 VanDerWaalsContact O-SG 3.4Å
217	I	85.8	Confident	78.8	Confident	114 Å²	114	98.3 Å²	98.3	59%	0.585	51%	0.507	S	S	*	.	H	α-helix	trans	-54.7	-30.6	-178.2	-171.2	59.5	0	0	0	113.5	M215 K219 C220 R221	M215-I217 PolarHBondContact O-N 3.44Å; I217-K219 VanDerWaalsContact C-N 3.33Å; I217-C220 HydrophobicContact CD1-CB 4.39Å; I217-C220 PolarHBondContact O-N 2.96Å; I217-R221 WeakPolarHBondContact O-CG 3.49Å; I217-R221 PolarHBondContact O-N 3.02Å; I217-R221 VanDerWaalsContact O-N 3.09Å
218	R	83.8	Confident	76.6	Confident	178 Å²	178	100.2 Å²	100.2	67%	0.672	51%	0.505	S	S	*	.	H	α-helix	trans	-71.3	-28.8	175.7	-59.5	174.3	-72.2	-166.3	-0.9	112.1	D216 R222	D216-R218 PolarHBondContact O-N 3.48Å; D216-R218 WeakPolarHBondContact OD1-CA 3.49Å; D216-R218 WeakPolarHBondContact OD1-CB 3.36Å; D216-R218 WeakPolarHBondContact OD1-CG 3.48Å; D216-R218 PolarHBondContact OD1-N 3.36Å; D216-R218 IonicContact OD1-NE 3.97Å; D216-R218 PolarHBondContact OD1-NE 3.22Å; D216-R218 VanDerWaalsContact OD1-NE 3.15Å; D216-R218 IonicContact OD2-CZ 2.64Å; D216-R218 IonicContact OD2-NE 3.3Å; D216-R218 PolarHBondContact OD2-NE 3.4Å; D216-R218 IonicContact OD2-NH2 3.95Å; D216-R218 PolarHBondContact OD2-NH2 3.23Å; R218-R222 PolarHBondContact O-NE 2.81Å; R218-R222 VanDerWaalsContact O-NE 3.17Å
219	K	81	Confident	74.5	Confident	66 Å²	66	98.2 Å²	98.2	29%	0.287	48%	0.475	S	S	.	.	H	α-helix	trans	-75.4	-43.5	170.7	-74.8	177.7	170.3	-171.4	0	110.1	P21 N22 M215 D216 I217 R221 R222	P21-K219 HydrophobicContact CB-CB 3.96Å; P21-K219 HydrophobicContact CB-CD 3.94Å; P21-K219 HydrophobicContact CB-CG 3.83Å; P21-K219 HydrophobicContact CG-CB 3.92Å; P21-K219 HydrophobicContact CG-CG 4.31Å; N22-K219 PolarHBondContact OD1-NZ 3.4Å; M215-K219 HydrophobicContact CG-CB 3.57Å; M215-K219 HydrophobicContact CG-CD 4.23Å; M215-K219 HydrophobicContact SD-CB 3.76Å; D216-K219 HydrophobicContact CB-CB 4.46Å; D216-K219 HydrophobicContact CB-CD 4.3Å; D216-K219 HydrophobicContact CB-CG 4.36Å; D216-K219 WeakPolarHBondContact O-CA 3.46Å; D216-K219 VanDerWaalsContact O-CB 3.28Å; D216-K219 WeakPolarHBondContact O-CB 3.49Å; D216-K219 PolarHBondContact O-N 3.27Å; I217-K219 VanDerWaalsContact C-N 3.33Å; K219-R221 VanDerWaalsContact C-N 3.33Å; K219-R221 PolarHBondContact O-N 2.77Å; K219-R222 PolarHBondContact O-N 2.78Å
220	C	75.1	Confident	72.5	Confident	49 Å²	49	102.6 Å²	102.6	33%	0.331	49%	0.488	S	S	.	.	H	α-helix	trans	-54.9	-44.8	176.5	-58.2	0	0	0	0	112.9	M215 D216 I217 R222 L223	M215-C220 HydrophobicContact CE-CB 4.34Å; M215-C220 VanDerWaalsContact CE-SG 3.51Å; D216-C220 PolarHBondContact O-N 3.01Å; D216-C220 PolarHBondContact O-SG 3.04Å; D216-C220 VanDerWaalsContact O-SG 3.4Å; I217-C220 HydrophobicContact CD1-CB 4.39Å; I217-C220 PolarHBondContact O-N 2.96Å; C220-R222 PolarHBondContact O-N 2.81Å; C220-L223 PolarHBondContact O-N 3.17Å
221	R	69.3	Low	70.8	Confident	215 Å²	215	101.8 Å²	101.8	81%	0.811	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-21.7	178.9	-75.1	-176.8	178.4	-134.6	1.4	114.6	I217 K219	I217-R221 WeakPolarHBondContact O-CG 3.49Å; I217-R221 PolarHBondContact O-N 3.02Å; I217-R221 VanDerWaalsContact O-N 3.09Å; K219-R221 VanDerWaalsContact C-N 3.33Å; K219-R221 PolarHBondContact O-N 2.77Å
222	R	67.4	Low	69.2	Low	161 Å²	161	102.5 Å²	102.5	61%	0.608	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-14	179.9	-72.3	-175.6	-76.7	166.1	-4.6	113.1	R218 K219 C220 K224	R218-R222 PolarHBondContact O-NE 2.81Å; R218-R222 VanDerWaalsContact O-NE 3.17Å; K219-R222 PolarHBondContact O-N 2.78Å; C220-R222 PolarHBondContact O-N 2.81Å; R222-K224 PolarHBondContact O-N 3.32Å
223	L	64.9	Low	67.6	Low	49 Å²	49	102 Å²	102	26%	0.257	48%	0.48	S	S	.	.			trans	-70.4	102.5	172.5	-77	120.2	0	0	0	109.5	P21 M215 C220 N225	P21-L223 HydrophobicContact CG-CD1 4.31Å; M215-L223 HydrophobicContact CE-CD1 3.29Å; M215-L223 HydrophobicContact SD-CD1 3.99Å; C220-L223 PolarHBondContact O-N 3.17Å; L223-N225 PolarHBondContact O-N 3.22Å
224	K	54.9	Low	66.3	Low	143 Å²	143	101 Å²	101	62%	0.622	47%	0.469	S	S	*	.	S	Bend	trans	-71.6	-3.1	-179	-75.5	-178	-180	172.4	0	114.2	E17 R222	E17-K224 IonicContact OE2-NZ 3.21Å; E17-K224 PolarHBondContact OE2-NZ 3.22Å; R222-K224 PolarHBondContact O-N 3.32Å
225	N	53.8	Low	64.6	Low	77 Å²	77	96.4 Å²	96.4	41%	0.412	46%	0.46	S	S	.	.			trans	-155.5	80.8	178.8	-104.4	-29.1	0	0	0	113.4	L223 Q227	L223-N225 PolarHBondContact O-N 3.22Å; N225-Q227 PolarHBondContact O-N 3.06Å; N225-Q227 VanDerWaalsContact O-N 3.14Å
226	P	50.2	Low	62.5	Low	84 Å²	84	99.2 Å²	99.2	55%	0.545	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-11.2	178.5	24.7	-32.3	0	0	0	114.5
227	Q	48.3	Very low	60.2	Low	167 Å²	167	102.1 Å²	102.1	78%	0.78	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-18.8	-174.8	-64.6	-159.7	-3	0	0	115.2	N225 V229	N225-Q227 PolarHBondContact O-N 3.06Å; N225-Q227 VanDerWaalsContact O-N 3.14Å; Q227-V229 VanDerWaalsContact C-N 3.33Å; Q227-V229 PolarHBondContact O-N 3.21Å
228	K	49.3	Very low	57.6	Low	137 Å²	137	100.8 Å²	100.8	60%	0.596	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-2.1	-174.6	-74.7	-172.8	178.5	-179.4	0	114.7
229	V	49.9	Very low	55.2	Low	48 Å²	48	101 Å²	101	29%	0.291	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	5.8	-165.5	-167.6	0	0	0	0	113.1	C123 Q227 K231	C123-V229 HydrophobicContact CB-CG1 3.1Å; Q227-V229 VanDerWaalsContact C-N 3.33Å; Q227-V229 PolarHBondContact O-N 3.21Å; V229-K231 PolarHBondContact O-N 3.25Å
230	K	55.3	Low	52.9	Low	142 Å²	142	103.3 Å²	103.3	62%	0.617	52%	0.524	S	S	*	.			trans	-79.4	91.3	-177.4	-62.5	-172.2	176.9	-171.5	0	111.6
231	K	58.9	Low	50.8	Low	107 Å²	107	108.2 Å²	108.2	47%	0.465	54%	0.542	S	S	.	.			trans	-93.3	119.8	165.5	-69	-179.6	-178.9	169.8	0	109.3	W124 V229	W124-K231 HydrophobicContact CE3-CB 3.81Å; W124-K231 HydrophobicContact CH2-CB 4.2Å; W124-K231 HydrophobicContact CZ3-CB 3.57Å; W124-K231 WeakPolarHBondContact CZ3-O 3.39Å; V229-K231 PolarHBondContact O-N 3.25Å
232	S	60.1	Low	48.9	Very low	55 Å²	55	102.9 Å²	102.9	39%	0.385	54%	0.538	S	S	.	.			trans	-83.4	145.2	169.7	168.6	0	0	0	0	110.3	D130 G235	D130-S232 PolarHBondContact OD1-OG 3.26Å; D130-S232 VanDerWaalsContact OD1-OG 3.09Å; S232-G235 PolarHBondContact OG-N 3.19Å; S232-G235 VanDerWaalsContact OG-N 3.09Å
233	V	60.7	Low	47.2	Very low	16 Å²	16	104.1 Å²	104.1	10%	0.097	55%	0.55	C	S	.	*	S	Bend	trans	-77.6	-35.7	-177.6	-178.3	0	0	0	0	111.7	W124 P126 F199	W124-V233 HydrophobicContact CE3-CG2 3.96Å; W124-V233 HydrophobicContact CZ3-CG2 3.95Å; P126-V233 HydrophobicContact CB-CG2 4.03Å; F199-V233 HydrophobicContact CE1-CG2 3.65Å; F199-V233 HydrophobicContact CZ-CG2 3.53Å
234	Y	63.2	Low	45.4	Very low	41 Å²	41	106.9 Å²	106.9	16%	0.161	57%	0.573	C	S	.	*	S	Bend	trans	-118	9.1	-177.6	-54.6	-71.7	0	0	0	113.9	D130 I133 Y134 E196 W200 V236	D130-Y234 HydrophobicContact CB-CD2 3.72Å; D130-Y234 HydrophobicContact CB-CE2 4.02Å; D130-Y234 WeakPolarHBondContact O-CE2 3.49Å; I133-Y234 HydrophobicContact CB-CD2 4.28Å; I133-Y234 HydrophobicContact CB-CE2 4.45Å; I133-Y234 HydrophobicContact CD1-CD2 4.3Å; I133-Y234 HydrophobicContact CG2-CD2 4.33Å; I133-Y234 HydrophobicContact CG2-CG 4.39Å; Y134-Y234 WeakPolarHBondContact CB-OH 3.45Å; E196-Y234 WeakPolarHBondContact OE1-CE1 3.45Å; E196-Y234 PolarHBondContact OE1-OH 2.69Å; W200-Y234 HydrophobicContact CZ2-CE2 4.02Å; W200-Y234 PolarHBondContact NE1-OH 3.02Å; Y234-V236 PolarHBondContact O-N 3.37Å
235	G	52.4	Low	44.5	Very low	48 Å²	48	105.6 Å²	105.6	50%	0.495	58%	0.58	S	S	.	*			trans	-56.1	127.6	173.8	0	0	0	0	0	111	S232 T237	S232-G235 PolarHBondContact OG-N 3.19Å; S232-G235 VanDerWaalsContact OG-N 3.09Å; G235-T237 PolarHBondContact O-N 3.01Å
236	V	39.9	Very low	43.6	Very low	123 Å²	123	107.9 Å²	107.9	75%	0.745	60%	0.597	S	S	*	*			trans	-62	128.3	163.2	-178.6	0	0	0	0	106.1	Y234 D238	Y234-V236 PolarHBondContact O-N 3.37Å; V236-D238 PolarHBondContact O-N 3.19Å
237	T	38.9	Very low	42.8	Very low	124 Å²	124	110.6 Å²	110.6	76%	0.761	60%	0.601	S	S	*	*			trans	-61.2	94	167	11.9	0	0	0	0	107.3	G235 E239	G235-T237 PolarHBondContact O-N 3.01Å; T237-E239 VanDerWaalsContact C-N 3.25Å; T237-E239 PolarHBondContact O-N 3.49Å
238	D	31.2	Very low	42.2	Very low	86 Å²	86	108.9 Å²	108.9	46%	0.46	60%	0.596	S	S	.	*			trans	-76	86.4	173.7	-156.8	-4.3	0	0	0	106.7	V236 T240 Q241	V236-D238 PolarHBondContact O-N 3.19Å; D238-T240 PolarHBondContact O-N 3.08Å; D238-T240 WeakPolarHBondContact OD1-CB 3.46Å; D238-T240 PolarHBondContact OD1-N 3.26Å; D238-T240 PolarHBondContact OD1-OG1 2.89Å; D238-Q241 HydrophobicContact CB-CG 4.44Å; D238-Q241 PolarHBondContact O-N 3.48Å
239	E	33.7	Very low	41.5	Very low	182 Å²	182	106 Å²	106	85%	0.85	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	5.2	166	-72.6	-79.8	141.2	0	0	111.8	T237	T237-E239 VanDerWaalsContact C-N 3.25Å; T237-E239 PolarHBondContact O-N 3.49Å
240	T	32.8	Very low	41.1	Very low	115 Å²	115	106.9 Å²	106.9	71%	0.706	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.6	13.4	-176.2	20.6	0	0	0	0	115.2	D238 S242	D238-T240 PolarHBondContact O-N 3.08Å; D238-T240 WeakPolarHBondContact OD1-CB 3.46Å; D238-T240 PolarHBondContact OD1-N 3.26Å; D238-T240 PolarHBondContact OD1-OG1 2.89Å; T240-S242 VanDerWaalsContact C-N 3.28Å; T240-S242 PolarHBondContact O-N 3.24Å
241	Q	31.6	Very low	40.4	Very low	152 Å²	152	108.3 Å²	108.3	71%	0.71	61%	0.609	S	S	*	*			trans	-73	93.2	158.9	-83.6	-175.7	22	0	0	109.4	D238 Q243	D238-Q241 HydrophobicContact CB-CG 4.44Å; D238-Q241 PolarHBondContact O-N 3.48Å; Q241-Q243 PolarHBondContact O-N 3.2Å
242	S	29.5	Very low	39.8	Very low	104 Å²	104	108.3 Å²	108.3	73%	0.727	62%	0.62	S	S	*	*			trans	-28.3	110.2	157.8	46.8	0	0	0	0	110	T240 S244	T240-S242 VanDerWaalsContact C-N 3.28Å; T240-S242 PolarHBondContact O-N 3.24Å; S242-S244 VanDerWaalsContact C-N 3.31Å; S242-S244 PolarHBondContact O-N 3.09Å
243	Q	30.4	Very low	39.3	Very low	186 Å²	186	112.8 Å²	112.8	87%	0.869	64%	0.638	S	S	*	*			trans	-50.2	98.4	168.2	-68.2	179	-9.5	0	0	107.7	Q241 P245	Q241-Q243 PolarHBondContact O-N 3.2Å; Q243-P245 VanDerWaalsContact O-CD 3.29Å; Q243-P245 WeakPolarHBondContact O-CD 3.21Å
244	S	28.3	Very low	39.1	Very low	107 Å²	107	121.2 Å²	121.2	75%	0.748	67%	0.668	S	S	*	*			trans	-76.7	111.2	155.4	-90.7	0	0	0	0	105.8	S242 V246	S242-S244 VanDerWaalsContact C-N 3.31Å; S242-S244 PolarHBondContact O-N 3.09Å; S244-V246 PolarHBondContact O-N 2.86Å
245	P	36.7	Very low	39.5	Very low	117 Å²	117	128.1 Å²	128.1	76%	0.76	70%	0.699	S	S	*	*			trans	-82.8	74.3	-177.6	35.1	-30.4	0	0	0	107.6	Q243 H247	Q243-P245 VanDerWaalsContact O-CD 3.29Å; Q243-P245 WeakPolarHBondContact O-CD 3.21Å; P245-H247 PolarHBondContact O-N 2.98Å
246	V	33.3	Very low	40.8	Very low	125 Å²	125	131 Å²	131	76%	0.758	71%	0.706	S	S	*	*			trans	-88.1	68.4	147.6	-169.6	0	0	0	0	105.8	S244 I248	S244-V246 PolarHBondContact O-N 2.86Å; V246-I248 HydrophobicContact CG1-CG1 4.17Å; V246-I248 PolarHBondContact O-N 2.91Å
247	H	35	Very low	43.2	Very low	140 Å²	140	127.8 Å²	127.8	65%	0.648	69%	0.688	S	S	*	*			trans	-62	88.3	160	-174.1	81.5	0	0	0	105.7	P245 P249	P245-H247 PolarHBondContact O-N 2.98Å; H247-P249 WeakPolarHBondContact O-CD 3.37Å
248	I	34.8	Very low	45.7	Very low	132 Å²	132	128.8 Å²	128.8	68%	0.677	68%	0.681	S	S	*	*			trans	-66.3	112.2	151.3	-57.3	178.7	0	0	0	102.8	V246 S250	V246-I248 HydrophobicContact CG1-CG1 4.17Å; V246-I248 PolarHBondContact O-N 2.91Å; I248-S250 PolarHBondContact O-N 2.84Å
249	P	35.5	Very low	48.6	Very low	75 Å²	75	128.8 Å²	128.8	49%	0.487	68%	0.681	S	S	.	*			trans	-53.3	133.3	-179.8	-18.8	30.4	0	0	0	107.4	H247 Q251	H247-P249 WeakPolarHBondContact O-CD 3.37Å; P249-Q251 PolarHBondContact O-N 2.93Å
250	S	40.3	Very low	51.3	Low	67 Å²	67	122.2 Å²	122.2	47%	0.469	65%	0.652	S	S	.	*			trans	-38.5	118.9	154	45.2	0	0	0	0	105.8	I248	I248-S250 PolarHBondContact O-N 2.84Å
251	Q	41.2	Very low	54.2	Low	173 Å²	173	121 Å²	121	81%	0.808	64%	0.64	S	S	*	*			trans	-48.9	123.3	-175.9	-76.7	-142.9	-13.8	0	0	106.9	P249 I253	P249-Q251 PolarHBondContact O-N 2.93Å; Q251-I253 PolarHBondContact O-N 2.93Å
252	P	45.6	Very low	57.2	Low	107 Å²	107	120 Å²	120	70%	0.695	63%	0.63	S	S	*	*			trans	-56.6	125.7	-176.2	20.6	-29.9	0	0	0	106.2	R254	P252-R254 WeakPolarHBondContact O-CA 3.32Å; P252-R254 PolarHBondContact O-N 2.63Å
253	I	49.6	Very low	60.3	Low	149 Å²	149	121.9 Å²	121.9	76%	0.764	63%	0.625	S	S	*	*			trans	-37.6	111	168.5	-65.9	167.3	0	0	0	105.5	Q251 K255	Q251-I253 PolarHBondContact O-N 2.93Å; I253-K255 PolarHBondContact O-N 3.19Å
254	R	57.8	Low	63.3	Low	192 Å²	192	117.8 Å²	117.8	73%	0.725	61%	0.606	S	S	*	*			trans	-59.2	105.2	-169.7	-176.1	179.5	177.3	-177.5	-2.2	106.3	P252 T256	P252-R254 WeakPolarHBondContact O-CA 3.32Å; P252-R254 PolarHBondContact O-N 2.63Å; R254-T256 PolarHBondContact O-N 2.91Å; R254-T256 VanDerWaalsContact O-N 3.11Å
255	K	71.8	Confident	66.5	Low	187 Å²	187	116.8 Å²	116.8	81%	0.813	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-60.8	121.2	-179.7	-69.6	-176.1	179	179.6	0	106.6	I253 T257	I253-K255 PolarHBondContact O-N 3.19Å; K255-T257 PolarHBondContact O-N 2.89Å; K255-T257 VanDerWaalsContact O-N 3.1Å
256	T	78.9	Confident	69.4	Low	107 Å²	107	115.9 Å²	115.9	66%	0.656	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-49.1	119.2	-180	-50.1	0	0	0	0	109.3	R254 D260 I261	R254-T256 PolarHBondContact O-N 2.91Å; R254-T256 VanDerWaalsContact O-N 3.11Å; T256-D260 HydrophobicContact CG2-CB 4.05Å; T256-I261 HydrophobicContact CG2-CD1 4.47Å; T256-I261 HydrophobicContact CG2-CG1 3.87Å
257	T	90.2	Very high	72.3	Confident	57 Å²	57	115.1 Å²	115.1	35%	0.35	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-85.6	162.1	-177.7	69.4	0	0	0	0	110.7	K255 D259 D260 I261	K255-T257 PolarHBondContact O-N 2.89Å; K255-T257 VanDerWaalsContact O-N 3.1Å; T257-D259 PolarHBondContact O-N 2.89Å; T257-D260 WeakPolarHBondContact CB-OD2 3.35Å; T257-D260 PolarHBondContact N-OD2 2.94Å; T257-D260 WeakPolarHBondContact O-CB 3.31Å; T257-D260 PolarHBondContact O-N 3.47Å; T257-D260 VanDerWaalsContact O-N 3.12Å; T257-D260 PolarHBondContact OG1-N 2.77Å; T257-D260 PolarHBondContact OG1-OD2 2.84Å; T257-I261 PolarHBondContact O-N 3.08Å; T257-I261 VanDerWaalsContact O-N 3.08Å
258	K	91.6	Very high	75.2	Confident	144 Å²	144	112.3 Å²	112.3	63%	0.626	56%	0.56	S	S	*	*	H	α-helix	trans	-55.9	-35.3	172.7	-175.5	178.8	-178.3	178.7	0	112	I261 R262	K258-I261 PolarHBondContact O-N 3.1Å; K258-R262 WeakPolarHBondContact O-CG 3.46Å; K258-R262 PolarHBondContact O-N 3.08Å
259	D	93	Very high	78.2	Confident	87 Å²	87	110.2 Å²	110.2	47%	0.465	55%	0.55	S	S	.	.	H	α-helix	trans	-74.3	-32.3	178.7	-67.6	-25.8	0	0	0	112.4	T257 I261 R262 K263	T257-D259 PolarHBondContact O-N 2.89Å; D259-I261 VanDerWaalsContact C-N 3.34Å; D259-R262 PolarHBondContact O-N 3.43Å; D259-R262 IonicContact OD1-CZ 3.28Å; D259-R262 IonicContact OD1-NH1 2.83Å; D259-R262 PolarHBondContact OD1-NH1 3.27Å; D259-K263 WeakPolarHBondContact O-CG 3.5Å; D259-K263 PolarHBondContact O-N 3.31Å
260	D	90.6	Very high	81	Confident	43 Å²	43	109.1 Å²	109.1	23%	0.23	55%	0.548	C	S	.	.	H	α-helix	trans	-63.8	-42.1	171.2	-58.9	-42.4	0	0	0	110.6	T256 T257 K263 Q264	T256-D260 HydrophobicContact CG2-CB 4.05Å; T257-D260 WeakPolarHBondContact CB-OD2 3.35Å; T257-D260 PolarHBondContact N-OD2 2.94Å; T257-D260 WeakPolarHBondContact O-CB 3.31Å; T257-D260 PolarHBondContact O-N 3.47Å; T257-D260 VanDerWaalsContact O-N 3.12Å; T257-D260 PolarHBondContact OG1-N 2.77Å; T257-D260 PolarHBondContact OG1-OD2 2.84Å; D260-K263 PolarHBondContact O-N 3.06Å; D260-Q264 WeakPolarHBondContact O-CB 3.42Å; D260-Q264 PolarHBondContact O-N 3.47Å
261	I	92.4	Very high	83.6	Confident	90 Å²	90	108.6 Å²	108.6	46%	0.462	54%	0.538	S	S	.	.	H	α-helix	trans	-62.6	-44.2	175	-63.5	173	0	0	0	110.9	T256 T257 K258 D259 K263 Q264 I265	T256-I261 HydrophobicContact CG2-CD1 4.47Å; T256-I261 HydrophobicContact CG2-CG1 3.87Å; T257-I261 PolarHBondContact O-N 3.08Å; T257-I261 VanDerWaalsContact O-N 3.08Å; K258-I261 PolarHBondContact O-N 3.1Å; D259-I261 VanDerWaalsContact C-N 3.34Å; I261-K263 PolarHBondContact O-N 3.48Å; I261-Q264 WeakPolarHBondContact O-CB 3.27Å; I261-Q264 PolarHBondContact O-N 3.33Å; I261-I265 HydrophobicContact CG2-CD1 4.01Å; I261-I265 HydrophobicContact CG2-CG1 4.49Å; I261-I265 WeakPolarHBondContact O-CG1 3.47Å; I261-I265 PolarHBondContact O-N 3.19Å
262	R	95.4	Very high	86.1	Confident	130 Å²	130	106.5 Å²	106.5	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-59.7	-46	176.8	-76.1	168.7	171.1	164.7	-12.5	111.8	K258 D259 Q264 I265 T266	K258-R262 WeakPolarHBondContact O-CG 3.46Å; K258-R262 PolarHBondContact O-N 3.08Å; D259-R262 PolarHBondContact O-N 3.43Å; D259-R262 IonicContact OD1-CZ 3.28Å; D259-R262 IonicContact OD1-NH1 2.83Å; D259-R262 PolarHBondContact OD1-NH1 3.27Å; R262-Q264 VanDerWaalsContact C-N 3.29Å; R262-Q264 PolarHBondContact O-N 3.14Å; R262-I265 PolarHBondContact O-N 2.9Å; R262-T266 PolarHBondContact O-N 2.73Å; R262-T266 PolarHBondContact O-OG1 3.21Å
263	K	94.1	Very high	88.5	Confident	145 Å²	145	107.4 Å²	107.4	63%	0.63	53%	0.53	S	S	*	.	H	α-helix	trans	-60	-40.9	175.3	-74.2	175.1	-178.6	177.1	0	111.6	D259 D260 I261 T266 F267	D259-K263 WeakPolarHBondContact O-CG 3.5Å; D259-K263 PolarHBondContact O-N 3.31Å; D260-K263 PolarHBondContact O-N 3.06Å; I261-K263 PolarHBondContact O-N 3.48Å; K263-T266 PolarHBondContact O-N 3.37Å; K263-F267 WeakPolarHBondContact O-CB 3.43Å; K263-F267 PolarHBondContact O-N 3.49Å
264	Q	93.8	Very high	90.6	Very high	99 Å²	99	107.4 Å²	107.4	46%	0.463	52%	0.52	S	S	.	.	H	α-helix	trans	-63.2	-42.2	176.5	-171.3	63.1	22.2	0	0	111.8	D260 I261 R262 F267 L268	D260-Q264 WeakPolarHBondContact O-CB 3.42Å; D260-Q264 PolarHBondContact O-N 3.47Å; I261-Q264 WeakPolarHBondContact O-CB 3.27Å; I261-Q264 PolarHBondContact O-N 3.33Å; R262-Q264 VanDerWaalsContact C-N 3.29Å; R262-Q264 PolarHBondContact O-N 3.14Å; Q264-F267 PolarHBondContact O-N 3.29Å; Q264-L268 HydrophobicContact CG-CD1 4.01Å; Q264-L268 HydrophobicContact CG-CG 4.4Å; Q264-L268 WeakPolarHBondContact O-CB 3.49Å; Q264-L268 VanDerWaalsContact O-CG 3.24Å; Q264-L268 WeakPolarHBondContact O-CG 3.48Å; Q264-L268 PolarHBondContact O-N 3.48Å
265	I	95.6	Very high	92.4	Very high	87 Å²	87	107.6 Å²	107.6	45%	0.446	53%	0.529	S	S	.	.	H	α-helix	trans	-62	-49.2	175.4	-68	166.1	0	0	0	110.4	I261 R262 F267 L268 N269	I261-I265 HydrophobicContact CG2-CD1 4.01Å; I261-I265 HydrophobicContact CG2-CG1 4.49Å; I261-I265 WeakPolarHBondContact O-CG1 3.47Å; I261-I265 PolarHBondContact O-N 3.19Å; R262-I265 PolarHBondContact O-N 2.9Å; I265-F267 VanDerWaalsContact C-N 3.3Å; I265-F267 PolarHBondContact O-N 2.74Å; I265-L268 PolarHBondContact O-N 2.95Å; I265-N269 WeakPolarHBondContact O-CB 3.34Å; I265-N269 PolarHBondContact O-N 3.36Å
266	T	96.3	Very high	93.4	Very high	98 Å²	98	104.2 Å²	104.2	60%	0.601	53%	0.527	S	S	*	.	H	α-helix	trans	-57.7	-44.8	177.2	-58.5	0	0	0	0	111.4	R262 K263 A270	R262-T266 PolarHBondContact O-N 2.73Å; R262-T266 PolarHBondContact O-OG1 3.21Å; K263-T266 PolarHBondContact O-N 3.37Å; T266-A270 WeakPolarHBondContact O-CB 3.22Å; T266-A270 PolarHBondContact O-N 2.95Å; T266-A270 VanDerWaalsContact O-N 3.1Å
267	F	95.3	Very high	94.2	Very high	108 Å²	108	105.7 Å²	105.7	47%	0.474	53%	0.53	S	S	.	.	H	α-helix	trans	-59.5	-51.8	176.5	173.1	-99.6	0	0	0	111.4	K263 Q264 I265 N269 A270 Q271	K263-F267 WeakPolarHBondContact O-CB 3.43Å; K263-F267 PolarHBondContact O-N 3.49Å; Q264-F267 PolarHBondContact O-N 3.29Å; I265-F267 VanDerWaalsContact C-N 3.3Å; I265-F267 PolarHBondContact O-N 2.74Å; F267-N269 PolarHBondContact O-N 3.36Å; F267-A270 CarbonylContact O-C 3.56Å; F267-A270 WeakPolarHBondContact O-CB 3.49Å; F267-A270 PolarHBondContact O-N 2.99Å; F267-Q271 HydrophobicContact CD1-CG 4.15Å; F267-Q271 HydrophobicContact CE1-CG 3.79Å; F267-Q271 HydrophobicContact CE2-CG 4.49Å; F267-Q271 HydrophobicContact CZ-CG 3.98Å; F267-Q271 WeakPolarHBondContact O-CG 3.49Å; F267-Q271 PolarHBondContact O-N 2.96Å
268	L	96	Very high	94.6	Very high	81 Å²	81	110.8 Å²	110.8	42%	0.424	55%	0.548	S	S	.	.	H	α-helix	trans	-64.2	-39.6	-177.9	-71.3	173.2	0	0	0	112.8	Q264 I265 A270 Q271 I272	Q264-L268 HydrophobicContact CG-CD1 4.01Å; Q264-L268 HydrophobicContact CG-CG 4.4Å; Q264-L268 WeakPolarHBondContact O-CB 3.49Å; Q264-L268 VanDerWaalsContact O-CG 3.24Å; Q264-L268 WeakPolarHBondContact O-CG 3.48Å; Q264-L268 PolarHBondContact O-N 3.48Å; I265-L268 PolarHBondContact O-N 2.95Å; L268-A270 VanDerWaalsContact C-N 3.33Å; L268-A270 PolarHBondContact O-N 3.46Å; L268-Q271 WeakPolarHBondContact O-CA 3.41Å; L268-Q271 VanDerWaalsContact O-CB 3.3Å; L268-Q271 WeakPolarHBondContact O-CB 3.47Å; L268-Q271 PolarHBondContact O-N 3.03Å; L268-I272 WeakPolarHBondContact O-CG1 3.37Å; L268-I272 PolarHBondContact O-N 2.76Å; L268-I272 VanDerWaalsContact O-N 3.08Å
269	N	96.4	Very high	94.9	Very high	88 Å²	88	110.2 Å²	110.2	47%	0.471	55%	0.549	S	S	.	.	H	α-helix	trans	-59.7	-46.5	173.5	-73.3	-14.1	0	0	0	110.6	I265 F267 Q271 I272 D273	I265-N269 WeakPolarHBondContact O-CB 3.34Å; I265-N269 PolarHBondContact O-N 3.36Å; F267-N269 PolarHBondContact O-N 3.36Å; N269-Q271 PolarHBondContact O-N 3.23Å; N269-I272 PolarHBondContact O-N 3Å; N269-I272 VanDerWaalsContact O-N 3.09Å; N269-D273 PolarHBondContact O-N 3.45Å
270	A	95	Very high	95.1	Very high	53 Å²	53	109.2 Å²	109.2	44%	0.438	55%	0.549	S	S	.	.	H	α-helix	trans	-63.5	-22.2	174.7	0	0	0	0	0	113.4	T266 F267 L268 R274	T266-A270 WeakPolarHBondContact O-CB 3.22Å; T266-A270 PolarHBondContact O-N 2.95Å; T266-A270 VanDerWaalsContact O-N 3.1Å; F267-A270 CarbonylContact O-C 3.56Å; F267-A270 WeakPolarHBondContact O-CB 3.49Å; F267-A270 PolarHBondContact O-N 2.99Å; L268-A270 VanDerWaalsContact C-N 3.33Å; L268-A270 PolarHBondContact O-N 3.46Å; A270-R274 WeakPolarHBondContact O-CG 3.33Å
271	Q	94.9	Very high	95.5	Very high	55 Å²	55	112.7 Å²	112.7	26%	0.257	56%	0.562	S	S	.	*	H	α-helix	trans	-74.3	-39.5	172.4	-59.7	-57.2	-80.4	0	0	112.3	F267 L268 N269 D273 R274	F267-Q271 HydrophobicContact CD1-CG 4.15Å; F267-Q271 HydrophobicContact CE1-CG 3.79Å; F267-Q271 HydrophobicContact CE2-CG 4.49Å; F267-Q271 HydrophobicContact CZ-CG 3.98Å; F267-Q271 WeakPolarHBondContact O-CG 3.49Å; F267-Q271 PolarHBondContact O-N 2.96Å; L268-Q271 WeakPolarHBondContact O-CA 3.41Å; L268-Q271 VanDerWaalsContact O-CB 3.3Å; L268-Q271 WeakPolarHBondContact O-CB 3.47Å; L268-Q271 PolarHBondContact O-N 3.03Å; N269-Q271 PolarHBondContact O-N 3.23Å; Q271-D273 VanDerWaalsContact C-N 3.31Å; Q271-R274 VanDerWaalsContact CD-NH2 3.29Å; Q271-R274 WeakPolarHBondContact O-CB 3.34Å; Q271-R274 PolarHBondContact O-N 2.85Å
272	I	94.5	Very high	95.8	Very high	130 Å²	130	110.6 Å²	110.6	67%	0.667	55%	0.553	S	S	*	*	H	α-helix	trans	-65.8	-37.6	-177.8	-70.1	160.4	0	0	0	110.6	L268 N269 R274	L268-I272 WeakPolarHBondContact O-CG1 3.37Å; L268-I272 PolarHBondContact O-N 2.76Å; L268-I272 VanDerWaalsContact O-N 3.08Å; N269-I272 PolarHBondContact O-N 3Å; N269-I272 VanDerWaalsContact O-N 3.09Å; I272-R274 PolarHBondContact O-N 3.32Å
273	D	94.9	Very high	95.9	Very high	126 Å²	126	106.1 Å²	106.1	67%	0.674	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-7.6	179.8	-63.1	-25.5	0	0	0	113.2	N269 Q271 H275	N269-D273 PolarHBondContact O-N 3.45Å; Q271-D273 VanDerWaalsContact C-N 3.31Å; D273-H275 PolarHBondContact O-N 2.91Å
274	R	94.3	Very high	96.1	Very high	148 Å²	148	104.1 Å²	104.1	56%	0.558	54%	0.537	S	S	*	.	S	Bend	trans	-77.7	119.4	179	-56.1	-158.4	-74.4	-167.2	15.4	110.6	A270 Q271 I272 C276	A270-R274 WeakPolarHBondContact O-CG 3.33Å; Q271-R274 VanDerWaalsContact CD-NH2 3.29Å; Q271-R274 WeakPolarHBondContact O-CB 3.34Å; Q271-R274 PolarHBondContact O-N 2.85Å; I272-R274 PolarHBondContact O-N 3.32Å; R274-C276 PolarHBondContact O-N 2.84Å; R274-C276 VanDerWaalsContact O-N 3.11Å
275	H	94.4	Very high	96.3	Very high	196 Å²	196	103.1 Å²	103.1	91%	0.907	54%	0.541	S	S	*	.			trans	-64.5	111.9	172.2	-70.1	-71.3	0	0	0	110.9	D273	D273-H275 PolarHBondContact O-N 2.91Å
276	C	94.4	Very high	96.5	Very high	116 Å²	116	104 Å²	104	78%	0.784	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-100.9	141.2	176.2	-69.7	0	0	0	0	111	R274	R274-C276 PolarHBondContact O-N 2.84Å; R274-C276 VanDerWaalsContact O-N 3.11Å
277	L	95.6	Very high	96.6	Very high	138 Å²	138	103.9 Å²	103.9	72%	0.723	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-88.7	152.8	172.4	-69.9	166.2	0	0	0	110.7	V282	L277-V282 HydrophobicContact CB-CG2 3.74Å; L277-V282 HydrophobicContact CD1-CG2 4.49Å
278	K	98	Very high	96.7	Very high	164 Å²	164	101.2 Å²	101.2	71%	0.713	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-62.7	140.3	171.1	-68.8	-175.4	178.3	-179.1	0	110	S280 K281 V282	K278-S280 PolarHBondContact O-N 3.16Å; K278-K281 PolarHBondContact O-N 2.91Å; K278-V282 PolarHBondContact O-N 3.24Å
279	M	97.9	Very high	96.8	Very high	133 Å²	133	103.1 Å²	103.1	66%	0.655	54%	0.541	S	S	*	.	H	α-helix	trans	-58.3	-35.3	-178.9	-166.3	61.4	-120.4	0	0	113	K281 V282 A283	M279-K281 VanDerWaalsContact C-N 3.33Å; M279-K281 PolarHBondContact O-N 3.36Å; M279-V282 HydrophobicContact CE-CB 3.74Å; M279-V282 HydrophobicContact CE-CG1 3.66Å; M279-V282 PolarHBondContact O-N 3.28Å; M279-A283 HydrophobicContact CE-CB 4.33Å; M279-A283 WeakPolarHBondContact O-CB 3.41Å; M279-A283 PolarHBondContact O-N 3.15Å
280	S	97.9	Very high	96.9	Very high	66 Å²	66	103 Å²	103	46%	0.462	54%	0.544	S	S	.	.	H	α-helix	trans	-59.5	-42.7	174.2	54.3	0	0	0	0	112.4	K278 A283 E284	K278-S280 PolarHBondContact O-N 3.16Å; S280-A283 PolarHBondContact O-N 2.64Å; S280-E284 WeakPolarHBondContact O-CB 3.49Å; S280-E284 VanDerWaalsContact O-CG 3.25Å; S280-E284 WeakPolarHBondContact O-CG 3.43Å; S280-E284 PolarHBondContact O-N 3.21Å
281	K	98.3	Very high	97	Very high	115 Å²	115	106.9 Å²	106.9	50%	0.5	55%	0.553	S	S	.	*	H	α-helix	trans	-69.6	-36.4	177.6	-67.1	-52.9	-176.7	-171.2	0	113	K278 M279 E284 S285	K278-K281 PolarHBondContact O-N 2.91Å; M279-K281 VanDerWaalsContact C-N 3.33Å; M279-K281 PolarHBondContact O-N 3.36Å; K281-E284 VanDerWaalsContact CD-OE2 3.32Å; K281-E284 WeakPolarHBondContact CD-OE2 3.46Å; K281-E284 IonicContact NZ-OE1 2.67Å; K281-E284 IonicContact NZ-OE2 3.74Å; K281-E284 PolarHBondContact NZ-OE2 3.48Å; K281-S285 VanDerWaalsContact O-CB 3.31Å; K281-S285 WeakPolarHBondContact O-CB 3.34Å; K281-S285 PolarHBondContact O-N 3Å; K281-S285 VanDerWaalsContact O-N 3.1Å
282	V	98.3	Very high	97.1	Very high	47 Å²	47	107.8 Å²	107.8	29%	0.285	56%	0.557	S	S	.	*	H	α-helix	trans	-64	-47.7	173	176.3	0	0	0	0	110.3	L277 K278 M279 S285 L286	L277-V282 HydrophobicContact CB-CG2 3.74Å; L277-V282 HydrophobicContact CD1-CG2 4.49Å; K278-V282 PolarHBondContact O-N 3.24Å; M279-V282 HydrophobicContact CE-CB 3.74Å; M279-V282 HydrophobicContact CE-CG1 3.66Å; M279-V282 PolarHBondContact O-N 3.28Å; V282-S285 PolarHBondContact O-N 3.26Å; V282-L286 HydrophobicContact CG1-CD1 3.89Å; V282-L286 HydrophobicContact CG1-CG 4.4Å; V282-L286 WeakPolarHBondContact O-CG 3.31Å; V282-L286 PolarHBondContact O-N 2.99Å
283	A	98.4	Very high	97.3	Very high	36 Å²	36	102.8 Å²	102.8	30%	0.298	53%	0.53	S	S	.	.	H	α-helix	trans	-63	-48.8	179.7	0	0	0	0	0	112.2	M279 S280 S285 L286 I287	M279-A283 HydrophobicContact CE-CB 4.33Å; M279-A283 WeakPolarHBondContact O-CB 3.41Å; M279-A283 PolarHBondContact O-N 3.15Å; S280-A283 PolarHBondContact O-N 2.64Å; A283-S285 VanDerWaalsContact C-N 3.28Å; A283-S285 PolarHBondContact O-N 3.19Å; A283-L286 PolarHBondContact O-N 3.49Å; A283-I287 WeakPolarHBondContact O-CB 3.48Å; A283-I287 VanDerWaalsContact O-CG1 3.27Å; A283-I287 WeakPolarHBondContact O-CG1 3.29Å; A283-I287 PolarHBondContact O-N 2.94Å
284	E	98.3	Very high	97.4	Very high	102 Å²	102	99.3 Å²	99.3	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-53.6	-45.8	175.4	-76.9	167.6	-156.8	0	0	111.3	S280 K281 A288	S280-E284 WeakPolarHBondContact O-CB 3.49Å; S280-E284 VanDerWaalsContact O-CG 3.25Å; S280-E284 WeakPolarHBondContact O-CG 3.43Å; S280-E284 PolarHBondContact O-N 3.21Å; K281-E284 VanDerWaalsContact CD-OE2 3.32Å; K281-E284 WeakPolarHBondContact CD-OE2 3.46Å; K281-E284 IonicContact NZ-OE1 2.67Å; K281-E284 IonicContact NZ-OE2 3.74Å; K281-E284 PolarHBondContact NZ-OE2 3.48Å; E284-A288 WeakPolarHBondContact O-CB 3.4Å; E284-A288 PolarHBondContact O-N 2.83Å
285	S	98.1	Very high	97.4	Very high	79 Å²	79	97.1 Å²	97.1	55%	0.552	51%	0.509	S	S	*	.	H	α-helix	trans	-65.7	-44.7	179.8	-173.4	0	0	0	0	112.7	K281 V282 A283 A288 Y289	K281-S285 VanDerWaalsContact O-CB 3.31Å; K281-S285 WeakPolarHBondContact O-CB 3.34Å; K281-S285 PolarHBondContact O-N 3Å; K281-S285 VanDerWaalsContact O-N 3.1Å; V282-S285 PolarHBondContact O-N 3.26Å; A283-S285 VanDerWaalsContact C-N 3.28Å; A283-S285 PolarHBondContact O-N 3.19Å; S285-A288 PolarHBondContact O-N 3.04Å; S285-Y289 WeakPolarHBondContact O-CB 3.49Å; S285-Y289 PolarHBondContact O-N 3.03Å
286	L	98.4	Very high	97.4	Very high	104 Å²	104	90 Å²	90	55%	0.545	48%	0.475	S	S	.	.	H	α-helix	trans	-66.8	-39	179.7	-70.4	174.4	0	0	0	112.3	V282 A283 T290	V282-L286 HydrophobicContact CG1-CD1 3.89Å; V282-L286 HydrophobicContact CG1-CG 4.4Å; V282-L286 WeakPolarHBondContact O-CG 3.31Å; V282-L286 PolarHBondContact O-N 2.99Å; A283-L286 PolarHBondContact O-N 3.49Å; L286-T290 WeakPolarHBondContact O-CB 3.48Å; L286-T290 PolarHBondContact O-N 2.96Å; L286-T290 PolarHBondContact O-OG1 3.1Å
287	I	98.4	Very high	97.5	Very high	96 Å²	96	87.3 Å²	87.3	49%	0.492	45%	0.453	S	S	.	.	H	α-helix	trans	-63.7	-52.9	175.3	-68.7	166.3	0	0	0	109.5	A283 Y289 T290 E291	A283-I287 WeakPolarHBondContact O-CB 3.48Å; A283-I287 VanDerWaalsContact O-CG1 3.27Å; A283-I287 WeakPolarHBondContact O-CG1 3.29Å; A283-I287 PolarHBondContact O-N 2.94Å; I287-Y289 VanDerWaalsContact C-N 3.3Å; I287-Y289 PolarHBondContact O-N 2.98Å; I287-T290 PolarHBondContact O-N 2.85Å; I287-E291 HydrophobicContact CG2-CG 4.25Å; I287-E291 WeakPolarHBondContact CG2-OE1 3.43Å; I287-E291 WeakPolarHBondContact O-CG 3.24Å; I287-E291 PolarHBondContact O-N 3.25Å
288	A	98.2	Very high	97.5	Very high	53 Å²	53	83.8 Å²	83.8	44%	0.438	44%	0.438	S	S	.	.	H	α-helix	trans	-59.9	-40.3	-179.6	0	0	0	0	0	112.4	E284 S285 Q292	E284-A288 WeakPolarHBondContact O-CB 3.4Å; E284-A288 PolarHBondContact O-N 2.83Å; S285-A288 PolarHBondContact O-N 3.04Å; A288-Q292 WeakPolarHBondContact O-CB 3.38Å; A288-Q292 PolarHBondContact O-N 3.32Å
289	Y	98.1	Very high	97.4	Very high	121 Å²	121	85 Å²	85	48%	0.475	44%	0.444	S	S	.	.	H	α-helix	trans	-61.1	-47.8	172.9	-175.8	-90.9	0	0	0	110.8	S285 I287 E291 Q292 Y293	S285-Y289 WeakPolarHBondContact O-CB 3.49Å; S285-Y289 PolarHBondContact O-N 3.03Å; I287-Y289 VanDerWaalsContact C-N 3.3Å; I287-Y289 PolarHBondContact O-N 2.98Å; Y289-E291 PolarHBondContact O-N 3.11Å; Y289-Q292 WeakPolarHBondContact O-CB 3.45Å; Y289-Q292 PolarHBondContact O-N 3.34Å; Y289-Y293 HydrophobicContact CD1-CD2 4.32Å; Y289-Y293 HydrophobicContact CD2-CD2 4.3Å; Y289-Y293 AromaticContact CD2-CE2 3.82Å; Y289-Y293 HydrophobicContact CD2-CE2 3.82Å; Y289-Y293 HydrophobicContact CE1-CD2 4.06Å; Y289-Y293 HydrophobicContact CE1-CE2 4.16Å; Y289-Y293 HydrophobicContact CE2-CD2 4.04Å; Y289-Y293 AromaticContact CE2-CE2 3.35Å; Y289-Y293 HydrophobicContact CE2-CE2 3.35Å; Y289-Y293 AromaticContact CE2-CZ 3.96Å; Y289-Y293 HydrophobicContact CG-CD2 4.43Å; Y289-Y293 HydrophobicContact CG-CE2 4.39Å; Y289-Y293 AromaticContact CZ-CD2 3.9Å; Y289-Y293 AromaticContact CZ-CE2 3.54Å; Y289-Y293 VanDerWaalsContact O-CD2 3.28Å; Y289-Y293 WeakPolarHBondContact O-CD2 3.42Å; Y289-Y293 PolarHBondContact O-N 3.11Å
290	T	98.1	Very high	97.4	Very high	86 Å²	86	83.8 Å²	83.8	53%	0.528	44%	0.439	S	S	.	.	H	α-helix	trans	-62.2	-45.4	-179.8	-54.6	0	0	0	0	111.7	L286 I287 Q292 Y293 V294	L286-T290 WeakPolarHBondContact O-CB 3.48Å; L286-T290 PolarHBondContact O-N 2.96Å; L286-T290 PolarHBondContact O-OG1 3.1Å; I287-T290 PolarHBondContact O-N 2.85Å; T290-Q292 VanDerWaalsContact C-N 3.28Å; T290-Q292 PolarHBondContact O-N 3.35Å; T290-Y293 PolarHBondContact O-N 3.43Å; T290-V294 PolarHBondContact O-N 2.87Å
291	E	97.6	Very high	97.2	Very high	133 Å²	133	83 Å²	83	62%	0.621	43%	0.431	S	S	*	.	H	α-helix	trans	-60.3	-37.3	176.7	-71.9	175.8	169.8	0	0	112.1	I287 Y289 Y293 V294	I287-E291 HydrophobicContact CG2-CG 4.25Å; I287-E291 WeakPolarHBondContact CG2-OE1 3.43Å; I287-E291 WeakPolarHBondContact O-CG 3.24Å; I287-E291 PolarHBondContact O-N 3.25Å; Y289-E291 PolarHBondContact O-N 3.11Å; E291-Y293 VanDerWaalsContact C-N 3.29Å; E291-Y293 PolarHBondContact O-N 3.14Å; E291-V294 VanDerWaalsContact O-CG1 3.27Å; E291-V294 WeakPolarHBondContact O-CG1 3.25Å; E291-V294 PolarHBondContact O-N 3Å
292	Q	97.4	Very high	97	Very high	74 Å²	74	82.8 Å²	82.8	35%	0.346	44%	0.442	S	S	.	.	H	α-helix	trans	-64.4	-32.5	178.4	-176.1	174.1	34.3	0	0	113	A288 Y289 T290 F335	A288-Q292 WeakPolarHBondContact O-CB 3.38Å; A288-Q292 PolarHBondContact O-N 3.32Å; Y289-Q292 WeakPolarHBondContact O-CB 3.45Å; Y289-Q292 PolarHBondContact O-N 3.34Å; T290-Q292 VanDerWaalsContact C-N 3.28Å; T290-Q292 PolarHBondContact O-N 3.35Å; Q292-F335 HydrophobicContact CG-CD1 4.04Å; Q292-F335 HydrophobicContact CG-CD2 3.71Å; Q292-F335 HydrophobicContact CG-CE1 4.03Å; Q292-F335 HydrophobicContact CG-CE2 3.69Å; Q292-F335 HydrophobicContact CG-CG 3.86Å; Q292-F335 HydrophobicContact CG-CZ 3.83Å; Q292-F335 VanDerWaalsContact NE2-CD1 3.26Å; Q292-F335 VanDerWaalsContact NE2-CG 3.28Å; Q292-F335 VanDerWaalsContact O-CE2 3.28Å; Q292-F335 WeakPolarHBondContact O-CE2 3.5Å; Q292-F335 WeakPolarHBondContact O-CZ 3.26Å
293	Y	97.3	Very high	96.6	Very high	26 Å²	26	81.7 Å²	81.7	10%	0.102	44%	0.437	C	S	.	.	H	α-helix	trans	-101.7	-0.9	-177.5	-71.1	-98.2	0	0	0	113.9	Y289 T290 E291 E295 Y296 D297 R332 F335 E339	Y289-Y293 HydrophobicContact CD1-CD2 4.32Å; Y289-Y293 HydrophobicContact CD2-CD2 4.3Å; Y289-Y293 AromaticContact CD2-CE2 3.82Å; Y289-Y293 HydrophobicContact CD2-CE2 3.82Å; Y289-Y293 HydrophobicContact CE1-CD2 4.06Å; Y289-Y293 HydrophobicContact CE1-CE2 4.16Å; Y289-Y293 HydrophobicContact CE2-CD2 4.04Å; Y289-Y293 AromaticContact CE2-CE2 3.35Å; Y289-Y293 HydrophobicContact CE2-CE2 3.35Å; Y289-Y293 AromaticContact CE2-CZ 3.96Å; Y289-Y293 HydrophobicContact CG-CD2 4.43Å; Y289-Y293 HydrophobicContact CG-CE2 4.39Å; Y289-Y293 AromaticContact CZ-CD2 3.9Å; Y289-Y293 AromaticContact CZ-CE2 3.54Å; Y289-Y293 VanDerWaalsContact O-CD2 3.28Å; Y289-Y293 WeakPolarHBondContact O-CD2 3.42Å; Y289-Y293 PolarHBondContact O-N 3.11Å; T290-Y293 PolarHBondContact O-N 3.43Å; E291-Y293 VanDerWaalsContact C-N 3.29Å; E291-Y293 PolarHBondContact O-N 3.14Å; Y293-E295 PolarHBondContact O-N 3.26Å; Y293-Y296 CarbonylContact O-C 3.59Å; Y293-Y296 WeakPolarHBondContact O-CA 3.47Å; Y293-Y296 WeakPolarHBondContact O-CB 3.25Å; Y293-Y296 PolarHBondContact O-N 2.8Å; Y293-D297 PolarHBondContact O-N 3.21Å; Y293-R332 HydrophobicContact CE1-CG 4.37Å; Y293-F335 HydrophobicContact CD1-CD2 4.26Å; Y293-F335 HydrophobicContact CD1-CE2 4.39Å; Y293-F335 HydrophobicContact CD2-CD2 4.43Å; Y293-F335 AromaticContact CE1-CD2 3.79Å; Y293-F335 HydrophobicContact CE1-CD2 3.79Å; Y293-F335 HydrophobicContact CE1-CE2 4.35Å; Y293-F335 AromaticContact CE2-CD2 3.98Å; Y293-F335 HydrophobicContact CE2-CD2 3.98Å; Y293-F335 AromaticContact CZ-CD2 3.64Å; Y293-E339 HydrophobicContact CE1-CG 4.42Å; Y293-E339 WeakPolarHBondContact OH-CG 3.22Å; Y293-E339 PolarHBondContact OH-OE1 3.03Å
294	V	97.3	Very high	96.1	Very high	52 Å²	52	86.8 Å²	86.8	32%	0.315	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-58.7	-35.3	-176.8	77.2	0	0	0	0	113	T290 E291 Y296 D297 I300 T301	T290-V294 PolarHBondContact O-N 2.87Å; E291-V294 VanDerWaalsContact O-CG1 3.27Å; E291-V294 WeakPolarHBondContact O-CG1 3.25Å; E291-V294 PolarHBondContact O-N 3Å; V294-Y296 PolarHBondContact O-N 3.25Å; V294-D297 PolarHBondContact O-N 3.04Å; V294-I300 HydrophobicContact CG2-CB 4.29Å; V294-I300 HydrophobicContact CG2-CD1 4.12Å; V294-I300 HydrophobicContact CG2-CG2 3.66Å; V294-T301 WeakPolarHBondContact O-CB 3.27Å; V294-T301 PolarHBondContact O-OG1 2.93Å
295	E	95.3	Very high	95.7	Very high	102 Å²	102	85.5 Å²	85.5	48%	0.477	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-67.2	-16.3	175.6	-67.1	-175.6	166.4	0	0	113	Y293 K331	Y293-E295 PolarHBondContact O-N 3.26Å; E295-K331 IonicContact OE2-NZ 2.69Å; E295-K331 PolarHBondContact OE2-NZ 3.26Å
296	Y	94.7	Very high	95.6	Very high	47 Å²	47	83 Å²	83	18%	0.184	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-107.7	-2	-177.4	-59.4	-96.7	0	0	0	112.8	Y293 V294 P298 Q328 R332 F335	Y293-Y296 CarbonylContact O-C 3.59Å; Y293-Y296 WeakPolarHBondContact O-CA 3.47Å; Y293-Y296 WeakPolarHBondContact O-CB 3.25Å; Y293-Y296 PolarHBondContact O-N 2.8Å; V294-Y296 PolarHBondContact O-N 3.25Å; Y296-P298 WeakPolarHBondContact O-CD 3.39Å; Y296-Q328 HydrophobicContact CE1-CB 4.02Å; Y296-Q328 WeakPolarHBondContact CE1-O 3.46Å; Y296-Q328 PolarHBondContact OH-O 3.48Å; Y296-Q328 VanDerWaalsContact OH-O 3.1Å; Y296-R332 HydrophobicContact CE1-CB 3.86Å; Y296-R332 HydrophobicContact CE1-CG 4.41Å; Y296-F335 HydrophobicContact CD2-CE2 4Å; Y296-F335 HydrophobicContact CD2-CZ 4.43Å; Y296-F335 AromaticContact CE2-CE2 3.42Å; Y296-F335 HydrophobicContact CE2-CE2 3.42Å; Y296-F335 VanDerWaalsContact CE2-CE2 3.42Å; Y296-F335 AromaticContact CE2-CZ 3.49Å; Y296-F335 HydrophobicContact CE2-CZ 3.49Å; Y296-F335 VanDerWaalsContact CE2-CZ 3.49Å; Y296-F335 AromaticContact CZ-CE2 3.97Å; Y296-F335 AromaticContact CZ-CZ 3.96Å
297	D	96.6	Very high	95.4	Very high	60 Å²	60	79.6 Å²	79.6	32%	0.321	42%	0.42	S	S	.	.			trans	-88.9	110.4	177.5	-170.1	-32.7	0	0	0	109.8	Y293 V294 F299 I300 T301	Y293-D297 PolarHBondContact O-N 3.21Å; V294-D297 PolarHBondContact O-N 3.04Å; D297-F299 PolarHBondContact O-N 3.11Å; D297-F299 VanDerWaalsContact O-N 3.14Å; D297-F299 WeakPolarHBondContact OD1-CB 3.36Å; D297-F299 WeakPolarHBondContact OD1-CD2 3.41Å; D297-F299 PolarHBondContact OD1-N 2.87Å; D297-I300 HydrophobicContact CB-CB 4.35Å; D297-I300 HydrophobicContact CB-CD1 4.32Å; D297-I300 HydrophobicContact CB-CG1 4.34Å; D297-I300 PolarHBondContact O-N 3.38Å; D297-I300 VanDerWaalsContact O-N 3.08Å; D297-T301 PolarHBondContact O-N 3.41Å; D297-T301 VanDerWaalsContact O-O 3.12Å
298	P	94.7	Very high	95.3	Very high	64 Å²	64	75.3 Å²	75.3	42%	0.416	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-10.1	-176.3	30.6	-36.7	0	0	0	113.9	Y296 T301 A303	Y296-P298 WeakPolarHBondContact O-CD 3.39Å; P298-T301 WeakPolarHBondContact CA-O 3.46Å; P298-A303 HydrophobicContact CB-CB 4.34Å
299	F	96.6	Very high	95.3	Very high	189 Å²	189	82.4 Å²	82.4	83%	0.829	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-23.3	173.1	-65.3	-73.4	0	0	0	112.8	D297	D297-F299 PolarHBondContact O-N 3.11Å; D297-F299 VanDerWaalsContact O-N 3.14Å; D297-F299 WeakPolarHBondContact OD1-CB 3.36Å; D297-F299 WeakPolarHBondContact OD1-CD2 3.41Å; D297-F299 PolarHBondContact OD1-N 2.87Å
300	I	96.5	Very high	95.2	Very high	107 Å²	107	83.4 Å²	83.4	55%	0.549	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-51.2	-178.1	-56.2	176.5	0	0	0	110.5	V294 D297	V294-I300 HydrophobicContact CG2-CB 4.29Å; V294-I300 HydrophobicContact CG2-CD1 4.12Å; V294-I300 HydrophobicContact CG2-CG2 3.66Å; D297-I300 HydrophobicContact CB-CB 4.35Å; D297-I300 HydrophobicContact CB-CD1 4.32Å; D297-I300 HydrophobicContact CB-CG1 4.34Å; D297-I300 PolarHBondContact O-N 3.38Å; D297-I300 VanDerWaalsContact O-N 3.08Å
301	T	95.3	Very high	95.1	Very high	49 Å²	49	81.7 Å²	81.7	30%	0.301	42%	0.418	S	S	.	.	S	Bend	trans	-105.7	126	179.9	-56.1	0	0	0	0	109.3	V294 D297 P298 A303	V294-T301 WeakPolarHBondContact O-CB 3.27Å; V294-T301 PolarHBondContact O-OG1 2.93Å; D297-T301 PolarHBondContact O-N 3.41Å; D297-T301 VanDerWaalsContact O-O 3.12Å; P298-T301 WeakPolarHBondContact CA-O 3.46Å; T301-A303 PolarHBondContact O-N 3Å
302	P	93.1	Very high	95	Very high	112 Å²	112	82.6 Å²	82.6	73%	0.727	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-56.2	126.1	177.7	-25.7	34.5	0	0	0	111.8
303	A	90.2	Very high	95	Very high	23 Å²	23	82 Å²	82	19%	0.19	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-68.9	137.1	177	0	0	0	0	0	111.2	P298 T301 P305 S306 L316	P298-A303 HydrophobicContact CB-CB 4.34Å; T301-A303 PolarHBondContact O-N 3Å; A303-P305 CarbonylContact O-C 3.57Å; A303-S306 CarbonylContact O-C 3.58Å; A303-S306 WeakPolarHBondContact O-CA 3.45Å; A303-S306 PolarHBondContact O-N 3.45Å; A303-L316 HydrophobicContact CB-CD2 3.68Å
304	E	88	Confident	94.9	Very high	143 Å²	143	85.1 Å²	85.1	67%	0.668	44%	0.444	S	S	*	.	S	Bend	trans	-101.3	128.8	177.3	-66.2	-172.4	170.7	0	0	111	L316	E304-L316 WeakPolarHBondContact O-CD1 3.47Å
305	P	90.8	Very high	94.8	Very high	75 Å²	75	85.3 Å²	85.3	49%	0.487	45%	0.446	S	S	.	.	S	Bend	cis	-81.2	-30.3	11.4	30.1	-35.1	0	0	0	114.5	A303 T315	A303-P305 CarbonylContact O-C 3.57Å; P305-T315 HydrophobicContact CG-CG2 4.03Å
306	S	94.1	Very high	94.7	Very high	28 Å²	28	81.4 Å²	81.4	20%	0.196	43%	0.428	C	S	.	.			trans	-161.4	160	173	63.9	0	0	0	0	110.2	A303 P308 S311	A303-S306 CarbonylContact O-C 3.58Å; A303-S306 WeakPolarHBondContact O-CA 3.45Å; A303-S306 PolarHBondContact O-N 3.45Å; S306-P308 VanDerWaalsContact O-CD 3.32Å; S306-P308 WeakPolarHBondContact O-CD 3.15Å; S306-S311 WeakPolarHBondContact OG-CB 3.48Å; S306-S311 PolarHBondContact OG-OG 2.91Å
307	N	95.4	Very high	94.8	Very high	31 Å²	31	83.8 Å²	83.8	17%	0.166	44%	0.437	C	S	.	.			trans	-75.4	116.8	172.7	-175.8	-26.9	0	0	0	109.8	W309 I310 S311	N307-W309 PolarHBondContact O-N 2.92Å; N307-W309 VanDerWaalsContact O-N 3.07Å; N307-W309 WeakPolarHBondContact OD1-CB 3.48Å; N307-W309 VanDerWaalsContact OD1-CD1 3.25Å; N307-W309 PolarHBondContact OD1-N 3.23Å; N307-W309 VanDerWaalsContact OD1-N 3.08Å; N307-I310 HydrophobicContact CB-CB 4.46Å; N307-I310 HydrophobicContact CB-CD1 4.09Å; N307-I310 HydrophobicContact CB-CG1 4.24Å; N307-I310 PolarHBondContact O-N 2.93Å; N307-S311 PolarHBondContact O-N 3.26Å; N307-S311 PolarHBondContact O-OG 2.95Å; N307-S311 VanDerWaalsContact O-OG 3.05Å
308	P	96.8	Very high	94.6	Very high	7 Å²	7	85.7 Å²	85.7	5%	0.045	45%	0.447	C	S	.	.	H	α-helix	trans	-57.3	-28.1	-175.6	-27.6	36.3	0	0	0	114.2	S306 I310 D312 D313 L316 W317	S306-P308 VanDerWaalsContact O-CD 3.32Å; S306-P308 WeakPolarHBondContact O-CD 3.15Å; P308-I310 PolarHBondContact O-N 3.45Å; P308-D312 VanDerWaalsContact O-CA 3.32Å; P308-D312 WeakPolarHBondContact O-CA 3.21Å; P308-D312 PolarHBondContact O-N 2.97Å; P308-D313 WeakPolarHBondContact CA-O 3.49Å; P308-D313 WeakPolarHBondContact CB-O 3.45Å; P308-D313 WeakPolarHBondContact CG-O 3.44Å; P308-L316 HydrophobicContact CG-CB 3.94Å; P308-L316 HydrophobicContact CG-CD2 4.25Å; P308-W317 HydrophobicContact CB-CD2 4.23Å; P308-W317 HydrophobicContact CB-CE3 4.44Å; P308-W317 HydrophobicContact CB-CH2 4.08Å; P308-W317 HydrophobicContact CB-CZ2 3.83Å; P308-W317 HydrophobicContact CB-CZ3 4.38Å; P308-W317 HydrophobicContact CG-CD2 4.03Å; P308-W317 HydrophobicContact CG-CG 4.25Å; P308-W317 HydrophobicContact CG-CZ2 4.18Å
309	W	96.8	Very high	94.5	Very high	201 Å²	201	85.2 Å²	85.2	76%	0.761	44%	0.44	S	S	*	.	H	α-helix	trans	-73.4	-15.1	178.3	-57.9	108.8	0	0	0	114	N307 W317	N307-W309 PolarHBondContact O-N 2.92Å; N307-W309 VanDerWaalsContact O-N 3.07Å; N307-W309 WeakPolarHBondContact OD1-CB 3.48Å; N307-W309 VanDerWaalsContact OD1-CD1 3.25Å; N307-W309 PolarHBondContact OD1-N 3.23Å; N307-W309 VanDerWaalsContact OD1-N 3.08Å; W309-W317 HydrophobicContact CD2-CZ2 4.42Å; W309-W317 AromaticContact CE2-CZ2 3.71Å; W309-W317 HydrophobicContact CH2-CH2 4.17Å; W309-W317 HydrophobicContact CH2-CZ2 4.44Å; W309-W317 AromaticContact CZ2-CH2 3.91Å; W309-W317 HydrophobicContact CZ2-CH2 3.91Å; W309-W317 AromaticContact CZ2-CZ2 3.73Å; W309-W317 HydrophobicContact CZ2-CZ2 3.73Å; W309-W317 AromaticContact NE1-CZ2 3.81Å
310	I	96.6	Very high	94.2	Very high	142 Å²	142	81.5 Å²	81.5	73%	0.728	43%	0.425	S	S	*	.	H	α-helix	trans	-107.3	-37.7	-179.1	-57.8	177.5	0	0	0	110.5	N307 P308	N307-I310 HydrophobicContact CB-CB 4.46Å; N307-I310 HydrophobicContact CB-CD1 4.09Å; N307-I310 HydrophobicContact CB-CG1 4.24Å; N307-I310 PolarHBondContact O-N 2.93Å; P308-I310 PolarHBondContact O-N 3.45Å
311	S	96.4	Very high	93.9	Very high	51 Å²	51	84.1 Å²	84.1	36%	0.357	44%	0.437	S	S	.	.	H	α-helix	trans	-98.2	-12.1	-174.1	59.1	0	0	0	0	114.6	S306 N307 D313	S306-S311 WeakPolarHBondContact OG-CB 3.48Å; S306-S311 PolarHBondContact OG-OG 2.91Å; N307-S311 PolarHBondContact O-N 3.26Å; N307-S311 PolarHBondContact O-OG 2.95Å; N307-S311 VanDerWaalsContact O-OG 3.05Å; S311-D313 PolarHBondContact O-N 3.41Å; S311-D313 VanDerWaalsContact O-N 3.17Å; S311-D313 PolarHBondContact OG-N 2.97Å
312	D	96.2	Very high	93.7	Very high	151 Å²	151	83.5 Å²	83.5	81%	0.807	44%	0.435	S	S	*	.			trans	55.2	21.3	-167.6	-61.5	-35.6	0	0	0	113.5	P308	P308-D312 VanDerWaalsContact O-CA 3.32Å; P308-D312 WeakPolarHBondContact O-CA 3.21Å; P308-D312 PolarHBondContact O-N 2.97Å
313	D	95.8	Very high	93.6	Very high	61 Å²	61	87.1 Å²	87.1	33%	0.326	44%	0.439	S	S	.	.			trans	-104.1	112.2	176.3	179.1	9.7	0	0	0	110.6	P308 S311 T315	P308-D313 WeakPolarHBondContact CA-O 3.49Å; P308-D313 WeakPolarHBondContact CB-O 3.45Å; P308-D313 WeakPolarHBondContact CG-O 3.44Å; S311-D313 PolarHBondContact O-N 3.41Å; S311-D313 VanDerWaalsContact O-N 3.17Å; S311-D313 PolarHBondContact OG-N 2.97Å; D313-T315 PolarHBondContact O-N 2.74Å; D313-T315 WeakPolarHBondContact OD1-CB 3.38Å; D313-T315 PolarHBondContact OD1-N 3.32Å; D313-T315 PolarHBondContact OD1-OG1 3.32Å; D313-T315 PolarHBondContact OD2-OG1 2.92Å
314	I	96.7	Very high	93.6	Very high	92 Å²	92	92.5 Å²	92.5	47%	0.472	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-0.5	-178.1	63.5	169.3	0	0	0	114	L316 W317 D318	I314-L316 PolarHBondContact O-N 2.84Å; I314-L316 VanDerWaalsContact O-N 3.08Å; I314-W317 HydrophobicContact CB-CE3 4.13Å; I314-W317 HydrophobicContact CG2-CE3 3.88Å; I314-W317 HydrophobicContact CG2-CZ3 3.95Å; I314-W317 PolarHBondContact O-N 3.07Å; I314-D318 PolarHBondContact O-N 3.26Å
315	T	95.4	Very high	93.8	Very high	57 Å²	57	87 Å²	87	35%	0.35	44%	0.437	S	S	.	.	H	α-helix	trans	-52.8	-35.6	-176.2	-62.2	0	0	0	0	112.7	P305 D313 D318 I319	P305-T315 HydrophobicContact CG-CG2 4.03Å; D313-T315 PolarHBondContact O-N 2.74Å; D313-T315 WeakPolarHBondContact OD1-CB 3.38Å; D313-T315 PolarHBondContact OD1-N 3.32Å; D313-T315 PolarHBondContact OD1-OG1 3.32Å; D313-T315 PolarHBondContact OD2-OG1 2.92Å; T315-D318 PolarHBondContact O-N 3.22Å; T315-I319 HydrophobicContact CG2-CD1 3.83Å; T315-I319 HydrophobicContact CG2-CG1 4.37Å; T315-I319 VanDerWaalsContact O-CG1 3.25Å; T315-I319 WeakPolarHBondContact O-CG1 3.25Å; T315-I319 PolarHBondContact O-N 2.86Å
316	L	93.1	Very high	93.8	Very high	20 Å²	20	85.3 Å²	85.3	11%	0.105	43%	0.427	C	S	.	.	H	α-helix	trans	-59	-48.4	175.6	176	65.1	0	0	0	111.9	A303 E304 P308 I314 D318 I319 E320	A303-L316 HydrophobicContact CB-CD2 3.68Å; E304-L316 WeakPolarHBondContact O-CD1 3.47Å; P308-L316 HydrophobicContact CG-CB 3.94Å; P308-L316 HydrophobicContact CG-CD2 4.25Å; I314-L316 PolarHBondContact O-N 2.84Å; I314-L316 VanDerWaalsContact O-N 3.08Å; L316-D318 VanDerWaalsContact C-N 3.32Å; L316-D318 PolarHBondContact O-N 2.95Å; L316-I319 WeakPolarHBondContact O-CB 3.37Å; L316-I319 PolarHBondContact O-N 3.19Å; L316-E320 HydrophobicContact CD1-CG 4.38Å; L316-E320 WeakPolarHBondContact O-CG 3.32Å; L316-E320 PolarHBondContact O-N 3.05Å
317	W	95	Very high	93.7	Very high	97 Å²	97	88.4 Å²	88.4	37%	0.367	44%	0.439	S	S	.	.	H	α-helix	trans	-64.6	-38.7	-179.7	-65.6	-25.1	0	0	0	111.8	P308 W309 I314 I319 E320 M321	P308-W317 HydrophobicContact CB-CD2 4.23Å; P308-W317 HydrophobicContact CB-CE3 4.44Å; P308-W317 HydrophobicContact CB-CH2 4.08Å; P308-W317 HydrophobicContact CB-CZ2 3.83Å; P308-W317 HydrophobicContact CB-CZ3 4.38Å; P308-W317 HydrophobicContact CG-CD2 4.03Å; P308-W317 HydrophobicContact CG-CG 4.25Å; P308-W317 HydrophobicContact CG-CZ2 4.18Å; W309-W317 HydrophobicContact CD2-CZ2 4.42Å; W309-W317 AromaticContact CE2-CZ2 3.71Å; W309-W317 HydrophobicContact CH2-CH2 4.17Å; W309-W317 HydrophobicContact CH2-CZ2 4.44Å; W309-W317 AromaticContact CZ2-CH2 3.91Å; W309-W317 HydrophobicContact CZ2-CH2 3.91Å; W309-W317 AromaticContact CZ2-CZ2 3.73Å; W309-W317 HydrophobicContact CZ2-CZ2 3.73Å; W309-W317 AromaticContact NE1-CZ2 3.81Å; I314-W317 HydrophobicContact CB-CE3 4.13Å; I314-W317 HydrophobicContact CG2-CE3 3.88Å; I314-W317 HydrophobicContact CG2-CZ3 3.95Å; I314-W317 PolarHBondContact O-N 3.07Å; W317-I319 VanDerWaalsContact C-N 3.32Å; W317-I319 PolarHBondContact O-N 3.35Å; W317-E320 PolarHBondContact O-N 3.22Å; W317-M321 WeakPolarHBondContact O-CB 3.46Å; W317-M321 WeakPolarHBondContact O-CG 3.37Å; W317-M321 PolarHBondContact O-N 3.4Å
318	D	94.3	Very high	93.5	Very high	100 Å²	100	91 Å²	91	54%	0.535	45%	0.45	S	S	.	.	H	α-helix	trans	-62	-40.9	174.7	-71.7	-25.3	0	0	0	111.6	I314 T315 L316 M321 S322	I314-D318 PolarHBondContact O-N 3.26Å; T315-D318 PolarHBondContact O-N 3.22Å; L316-D318 VanDerWaalsContact C-N 3.32Å; L316-D318 PolarHBondContact O-N 2.95Å; D318-M321 PolarHBondContact O-N 3.21Å; D318-S322 PolarHBondContact O-N 3.33Å; D318-S322 VanDerWaalsContact O-N 3.08Å
319	I	90.9	Very high	93.4	Very high	54 Å²	54	92.9 Å²	92.9	28%	0.277	46%	0.456	S	S	.	.	H	α-helix	trans	-64.4	-43.6	175	-68.8	165.3	0	0	0	110.8	T315 L316 W317 M321 S322	T315-I319 HydrophobicContact CG2-CD1 3.83Å; T315-I319 HydrophobicContact CG2-CG1 4.37Å; T315-I319 VanDerWaalsContact O-CG1 3.25Å; T315-I319 WeakPolarHBondContact O-CG1 3.25Å; T315-I319 PolarHBondContact O-N 2.86Å; L316-I319 WeakPolarHBondContact O-CB 3.37Å; L316-I319 PolarHBondContact O-N 3.19Å; W317-I319 VanDerWaalsContact C-N 3.32Å; W317-I319 PolarHBondContact O-N 3.35Å; I319-M321 PolarHBondContact O-N 3.34Å; I319-S322 WeakPolarHBondContact O-CB 3.36Å; I319-S322 PolarHBondContact O-N 3.43Å
320	E	90.1	Very high	93.3	Very high	111 Å²	111	83.4 Å²	83.4	52%	0.519	42%	0.42	S	S	.	.	H	α-helix	trans	-66.7	-34.6	179.3	-73.2	-175.7	160.6	0	0	112.7	L316 W317 S322 R329	L316-E320 HydrophobicContact CD1-CG 4.38Å; L316-E320 WeakPolarHBondContact O-CG 3.32Å; L316-E320 PolarHBondContact O-N 3.05Å; W317-E320 PolarHBondContact O-N 3.22Å; E320-S322 VanDerWaalsContact C-N 3.32Å; E320-R329 PolarHBondContact O-NH1 2.92Å
321	M	90.9	Very high	93.3	Very high	162 Å²	162	80.6 Å²	80.6	80%	0.798	40%	0.402	S	S	*	.	H	α-helix	trans	-80.8	-11.3	176.1	-69.9	-174.9	64.3	0	0	113.8	W317 D318 I319	W317-M321 WeakPolarHBondContact O-CB 3.46Å; W317-M321 WeakPolarHBondContact O-CG 3.37Å; W317-M321 PolarHBondContact O-N 3.4Å; D318-M321 PolarHBondContact O-N 3.21Å; I319-M321 PolarHBondContact O-N 3.34Å
322	S	91.5	Very high	93.3	Very high	36 Å²	36	82.7 Å²	82.7	25%	0.252	40%	0.403	S	S	.	.			trans	-57.8	147.7	-179.7	-177	0	0	0	0	112.6	D318 I319 E320 E324 R329	D318-S322 PolarHBondContact O-N 3.33Å; D318-S322 VanDerWaalsContact O-N 3.08Å; I319-S322 WeakPolarHBondContact O-CB 3.36Å; I319-S322 PolarHBondContact O-N 3.43Å; E320-S322 VanDerWaalsContact C-N 3.32Å; S322-E324 PolarHBondContact OG-N 3.02Å; S322-E324 PolarHBondContact OG-O 2.9Å; S322-R329 PolarHBondContact O-NH1 3.18Å
323	K	90.9	Very high	93.3	Very high	188 Å²	188	75.6 Å²	75.6	82%	0.817	36%	0.364	S	S	*	.	S	Bend	trans	-74.7	-18	168.4	-66.4	-173.3	179.7	-177.3	0	112.5	P325	K323-P325 WeakPolarHBondContact O-CD 3.46Å
324	E	90.3	Very high	93.4	Very high	135 Å²	135	73.9 Å²	73.9	63%	0.631	36%	0.361	S	S	*	.	S	Bend	trans	-95.9	102.5	171.9	-66.7	-178.3	-178.7	0	0	108.9	S322	S322-E324 PolarHBondContact OG-N 3.02Å; S322-E324 PolarHBondContact OG-O 2.9Å
325	P	91.4	Very high	93.4	Very high	28 Å²	28	71.5 Å²	71.5	18%	0.182	35%	0.347	C	S	.	.			trans	-73.8	143.7	-172.9	33.1	-35.5	0	0	0	110.5	K323 R329 V330 W333 V345	K323-P325 WeakPolarHBondContact O-CD 3.46Å; P325-R329 HydrophobicContact CB-CB 4.37Å; P325-R329 HydrophobicContact CB-CG 4.25Å; P325-V330 HydrophobicContact CB-CG2 3.82Å; P325-V330 HydrophobicContact CG-CG2 3.62Å; P325-W333 HydrophobicContact CB-CH2 4.06Å; P325-W333 HydrophobicContact CB-CZ2 3.94Å; P325-W333 HydrophobicContact CG-CH2 3.76Å; P325-W333 HydrophobicContact CG-CZ2 4.17Å; P325-V345 HydrophobicContact CG-CG1 4.08Å
326	S	91.1	Very high	93.5	Very high	40 Å²	40	70.2 Å²	70.2	28%	0.28	34%	0.341	S	S	.	.			trans	-68.7	160.3	171.1	71.2	0	0	0	0	111.2	Q328 R329 V330	S326-Q328 VanDerWaalsContact C-N 3.26Å; S326-Q328 PolarHBondContact O-N 3.4Å; S326-R329 WeakPolarHBondContact O-CB 3.49Å; S326-R329 PolarHBondContact O-N 2.87Å; S326-R329 VanDerWaalsContact O-N 3.11Å; S326-R329 WeakPolarHBondContact OG-CB 3.46Å; S326-R329 PolarHBondContact OG-N 3.07Å; S326-V330 WeakPolarHBondContact O-CG2 3.15Å; S326-V330 PolarHBondContact O-N 3.3Å
327	Q	91.4	Very high	93.7	Very high	93 Å²	93	69.3 Å²	69.3	44%	0.435	34%	0.336	S	S	.	.	H	α-helix	trans	-57.2	-39.9	176.4	-174.9	178.1	38.3	0	0	112.3	V330 K331 L451	Q327-V330 PolarHBondContact O-N 3.06Å; Q327-K331 WeakPolarHBondContact O-CB 3.33Å; Q327-K331 PolarHBondContact O-N 2.95Å; Q327-L451 WeakPolarHBondContact CG-O 3.33Å; Q327-L451 PolarHBondContact NE2-O 2.72Å
328	Q	91.4	Very high	93.8	Very high	86 Å²	86	67.5 Å²	67.5	40%	0.402	33%	0.334	S	S	.	.	H	α-helix	trans	-63.3	-45.1	176.1	-72.4	179.9	-14.6	0	0	111.2	Y296 S326 V330 K331 R332	Y296-Q328 HydrophobicContact CE1-CB 4.02Å; Y296-Q328 WeakPolarHBondContact CE1-O 3.46Å; Y296-Q328 PolarHBondContact OH-O 3.48Å; Y296-Q328 VanDerWaalsContact OH-O 3.1Å; S326-Q328 VanDerWaalsContact C-N 3.26Å; S326-Q328 PolarHBondContact O-N 3.4Å; Q328-V330 VanDerWaalsContact C-N 3.32Å; Q328-V330 PolarHBondContact O-N 3.44Å; Q328-K331 PolarHBondContact O-N 3.45Å; Q328-R332 PolarHBondContact O-N 2.94Å
329	R	94.4	Very high	94	Very high	46 Å²	46	63.1 Å²	63.1	17%	0.174	31%	0.31	C	S	.	.	H	α-helix	trans	-59.9	-42.1	176.6	-174.8	171.7	172.9	-157.8	-8.6	111.8	E320 S322 P325 S326 R332 W333 D343	E320-R329 PolarHBondContact O-NH1 2.92Å; S322-R329 PolarHBondContact O-NH1 3.18Å; P325-R329 HydrophobicContact CB-CB 4.37Å; P325-R329 HydrophobicContact CB-CG 4.25Å; S326-R329 WeakPolarHBondContact O-CB 3.49Å; S326-R329 PolarHBondContact O-N 2.87Å; S326-R329 VanDerWaalsContact O-N 3.11Å; S326-R329 WeakPolarHBondContact OG-CB 3.46Å; S326-R329 PolarHBondContact OG-N 3.07Å; R329-R332 WeakPolarHBondContact O-CB 3.32Å; R329-R332 PolarHBondContact O-N 2.95Å; R329-W333 VanDerWaalsContact O-CD1 3.27Å; R329-W333 PolarHBondContact O-NE1 3.32Å; R329-D343 WeakPolarHBondContact CG-OD2 3.45Å; R329-D343 IonicContact CZ-OD1 3.75Å; R329-D343 IonicContact CZ-OD2 2.71Å; R329-D343 IonicContact NE-OD1 2.82Å; R329-D343 IonicContact NE-OD2 2.77Å; R329-D343 PolarHBondContact NE-OD2 2.8Å; R329-D343 IonicContact NH2-OD1 2.94Å; R329-D343 PolarHBondContact NH2-OD1 3.09Å; R329-D343 IonicContact NH2-OD2 3.12Å; R329-D343 PolarHBondContact NH2-OD2 3.22Å
330	V	95.9	Very high	94.3	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-44.8	175.1	178.9	0	0	0	0	111.7	P325 S326 Q327 Q328 R332 W333 Y447 L450 L451	P325-V330 HydrophobicContact CB-CG2 3.82Å; P325-V330 HydrophobicContact CG-CG2 3.62Å; S326-V330 WeakPolarHBondContact O-CG2 3.15Å; S326-V330 PolarHBondContact O-N 3.3Å; Q327-V330 PolarHBondContact O-N 3.06Å; Q328-V330 VanDerWaalsContact C-N 3.32Å; Q328-V330 PolarHBondContact O-N 3.44Å; V330-R332 PolarHBondContact O-N 3.32Å; V330-W333 HydrophobicContact CB-CE3 4.3Å; V330-W333 HydrophobicContact CB-CZ3 4.4Å; V330-W333 HydrophobicContact CG1-CE3 3.94Å; V330-W333 HydrophobicContact CG1-CZ3 4.12Å; V330-W333 HydrophobicContact CG2-CE3 4.32Å; V330-W333 HydrophobicContact CG2-CH2 4.02Å; V330-W333 HydrophobicContact CG2-CZ2 4.44Å; V330-W333 HydrophobicContact CG2-CZ3 3.94Å; V330-W333 VanDerWaalsContact O-CB 3.29Å; V330-W333 WeakPolarHBondContact O-CB 3.48Å; V330-W333 PolarHBondContact O-N 2.85Å; V330-Y447 HydrophobicContact CG1-CD2 4.17Å; V330-Y447 HydrophobicContact CG1-CE2 3.72Å; V330-Y447 PolarHBondContact O-OH 3.16Å; V330-L450 HydrophobicContact CG1-CB 4.04Å; V330-L450 HydrophobicContact CG2-CB 4.41Å; V330-L451 HydrophobicContact CG1-CB 4.29Å; V330-L451 HydrophobicContact CG1-CD1 4.3Å
331	K	95.7	Very high	94.7	Very high	83 Å²	83	55.6 Å²	55.6	36%	0.361	27%	0.274	S	S	.	.	H	α-helix	trans	-55.6	-38.9	177.4	-179	-176.3	174.2	-166.6	0	111.3	E295 Q327 Q328 W333 G334 F335 L451	E295-K331 IonicContact OE2-NZ 2.69Å; E295-K331 PolarHBondContact OE2-NZ 3.26Å; Q327-K331 WeakPolarHBondContact O-CB 3.33Å; Q327-K331 PolarHBondContact O-N 2.95Å; Q328-K331 PolarHBondContact O-N 3.45Å; K331-W333 VanDerWaalsContact C-N 3.32Å; K331-W333 PolarHBondContact O-N 3.2Å; K331-G334 PolarHBondContact O-N 2.91Å; K331-G334 VanDerWaalsContact O-N 3.15Å; K331-F335 HydrophobicContact CG-CE1 4.29Å; K331-L451 HydrophobicContact CB-CD1 3.89Å
332	R	96.6	Very high	94.9	Very high	95 Å²	95	54.1 Å²	54.1	36%	0.358	26%	0.263	S	S	.	.	H	α-helix	trans	-63.4	-32.7	177.8	-172.8	174.1	168.7	173.7	-0.2	113.3	Y293 Y296 Q328 R329 V330 G334 F335 E339	Y293-R332 HydrophobicContact CE1-CG 4.37Å; Y296-R332 HydrophobicContact CE1-CB 3.86Å; Y296-R332 HydrophobicContact CE1-CG 4.41Å; Q328-R332 PolarHBondContact O-N 2.94Å; R329-R332 WeakPolarHBondContact O-CB 3.32Å; R329-R332 PolarHBondContact O-N 2.95Å; V330-R332 PolarHBondContact O-N 3.32Å; R332-G334 PolarHBondContact O-N 3.42Å; R332-F335 HydrophobicContact CB-CD2 4.47Å; R332-F335 HydrophobicContact CG-CD2 4.05Å; R332-F335 HydrophobicContact CG-CE2 4.37Å; R332-F335 VanDerWaalsContact O-CB 3.31Å; R332-F335 WeakPolarHBondContact O-CB 3.44Å; R332-F335 WeakPolarHBondContact O-CG 3.42Å; R332-F335 PolarHBondContact O-N 2.97Å; R332-E339 HydrophobicContact CG-CG 4.32Å; R332-E339 IonicContact CZ-OE2 2.72Å; R332-E339 IonicContact NE-OE2 2.96Å; R332-E339 PolarHBondContact NE-OE2 3.39Å; R332-E339 IonicContact NH2-OE2 3.85Å; R332-E339 PolarHBondContact NH2-OE2 3.46Å; R332-E339 WeakPolarHBondContact O-CB 3.46Å
333	W	97.4	Very high	95.2	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.008	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-28.1	175	-58	-17.3	0	0	0	112.6	P325 R329 V330 K331 F335 I340 D343 V345 Q349 Y438 Y447 L450	P325-W333 HydrophobicContact CB-CH2 4.06Å; P325-W333 HydrophobicContact CB-CZ2 3.94Å; P325-W333 HydrophobicContact CG-CH2 3.76Å; P325-W333 HydrophobicContact CG-CZ2 4.17Å; R329-W333 VanDerWaalsContact O-CD1 3.27Å; R329-W333 PolarHBondContact O-NE1 3.32Å; V330-W333 HydrophobicContact CB-CE3 4.3Å; V330-W333 HydrophobicContact CB-CZ3 4.4Å; V330-W333 HydrophobicContact CG1-CE3 3.94Å; V330-W333 HydrophobicContact CG1-CZ3 4.12Å; V330-W333 HydrophobicContact CG2-CE3 4.32Å; V330-W333 HydrophobicContact CG2-CH2 4.02Å; V330-W333 HydrophobicContact CG2-CZ2 4.44Å; V330-W333 HydrophobicContact CG2-CZ3 3.94Å; V330-W333 VanDerWaalsContact O-CB 3.29Å; V330-W333 WeakPolarHBondContact O-CB 3.48Å; V330-W333 PolarHBondContact O-N 2.85Å; K331-W333 VanDerWaalsContact C-N 3.32Å; K331-W333 PolarHBondContact O-N 3.2Å; W333-F335 VanDerWaalsContact C-N 3.29Å; W333-F335 PolarHBondContact O-N 3.09Å; W333-I340 HydrophobicContact CB-CB 4.01Å; W333-I340 HydrophobicContact CB-CD1 4.45Å; W333-I340 HydrophobicContact CB-CG1 4.25Å; W333-I340 HydrophobicContact CG-CB 4.38Å; W333-I340 HydrophobicContact CG-CG1 4.33Å; W333-D343 PolarHBondContact NE1-OD2 3.3Å; W333-V345 HydrophobicContact CH2-CB 4.36Å; W333-V345 HydrophobicContact CH2-CG1 3.94Å; W333-V345 HydrophobicContact CZ2-CB 4.13Å; W333-V345 HydrophobicContact CZ2-CG1 4.19Å; W333-Q349 HydrophobicContact CH2-CG 4.37Å; W333-Q349 HydrophobicContact CZ3-CG 4.36Å; W333-Y438 PolarHBondContact O-OH 2.99Å; W333-Y447 HydrophobicContact CB-CE2 4.39Å; W333-Y447 HydrophobicContact CE3-CE2 4.41Å; W333-L450 HydrophobicContact CZ3-CD1 4.22Å
334	G	96.9	Very high	95.4	Very high	25 Å²	25	49.4 Å²	49.4	26%	0.258	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-10.7	177.1	0	0	0	0	0	114.9	K331 R332 Y438	K331-G334 PolarHBondContact O-N 2.91Å; K331-G334 VanDerWaalsContact O-N 3.15Å; R332-G334 PolarHBondContact O-N 3.42Å; G334-Y438 WeakPolarHBondContact CA-OH 3.33Å; G334-Y438 PolarHBondContact O-OH 3.38Å
335	F	97	Very high	95.7	Very high	42 Å²	42	43.7 Å²	43.7	18%	0.184	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-39.9	-176	-68.1	-5.3	0	0	0	112.5	Q292 Y293 Y296 K331 R332 W333 E339	Q292-F335 HydrophobicContact CG-CD1 4.04Å; Q292-F335 HydrophobicContact CG-CD2 3.71Å; Q292-F335 HydrophobicContact CG-CE1 4.03Å; Q292-F335 HydrophobicContact CG-CE2 3.69Å; Q292-F335 HydrophobicContact CG-CG 3.86Å; Q292-F335 HydrophobicContact CG-CZ 3.83Å; Q292-F335 VanDerWaalsContact NE2-CD1 3.26Å; Q292-F335 VanDerWaalsContact NE2-CG 3.28Å; Q292-F335 VanDerWaalsContact O-CE2 3.28Å; Q292-F335 WeakPolarHBondContact O-CE2 3.5Å; Q292-F335 WeakPolarHBondContact O-CZ 3.26Å; Y293-F335 HydrophobicContact CD1-CD2 4.26Å; Y293-F335 HydrophobicContact CD1-CE2 4.39Å; Y293-F335 HydrophobicContact CD2-CD2 4.43Å; Y293-F335 AromaticContact CE1-CD2 3.79Å; Y293-F335 HydrophobicContact CE1-CD2 3.79Å; Y293-F335 HydrophobicContact CE1-CE2 4.35Å; Y293-F335 AromaticContact CE2-CD2 3.98Å; Y293-F335 HydrophobicContact CE2-CD2 3.98Å; Y293-F335 AromaticContact CZ-CD2 3.64Å; Y296-F335 HydrophobicContact CD2-CE2 4Å; Y296-F335 HydrophobicContact CD2-CZ 4.43Å; Y296-F335 AromaticContact CE2-CE2 3.42Å; Y296-F335 HydrophobicContact CE2-CE2 3.42Å; Y296-F335 VanDerWaalsContact CE2-CE2 3.42Å; Y296-F335 AromaticContact CE2-CZ 3.49Å; Y296-F335 HydrophobicContact CE2-CZ 3.49Å; Y296-F335 VanDerWaalsContact CE2-CZ 3.49Å; Y296-F335 AromaticContact CZ-CE2 3.97Å; Y296-F335 AromaticContact CZ-CZ 3.96Å; K331-F335 HydrophobicContact CG-CE1 4.29Å; R332-F335 HydrophobicContact CB-CD2 4.47Å; R332-F335 HydrophobicContact CG-CD2 4.05Å; R332-F335 HydrophobicContact CG-CE2 4.37Å; R332-F335 VanDerWaalsContact O-CB 3.31Å; R332-F335 WeakPolarHBondContact O-CB 3.44Å; R332-F335 WeakPolarHBondContact O-CG 3.42Å; R332-F335 PolarHBondContact O-N 2.97Å; W333-F335 VanDerWaalsContact C-N 3.29Å; W333-F335 PolarHBondContact O-N 3.09Å; F335-E339 HydrophobicContact CB-CG 4.28Å
336	S	97.3	Very high	95.9	Very high	31 Å²	31	42.3 Å²	42.3	22%	0.217	21%	0.206	C	C	.	.			trans	-161.3	158.8	175.8	73.7	0	0	0	0	110.8	D338 E339 Y438	S336-D338 PolarHBondContact O-N 3Å; S336-D338 PolarHBondContact OG-N 3.47Å; S336-E339 PolarHBondContact O-N 2.9Å; S336-E339 PolarHBondContact OG-N 2.98Å; S336-Y438 PolarHBondContact N-OH 3.49Å; S336-Y438 PolarHBondContact O-OH 2.89Å
337	F	98.1	Very high	96.2	Very high	1 Å²	1	42.8 Å²	42.8	0%	0.004	20%	0.202	C	C	.	.	H	α-helix	trans	-59.6	-29.6	175.1	-171.9	-138.1	0	0	0	112.5	E339 I340 L341 F350 Y430 M433 K434 Y438	F337-E339 VanDerWaalsContact C-N 3.34Å; F337-E339 PolarHBondContact O-N 3.41Å; F337-I340 HydrophobicContact CD2-CG2 3.78Å; F337-I340 HydrophobicContact CE2-CG2 4.29Å; F337-I340 WeakPolarHBondContact O-CG2 3.4Å; F337-L341 HydrophobicContact CD1-CD1 3.83Å; F337-L341 HydrophobicContact CD2-CD1 4.32Å; F337-L341 HydrophobicContact CD2-CG 4.2Å; F337-L341 HydrophobicContact CE1-CD1 3.56Å; F337-L341 HydrophobicContact CE1-CG 4.34Å; F337-L341 HydrophobicContact CE2-CD1 4.06Å; F337-L341 HydrophobicContact CE2-CD2 4.11Å; F337-L341 HydrophobicContact CE2-CG 3.93Å; F337-L341 HydrophobicContact CG-CD1 4.22Å; F337-L341 HydrophobicContact CZ-CD1 3.67Å; F337-L341 HydrophobicContact CZ-CD2 4.1Å; F337-L341 HydrophobicContact CZ-CG 4.01Å; F337-L341 WeakPolarHBondContact O-CB 3.5Å; F337-L341 VanDerWaalsContact O-CG 3.28Å; F337-L341 WeakPolarHBondContact O-CG 3.49Å; F337-L341 PolarHBondContact O-N 2.97Å; F337-L341 VanDerWaalsContact O-N 3.14Å; F337-F350 HydrophobicContact CE2-CD1 4.2Å; F337-F350 AromaticContact CE2-CE1 3.52Å; F337-F350 HydrophobicContact CE2-CE1 3.52Å; F337-F350 AromaticContact CE2-CZ 3.87Å; F337-F350 HydrophobicContact CE2-CZ 3.87Å; F337-F350 AromaticContact CZ-CE1 3.93Å; F337-F350 HydrophobicContact CZ-CE1 3.93Å; F337-F350 HydrophobicContact CZ-CZ 4.38Å; F337-Y430 AromaticContact CD1-CD2 3.85Å; F337-Y430 HydrophobicContact CD1-CD2 3.85Å; F337-Y430 HydrophobicContact CD1-CE1 4.33Å; F337-Y430 AromaticContact CD1-CE2 3.48Å; F337-Y430 HydrophobicContact CD1-CE2 3.48Å; F337-Y430 VanDerWaalsContact CD1-CE2 3.48Å; F337-Y430 HydrophobicContact CD1-CG 4.45Å; F337-Y430 AromaticContact CD1-CZ 3.73Å; F337-Y430 AromaticContact CE1-CD2 3.73Å; F337-Y430 HydrophobicContact CE1-CD2 3.73Å; F337-Y430 AromaticContact CE1-CE2 3.85Å; F337-Y430 HydrophobicContact CE1-CE2 3.85Å; F337-Y430 HydrophobicContact CE1-CG 4.29Å; F337-M433 HydrophobicContact CE1-CB 3.84Å; F337-M433 HydrophobicContact CE1-CE 4.28Å; F337-M433 HydrophobicContact CE2-CB 4.43Å; F337-M433 HydrophobicContact CZ-CB 3.51Å; F337-M433 HydrophobicContact CZ-CE 4Å; F337-M433 HydrophobicContact CZ-SD 4.32Å; F337-K434 HydrophobicContact CB-CB 4.33Å; F337-K434 HydrophobicContact CB-CD 4.22Å; F337-K434 HydrophobicContact CB-CG 3.93Å; F337-K434 HydrophobicContact CD1-CB 3.61Å; F337-K434 HydrophobicContact CD1-CD 4.39Å; F337-K434 HydrophobicContact CD1-CG 4.12Å; F337-K434 HydrophobicContact CE1-CB 4.17Å; F337-K434 HydrophobicContact CG-CB 4.16Å; F337-K434 HydrophobicContact CG-CG 4.31Å; F337-Y438 HydrophobicContact CB-CD1 3.92Å; F337-Y438 HydrophobicContact CB-CD2 4.49Å; F337-Y438 HydrophobicContact CB-CE1 4.09Å; F337-Y438 HydrophobicContact CB-CG 4.13Å; F337-Y438 HydrophobicContact CD2-CD1 4.18Å; F337-Y438 AromaticContact CD2-CD2 3.56Å; F337-Y438 HydrophobicContact CD2-CD2 3.56Å; F337-Y438 HydrophobicContact CD2-CE2 4.25Å; F337-Y438 AromaticContact CD2-CG 3.51Å; F337-Y438 HydrophobicContact CD2-CG 3.51Å; F337-Y438 HydrophobicContact CE2-CD2 4.27Å; F337-Y438 HydrophobicContact CE2-CG 4.25Å; F337-Y438 HydrophobicContact CG-CD1 4.36Å; F337-Y438 HydrophobicContact CG-CD2 4.45Å; F337-Y438 HydrophobicContact CG-CG 4.12Å
338	D	97.3	Very high	96.5	Very high	58 Å²	58	41.1 Å²	41.1	31%	0.31	20%	0.196	S	C	.	.	H	α-helix	trans	-68.3	-32.3	176.1	-58.4	-68.1	0	0	0	112.5	S336 L341 K342 Y430	S336-D338 PolarHBondContact O-N 3Å; S336-D338 PolarHBondContact OG-N 3.47Å; D338-L341 PolarHBondContact O-N 3.38Å; D338-K342 WeakPolarHBondContact O-CB 3.39Å; D338-K342 WeakPolarHBondContact O-CD 3.38Å; D338-K342 WeakPolarHBondContact O-CG 3.42Å; D338-K342 PolarHBondContact O-N 3.05Å; D338-Y430 PolarHBondContact OD1-OH 3.39Å; D338-Y430 PolarHBondContact OD2-OH 3.47Å
339	E	97.8	Very high	96.7	Very high	8 Å²	8	39.1 Å²	39.1	4%	0.037	19%	0.186	C	C	.	.	H	α-helix	trans	-66.8	-45.1	179.4	-70.6	-53	114.6	0	0	111.8	Y293 R332 F335 S336 F337 L341 K342 D343	Y293-E339 HydrophobicContact CE1-CG 4.42Å; Y293-E339 WeakPolarHBondContact OH-CG 3.22Å; Y293-E339 PolarHBondContact OH-OE1 3.03Å; R332-E339 HydrophobicContact CG-CG 4.32Å; R332-E339 IonicContact CZ-OE2 2.72Å; R332-E339 IonicContact NE-OE2 2.96Å; R332-E339 PolarHBondContact NE-OE2 3.39Å; R332-E339 IonicContact NH2-OE2 3.85Å; R332-E339 PolarHBondContact NH2-OE2 3.46Å; R332-E339 WeakPolarHBondContact O-CB 3.46Å; F335-E339 HydrophobicContact CB-CG 4.28Å; S336-E339 PolarHBondContact O-N 2.9Å; S336-E339 PolarHBondContact OG-N 2.98Å; F337-E339 VanDerWaalsContact C-N 3.34Å; F337-E339 PolarHBondContact O-N 3.41Å; E339-L341 VanDerWaalsContact C-N 3.34Å; E339-K342 PolarHBondContact O-N 3.49Å; E339-K342 IonicContact OE1-NZ 2.72Å; E339-K342 PolarHBondContact OE1-NZ 2.96Å; E339-D343 PolarHBondContact O-N 2.83Å
340	I	97.4	Very high	96.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-67.1	-36.2	175.5	-168.3	168.6	0	0	0	112	W333 F337 K342 D343 G346 R347 F350 Y438 F441	W333-I340 HydrophobicContact CB-CB 4.01Å; W333-I340 HydrophobicContact CB-CD1 4.45Å; W333-I340 HydrophobicContact CB-CG1 4.25Å; W333-I340 HydrophobicContact CG-CB 4.38Å; W333-I340 HydrophobicContact CG-CG1 4.33Å; F337-I340 HydrophobicContact CD2-CG2 3.78Å; F337-I340 HydrophobicContact CE2-CG2 4.29Å; F337-I340 WeakPolarHBondContact O-CG2 3.4Å; I340-K342 VanDerWaalsContact C-N 3.35Å; I340-D343 PolarHBondContact O-N 2.67Å; I340-D343 VanDerWaalsContact O-O 3.13Å; I340-G346 WeakPolarHBondContact CG1-O 3.38Å; I340-R347 PolarHBondContact O-N 3.44Å; I340-F350 HydrophobicContact CD1-CB 3.78Å; I340-F350 HydrophobicContact CD1-CG 4.23Å; I340-F350 HydrophobicContact CG1-CB 4.37Å; I340-Y438 HydrophobicContact CB-CE2 4.41Å; I340-Y438 HydrophobicContact CG2-CD2 3.89Å; I340-Y438 HydrophobicContact CG2-CE2 3.65Å; I340-F441 HydrophobicContact CD1-CD1 3.73Å; I340-F441 HydrophobicContact CD1-CE1 3.22Å; I340-F441 HydrophobicContact CD1-CZ 3.83Å
341	L	97.2	Very high	97	Very high	8 Å²	8	38.8 Å²	38.8	4%	0.042	19%	0.188	C	C	.	.	H	α-helix	trans	-72.6	-24.9	178.4	-72.2	-179.3	0	0	0	113.3	F337 D338 E339 R347 L363 W366 Y430	F337-L341 HydrophobicContact CD1-CD1 3.83Å; F337-L341 HydrophobicContact CD2-CD1 4.32Å; F337-L341 HydrophobicContact CD2-CG 4.2Å; F337-L341 HydrophobicContact CE1-CD1 3.56Å; F337-L341 HydrophobicContact CE1-CG 4.34Å; F337-L341 HydrophobicContact CE2-CD1 4.06Å; F337-L341 HydrophobicContact CE2-CD2 4.11Å; F337-L341 HydrophobicContact CE2-CG 3.93Å; F337-L341 HydrophobicContact CG-CD1 4.22Å; F337-L341 HydrophobicContact CZ-CD1 3.67Å; F337-L341 HydrophobicContact CZ-CD2 4.1Å; F337-L341 HydrophobicContact CZ-CG 4.01Å; F337-L341 WeakPolarHBondContact O-CB 3.5Å; F337-L341 VanDerWaalsContact O-CG 3.28Å; F337-L341 WeakPolarHBondContact O-CG 3.49Å; F337-L341 PolarHBondContact O-N 2.97Å; F337-L341 VanDerWaalsContact O-N 3.14Å; D338-L341 PolarHBondContact O-N 3.38Å; E339-L341 VanDerWaalsContact C-N 3.34Å; L341-R347 VanDerWaalsContact O-CD 3.27Å; L341-R347 WeakPolarHBondContact O-CD 3.06Å; L341-R347 WeakPolarHBondContact O-CG 3.14Å; L341-R347 PolarHBondContact O-NH1 3.15Å; L341-L363 HydrophobicContact CD2-CD1 3.59Å; L341-W366 HydrophobicContact CB-CH2 4.23Å; L341-W366 HydrophobicContact CB-CZ3 4.38Å; L341-W366 HydrophobicContact CD1-CE3 4.44Å; L341-W366 HydrophobicContact CD1-CH2 3.81Å; L341-W366 HydrophobicContact CD1-CZ2 3.91Å; L341-W366 HydrophobicContact CD1-CZ3 4.08Å; L341-W366 HydrophobicContact CD2-CE3 4.42Å; L341-W366 HydrophobicContact CD2-CZ3 4.19Å; L341-W366 HydrophobicContact CG-CH2 4.49Å; L341-W366 HydrophobicContact CG-CZ3 4.47Å; L341-Y430 HydrophobicContact CD1-CD2 4.02Å; L341-Y430 HydrophobicContact CD1-CE2 3.82Å
342	K	96.1	Very high	97	Very high	131 Å²	131	41.2 Å²	41.2	57%	0.57	20%	0.195	S	C	*	.	H	α-helix	trans	-75.7	-36	173.5	-73.6	166	-161.7	166.8	0	111.9	D338 E339 I340 R347	D338-K342 WeakPolarHBondContact O-CB 3.39Å; D338-K342 WeakPolarHBondContact O-CD 3.38Å; D338-K342 WeakPolarHBondContact O-CG 3.42Å; D338-K342 PolarHBondContact O-N 3.05Å; E339-K342 PolarHBondContact O-N 3.49Å; E339-K342 IonicContact OE1-NZ 2.72Å; E339-K342 PolarHBondContact OE1-NZ 2.96Å; I340-K342 VanDerWaalsContact C-N 3.35Å; K342-R347 PolarHBondContact O-NH1 2.99Å
343	D	96.7	Very high	97.1	Very high	24 Å²	24	37.6 Å²	37.6	13%	0.128	18%	0.182	C	C	.	.			trans	-77.9	125.1	-178.2	-167.1	-52	0	0	0	112.3	R329 W333 E339 I340 V345 G346 R347	R329-D343 WeakPolarHBondContact CG-OD2 3.45Å; R329-D343 IonicContact CZ-OD1 3.75Å; R329-D343 IonicContact CZ-OD2 2.71Å; R329-D343 IonicContact NE-OD1 2.82Å; R329-D343 IonicContact NE-OD2 2.77Å; R329-D343 PolarHBondContact NE-OD2 2.8Å; R329-D343 IonicContact NH2-OD1 2.94Å; R329-D343 PolarHBondContact NH2-OD1 3.09Å; R329-D343 IonicContact NH2-OD2 3.12Å; R329-D343 PolarHBondContact NH2-OD2 3.22Å; W333-D343 PolarHBondContact NE1-OD2 3.3Å; E339-D343 PolarHBondContact O-N 2.83Å; I340-D343 PolarHBondContact O-N 2.67Å; I340-D343 VanDerWaalsContact O-O 3.13Å; D343-V345 PolarHBondContact O-N 3.19Å; D343-V345 PolarHBondContact OD1-N 2.93Å; D343-G346 PolarHBondContact O-N 3.13Å; D343-G346 PolarHBondContact OD1-N 3.12Å; D343-R347 WeakPolarHBondContact O-CG 3.47Å; D343-R347 PolarHBondContact O-N 2.71Å
344	Q	95.6	Very high	97.1	Very high	101 Å²	101	37.5 Å²	37.5	47%	0.472	18%	0.181	S	C	.	.	H	α-helix	trans	-62.2	-44.5	178.6	-178.5	63.1	57.4	0	0	112.9	G346 R347 D348	Q344-G346 VanDerWaalsContact C-N 3.32Å; Q344-R347 PolarHBondContact O-N 3.36Å; Q344-D348 PolarHBondContact NE2-OD1 3.49Å; Q344-D348 PolarHBondContact O-N 3.14Å
345	V	96.3	Very high	97	Very high	14 Å²	14	40.5 Å²	40.5	9%	0.085	19%	0.189	C	C	.	.	H	α-helix	trans	-70.2	-37.4	179.9	-178	0	0	0	0	109.5	P325 W333 D343 D348 Q349	P325-V345 HydrophobicContact CG-CG1 4.08Å; W333-V345 HydrophobicContact CH2-CB 4.36Å; W333-V345 HydrophobicContact CH2-CG1 3.94Å; W333-V345 HydrophobicContact CZ2-CB 4.13Å; W333-V345 HydrophobicContact CZ2-CG1 4.19Å; D343-V345 PolarHBondContact O-N 3.19Å; D343-V345 PolarHBondContact OD1-N 2.93Å; V345-D348 PolarHBondContact O-N 3.32Å; V345-Q349 HydrophobicContact CG1-CG 4.44Å; V345-Q349 WeakPolarHBondContact O-CG 3.4Å; V345-Q349 PolarHBondContact O-N 2.85Å
346	G	96.8	Very high	96.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57.7	-48.6	172.8	0	0	0	0	0	112.3	I340 D343 Q344 D348 Q349 F350	I340-G346 WeakPolarHBondContact CG1-O 3.38Å; D343-G346 PolarHBondContact O-N 3.13Å; D343-G346 PolarHBondContact OD1-N 3.12Å; Q344-G346 VanDerWaalsContact C-N 3.32Å; G346-D348 PolarHBondContact O-N 3.26Å; G346-Q349 PolarHBondContact O-N 3.25Å; G346-F350 WeakPolarHBondContact O-CB 3.39Å; G346-F350 PolarHBondContact O-N 3.23Å
347	R	97.6	Very high	96.8	Very high	49 Å²	49	44.2 Å²	44.2	19%	0.185	21%	0.212	C	C	.	.	H	α-helix	trans	-57	-45.7	173.6	-74.7	-168.6	-63.7	-90.9	4.2	112.4	I340 L341 K342 D343 Q344 Q349 F350 L351	I340-R347 PolarHBondContact O-N 3.44Å; L341-R347 VanDerWaalsContact O-CD 3.27Å; L341-R347 WeakPolarHBondContact O-CD 3.06Å; L341-R347 WeakPolarHBondContact O-CG 3.14Å; L341-R347 PolarHBondContact O-NH1 3.15Å; K342-R347 PolarHBondContact O-NH1 2.99Å; D343-R347 WeakPolarHBondContact O-CG 3.47Å; D343-R347 PolarHBondContact O-N 2.71Å; Q344-R347 PolarHBondContact O-N 3.36Å; R347-Q349 PolarHBondContact O-N 3.44Å; R347-F350 PolarHBondContact O-N 3.47Å; R347-L351 VanDerWaalsContact O-CB 3.31Å; R347-L351 WeakPolarHBondContact O-CB 3.4Å; R347-L351 PolarHBondContact O-N 2.97Å
348	D	96.8	Very high	96.5	Very high	59 Å²	59	52.9 Å²	52.9	32%	0.316	25%	0.25	S	S	.	.	H	α-helix	trans	-64.2	-41.8	-178.6	-64.4	-13.3	0	0	0	111.4	Q344 V345 G346 L351 R352	Q344-D348 PolarHBondContact NE2-OD1 3.49Å; Q344-D348 PolarHBondContact O-N 3.14Å; V345-D348 PolarHBondContact O-N 3.32Å; G346-D348 PolarHBondContact O-N 3.26Å; D348-L351 PolarHBondContact O-N 3.04Å; D348-R352 WeakPolarHBondContact O-CG 3.45Å; D348-R352 PolarHBondContact O-N 2.86Å
349	Q	96.8	Very high	96.3	Very high	43 Å²	43	50.9 Å²	50.9	20%	0.201	24%	0.241	C	C	.	.	H	α-helix	trans	-68.7	-40	176.8	-64	-62.6	-1.5	0	0	112	W333 V345 G346 R347 R352 F353 F441 L450	W333-Q349 HydrophobicContact CH2-CG 4.37Å; W333-Q349 HydrophobicContact CZ3-CG 4.36Å; V345-Q349 HydrophobicContact CG1-CG 4.44Å; V345-Q349 WeakPolarHBondContact O-CG 3.4Å; V345-Q349 PolarHBondContact O-N 2.85Å; G346-Q349 PolarHBondContact O-N 3.25Å; R347-Q349 PolarHBondContact O-N 3.44Å; Q349-R352 VanDerWaalsContact CD-NH1 3.34Å; Q349-R352 VanDerWaalsContact NE2-NH1 3.12Å; Q349-R352 PolarHBondContact O-N 3.01Å; Q349-R352 VanDerWaalsContact OE1-NH1 3.17Å; Q349-F353 PolarHBondContact O-N 2.91Å; Q349-F353 VanDerWaalsContact O-N 3.09Å; Q349-F441 HydrophobicContact CB-CZ 4.39Å; Q349-L450 HydrophobicContact CB-CD1 4.4Å; Q349-L450 HydrophobicContact CG-CD1 3.86Å
350	F	97.9	Very high	96.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-41.9	175.3	-173	-128.9	0	0	0	111.6	F337 I340 G346 R347 F353 L354 L363 M433 F441	F337-F350 HydrophobicContact CE2-CD1 4.2Å; F337-F350 AromaticContact CE2-CE1 3.52Å; F337-F350 HydrophobicContact CE2-CE1 3.52Å; F337-F350 AromaticContact CE2-CZ 3.87Å; F337-F350 HydrophobicContact CE2-CZ 3.87Å; F337-F350 AromaticContact CZ-CE1 3.93Å; F337-F350 HydrophobicContact CZ-CE1 3.93Å; F337-F350 HydrophobicContact CZ-CZ 4.38Å; I340-F350 HydrophobicContact CD1-CB 3.78Å; I340-F350 HydrophobicContact CD1-CG 4.23Å; I340-F350 HydrophobicContact CG1-CB 4.37Å; G346-F350 WeakPolarHBondContact O-CB 3.39Å; G346-F350 PolarHBondContact O-N 3.23Å; R347-F350 PolarHBondContact O-N 3.47Å; F350-F353 HydrophobicContact CD2-CD1 4.3Å; F350-F353 HydrophobicContact CE2-CD1 4.27Å; F350-F353 WeakPolarHBondContact O-CB 3.45Å; F350-F353 PolarHBondContact O-N 3.26Å; F350-L354 HydrophobicContact CD1-CD1 4.14Å; F350-L354 HydrophobicContact CE1-CD1 3.77Å; F350-L354 HydrophobicContact CE1-CG 4.39Å; F350-L354 HydrophobicContact CE2-CD1 4.49Å; F350-L354 HydrophobicContact CE2-CD2 4.12Å; F350-L354 HydrophobicContact CE2-CG 4.25Å; F350-L354 HydrophobicContact CZ-CD1 3.98Å; F350-L354 HydrophobicContact CZ-CD2 4.03Å; F350-L354 HydrophobicContact CZ-CG 4.18Å; F350-L354 WeakPolarHBondContact O-CG 3.31Å; F350-L354 PolarHBondContact O-N 3.35Å; F350-L363 HydrophobicContact CD1-CD1 4.33Å; F350-L363 HydrophobicContact CD1-CD2 3.68Å; F350-L363 HydrophobicContact CE1-CD1 4.46Å; F350-L363 HydrophobicContact CE1-CD2 4.27Å; F350-L363 HydrophobicContact CG-CD2 4.49Å; F350-M433 HydrophobicContact CE1-SD 4.37Å; F350-F441 HydrophobicContact CD2-CB 3.75Å; F350-F441 HydrophobicContact CD2-CD1 4.14Å; F350-F441 AromaticContact CD2-CD2 3.92Å; F350-F441 HydrophobicContact CD2-CD2 3.92Å; F350-F441 AromaticContact CD2-CG 3.66Å; F350-F441 HydrophobicContact CD2-CG 3.66Å; F350-F441 HydrophobicContact CE2-CB 3.75Å; F350-F441 HydrophobicContact CE2-CG 4.19Å
351	L	97.8	Very high	96.2	Very high	40 Å²	40	52.8 Å²	52.8	21%	0.209	25%	0.25	C	S	.	.	H	α-helix	trans	-60	-47.6	176	-178.2	62.9	0	0	0	111.6	R347 D348 F353 L354 E355 L363 R364	R347-L351 VanDerWaalsContact O-CB 3.31Å; R347-L351 WeakPolarHBondContact O-CB 3.4Å; R347-L351 PolarHBondContact O-N 2.97Å; D348-L351 PolarHBondContact O-N 3.04Å; L351-F353 VanDerWaalsContact C-N 3.27Å; L351-F353 PolarHBondContact O-N 3.31Å; L351-L354 PolarHBondContact O-N 3.31Å; L351-L354 VanDerWaalsContact O-N 3.11Å; L351-E355 WeakPolarHBondContact O-CG 3.42Å; L351-E355 PolarHBondContact O-N 3.48Å; L351-L363 HydrophobicContact CB-CD2 3.83Å; L351-L363 HydrophobicContact CD1-CD2 4.03Å; L351-R364 HydrophobicContact CD1-CG 4.19Å
352	R	96.8	Very high	96.2	Very high	135 Å²	135	53 Å²	53	51%	0.509	25%	0.252	S	S	.	.	H	α-helix	trans	-58.8	-39.7	176.5	-73.5	176.3	-169	142.1	4.5	112.4	D348 Q349 E355 S356	D348-R352 WeakPolarHBondContact O-CG 3.45Å; D348-R352 PolarHBondContact O-N 2.86Å; Q349-R352 VanDerWaalsContact CD-NH1 3.34Å; Q349-R352 VanDerWaalsContact NE2-NH1 3.12Å; Q349-R352 PolarHBondContact O-N 3.01Å; Q349-R352 VanDerWaalsContact OE1-NH1 3.17Å; R352-E355 PolarHBondContact O-N 3.07Å; R352-S356 PolarHBondContact O-N 3.34Å; R352-S356 VanDerWaalsContact O-N 3.07Å
353	F	97.4	Very high	96.2	Very high	19 Å²	19	46.8 Å²	46.8	8%	0.083	23%	0.225	C	C	.	.	H	α-helix	trans	-61.7	-47.9	174.3	169	-100.2	0	0	0	111.2	Q349 F350 L351 E355 S356 E357 R440 F441	Q349-F353 PolarHBondContact O-N 2.91Å; Q349-F353 VanDerWaalsContact O-N 3.09Å; F350-F353 HydrophobicContact CD2-CD1 4.3Å; F350-F353 HydrophobicContact CE2-CD1 4.27Å; F350-F353 WeakPolarHBondContact O-CB 3.45Å; F350-F353 PolarHBondContact O-N 3.26Å; L351-F353 VanDerWaalsContact C-N 3.27Å; L351-F353 PolarHBondContact O-N 3.31Å; F353-E355 VanDerWaalsContact C-N 3.32Å; F353-E355 PolarHBondContact O-N 3.46Å; F353-S356 WeakPolarHBondContact O-CB 3.49Å; F353-S356 PolarHBondContact O-N 3.42Å; F353-S356 VanDerWaalsContact O-N 3.15Å; F353-S356 PolarHBondContact O-OG 3.32Å; F353-E357 HydrophobicContact CE2-CG 4.38Å; F353-E357 HydrophobicContact CZ-CG 4.29Å; F353-E357 VanDerWaalsContact CZ-OE1 3.22Å; F353-E357 WeakPolarHBondContact CZ-OE1 3.48Å; F353-E357 WeakPolarHBondContact CZ-OE2 3.49Å; F353-E357 PolarHBondContact O-N 2.82Å; F353-R440 HydrophobicContact CE1-CB 4.46Å; F353-R440 HydrophobicContact CZ-CB 4.05Å; F353-F441 HydrophobicContact CB-CD2 3.71Å; F353-F441 HydrophobicContact CB-CE2 4.19Å; F353-F441 HydrophobicContact CD1-CB 3.79Å; F353-F441 AromaticContact CD1-CD2 3.92Å; F353-F441 HydrophobicContact CD1-CD2 3.92Å; F353-F441 HydrophobicContact CD1-CG 4.33Å; F353-F441 HydrophobicContact CD2-CD2 4.31Å; F353-F441 HydrophobicContact CE1-CB 3.83Å; F353-F441 HydrophobicContact CG-CB 4.34Å; F353-F441 AromaticContact CG-CD2 3.7Å; F353-F441 HydrophobicContact CG-CD2 3.7Å; F353-F441 HydrophobicContact CZ-CB 4.42Å
354	L	96.7	Very high	96.3	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-35.6	177.6	-63.4	176	0	0	0	112.8	F350 L351 S356 E357 F358 S359 L363	F350-L354 HydrophobicContact CD1-CD1 4.14Å; F350-L354 HydrophobicContact CE1-CD1 3.77Å; F350-L354 HydrophobicContact CE1-CG 4.39Å; F350-L354 HydrophobicContact CE2-CD1 4.49Å; F350-L354 HydrophobicContact CE2-CD2 4.12Å; F350-L354 HydrophobicContact CE2-CG 4.25Å; F350-L354 HydrophobicContact CZ-CD1 3.98Å; F350-L354 HydrophobicContact CZ-CD2 4.03Å; F350-L354 HydrophobicContact CZ-CG 4.18Å; F350-L354 WeakPolarHBondContact O-CG 3.31Å; F350-L354 PolarHBondContact O-N 3.35Å; L351-L354 PolarHBondContact O-N 3.31Å; L351-L354 VanDerWaalsContact O-N 3.11Å; L354-S356 VanDerWaalsContact C-N 3.32Å; L354-E357 CarbonylContact O-C 3.29Å; L354-E357 PolarHBondContact O-N 2.53Å; L354-F358 PolarHBondContact O-N 3.39Å; L354-S359 PolarHBondContact O-N 3.16Å; L354-S359 PolarHBondContact O-OG 2.84Å; L354-L363 HydrophobicContact CD1-CB 3.55Å; L354-L363 HydrophobicContact CD1-CD2 3.94Å; L354-L363 HydrophobicContact CD1-CG 4.38Å
355	E	96.3	Very high	96.4	Very high	88 Å²	88	45.1 Å²	45.1	41%	0.411	21%	0.212	S	C	.	.	H	α-helix	trans	-62.8	-39.8	174.2	-74	173.3	166.3	0	0	111.3	L351 R352 F353 E357 F358	L351-E355 WeakPolarHBondContact O-CG 3.42Å; L351-E355 PolarHBondContact O-N 3.48Å; R352-E355 PolarHBondContact O-N 3.07Å; F353-E355 VanDerWaalsContact C-N 3.32Å; F353-E355 PolarHBondContact O-N 3.46Å; E355-E357 PolarHBondContact O-N 3.42Å; E355-F358 PolarHBondContact O-N 3.25Å; E355-F358 VanDerWaalsContact O-N 3.13Å
356	S	94.8	Very high	96.5	Very high	82 Å²	82	45.9 Å²	45.9	57%	0.573	21%	0.214	S	C	*	.	H	α-helix	trans	-65.5	-22.7	175.9	78	0	0	0	0	113.5	R352 F353 L354	R352-S356 PolarHBondContact O-N 3.34Å; R352-S356 VanDerWaalsContact O-N 3.07Å; F353-S356 WeakPolarHBondContact O-CB 3.49Å; F353-S356 PolarHBondContact O-N 3.42Å; F353-S356 VanDerWaalsContact O-N 3.15Å; F353-S356 PolarHBondContact O-OG 3.32Å; L354-S356 VanDerWaalsContact C-N 3.32Å
357	E	94.3	Very high	96.5	Very high	68 Å²	68	48.5 Å²	48.5	32%	0.318	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	9.5	176.3	-62.6	-168.8	150.5	0	0	113.1	F353 L354 E355 S359 R440	F353-E357 HydrophobicContact CE2-CG 4.38Å; F353-E357 HydrophobicContact CZ-CG 4.29Å; F353-E357 VanDerWaalsContact CZ-OE1 3.22Å; F353-E357 WeakPolarHBondContact CZ-OE1 3.48Å; F353-E357 WeakPolarHBondContact CZ-OE2 3.49Å; F353-E357 PolarHBondContact O-N 2.82Å; L354-E357 CarbonylContact O-C 3.29Å; L354-E357 PolarHBondContact O-N 2.53Å; E355-E357 PolarHBondContact O-N 3.42Å; E357-S359 VanDerWaalsContact C-N 3.26Å; E357-S359 PolarHBondContact O-N 2.81Å; E357-R440 IonicContact OE1-NH1 3.48Å; E357-R440 PolarHBondContact OE1-NH1 2.87Å; E357-R440 IonicContact OE2-CZ 3.91Å; E357-R440 IonicContact OE2-NH1 3.02Å; E357-R440 PolarHBondContact OE2-NH1 3.18Å; E357-R440 IonicContact OE2-NH2 2.86Å
358	F	91.2	Very high	96.5	Very high	183 Å²	183	46.9 Å²	46.9	80%	0.803	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	39.6	-178.2	-54.3	-86.8	0	0	0	113.9	L354 E355	L354-F358 PolarHBondContact O-N 3.39Å; E355-F358 PolarHBondContact O-N 3.25Å; E355-F358 VanDerWaalsContact O-N 3.13Å
359	S	94.5	Very high	96.6	Very high	16 Å²	16	44.1 Å²	44.1	11%	0.112	21%	0.208	C	C	.	.			trans	-131.4	18	-177.8	60.5	0	0	0	0	114.4	L354 E357 E361 N362	L354-S359 PolarHBondContact O-N 3.16Å; L354-S359 PolarHBondContact O-OG 2.84Å; E357-S359 VanDerWaalsContact C-N 3.26Å; E357-S359 PolarHBondContact O-N 2.81Å; S359-E361 VanDerWaalsContact C-N 3.3Å; S359-E361 WeakPolarHBondContact CA-OE1 3.22Å; S359-E361 VanDerWaalsContact CA-OE2 3.24Å; S359-E361 WeakPolarHBondContact CA-OE2 3.44Å; S359-E361 PolarHBondContact O-N 3.41Å; S359-N362 PolarHBondContact O-ND2 3.02Å
360	S	96.2	Very high	96.6	Very high	5 Å²	5	44.6 Å²	44.6	4%	0.035	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-19.4	-175.2	61	0	0	0	0	115.1	N362 L363 R364	S360-N362 PolarHBondContact O-N 3.24Å; S360-L363 PolarHBondContact O-N 3.49Å; S360-R364 WeakPolarHBondContact O-CG 3.32Å; S360-R364 PolarHBondContact O-N 3.48Å; S360-R364 VanDerWaalsContact O-N 3.08Å; S360-R364 PolarHBondContact OG-NE 3.31Å; S360-R364 PolarHBondContact OG-NH2 2.93Å
361	E	96.8	Very high	96.5	Very high	44 Å²	44	47.5 Å²	47.5	21%	0.206	23%	0.226	C	C	.	.	H	α-helix	trans	-55.5	-35.4	178.2	64.9	-72.8	167.8	0	0	112.3	S359 L363 R364 F365 I400	S359-E361 VanDerWaalsContact C-N 3.3Å; S359-E361 WeakPolarHBondContact CA-OE1 3.22Å; S359-E361 VanDerWaalsContact CA-OE2 3.24Å; S359-E361 WeakPolarHBondContact CA-OE2 3.44Å; S359-E361 PolarHBondContact O-N 3.41Å; E361-L363 PolarHBondContact O-N 2.97Å; E361-R364 PolarHBondContact O-N 3.4Å; E361-F365 WeakPolarHBondContact O-CB 3.38Å; E361-F365 PolarHBondContact O-N 3.03Å; E361-I400 HydrophobicContact CB-CG2 4.08Å; E361-I400 HydrophobicContact CG-CG2 3.86Å
362	N	96.3	Very high	96.5	Very high	13 Å²	13	45.6 Å²	45.6	7%	0.07	22%	0.216	C	C	.	.	H	α-helix	trans	-62.4	-46.4	178.8	-65.9	-44.7	0	0	0	112.1	S359 S360 W366 I429 M433	S359-N362 PolarHBondContact O-ND2 3.02Å; S360-N362 PolarHBondContact O-N 3.24Å; N362-W366 WeakPolarHBondContact O-CB 3.25Å; N362-W366 PolarHBondContact O-N 3.35Å; N362-I429 HydrophobicContact CB-CG2 3.87Å; N362-I429 WeakPolarHBondContact O-CG2 3.36Å; N362-M433 HydrophobicContact CB-CG 3.95Å; N362-M433 HydrophobicContact CB-SD 3.78Å
363	L	97.4	Very high	96.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-71.5	-39.6	178.8	-179	61.1	0	0	0	111.2	L341 F350 L351 L354 S360 E361 W366 L367 M433	L341-L363 HydrophobicContact CD2-CD1 3.59Å; F350-L363 HydrophobicContact CD1-CD1 4.33Å; F350-L363 HydrophobicContact CD1-CD2 3.68Å; F350-L363 HydrophobicContact CE1-CD1 4.46Å; F350-L363 HydrophobicContact CE1-CD2 4.27Å; F350-L363 HydrophobicContact CG-CD2 4.49Å; L351-L363 HydrophobicContact CB-CD2 3.83Å; L351-L363 HydrophobicContact CD1-CD2 4.03Å; L354-L363 HydrophobicContact CD1-CB 3.55Å; L354-L363 HydrophobicContact CD1-CD2 3.94Å; L354-L363 HydrophobicContact CD1-CG 4.38Å; S360-L363 PolarHBondContact O-N 3.49Å; E361-L363 PolarHBondContact O-N 2.97Å; L363-W366 PolarHBondContact O-N 3.44Å; L363-L367 HydrophobicContact CD1-CD1 4.21Å; L363-L367 HydrophobicContact CD1-CG 4.15Å; L363-L367 HydrophobicContact CG-CD1 3.96Å; L363-L367 HydrophobicContact CG-CG 4.34Å; L363-L367 WeakPolarHBondContact O-CB 3.34Å; L363-L367 VanDerWaalsContact O-CG 3.26Å; L363-L367 WeakPolarHBondContact O-CG 3.47Å; L363-L367 PolarHBondContact O-N 3.2Å; L363-M433 HydrophobicContact CB-SD 3.93Å; L363-M433 HydrophobicContact CD1-CE 4.47Å; L363-M433 HydrophobicContact CD1-SD 4.41Å
364	R	97.9	Very high	96.5	Very high	90 Å²	90	48.3 Å²	48.3	34%	0.34	23%	0.232	S	C	.	.	H	α-helix	trans	-62.6	-42.8	176.8	-67.7	-174.2	-134.4	167.5	-1	112	L351 S360 E361 L367 S368 F391	L351-R364 HydrophobicContact CD1-CG 4.19Å; S360-R364 WeakPolarHBondContact O-CG 3.32Å; S360-R364 PolarHBondContact O-N 3.48Å; S360-R364 VanDerWaalsContact O-N 3.08Å; S360-R364 PolarHBondContact OG-NE 3.31Å; S360-R364 PolarHBondContact OG-NH2 2.93Å; E361-R364 PolarHBondContact O-N 3.4Å; R364-L367 PolarHBondContact O-N 2.87Å; R364-S368 WeakPolarHBondContact O-CB 3.47Å; R364-S368 PolarHBondContact O-N 3.12Å; R364-S368 PolarHBondContact O-OG 3.27Å; R364-F391 HydrophobicContact CB-CE1 3.91Å; R364-F391 HydrophobicContact CB-CZ 3.9Å
365	F	98.1	Very high	96.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.2	-52.2	172.6	171	-104.5	0	0	0	110.6	E361 L367 S368 V369 I387 F391 L392 I400 F422 A425 I429	E361-F365 WeakPolarHBondContact O-CB 3.38Å; E361-F365 PolarHBondContact O-N 3.03Å; F365-L367 VanDerWaalsContact C-N 3.31Å; F365-L367 PolarHBondContact O-N 3.09Å; F365-S368 WeakPolarHBondContact O-CB 3.36Å; F365-S368 PolarHBondContact O-N 3.21Å; F365-S368 VanDerWaalsContact O-N 3.08Å; F365-V369 HydrophobicContact CD2-CG2 4.22Å; F365-V369 HydrophobicContact CE1-CG2 4.12Å; F365-V369 HydrophobicContact CE2-CG2 3.76Å; F365-V369 HydrophobicContact CZ-CG2 3.72Å; F365-V369 WeakPolarHBondContact O-CG2 3.34Å; F365-V369 PolarHBondContact O-N 3.37Å; F365-I387 HydrophobicContact CD2-CG2 4.06Å; F365-I387 HydrophobicContact CE2-CG2 3.87Å; F365-F391 HydrophobicContact CB-CB 4.47Å; F365-F391 HydrophobicContact CB-CD1 3.73Å; F365-F391 HydrophobicContact CB-CD2 4.29Å; F365-F391 HydrophobicContact CB-CE1 3.99Å; F365-F391 HydrophobicContact CB-CG 3.91Å; F365-F391 HydrophobicContact CB-CZ 4.39Å; F365-F391 HydrophobicContact CD2-CB 3.69Å; F365-F391 HydrophobicContact CD2-CD1 4.41Å; F365-F391 AromaticContact CD2-CD2 3.85Å; F365-F391 HydrophobicContact CD2-CD2 3.85Å; F365-F391 AromaticContact CD2-CG 3.73Å; F365-F391 HydrophobicContact CD2-CG 3.73Å; F365-F391 HydrophobicContact CE2-CB 4.41Å; F365-F391 HydrophobicContact CG-CB 4.44Å; F365-F391 HydrophobicContact CG-CG 4.28Å; F365-L392 HydrophobicContact CE2-CD1 4.16Å; F365-L392 HydrophobicContact CZ-CD1 4.47Å; F365-I400 HydrophobicContact CB-CD1 4.3Å; F365-I400 HydrophobicContact CB-CG2 4Å; F365-I400 HydrophobicContact CD1-CD1 3.54Å; F365-I400 HydrophobicContact CD2-CD1 3.85Å; F365-I400 HydrophobicContact CE1-CD1 3.68Å; F365-I400 HydrophobicContact CE2-CD1 3.99Å; F365-I400 HydrophobicContact CG-CD1 3.61Å; F365-I400 HydrophobicContact CG-CG2 4.47Å; F365-I400 HydrophobicContact CZ-CD1 3.9Å; F365-F422 HydrophobicContact CE2-CD1 4.18Å; F365-F422 HydrophobicContact CZ-CB 4.18Å; F365-F422 HydrophobicContact CZ-CD1 4.27Å; F365-F422 HydrophobicContact CZ-CG 4.46Å; F365-A425 HydrophobicContact CE1-CB 4.13Å; F365-A425 HydrophobicContact CZ-CB 3.79Å; F365-I429 HydrophobicContact CD1-CB 4.23Å; F365-I429 HydrophobicContact CD1-CG1 3.91Å; F365-I429 HydrophobicContact CD1-CG2 4.24Å; F365-I429 HydrophobicContact CE1-CB 4.44Å; F365-I429 HydrophobicContact CE1-CG1 4Å
366	W	97.7	Very high	96.5	Very high	30 Å²	30	49.5 Å²	49.5	11%	0.114	24%	0.243	C	C	.	.	H	α-helix	trans	-58.1	-43.2	-178.4	-174.4	92.8	0	0	0	112.3	L341 N362 L363 V369 Q370 Q426 Y430 M433	L341-W366 HydrophobicContact CB-CH2 4.23Å; L341-W366 HydrophobicContact CB-CZ3 4.38Å; L341-W366 HydrophobicContact CD1-CE3 4.44Å; L341-W366 HydrophobicContact CD1-CH2 3.81Å; L341-W366 HydrophobicContact CD1-CZ2 3.91Å; L341-W366 HydrophobicContact CD1-CZ3 4.08Å; L341-W366 HydrophobicContact CD2-CE3 4.42Å; L341-W366 HydrophobicContact CD2-CZ3 4.19Å; L341-W366 HydrophobicContact CG-CH2 4.49Å; L341-W366 HydrophobicContact CG-CZ3 4.47Å; N362-W366 WeakPolarHBondContact O-CB 3.25Å; N362-W366 PolarHBondContact O-N 3.35Å; L363-W366 PolarHBondContact O-N 3.44Å; W366-V369 PolarHBondContact O-N 2.94Å; W366-Q370 HydrophobicContact CD2-CG 4.03Å; W366-Q370 HydrophobicContact CE3-CG 3.77Å; W366-Q370 HydrophobicContact CH2-CG 3.54Å; W366-Q370 HydrophobicContact CZ2-CG 3.8Å; W366-Q370 HydrophobicContact CZ3-CG 3.53Å; W366-Q370 WeakPolarHBondContact O-CG 3.47Å; W366-Q370 PolarHBondContact O-N 2.88Å; W366-Q426 HydrophobicContact CG-CG 4.24Å; W366-Q426 PolarHBondContact O-NE2 3.23Å; W366-Y430 HydrophobicContact CZ2-CD2 4.28Å; W366-Y430 AromaticContact NE1-CD2 3.65Å; W366-M433 HydrophobicContact CB-CE 3.86Å; W366-M433 HydrophobicContact CG-CE 4.08Å
367	L	97.4	Very high	96.5	Very high	55 Å²	55	52 Å²	52	29%	0.288	25%	0.249	S	C	.	.	H	α-helix	trans	-66	-39.2	176.3	-69.6	172.1	0	0	0	112.2	L363 R364 F365 V369 Q370 D371	L363-L367 HydrophobicContact CD1-CD1 4.21Å; L363-L367 HydrophobicContact CD1-CG 4.15Å; L363-L367 HydrophobicContact CG-CD1 3.96Å; L363-L367 HydrophobicContact CG-CG 4.34Å; L363-L367 WeakPolarHBondContact O-CB 3.34Å; L363-L367 VanDerWaalsContact O-CG 3.26Å; L363-L367 WeakPolarHBondContact O-CG 3.47Å; L363-L367 PolarHBondContact O-N 3.2Å; R364-L367 PolarHBondContact O-N 2.87Å; F365-L367 VanDerWaalsContact C-N 3.31Å; F365-L367 PolarHBondContact O-N 3.09Å; L367-V369 VanDerWaalsContact C-N 3.32Å; L367-V369 PolarHBondContact O-N 3.25Å; L367-Q370 WeakPolarHBondContact O-CB 3.28Å; L367-Q370 PolarHBondContact O-N 2.91Å; L367-D371 WeakPolarHBondContact O-CB 3.47Å; L367-D371 PolarHBondContact O-N 3.3Å
368	S	97.8	Very high	96.6	Very high	15 Å²	15	56.5 Å²	56.5	11%	0.105	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-38.5	176.3	-62.2	0	0	0	0	111.9	R364 F365 D371 L372 I387	R364-S368 WeakPolarHBondContact O-CB 3.47Å; R364-S368 PolarHBondContact O-N 3.12Å; R364-S368 PolarHBondContact O-OG 3.27Å; F365-S368 WeakPolarHBondContact O-CB 3.36Å; F365-S368 PolarHBondContact O-N 3.21Å; F365-S368 VanDerWaalsContact O-N 3.08Å; S368-D371 PolarHBondContact O-N 3.23Å; S368-L372 PolarHBondContact O-N 3.31Å; S368-I387 WeakPolarHBondContact O-CD1 3.36Å
369	V	97.8	Very high	96.9	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-70.3	-36	174	-179.9	0	0	0	0	111.8	F365 W366 L367 D371 L372 K373 I387 F422 Q426	F365-V369 HydrophobicContact CD2-CG2 4.22Å; F365-V369 HydrophobicContact CE1-CG2 4.12Å; F365-V369 HydrophobicContact CE2-CG2 3.76Å; F365-V369 HydrophobicContact CZ-CG2 3.72Å; F365-V369 WeakPolarHBondContact O-CG2 3.34Å; F365-V369 PolarHBondContact O-N 3.37Å; W366-V369 PolarHBondContact O-N 2.94Å; L367-V369 VanDerWaalsContact C-N 3.32Å; L367-V369 PolarHBondContact O-N 3.25Å; V369-D371 VanDerWaalsContact C-N 3.31Å; V369-D371 PolarHBondContact O-N 2.79Å; V369-L372 WeakPolarHBondContact O-CB 3.44Å; V369-L372 PolarHBondContact O-N 2.7Å; V369-K373 PolarHBondContact O-N 3.45Å; V369-I387 HydrophobicContact CG2-CG2 4.35Å; V369-F422 HydrophobicContact CB-CB 4.43Å; V369-F422 HydrophobicContact CG1-CB 3.84Å; V369-F422 HydrophobicContact CG2-CB 3.63Å; V369-F422 HydrophobicContact CG2-CD2 4.11Å; V369-F422 HydrophobicContact CG2-CG 3.99Å; V369-Q426 HydrophobicContact CB-CB 4.46Å; V369-Q426 HydrophobicContact CB-CG 4.32Å; V369-Q426 HydrophobicContact CG1-CB 4.02Å; V369-Q426 VanDerWaalsContact CG1-CD 3.43Å; V369-Q426 HydrophobicContact CG1-CG 4.12Å
370	Q	96.8	Very high	97	Very high	53 Å²	53	50 Å²	50	25%	0.248	24%	0.243	C	C	.	.	H	α-helix	trans	-63.1	-38.3	171.9	-73.3	-61.3	-28.7	0	0	112.3	W366 L367	W366-Q370 HydrophobicContact CD2-CG 4.03Å; W366-Q370 HydrophobicContact CE3-CG 3.77Å; W366-Q370 HydrophobicContact CH2-CG 3.54Å; W366-Q370 HydrophobicContact CZ2-CG 3.8Å; W366-Q370 HydrophobicContact CZ3-CG 3.53Å; W366-Q370 WeakPolarHBondContact O-CG 3.47Å; W366-Q370 PolarHBondContact O-N 2.88Å; L367-Q370 WeakPolarHBondContact O-CB 3.28Å; L367-Q370 PolarHBondContact O-N 2.91Å
371	D	96.9	Very high	96.9	Very high	62 Å²	62	53 Å²	53	33%	0.332	27%	0.268	S	S	.	.	H	α-helix	trans	-66.9	-45.8	175.1	179	69.9	0	0	0	111.4	L367 S368 V369 K373 K374 Q375 R383	L367-D371 WeakPolarHBondContact O-CB 3.47Å; L367-D371 PolarHBondContact O-N 3.3Å; S368-D371 PolarHBondContact O-N 3.23Å; V369-D371 VanDerWaalsContact C-N 3.31Å; V369-D371 PolarHBondContact O-N 2.79Å; D371-K373 VanDerWaalsContact C-N 3.25Å; D371-K373 PolarHBondContact O-N 2.92Å; D371-K374 WeakPolarHBondContact O-CA 3.27Å; D371-K374 WeakPolarHBondContact O-CB 3.4Å; D371-K374 PolarHBondContact O-N 2.98Å; D371-Q375 VanDerWaalsContact CG-NE2 3.34Å; D371-Q375 PolarHBondContact O-N 3.31Å; D371-Q375 PolarHBondContact OD1-NE2 3.5Å; D371-Q375 PolarHBondContact OD2-NE2 3.31Å; D371-R383 IonicContact OD2-NE 3.97Å; D371-R383 PolarHBondContact OD2-NE 3.33Å
372	L	97.8	Very high	96.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-50.2	-44.6	175.2	174.3	67.6	0	0	0	112.5	S368 V369 K374 Q375 V380 R383 V384 I387 F422	S368-L372 PolarHBondContact O-N 3.31Å; V369-L372 WeakPolarHBondContact O-CB 3.44Å; V369-L372 PolarHBondContact O-N 2.7Å; L372-K374 PolarHBondContact O-N 2.96Å; L372-K374 VanDerWaalsContact O-N 3.15Å; L372-Q375 PolarHBondContact O-N 2.98Å; L372-V380 HydrophobicContact CD1-CB 4.49Å; L372-V380 HydrophobicContact CD1-CG1 4.12Å; L372-R383 HydrophobicContact CB-CG 4.27Å; L372-R383 HydrophobicContact CD1-CB 3.68Å; L372-R383 HydrophobicContact CD1-CG 3.69Å; L372-V384 HydrophobicContact CD1-CG2 3.91Å; L372-V384 HydrophobicContact CD2-CG2 3.83Å; L372-I387 HydrophobicContact CB-CD1 3.89Å; L372-I387 HydrophobicContact CD2-CD1 4.24Å; L372-F422 HydrophobicContact CD2-CD2 3.59Å; L372-F422 HydrophobicContact CD2-CE2 3.83Å
373	K	97	Very high	96.9	Very high	50 Å²	50	59.3 Å²	59.3	22%	0.217	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.7	179.8	-74	174.1	175.1	-178.9	0	113	V369 D371 R419	V369-K373 PolarHBondContact O-N 3.45Å; D371-K373 VanDerWaalsContact C-N 3.25Å; D371-K373 PolarHBondContact O-N 2.92Å; K373-R419 VanDerWaalsContact CG-O 3.31Å; K373-R419 WeakPolarHBondContact CG-O 3.28Å; K373-R419 PolarHBondContact O-NH1 2.94Å
374	K	96.5	Very high	97	Very high	161 Å²	161	59.4 Å²	59.4	70%	0.7	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-12.1	-178.8	-61.1	172.2	-172.5	173.4	0	113.4	D371 L372	D371-K374 WeakPolarHBondContact O-CA 3.27Å; D371-K374 WeakPolarHBondContact O-CB 3.4Å; D371-K374 PolarHBondContact O-N 2.98Å; L372-K374 PolarHBondContact O-N 2.96Å; L372-K374 VanDerWaalsContact O-N 3.15Å
375	Q	96.8	Very high	96.9	Very high	47 Å²	47	59.4 Å²	59.4	22%	0.22	30%	0.297	C	S	.	.	S	Bend	trans	-63.1	150.9	-178.6	-69.4	-59.5	-27.3	0	0	112.6	D371 L372 V380 R383 R419	D371-Q375 VanDerWaalsContact CG-NE2 3.34Å; D371-Q375 PolarHBondContact O-N 3.31Å; D371-Q375 PolarHBondContact OD1-NE2 3.5Å; D371-Q375 PolarHBondContact OD2-NE2 3.31Å; L372-Q375 PolarHBondContact O-N 2.98Å; Q375-V380 HydrophobicContact CB-CG2 4.34Å; Q375-R383 HydrophobicContact CG-CG 4.29Å; Q375-R419 PolarHBondContact O-NH1 3.41Å; Q375-R419 PolarHBondContact O-NH2 3.12Å
376	P	96.6	Very high	96.8	Very high	65 Å²	65	62.8 Å²	62.8	42%	0.422	31%	0.313	S	S	.	.			trans	-57.9	146	166.2	-21.7	34.2	0	0	0	111	Q378 D379 V380	P376-Q378 HydrophobicContact CB-CG 4.2Å; P376-Q378 PolarHBondContact O-N 3.08Å; P376-Q378 VanDerWaalsContact O-N 3.1Å; P376-D379 PolarHBondContact O-N 2.91Å; P376-V380 PolarHBondContact O-N 3.48Å
377	L	95.8	Very high	96.8	Very high	135 Å²	135	61.4 Å²	61.4	71%	0.707	31%	0.307	S	S	*	.	H	α-helix	trans	-57.4	-33.1	-172.9	-172.9	64.5	0	0	0	113.3	D379 V380	L377-D379 VanDerWaalsContact C-N 3.27Å; L377-D379 PolarHBondContact O-N 3.04Å; L377-V380 PolarHBondContact O-N 2.94Å
378	Q	95.9	Very high	96.8	Very high	163 Å²	163	60.2 Å²	60.2	76%	0.762	30%	0.299	S	S	*	.	H	α-helix	trans	-64.1	-28.4	178.2	69.3	-172.5	21.9	0	0	113.7	P376	P376-Q378 HydrophobicContact CB-CG 4.2Å; P376-Q378 PolarHBondContact O-N 3.08Å; P376-Q378 VanDerWaalsContact O-N 3.1Å
379	D	96.3	Very high	96.8	Very high	60 Å²	60	64 Å²	64	32%	0.321	32%	0.316	S	S	.	.	H	α-helix	trans	-95.8	-13.4	-175.2	-60.1	-50.2	0	0	0	112.1	P376 L377 A381 K382 R383	P376-D379 PolarHBondContact O-N 2.91Å; L377-D379 VanDerWaalsContact C-N 3.27Å; L377-D379 PolarHBondContact O-N 3.04Å; D379-A381 PolarHBondContact O-N 3.13Å; D379-K382 PolarHBondContact O-N 2.76Å; D379-R383 WeakPolarHBondContact O-CB 3.13Å; D379-R383 PolarHBondContact O-N 3.49Å
380	V	96.8	Very high	96.7	Very high	3 Å²	3	67.1 Å²	67.1	2%	0.018	33%	0.33	C	S	.	.	H	α-helix	trans	-56.6	-49.3	-177	168.9	0	0	0	0	111.5	L372 Q375 P376 L377 K382 R383 V384 R419	L372-V380 HydrophobicContact CD1-CB 4.49Å; L372-V380 HydrophobicContact CD1-CG1 4.12Å; Q375-V380 HydrophobicContact CB-CG2 4.34Å; P376-V380 PolarHBondContact O-N 3.48Å; L377-V380 PolarHBondContact O-N 2.94Å; V380-K382 VanDerWaalsContact C-N 3.34Å; V380-K382 PolarHBondContact O-N 3.27Å; V380-R383 PolarHBondContact O-N 2.92Å; V380-V384 HydrophobicContact CG1-CG2 4.31Å; V380-V384 VanDerWaalsContact O-CG2 3.32Å; V380-V384 WeakPolarHBondContact O-CG2 3.37Å; V380-V384 PolarHBondContact O-N 2.91Å; V380-R419 HydrophobicContact CG1-CG 4.37Å; V380-R419 HydrophobicContact CG2-CG 3.94Å
381	A	95.4	Very high	96.8	Very high	67 Å²	67	64.7 Å²	64.7	55%	0.554	32%	0.318	S	S	*	.	H	α-helix	trans	-61.1	-43.6	-177.2	0	0	0	0	0	112	D379 V384 E385	D379-A381 PolarHBondContact O-N 3.13Å; A381-V384 PolarHBondContact O-N 3.04Å; A381-E385 PolarHBondContact O-N 2.84Å
382	K	95.9	Very high	96.7	Very high	141 Å²	141	62.2 Å²	62.2	61%	0.613	31%	0.305	S	S	*	.	H	α-helix	trans	-63.5	-45.3	175.9	-173.9	-171.2	177.2	-153.9	0	111.1	D379 V380 V384 E385 E386	D379-K382 PolarHBondContact O-N 2.76Å; V380-K382 VanDerWaalsContact C-N 3.34Å; V380-K382 PolarHBondContact O-N 3.27Å; K382-V384 VanDerWaalsContact C-N 3.32Å; K382-V384 PolarHBondContact O-N 2.91Å; K382-E385 PolarHBondContact O-N 2.84Å; K382-E386 WeakPolarHBondContact CE-OE1 3.48Å; K382-E386 IonicContact NZ-OE1 3.48Å; K382-E386 PolarHBondContact NZ-OE1 3.45Å; K382-E386 WeakPolarHBondContact O-CG 3.37Å; K382-E386 PolarHBondContact O-N 3.15Å
383	R	97.4	Very high	96.6	Very high	48 Å²	48	62.6 Å²	62.6	18%	0.181	31%	0.308	C	S	.	.	H	α-helix	trans	-66.2	-33.8	-179.1	-171.5	63.5	176.8	143.8	9.2	112.4	D371 L372 Q375 D379 V380 E386 I387	D371-R383 IonicContact OD2-NE 3.97Å; D371-R383 PolarHBondContact OD2-NE 3.33Å; L372-R383 HydrophobicContact CB-CG 4.27Å; L372-R383 HydrophobicContact CD1-CB 3.68Å; L372-R383 HydrophobicContact CD1-CG 3.69Å; Q375-R383 HydrophobicContact CG-CG 4.29Å; D379-R383 WeakPolarHBondContact O-CB 3.13Å; D379-R383 PolarHBondContact O-N 3.49Å; V380-R383 PolarHBondContact O-N 2.92Å; R383-E386 WeakPolarHBondContact CD-OE2 3.32Å; R383-E386 IonicContact CZ-OE2 3.28Å; R383-E386 IonicContact NH1-OE2 3.15Å; R383-E386 PolarHBondContact NH1-OE2 3.03Å; R383-E386 PolarHBondContact O-N 3.28Å; R383-I387 HydrophobicContact CG-CD1 4.05Å; R383-I387 VanDerWaalsContact O-CG1 3.27Å; R383-I387 WeakPolarHBondContact O-CG1 3.47Å; R383-I387 PolarHBondContact O-N 3.24Å
384	V	97.6	Very high	96.3	Very high	3 Å²	3	65.9 Å²	65.9	2%	0.018	34%	0.335	C	S	.	.	H	α-helix	trans	-60.2	-48.1	172.7	167	0	0	0	0	110.6	L372 V380 A381 K382 E386 I387 W388 V414 T421 F422	L372-V384 HydrophobicContact CD1-CG2 3.91Å; L372-V384 HydrophobicContact CD2-CG2 3.83Å; V380-V384 HydrophobicContact CG1-CG2 4.31Å; V380-V384 VanDerWaalsContact O-CG2 3.32Å; V380-V384 WeakPolarHBondContact O-CG2 3.37Å; V380-V384 PolarHBondContact O-N 2.91Å; A381-V384 PolarHBondContact O-N 3.04Å; K382-V384 VanDerWaalsContact C-N 3.32Å; K382-V384 PolarHBondContact O-N 2.91Å; V384-E386 PolarHBondContact O-N 3.29Å; V384-I387 PolarHBondContact O-N 2.74Å; V384-W388 WeakPolarHBondContact O-CB 3.39Å; V384-W388 PolarHBondContact O-N 3.46Å; V384-V414 HydrophobicContact CG1-CB 4.46Å; V384-V414 HydrophobicContact CG1-CG1 4.13Å; V384-V414 HydrophobicContact CG1-CG2 4.13Å; V384-T421 HydrophobicContact CG1-CG2 3.98Å; V384-F422 HydrophobicContact CB-CE2 4.24Å; V384-F422 HydrophobicContact CG1-CE2 4.02Å; V384-F422 HydrophobicContact CG1-CZ 3.98Å; V384-F422 HydrophobicContact CG2-CE2 4.13Å; V384-F422 WeakPolarHBondContact O-CZ 3.42Å
385	E	96.1	Very high	96.1	Very high	89 Å²	89	62.2 Å²	62.2	42%	0.416	34%	0.342	S	S	.	.	H	α-helix	trans	-62.3	-44.4	178.8	-171.8	60.8	-145.4	0	0	111.7	A381 K382 I387 W388 Q389	A381-E385 PolarHBondContact O-N 2.84Å; K382-E385 PolarHBondContact O-N 2.84Å; E385-I387 PolarHBondContact O-N 2.67Å; E385-W388 PolarHBondContact O-N 3.11Å; E385-Q389 HydrophobicContact CG-CG 4.41Å; E385-Q389 VanDerWaalsContact O-CG 3.3Å; E385-Q389 WeakPolarHBondContact O-CG 3.43Å; E385-Q389 PolarHBondContact O-N 3.06Å; E385-Q389 WeakPolarHBondContact OE1-CG 3.19Å; E385-Q389 PolarHBondContact OE1-NE2 2.76Å
386	E	97.1	Very high	96	Very high	72 Å²	72	60.6 Å²	60.6	34%	0.336	34%	0.337	S	S	.	.	H	α-helix	trans	-57.3	-47.4	176.8	-71.1	171.8	-176.9	0	0	112.1	K382 R383 V384 Q389 E390	K382-E386 WeakPolarHBondContact CE-OE1 3.48Å; K382-E386 IonicContact NZ-OE1 3.48Å; K382-E386 PolarHBondContact NZ-OE1 3.45Å; K382-E386 WeakPolarHBondContact O-CG 3.37Å; K382-E386 PolarHBondContact O-N 3.15Å; R383-E386 WeakPolarHBondContact CD-OE2 3.32Å; R383-E386 IonicContact CZ-OE2 3.28Å; R383-E386 IonicContact NH1-OE2 3.15Å; R383-E386 PolarHBondContact NH1-OE2 3.03Å; R383-E386 PolarHBondContact O-N 3.28Å; V384-E386 PolarHBondContact O-N 3.29Å; E386-Q389 PolarHBondContact O-N 3.38Å; E386-E390 WeakPolarHBondContact O-CB 2.97Å; E386-E390 PolarHBondContact O-N 2.93Å
387	I	97.8	Very high	95.9	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-65.5	-40.9	179.3	-67.5	169.8	0	0	0	110.8	F365 S368 V369 L372 R383 V384 E385 E390 F391 F422	F365-I387 HydrophobicContact CD2-CG2 4.06Å; F365-I387 HydrophobicContact CE2-CG2 3.87Å; S368-I387 WeakPolarHBondContact O-CD1 3.36Å; V369-I387 HydrophobicContact CG2-CG2 4.35Å; L372-I387 HydrophobicContact CB-CD1 3.89Å; L372-I387 HydrophobicContact CD2-CD1 4.24Å; R383-I387 HydrophobicContact CG-CD1 4.05Å; R383-I387 VanDerWaalsContact O-CG1 3.27Å; R383-I387 WeakPolarHBondContact O-CG1 3.47Å; R383-I387 PolarHBondContact O-N 3.24Å; V384-I387 PolarHBondContact O-N 2.74Å; E385-I387 PolarHBondContact O-N 2.67Å; I387-E390 PolarHBondContact O-N 3.36Å; I387-F391 HydrophobicContact CG2-CD2 4.09Å; I387-F391 WeakPolarHBondContact O-CD2 3.36Å; I387-F391 PolarHBondContact O-N 3.42Å; I387-F391 VanDerWaalsContact O-N 3.13Å; I387-F422 HydrophobicContact CB-CE2 3.88Å; I387-F422 HydrophobicContact CB-CZ 3.9Å; I387-F422 HydrophobicContact CD1-CE2 4.28Å; I387-F422 HydrophobicContact CG2-CD1 4.41Å; I387-F422 HydrophobicContact CG2-CD2 4.14Å; I387-F422 HydrophobicContact CG2-CE1 4.04Å; I387-F422 HydrophobicContact CG2-CE2 3.72Å; I387-F422 HydrophobicContact CG2-CG 4.47Å; I387-F422 HydrophobicContact CG2-CZ 3.67Å
388	W	96.7	Very high	95.8	Very high	30 Å²	30	57.5 Å²	57.5	11%	0.114	33%	0.326	C	S	.	.	H	α-helix	trans	-60.1	-49.8	176.3	176.1	-101.1	0	0	0	111.1	V384 E385 E390 L392 A393 Y407 T410 V414 F422	V384-W388 WeakPolarHBondContact O-CB 3.39Å; V384-W388 PolarHBondContact O-N 3.46Å; E385-W388 PolarHBondContact O-N 3.11Å; W388-E390 VanDerWaalsContact C-N 3.34Å; W388-E390 PolarHBondContact O-N 3.38Å; W388-L392 HydrophobicContact CD2-CB 4.11Å; W388-L392 HydrophobicContact CE3-CB 3.57Å; W388-L392 HydrophobicContact CE3-CD1 3.9Å; W388-L392 HydrophobicContact CE3-CG 4.39Å; W388-L392 HydrophobicContact CH2-CB 4.37Å; W388-L392 HydrophobicContact CZ3-CB 3.73Å; W388-L392 HydrophobicContact CZ3-CD1 4.02Å; W388-L392 CarbonylContact O-C 3.55Å; W388-L392 PolarHBondContact O-N 2.81Å; W388-A393 PolarHBondContact O-N 2.95Å; W388-Y407 HydrophobicContact CH2-CE2 4.02Å; W388-Y407 AromaticContact CH2-CZ 3.89Å; W388-Y407 HydrophobicContact CZ3-CE2 4.5Å; W388-T410 HydrophobicContact CE3-CG2 4.47Å; W388-T410 HydrophobicContact CZ3-CG2 4.2Å; W388-V414 HydrophobicContact CB-CG1 4.47Å; W388-V414 HydrophobicContact CD2-CG1 4.4Å; W388-V414 HydrophobicContact CD2-CG2 4.24Å; W388-V414 HydrophobicContact CE3-CG2 3.75Å; W388-V414 HydrophobicContact CG-CG1 4.29Å; W388-V414 HydrophobicContact CZ3-CG2 4.32Å; W388-F422 HydrophobicContact CB-CZ 4.36Å; W388-F422 HydrophobicContact CE3-CE1 4.41Å
389	Q	97.1	Very high	95.7	Very high	96 Å²	96	52.8 Å²	52.8	45%	0.449	32%	0.315	S	S	.	.	H	α-helix	trans	-65.1	-35	-179.2	-66.1	-60.9	-27.9	0	0	113.1	E385 E386 A396 P397	E385-Q389 HydrophobicContact CG-CG 4.41Å; E385-Q389 VanDerWaalsContact O-CG 3.3Å; E385-Q389 WeakPolarHBondContact O-CG 3.43Å; E385-Q389 PolarHBondContact O-N 3.06Å; E385-Q389 WeakPolarHBondContact OE1-CG 3.19Å; E385-Q389 PolarHBondContact OE1-NE2 2.76Å; E386-Q389 PolarHBondContact O-N 3.38Å; Q389-A396 WeakPolarHBondContact O-CB 3.28Å; Q389-P397 WeakPolarHBondContact O-CD 3.49Å
390	E	97.6	Very high	95.6	Very high	65 Å²	65	50.8 Å²	50.8	30%	0.304	30%	0.304	S	S	.	.	H	α-helix	trans	-75.8	-37.6	-177.8	-173.5	176.7	174.5	0	0	113.4	E386 I387 W388 A396 P397 S398	E386-E390 WeakPolarHBondContact O-CB 2.97Å; E386-E390 PolarHBondContact O-N 2.93Å; I387-E390 PolarHBondContact O-N 3.36Å; W388-E390 VanDerWaalsContact C-N 3.34Å; W388-E390 PolarHBondContact O-N 3.38Å; E390-A396 WeakPolarHBondContact O-CB 3.41Å; E390-P397 WeakPolarHBondContact O-CD 3.42Å; E390-S398 CarbonylContact O-C 3.53Å; E390-S398 PolarHBondContact O-N 3.2Å
391	F	97.3	Very high	95.2	Very high	1 Å²	1	56.8 Å²	56.8	0%	0.004	34%	0.336	C	S	.	.	H	α-helix	trans	-119.7	-23.8	-167.2	-61.7	-76.2	0	0	0	115.7	R364 F365 I387 S398 A399 I400	R364-F391 HydrophobicContact CB-CE1 3.91Å; R364-F391 HydrophobicContact CB-CZ 3.9Å; F365-F391 HydrophobicContact CB-CB 4.47Å; F365-F391 HydrophobicContact CB-CD1 3.73Å; F365-F391 HydrophobicContact CB-CD2 4.29Å; F365-F391 HydrophobicContact CB-CE1 3.99Å; F365-F391 HydrophobicContact CB-CG 3.91Å; F365-F391 HydrophobicContact CB-CZ 4.39Å; F365-F391 HydrophobicContact CD2-CB 3.69Å; F365-F391 HydrophobicContact CD2-CD1 4.41Å; F365-F391 AromaticContact CD2-CD2 3.85Å; F365-F391 HydrophobicContact CD2-CD2 3.85Å; F365-F391 AromaticContact CD2-CG 3.73Å; F365-F391 HydrophobicContact CD2-CG 3.73Å; F365-F391 HydrophobicContact CE2-CB 4.41Å; F365-F391 HydrophobicContact CG-CB 4.44Å; F365-F391 HydrophobicContact CG-CG 4.28Å; I387-F391 HydrophobicContact CG2-CD2 4.09Å; I387-F391 WeakPolarHBondContact O-CD2 3.36Å; I387-F391 PolarHBondContact O-N 3.42Å; I387-F391 VanDerWaalsContact O-N 3.13Å; F391-S398 VanDerWaalsContact CD1-O 3.3Å; F391-S398 WeakPolarHBondContact CD1-O 3.3Å; F391-A399 WeakPolarHBondContact O-CA 3.49Å; F391-I400 HydrophobicContact CB-CG1 4.35Å; F391-I400 HydrophobicContact CB-CG2 4.43Å; F391-I400 HydrophobicContact CD1-CG2 4.06Å; F391-I400 PolarHBondContact O-N 2.88Å
392	L	95.9	Very high	95	Very high	10 Å²	10	54.7 Å²	54.7	5%	0.052	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	-24.7	-167.7	-68.8	176.4	0	0	0	115	F365 W388 I400 L402 Y407 T410 F422	F365-L392 HydrophobicContact CE2-CD1 4.16Å; F365-L392 HydrophobicContact CZ-CD1 4.47Å; W388-L392 HydrophobicContact CD2-CB 4.11Å; W388-L392 HydrophobicContact CE3-CB 3.57Å; W388-L392 HydrophobicContact CE3-CD1 3.9Å; W388-L392 HydrophobicContact CE3-CG 4.39Å; W388-L392 HydrophobicContact CH2-CB 4.37Å; W388-L392 HydrophobicContact CZ3-CB 3.73Å; W388-L392 HydrophobicContact CZ3-CD1 4.02Å; W388-L392 CarbonylContact O-C 3.55Å; W388-L392 PolarHBondContact O-N 2.81Å; L392-I400 HydrophobicContact CD2-CD1 3.77Å; L392-I400 HydrophobicContact CD2-CG1 3.55Å; L392-I400 HydrophobicContact CG-CD1 4.42Å; L392-I400 HydrophobicContact CG-CG1 4.36Å; L392-L402 HydrophobicContact CD1-CD1 4.33Å; L392-L402 HydrophobicContact CD2-CD1 3.37Å; L392-L402 HydrophobicContact CD2-CG 4.11Å; L392-L402 HydrophobicContact CG-CD1 4.5Å; L392-Y407 HydrophobicContact CB-CE2 4.49Å; L392-Y407 HydrophobicContact CD2-CD2 4.37Å; L392-Y407 WeakPolarHBondContact O-CE2 3.48Å; L392-T410 HydrophobicContact CD1-CG2 3.82Å; L392-F422 HydrophobicContact CD1-CD1 3.98Å; L392-F422 HydrophobicContact CD1-CE1 3.91Å
393	A	94.1	Very high	94.8	Very high	8 Å²	8	51 Å²	51	7%	0.066	30%	0.302	C	S	.	.	S	Bend	trans	-59.8	151.1	178.8	0	0	0	0	0	111.6	W388 G395 A396	W388-A393 PolarHBondContact O-N 2.95Å; A393-G395 PolarHBondContact O-N 3.5Å; A393-G395 VanDerWaalsContact O-N 3.1Å; A393-A396 WeakPolarHBondContact O-CB 3.42Å; A393-A396 PolarHBondContact O-N 2.87Å
394	P	92	Very high	94.4	Very high	120 Å²	120	52.9 Å²	52.9	78%	0.779	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	119.1	173.8	-24.4	34.3	0	0	0	111.2
395	G	91.8	Very high	94.1	Very high	83 Å²	83	58.5 Å²	58.5	86%	0.856	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	18.3	-175.4	0	0	0	0	0	114.6	A393	A393-G395 PolarHBondContact O-N 3.5Å; A393-G395 VanDerWaalsContact O-N 3.1Å
396	A	94.8	Very high	93.9	Very high	13 Å²	13	54.7 Å²	54.7	11%	0.107	33%	0.332	C	S	.	.			trans	-52.5	138.1	176.2	0	0	0	0	0	112.2	Q389 E390 A393 S398 A399	Q389-A396 WeakPolarHBondContact O-CB 3.28Å; E390-A396 WeakPolarHBondContact O-CB 3.41Å; A393-A396 WeakPolarHBondContact O-CB 3.42Å; A393-A396 PolarHBondContact O-N 2.87Å; A396-S398 PolarHBondContact O-N 3.25Å; A396-A399 HydrophobicContact CB-CB 4.17Å; A396-A399 PolarHBondContact O-N 3.38Å
397	P	93.8	Very high	93.7	Very high	111 Å²	111	55 Å²	55	72%	0.721	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-24.1	-176	27.3	-35.7	0	0	0	113.5	Q389 E390	Q389-P397 WeakPolarHBondContact O-CD 3.49Å; E390-P397 WeakPolarHBondContact O-CD 3.42Å
398	S	94.6	Very high	93.5	Very high	25 Å²	25	61 Å²	61	18%	0.175	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	50.1	176	-67.4	0	0	0	0	110.2	E390 F391 A396 I400	E390-S398 CarbonylContact O-C 3.53Å; E390-S398 PolarHBondContact O-N 3.2Å; F391-S398 VanDerWaalsContact CD1-O 3.3Å; F391-S398 WeakPolarHBondContact CD1-O 3.3Å; A396-S398 PolarHBondContact O-N 3.25Å; S398-I400 PolarHBondContact O-N 3.36Å
399	A	93.7	Very high	93.3	Very high	64 Å²	64	61.9 Å²	61.9	53%	0.529	37%	0.365	S	S	.	.			trans	-54.8	122.1	-176.8	0	0	0	0	0	112.5	F391 A396	F391-A399 WeakPolarHBondContact O-CA 3.49Å; A396-A399 HydrophobicContact CB-CB 4.17Å; A396-A399 PolarHBondContact O-N 3.38Å
400	I	94.9	Very high	93.1	Very high	18 Å²	18	57.3 Å²	57.3	9%	0.092	34%	0.344	C	S	.	.			trans	-90.3	151.9	175.5	58.9	165.5	0	0	0	111.2	E361 F365 F391 L392 S398 L402 I429	E361-I400 HydrophobicContact CB-CG2 4.08Å; E361-I400 HydrophobicContact CG-CG2 3.86Å; F365-I400 HydrophobicContact CB-CD1 4.3Å; F365-I400 HydrophobicContact CB-CG2 4Å; F365-I400 HydrophobicContact CD1-CD1 3.54Å; F365-I400 HydrophobicContact CD2-CD1 3.85Å; F365-I400 HydrophobicContact CE1-CD1 3.68Å; F365-I400 HydrophobicContact CE2-CD1 3.99Å; F365-I400 HydrophobicContact CG-CD1 3.61Å; F365-I400 HydrophobicContact CG-CG2 4.47Å; F365-I400 HydrophobicContact CZ-CD1 3.9Å; F391-I400 HydrophobicContact CB-CG1 4.35Å; F391-I400 HydrophobicContact CB-CG2 4.43Å; F391-I400 HydrophobicContact CD1-CG2 4.06Å; F391-I400 PolarHBondContact O-N 2.88Å; L392-I400 HydrophobicContact CD2-CD1 3.77Å; L392-I400 HydrophobicContact CD2-CG1 3.55Å; L392-I400 HydrophobicContact CG-CD1 4.42Å; L392-I400 HydrophobicContact CG-CG1 4.36Å; S398-I400 PolarHBondContact O-N 3.36Å; I400-L402 HydrophobicContact CD1-CD1 4.07Å; I400-L402 HydrophobicContact CD1-CD2 4.09Å; I400-L402 HydrophobicContact CD1-CG 3.87Å; I400-L402 HydrophobicContact CG1-CG 4.21Å; I400-I429 HydrophobicContact CB-CD1 4.29Å; I400-I429 HydrophobicContact CD1-CD1 3.92Å; I400-I429 HydrophobicContact CD1-CG1 3.83Å
401	N	88.7	Confident	92.8	Very high	129 Å²	129	56.1 Å²	56.1	69%	0.69	34%	0.343	S	S	*	.			trans	-86.4	113.2	174.5	-170.2	15.6	0	0	0	110.2
402	L	91.2	Very high	92.6	Very high	22 Å²	22	61.4 Å²	61.4	12%	0.115	37%	0.367	C	S	.	.			trans	-119.7	149.5	174.2	-72.7	-176.3	0	0	0	110.5	L392 I400 A425 H428 I429	L392-L402 HydrophobicContact CD1-CD1 4.33Å; L392-L402 HydrophobicContact CD2-CD1 3.37Å; L392-L402 HydrophobicContact CD2-CG 4.11Å; L392-L402 HydrophobicContact CG-CD1 4.5Å; I400-L402 HydrophobicContact CD1-CD1 4.07Å; I400-L402 HydrophobicContact CD1-CD2 4.09Å; I400-L402 HydrophobicContact CD1-CG 3.87Å; I400-L402 HydrophobicContact CG1-CG 4.21Å; L402-A425 HydrophobicContact CD1-CB 3.65Å; L402-A425 HydrophobicContact CD2-CB 4.23Å; L402-H428 HydrophobicContact CD2-CB 4.19Å; L402-I429 HydrophobicContact CD2-CD1 3.74Å; L402-I429 HydrophobicContact CD2-CG1 3.69Å
403	D	90.4	Very high	92.4	Very high	64 Å²	64	63.7 Å²	63.7	34%	0.342	38%	0.38	S	S	.	.			trans	-65	155.9	166.9	65	36.5	0	0	0	111.8	H405 S406 Y407 H428	D403-H405 PolarHBondContact O-N 3.03Å; D403-S406 PolarHBondContact O-N 3.01Å; D403-S406 WeakPolarHBondContact OD1-CB 3.43Å; D403-S406 PolarHBondContact OD1-N 3.32Å; D403-S406 PolarHBondContact OD1-OG 3.3Å; D403-Y407 WeakPolarHBondContact O-CB 3.25Å; D403-Y407 PolarHBondContact O-N 2.92Å; D403-Y407 VanDerWaalsContact O-N 3.08Å; D403-H428 IonicContact OD2-CE1 3.43Å; D403-H428 PolarHBondContact OD2-CE1 3.42Å; D403-H428 IonicContact OD2-ND1 3.67Å; D403-H428 PolarHBondContact OD2-ND1 3.14Å
404	S	90.4	Very high	92.4	Very high	88 Å²	88	64.4 Å²	64.4	62%	0.615	38%	0.383	S	S	*	.	H	α-helix	trans	-59.4	-36.2	-175.5	59.3	0	0	0	0	112.3	Y407 E408	S404-Y407 PolarHBondContact O-N 3.23Å; S404-E408 WeakPolarHBondContact O-CB 3.45Å; S404-E408 VanDerWaalsContact O-CG 3.27Å; S404-E408 WeakPolarHBondContact O-CG 3.45Å; S404-E408 PolarHBondContact O-N 2.96Å
405	H	90.7	Very high	92.3	Very high	120 Å²	120	66 Å²	66	56%	0.556	38%	0.378	S	S	*	.	H	α-helix	trans	-65.6	-50.1	-178.4	-175.6	59.1	0	0	0	112.3	D403 Y407 E408 I409	D403-H405 PolarHBondContact O-N 3.03Å; H405-Y407 VanDerWaalsContact C-N 3.3Å; H405-Y407 PolarHBondContact O-N 2.66Å; H405-E408 PolarHBondContact O-N 3.13Å; H405-I409 WeakPolarHBondContact NE2-CD1 3.45Å; H405-I409 WeakPolarHBondContact O-CG1 3.01Å; H405-I409 PolarHBondContact O-N 3.36Å; H405-I409 VanDerWaalsContact O-N 3.08Å
406	S	91.5	Very high	92.1	Very high	10 Å²	10	69.1 Å²	69.1	7%	0.07	38%	0.375	C	S	.	.	H	α-helix	trans	-65.8	-36.6	179	-53.2	0	0	0	0	111.1	D403 T410	D403-S406 PolarHBondContact O-N 3.01Å; D403-S406 WeakPolarHBondContact OD1-CB 3.43Å; D403-S406 PolarHBondContact OD1-N 3.32Å; D403-S406 PolarHBondContact OD1-OG 3.3Å; S406-T410 VanDerWaalsContact O-CB 3.25Å; S406-T410 WeakPolarHBondContact O-CB 3.24Å; S406-T410 PolarHBondContact O-N 2.94Å; S406-T410 PolarHBondContact O-OG1 2.86Å
407	Y	93.2	Very high	91.7	Very high	77 Å²	77	69.8 Å²	69.8	30%	0.302	38%	0.383	S	S	.	.	H	α-helix	trans	-64	-45.9	175.3	-175.4	-91.2	0	0	0	112	W388 L392 D403 S404 H405 T410 S411	W388-Y407 HydrophobicContact CH2-CE2 4.02Å; W388-Y407 AromaticContact CH2-CZ 3.89Å; W388-Y407 HydrophobicContact CZ3-CE2 4.5Å; L392-Y407 HydrophobicContact CB-CE2 4.49Å; L392-Y407 HydrophobicContact CD2-CD2 4.37Å; L392-Y407 WeakPolarHBondContact O-CE2 3.48Å; D403-Y407 WeakPolarHBondContact O-CB 3.25Å; D403-Y407 PolarHBondContact O-N 2.92Å; D403-Y407 VanDerWaalsContact O-N 3.08Å; S404-Y407 PolarHBondContact O-N 3.23Å; H405-Y407 VanDerWaalsContact C-N 3.3Å; H405-Y407 PolarHBondContact O-N 2.66Å; Y407-T410 PolarHBondContact O-N 2.98Å; Y407-S411 VanDerWaalsContact O-CB 3.23Å; Y407-S411 WeakPolarHBondContact O-CB 3.39Å; Y407-S411 PolarHBondContact O-N 2.88Å
408	E	92.7	Very high	91.7	Very high	128 Å²	128	65.8 Å²	65.8	60%	0.598	36%	0.362	S	S	*	.	H	α-helix	trans	-61.7	-47.1	178.1	-77.7	171.4	-163.1	0	0	112.3	S404 H405 S411 Q412	S404-E408 WeakPolarHBondContact O-CB 3.45Å; S404-E408 VanDerWaalsContact O-CG 3.27Å; S404-E408 WeakPolarHBondContact O-CG 3.45Å; S404-E408 PolarHBondContact O-N 2.96Å; H405-E408 PolarHBondContact O-N 3.13Å; E408-S411 PolarHBondContact O-N 3.06Å; E408-Q412 PolarHBondContact O-N 3.46Å; E408-Q412 VanDerWaalsContact O-N 3.09Å
409	I	92.1	Very high	91.8	Very high	47 Å²	47	68.4 Å²	68.4	24%	0.241	37%	0.368	C	S	.	.	H	α-helix	trans	-60.2	-49.5	177	-69.3	169.6	0	0	0	110.3	H405 S411 Q412 N413 D424	H405-I409 WeakPolarHBondContact NE2-CD1 3.45Å; H405-I409 WeakPolarHBondContact O-CG1 3.01Å; H405-I409 PolarHBondContact O-N 3.36Å; H405-I409 VanDerWaalsContact O-N 3.08Å; I409-S411 VanDerWaalsContact C-N 3.35Å; I409-S411 PolarHBondContact O-N 3.39Å; I409-Q412 PolarHBondContact O-N 3.11Å; I409-N413 WeakPolarHBondContact CG2-ND2 3.5Å; I409-N413 WeakPolarHBondContact O-CB 3.42Å; I409-N413 PolarHBondContact O-N 3.32Å; I409-N413 PolarHBondContact O-OD1 3.23Å; I409-D424 HydrophobicContact CG2-CB 4.47Å; I409-D424 WeakPolarHBondContact CG2-OD2 3.37Å
410	T	93.3	Very high	91.9	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-61.9	-43.7	-178.9	-57.4	0	0	0	0	111.2	W388 L392 S406 Y407 Q412 N413 V414 F422	W388-T410 HydrophobicContact CE3-CG2 4.47Å; W388-T410 HydrophobicContact CZ3-CG2 4.2Å; L392-T410 HydrophobicContact CD1-CG2 3.82Å; S406-T410 VanDerWaalsContact O-CB 3.25Å; S406-T410 WeakPolarHBondContact O-CB 3.24Å; S406-T410 PolarHBondContact O-N 2.94Å; S406-T410 PolarHBondContact O-OG1 2.86Å; Y407-T410 PolarHBondContact O-N 2.98Å; T410-Q412 VanDerWaalsContact C-N 3.27Å; T410-Q412 PolarHBondContact O-N 2.94Å; T410-N413 PolarHBondContact O-N 3.28Å; T410-N413 VanDerWaalsContact O-N 3.13Å; T410-V414 HydrophobicContact CG2-CG2 4.32Å; T410-V414 VanDerWaalsContact O-CG2 3.26Å; T410-V414 WeakPolarHBondContact O-CG2 3.49Å; T410-V414 PolarHBondContact O-N 3.34Å; T410-F422 HydrophobicContact CG2-CD1 3.44Å; T410-F422 VanDerWaalsContact CG2-CD1 3.44Å; T410-F422 HydrophobicContact CG2-CE1 3.78Å; T410-F422 HydrophobicContact CG2-CG 4.48Å
411	S	92.7	Very high	91.9	Very high	41 Å²	41	71.8 Å²	71.8	29%	0.287	37%	0.368	S	S	.	.	H	α-helix	trans	-58.8	-37.8	176.9	-178.6	0	0	0	0	112.5	Y407 E408 I409	Y407-S411 VanDerWaalsContact O-CB 3.23Å; Y407-S411 WeakPolarHBondContact O-CB 3.39Å; Y407-S411 PolarHBondContact O-N 2.88Å; E408-S411 PolarHBondContact O-N 3.06Å; I409-S411 VanDerWaalsContact C-N 3.35Å; I409-S411 PolarHBondContact O-N 3.39Å
412	Q	92.8	Very high	92.3	Very high	111 Å²	111	65.7 Å²	65.7	52%	0.519	34%	0.335	S	S	.	.	H	α-helix	trans	-72.3	-41.5	174.6	-173.1	61.9	19.9	0	0	111.9	E408 I409 T410 V414 K415	E408-Q412 PolarHBondContact O-N 3.46Å; E408-Q412 VanDerWaalsContact O-N 3.09Å; I409-Q412 PolarHBondContact O-N 3.11Å; T410-Q412 VanDerWaalsContact C-N 3.27Å; T410-Q412 PolarHBondContact O-N 2.94Å; Q412-V414 VanDerWaalsContact C-N 3.32Å; Q412-V414 PolarHBondContact O-N 3.1Å; Q412-K415 WeakPolarHBondContact O-CB 3.28Å; Q412-K415 PolarHBondContact O-N 2.87Å
413	N	92.2	Very high	92.5	Very high	58 Å²	58	69.2 Å²	69.2	31%	0.31	35%	0.351	S	S	.	.	H	α-helix	trans	-66.4	-30.3	-180	-68.9	-13.6	0	0	0	113.1	I409 T410 K415 D416 T421	I409-N413 WeakPolarHBondContact CG2-ND2 3.5Å; I409-N413 WeakPolarHBondContact O-CB 3.42Å; I409-N413 PolarHBondContact O-N 3.32Å; I409-N413 PolarHBondContact O-OD1 3.23Å; T410-N413 PolarHBondContact O-N 3.28Å; T410-N413 VanDerWaalsContact O-N 3.13Å; N413-K415 PolarHBondContact O-N 3.36Å; N413-D416 CarbonylContact O-C 3.58Å; N413-D416 VanDerWaalsContact O-C 3.29Å; N413-D416 PolarHBondContact O-N 2.7Å; N413-T421 HydrophobicContact CB-CG2 3.94Å; N413-T421 PolarHBondContact ND2-O 2.97Å
414	V	92.8	Very high	92.7	Very high	24 Å²	24	69 Å²	69	15%	0.145	35%	0.35	C	S	.	.	H	α-helix	trans	-65	-26.1	178.3	168.2	0	0	0	0	111.9	V384 W388 T410 Q412 D416 G417 T421 F422	V384-V414 HydrophobicContact CG1-CB 4.46Å; V384-V414 HydrophobicContact CG1-CG1 4.13Å; V384-V414 HydrophobicContact CG1-CG2 4.13Å; W388-V414 HydrophobicContact CB-CG1 4.47Å; W388-V414 HydrophobicContact CD2-CG1 4.4Å; W388-V414 HydrophobicContact CD2-CG2 4.24Å; W388-V414 HydrophobicContact CE3-CG2 3.75Å; W388-V414 HydrophobicContact CG-CG1 4.29Å; W388-V414 HydrophobicContact CZ3-CG2 4.32Å; T410-V414 HydrophobicContact CG2-CG2 4.32Å; T410-V414 VanDerWaalsContact O-CG2 3.26Å; T410-V414 WeakPolarHBondContact O-CG2 3.49Å; T410-V414 PolarHBondContact O-N 3.34Å; Q412-V414 VanDerWaalsContact C-N 3.32Å; Q412-V414 PolarHBondContact O-N 3.1Å; V414-D416 PolarHBondContact O-N 3.24Å; V414-G417 PolarHBondContact O-N 3.11Å; V414-T421 HydrophobicContact CB-CG2 4.22Å; V414-T421 HydrophobicContact CG2-CG2 3.44Å; V414-T421 VanDerWaalsContact CG2-CG2 3.44Å; V414-F422 HydrophobicContact CG2-CE1 4.02Å; V414-F422 HydrophobicContact CG2-CZ 4.15Å
415	K	90.1	Very high	92.9	Very high	154 Å²	154	64.9 Å²	64.9	67%	0.67	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-29.6	177.9	-62.9	176.8	-177.3	169.6	0	113.2	Q412 N413	Q412-K415 WeakPolarHBondContact O-CB 3.28Å; Q412-K415 PolarHBondContact O-N 2.87Å; N413-K415 PolarHBondContact O-N 3.36Å
416	D	88.1	Confident	93.2	Very high	147 Å²	147	59.6 Å²	59.6	79%	0.786	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.7	68.8	173	-171.1	20.2	0	0	0	108.7	N413 V414 G418	N413-D416 CarbonylContact O-C 3.58Å; N413-D416 VanDerWaalsContact O-C 3.29Å; N413-D416 PolarHBondContact O-N 2.7Å; V414-D416 PolarHBondContact O-N 3.24Å; D416-G418 PolarHBondContact O-N 3.23Å
417	G	86.8	Confident	93.4	Very high	28 Å²	28	63.9 Å²	63.9	29%	0.289	32%	0.315	S	S	.	.			trans	-61.5	124.2	-169.5	0	0	0	0	0	114	V414 T421	V414-G417 PolarHBondContact O-N 3.11Å; G417-T421 WeakPolarHBondContact CA-OG1 3.44Å
418	G	92.8	Very high	93.5	Very high	26 Å²	26	62.6 Å²	62.6	27%	0.268	31%	0.312	S	S	.	.			trans	-134.3	-177.8	175.2	0	0	0	0	0	112.5	D416 Y420 T421	D416-G418 PolarHBondContact O-N 3.23Å; G418-Y420 PolarHBondContact O-N 2.56Å; G418-Y420 VanDerWaalsContact O-N 3.08Å; G418-T421 PolarHBondContact N-OG1 2.86Å; G418-T421 WeakPolarHBondContact O-CB 3.29Å; G418-T421 PolarHBondContact O-N 2.69Å; G418-T421 PolarHBondContact O-OG1 3.31Å; G418-T421 VanDerWaalsContact O-OG1 3.09Å
419	R	96.1	Very high	93.7	Very high	80 Å²	80	56.5 Å²	56.5	30%	0.302	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-21	-178.1	-67.2	-178.9	-174.7	-119.4	-5.9	114.1	K373 Q375 V380	K373-R419 VanDerWaalsContact CG-O 3.31Å; K373-R419 WeakPolarHBondContact CG-O 3.28Å; K373-R419 PolarHBondContact O-NH1 2.94Å; Q375-R419 PolarHBondContact O-NH1 3.41Å; Q375-R419 PolarHBondContact O-NH2 3.12Å; V380-R419 HydrophobicContact CG1-CG 4.37Å; V380-R419 HydrophobicContact CG2-CG 3.94Å
420	Y	96.1	Very high	93.9	Very high	147 Å²	147	56 Å²	56	58%	0.576	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	10.7	-174.5	-55.6	-79.8	0	0	0	112.7	G418 F422 E423	G418-Y420 PolarHBondContact O-N 2.56Å; G418-Y420 VanDerWaalsContact O-N 3.08Å; Y420-F422 PolarHBondContact O-N 3.03Å; Y420-F422 VanDerWaalsContact O-N 3.15Å; Y420-E423 WeakPolarHBondContact O-CB 3.32Å; Y420-E423 PolarHBondContact O-N 3.14Å; Y420-E423 VanDerWaalsContact O-N 3.1Å
421	T	96.2	Very high	94	Very high	6 Å²	6	61.5 Å²	61.5	4%	0.037	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-37	-177.4	-72.3	0	0	0	0	113.8	V384 N413 V414 G417 G418	V384-T421 HydrophobicContact CG1-CG2 3.98Å; N413-T421 HydrophobicContact CB-CG2 3.94Å; N413-T421 PolarHBondContact ND2-O 2.97Å; V414-T421 HydrophobicContact CB-CG2 4.22Å; V414-T421 HydrophobicContact CG2-CG2 3.44Å; V414-T421 VanDerWaalsContact CG2-CG2 3.44Å; G417-T421 WeakPolarHBondContact CA-OG1 3.44Å; G418-T421 PolarHBondContact N-OG1 2.86Å; G418-T421 WeakPolarHBondContact O-CB 3.29Å; G418-T421 PolarHBondContact O-N 2.69Å; G418-T421 PolarHBondContact O-OG1 3.31Å; G418-T421 VanDerWaalsContact O-OG1 3.09Å
422	F	97.1	Very high	94.2	Very high	1 Å²	1	62.4 Å²	62.4	0%	0.004	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	19.6	-177.6	-56.5	-76.4	0	0	0	113.4	F365 V369 L372 V384 I387 W388 L392 T410 V414 Y420 A425 Q426	F365-F422 HydrophobicContact CE2-CD1 4.18Å; F365-F422 HydrophobicContact CZ-CB 4.18Å; F365-F422 HydrophobicContact CZ-CD1 4.27Å; F365-F422 HydrophobicContact CZ-CG 4.46Å; V369-F422 HydrophobicContact CB-CB 4.43Å; V369-F422 HydrophobicContact CG1-CB 3.84Å; V369-F422 HydrophobicContact CG2-CB 3.63Å; V369-F422 HydrophobicContact CG2-CD2 4.11Å; V369-F422 HydrophobicContact CG2-CG 3.99Å; L372-F422 HydrophobicContact CD2-CD2 3.59Å; L372-F422 HydrophobicContact CD2-CE2 3.83Å; V384-F422 HydrophobicContact CB-CE2 4.24Å; V384-F422 HydrophobicContact CG1-CE2 4.02Å; V384-F422 HydrophobicContact CG1-CZ 3.98Å; V384-F422 HydrophobicContact CG2-CE2 4.13Å; V384-F422 WeakPolarHBondContact O-CZ 3.42Å; I387-F422 HydrophobicContact CB-CE2 3.88Å; I387-F422 HydrophobicContact CB-CZ 3.9Å; I387-F422 HydrophobicContact CD1-CE2 4.28Å; I387-F422 HydrophobicContact CG2-CD1 4.41Å; I387-F422 HydrophobicContact CG2-CD2 4.14Å; I387-F422 HydrophobicContact CG2-CE1 4.04Å; I387-F422 HydrophobicContact CG2-CE2 3.72Å; I387-F422 HydrophobicContact CG2-CG 4.47Å; I387-F422 HydrophobicContact CG2-CZ 3.67Å; W388-F422 HydrophobicContact CB-CZ 4.36Å; W388-F422 HydrophobicContact CE3-CE1 4.41Å; L392-F422 HydrophobicContact CD1-CD1 3.98Å; L392-F422 HydrophobicContact CD1-CE1 3.91Å; T410-F422 HydrophobicContact CG2-CD1 3.44Å; T410-F422 VanDerWaalsContact CG2-CD1 3.44Å; T410-F422 HydrophobicContact CG2-CE1 3.78Å; T410-F422 HydrophobicContact CG2-CG 4.48Å; V414-F422 HydrophobicContact CG2-CE1 4.02Å; V414-F422 HydrophobicContact CG2-CZ 4.15Å; Y420-F422 PolarHBondContact O-N 3.03Å; Y420-F422 VanDerWaalsContact O-N 3.15Å; F422-A425 PolarHBondContact O-N 3.42Å; F422-Q426 WeakPolarHBondContact O-CB 3.49Å; F422-Q426 PolarHBondContact O-N 3.42Å
423	E	95.1	Very high	94.3	Very high	96 Å²	96	57.1 Å²	57.1	45%	0.449	28%	0.279	S	S	.	.	H	α-helix	trans	-60.8	-48.8	-174	-174	160.7	-150.4	0	0	112.7	Y420 Q426 E427	Y420-E423 WeakPolarHBondContact O-CB 3.32Å; Y420-E423 PolarHBondContact O-N 3.14Å; Y420-E423 VanDerWaalsContact O-N 3.1Å; E423-Q426 PolarHBondContact O-N 3.49Å; E423-E427 PolarHBondContact O-N 3.13Å
424	D	93.7	Very high	94.6	Very high	61 Å²	61	58.8 Å²	58.8	33%	0.326	28%	0.284	S	S	.	.	H	α-helix	trans	-61.6	-48.5	177.6	-57.3	-87.4	0	0	0	111.9	I409 Q426 E427 H428	I409-D424 HydrophobicContact CG2-CB 4.47Å; I409-D424 WeakPolarHBondContact CG2-OD2 3.37Å; D424-Q426 VanDerWaalsContact C-N 3.34Å; D424-Q426 PolarHBondContact O-N 2.58Å; D424-E427 PolarHBondContact O-N 3.07Å; D424-H428 PolarHBondContact O-N 3.15Å
425	A	95.9	Very high	94.7	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.1	-41.8	176.9	0	0	0	0	0	112.1	F365 L402 F422 H428 I429	F365-A425 HydrophobicContact CE1-CB 4.13Å; F365-A425 HydrophobicContact CZ-CB 3.79Å; L402-A425 HydrophobicContact CD1-CB 3.65Å; L402-A425 HydrophobicContact CD2-CB 4.23Å; F422-A425 PolarHBondContact O-N 3.42Å; A425-H428 PolarHBondContact O-N 3.48Å; A425-I429 VanDerWaalsContact O-CG1 3.3Å; A425-I429 WeakPolarHBondContact O-CG1 3.45Å; A425-I429 PolarHBondContact O-N 2.84Å
426	Q	96.8	Very high	95	Very high	10 Å²	10	57.6 Å²	57.6	5%	0.047	29%	0.291	C	S	.	.	H	α-helix	trans	-65.2	-40.7	178	-175.2	-179.5	45.1	0	0	111.6	W366 V369 F422 E423 D424 Y430	W366-Q426 HydrophobicContact CG-CG 4.24Å; W366-Q426 PolarHBondContact O-NE2 3.23Å; V369-Q426 HydrophobicContact CB-CB 4.46Å; V369-Q426 HydrophobicContact CB-CG 4.32Å; V369-Q426 HydrophobicContact CG1-CB 4.02Å; V369-Q426 VanDerWaalsContact CG1-CD 3.43Å; V369-Q426 HydrophobicContact CG1-CG 4.12Å; F422-Q426 WeakPolarHBondContact O-CB 3.49Å; F422-Q426 PolarHBondContact O-N 3.42Å; E423-Q426 PolarHBondContact O-N 3.49Å; D424-Q426 VanDerWaalsContact C-N 3.34Å; D424-Q426 PolarHBondContact O-N 2.58Å; Q426-Y430 VanDerWaalsContact O-CB 3.26Å; Q426-Y430 WeakPolarHBondContact O-CB 3.48Å; Q426-Y430 PolarHBondContact O-N 2.8Å
427	E	95.6	Very high	95.4	Very high	99 Å²	99	50.8 Å²	50.8	46%	0.463	26%	0.255	S	S	.	.	H	α-helix	trans	-65.3	-43.1	177	-171.8	179.6	-178	0	0	111.4	E423 D424 Y430 K431	E423-E427 PolarHBondContact O-N 3.13Å; D424-E427 PolarHBondContact O-N 3.07Å; E427-Y430 PolarHBondContact O-N 3Å; E427-K431 VanDerWaalsContact CD-NZ 3.32Å; E427-K431 HydrophobicContact CG-CD 4.28Å; E427-K431 WeakPolarHBondContact O-CG 3.29Å; E427-K431 PolarHBondContact O-N 3.19Å; E427-K431 WeakPolarHBondContact OE1-CE 3.48Å; E427-K431 IonicContact OE1-NZ 2.69Å; E427-K431 PolarHBondContact OE1-NZ 3.31Å
428	H	95.3	Very high	95.9	Very high	51 Å²	51	50.3 Å²	50.3	24%	0.236	25%	0.245	C	C	.	.	H	α-helix	trans	-57.2	-53	175.2	-175.6	95.6	0	0	0	111.1	L402 D403 D424 A425 Y430 K431 L432	L402-H428 HydrophobicContact CD2-CB 4.19Å; D403-H428 IonicContact OD2-CE1 3.43Å; D403-H428 PolarHBondContact OD2-CE1 3.42Å; D403-H428 IonicContact OD2-ND1 3.67Å; D403-H428 PolarHBondContact OD2-ND1 3.14Å; D424-H428 PolarHBondContact O-N 3.15Å; A425-H428 PolarHBondContact O-N 3.48Å; H428-Y430 VanDerWaalsContact C-N 3.34Å; H428-Y430 PolarHBondContact O-N 2.96Å; H428-K431 PolarHBondContact O-N 3.39Å; H428-L432 WeakPolarHBondContact O-CB 3.27Å; H428-L432 PolarHBondContact O-N 3.02Å
429	I	96.4	Very high	96.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-38	-179.7	-65.8	-63.7	0	0	0	112	N362 F365 I400 L402 A425 L432 M433	N362-I429 HydrophobicContact CB-CG2 3.87Å; N362-I429 WeakPolarHBondContact O-CG2 3.36Å; F365-I429 HydrophobicContact CD1-CB 4.23Å; F365-I429 HydrophobicContact CD1-CG1 3.91Å; F365-I429 HydrophobicContact CD1-CG2 4.24Å; F365-I429 HydrophobicContact CE1-CB 4.44Å; F365-I429 HydrophobicContact CE1-CG1 4Å; I400-I429 HydrophobicContact CB-CD1 4.29Å; I400-I429 HydrophobicContact CD1-CD1 3.92Å; I400-I429 HydrophobicContact CD1-CG1 3.83Å; L402-I429 HydrophobicContact CD2-CD1 3.74Å; L402-I429 HydrophobicContact CD2-CG1 3.69Å; A425-I429 VanDerWaalsContact O-CG1 3.3Å; A425-I429 WeakPolarHBondContact O-CG1 3.45Å; A425-I429 PolarHBondContact O-N 2.84Å; I429-L432 HydrophobicContact CD1-CD2 4.43Å; I429-L432 PolarHBondContact O-N 3.28Å; I429-M433 HydrophobicContact CG2-CE 3.85Å; I429-M433 HydrophobicContact CG2-SD 4.46Å; I429-M433 WeakPolarHBondContact O-CG 3.34Å; I429-M433 PolarHBondContact O-N 2.72Å
430	Y	96.9	Very high	96.2	Very high	35 Å²	35	50.6 Å²	50.6	14%	0.137	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-47.7	174.2	175.1	-85.8	0	0	0	111.7	F337 D338 L341 W366 Q426 E427 H428 L432 M433 K434	F337-Y430 AromaticContact CD1-CD2 3.85Å; F337-Y430 HydrophobicContact CD1-CD2 3.85Å; F337-Y430 HydrophobicContact CD1-CE1 4.33Å; F337-Y430 AromaticContact CD1-CE2 3.48Å; F337-Y430 HydrophobicContact CD1-CE2 3.48Å; F337-Y430 VanDerWaalsContact CD1-CE2 3.48Å; F337-Y430 HydrophobicContact CD1-CG 4.45Å; F337-Y430 AromaticContact CD1-CZ 3.73Å; F337-Y430 AromaticContact CE1-CD2 3.73Å; F337-Y430 HydrophobicContact CE1-CD2 3.73Å; F337-Y430 AromaticContact CE1-CE2 3.85Å; F337-Y430 HydrophobicContact CE1-CE2 3.85Å; F337-Y430 HydrophobicContact CE1-CG 4.29Å; D338-Y430 PolarHBondContact OD1-OH 3.39Å; D338-Y430 PolarHBondContact OD2-OH 3.47Å; L341-Y430 HydrophobicContact CD1-CD2 4.02Å; L341-Y430 HydrophobicContact CD1-CE2 3.82Å; W366-Y430 HydrophobicContact CZ2-CD2 4.28Å; W366-Y430 AromaticContact NE1-CD2 3.65Å; Q426-Y430 VanDerWaalsContact O-CB 3.26Å; Q426-Y430 WeakPolarHBondContact O-CB 3.48Å; Q426-Y430 PolarHBondContact O-N 2.8Å; E427-Y430 PolarHBondContact O-N 3Å; H428-Y430 VanDerWaalsContact C-N 3.34Å; H428-Y430 PolarHBondContact O-N 2.96Å; Y430-L432 VanDerWaalsContact C-N 3.33Å; Y430-L432 PolarHBondContact O-N 2.96Å; Y430-M433 PolarHBondContact O-N 2.93Å; Y430-K434 HydrophobicContact CD1-CD 4.49Å; Y430-K434 HydrophobicContact CE1-CB 4.48Å; Y430-K434 HydrophobicContact CE1-CD 3.62Å; Y430-K434 WeakPolarHBondContact O-CB 3.34Å; Y430-K434 PolarHBondContact O-N 2.92Å; Y430-K434 PolarHBondContact OH-NZ 2.95Å
431	K	95.6	Very high	96.3	Very high	116 Å²	116	43.6 Å²	43.6	50%	0.504	22%	0.217	S	C	.	.	H	α-helix	trans	-64	-38.5	179.1	-74.5	174.2	-176.4	164.7	0	111.8	E427 H428 K434 S435	E427-K431 VanDerWaalsContact CD-NZ 3.32Å; E427-K431 HydrophobicContact CG-CD 4.28Å; E427-K431 WeakPolarHBondContact O-CG 3.29Å; E427-K431 PolarHBondContact O-N 3.19Å; E427-K431 WeakPolarHBondContact OE1-CE 3.48Å; E427-K431 IonicContact OE1-NZ 2.69Å; E427-K431 PolarHBondContact OE1-NZ 3.31Å; H428-K431 PolarHBondContact O-N 3.39Å; K431-K434 PolarHBondContact O-N 3.21Å; K431-S435 WeakPolarHBondContact O-CB 3.46Å; K431-S435 PolarHBondContact O-N 3.41Å; K431-S435 VanDerWaalsContact O-N 3.07Å; K431-S435 PolarHBondContact O-OG 3.02Å
432	L	94.9	Very high	96.3	Very high	61 Å²	61	45 Å²	45	32%	0.319	22%	0.224	S	C	.	.	H	α-helix	trans	-61	-53.8	175.3	179.3	64.2	0	0	0	111.2	H428 I429 Y430 K434 S435 D436	H428-L432 WeakPolarHBondContact O-CB 3.27Å; H428-L432 PolarHBondContact O-N 3.02Å; I429-L432 HydrophobicContact CD1-CD2 4.43Å; I429-L432 PolarHBondContact O-N 3.28Å; Y430-L432 VanDerWaalsContact C-N 3.33Å; Y430-L432 PolarHBondContact O-N 2.96Å; L432-K434 VanDerWaalsContact C-N 3.31Å; L432-K434 PolarHBondContact O-N 2.7Å; L432-S435 PolarHBondContact O-N 3.38Å; L432-S435 PolarHBondContact O-OG 3.12Å; L432-D436 PolarHBondContact O-N 3.07Å; L432-D436 VanDerWaalsContact O-N 3.08Å
433	M	96.5	Very high	96.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.7	-39	178.3	-70	-172	-65.4	0	0	112	F337 F350 N362 L363 W366 I429 Y430 S437 Y438	F337-M433 HydrophobicContact CE1-CB 3.84Å; F337-M433 HydrophobicContact CE1-CE 4.28Å; F337-M433 HydrophobicContact CE2-CB 4.43Å; F337-M433 HydrophobicContact CZ-CB 3.51Å; F337-M433 HydrophobicContact CZ-CE 4Å; F337-M433 HydrophobicContact CZ-SD 4.32Å; F350-M433 HydrophobicContact CE1-SD 4.37Å; N362-M433 HydrophobicContact CB-CG 3.95Å; N362-M433 HydrophobicContact CB-SD 3.78Å; L363-M433 HydrophobicContact CB-SD 3.93Å; L363-M433 HydrophobicContact CD1-CE 4.47Å; L363-M433 HydrophobicContact CD1-SD 4.41Å; W366-M433 HydrophobicContact CB-CE 3.86Å; W366-M433 HydrophobicContact CG-CE 4.08Å; I429-M433 HydrophobicContact CG2-CE 3.85Å; I429-M433 HydrophobicContact CG2-SD 4.46Å; I429-M433 WeakPolarHBondContact O-CG 3.34Å; I429-M433 PolarHBondContact O-N 2.72Å; Y430-M433 PolarHBondContact O-N 2.93Å; M433-S437 PolarHBondContact O-N 3.26Å; M433-Y438 VanDerWaalsContact O-CB 3.27Å; M433-Y438 WeakPolarHBondContact O-CB 3.39Å; M433-Y438 PolarHBondContact O-N 3.46Å
434	K	97.1	Very high	96.3	Very high	92 Å²	92	49.8 Å²	49.8	40%	0.4	24%	0.24	S	C	.	.	H	α-helix	trans	-63	-42.2	-179.6	-177.4	167.1	-176.6	164.5	0	112.7	F337 Y430 K431 L432	F337-K434 HydrophobicContact CB-CB 4.33Å; F337-K434 HydrophobicContact CB-CD 4.22Å; F337-K434 HydrophobicContact CB-CG 3.93Å; F337-K434 HydrophobicContact CD1-CB 3.61Å; F337-K434 HydrophobicContact CD1-CD 4.39Å; F337-K434 HydrophobicContact CD1-CG 4.12Å; F337-K434 HydrophobicContact CE1-CB 4.17Å; F337-K434 HydrophobicContact CG-CB 4.16Å; F337-K434 HydrophobicContact CG-CG 4.31Å; Y430-K434 HydrophobicContact CD1-CD 4.49Å; Y430-K434 HydrophobicContact CE1-CB 4.48Å; Y430-K434 HydrophobicContact CE1-CD 3.62Å; Y430-K434 WeakPolarHBondContact O-CB 3.34Å; Y430-K434 PolarHBondContact O-N 2.92Å; Y430-K434 PolarHBondContact OH-NZ 2.95Å; K431-K434 PolarHBondContact O-N 3.21Å; L432-K434 VanDerWaalsContact C-N 3.31Å; L432-K434 PolarHBondContact O-N 2.7Å
435	S	95.6	Very high	96.4	Very high	89 Å²	89	52.7 Å²	52.7	62%	0.622	26%	0.256	S	S	*	.	H	α-helix	trans	-84.1	-29.3	-175.3	65.1	0	0	0	0	113.3	K431 L432	K431-S435 WeakPolarHBondContact O-CB 3.46Å; K431-S435 PolarHBondContact O-N 3.41Å; K431-S435 VanDerWaalsContact O-N 3.07Å; K431-S435 PolarHBondContact O-OG 3.02Å; L432-S435 PolarHBondContact O-N 3.38Å; L432-S435 PolarHBondContact O-OG 3.12Å
436	D	95.5	Very high	96.2	Very high	64 Å²	64	55 Å²	55	34%	0.342	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-76.1	-177.5	179.5	46.2	0	0	0	112.9	L432 Y438 A439 R440	L432-D436 PolarHBondContact O-N 3.07Å; L432-D436 VanDerWaalsContact O-N 3.08Å; D436-Y438 PolarHBondContact O-N 2.98Å; D436-A439 PolarHBondContact O-N 2.97Å; D436-A439 VanDerWaalsContact O-N 3.13Å; D436-R440 PolarHBondContact O-N 3.44Å; D436-R440 IonicContact OD1-CZ 3.6Å; D436-R440 IonicContact OD1-NE 2.75Å; D436-R440 PolarHBondContact OD1-NE 2.83Å; D436-R440 IonicContact OD1-NH2 3.04Å; D436-R440 IonicContact OD2-CZ 3.42Å; D436-R440 IonicContact OD2-NE 3.27Å; D436-R440 PolarHBondContact OD2-NE 3.32Å; D436-R440 IonicContact OD2-NH2 2.66Å; D436-R440 PolarHBondContact OD2-NH2 3.5Å
437	S	96.7	Very high	96.1	Very high	4 Å²	4	55.1 Å²	55.1	3%	0.028	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-40.4	-168.1	-39.6	0	0	0	0	113.5	M433 R440 F441	M433-S437 PolarHBondContact O-N 3.26Å; S437-R440 PolarHBondContact O-N 3.28Å; S437-F441 WeakPolarHBondContact O-CB 3.44Å; S437-F441 PolarHBondContact O-N 3.16Å
438	Y	98.1	Very high	96.2	Very high	19 Å²	19	53.8 Å²	53.8	8%	0.075	27%	0.269	C	S	.	.	H	α-helix	trans	-65.8	-42.9	176.4	172.8	-113.4	0	0	0	111.9	W333 G334 S336 F337 I340 M433 D436 R440 F441 L442	W333-Y438 PolarHBondContact O-OH 2.99Å; G334-Y438 WeakPolarHBondContact CA-OH 3.33Å; G334-Y438 PolarHBondContact O-OH 3.38Å; S336-Y438 PolarHBondContact N-OH 3.49Å; S336-Y438 PolarHBondContact O-OH 2.89Å; F337-Y438 HydrophobicContact CB-CD1 3.92Å; F337-Y438 HydrophobicContact CB-CD2 4.49Å; F337-Y438 HydrophobicContact CB-CE1 4.09Å; F337-Y438 HydrophobicContact CB-CG 4.13Å; F337-Y438 HydrophobicContact CD2-CD1 4.18Å; F337-Y438 AromaticContact CD2-CD2 3.56Å; F337-Y438 HydrophobicContact CD2-CD2 3.56Å; F337-Y438 HydrophobicContact CD2-CE2 4.25Å; F337-Y438 AromaticContact CD2-CG 3.51Å; F337-Y438 HydrophobicContact CD2-CG 3.51Å; F337-Y438 HydrophobicContact CE2-CD2 4.27Å; F337-Y438 HydrophobicContact CE2-CG 4.25Å; F337-Y438 HydrophobicContact CG-CD1 4.36Å; F337-Y438 HydrophobicContact CG-CD2 4.45Å; F337-Y438 HydrophobicContact CG-CG 4.12Å; I340-Y438 HydrophobicContact CB-CE2 4.41Å; I340-Y438 HydrophobicContact CG2-CD2 3.89Å; I340-Y438 HydrophobicContact CG2-CE2 3.65Å; M433-Y438 VanDerWaalsContact O-CB 3.27Å; M433-Y438 WeakPolarHBondContact O-CB 3.39Å; M433-Y438 PolarHBondContact O-N 3.46Å; D436-Y438 PolarHBondContact O-N 2.98Å; Y438-R440 VanDerWaalsContact C-N 3.28Å; Y438-R440 PolarHBondContact O-N 2.95Å; Y438-F441 WeakPolarHBondContact O-CB 3.32Å; Y438-F441 PolarHBondContact O-N 3.36Å; Y438-L442 HydrophobicContact CD2-CG 4.37Å; Y438-L442 HydrophobicContact CE1-CD1 3.81Å; Y438-L442 HydrophobicContact CE1-CG 4.41Å; Y438-L442 HydrophobicContact CE2-CD1 4.11Å; Y438-L442 HydrophobicContact CE2-CD2 3.88Å; Y438-L442 HydrophobicContact CE2-CG 3.94Å; Y438-L442 WeakPolarHBondContact O-CG 3.41Å; Y438-L442 PolarHBondContact O-N 3.13Å
439	A	97	Very high	96.1	Very high	30 Å²	30	56.4 Å²	56.4	25%	0.248	28%	0.284	C	S	.	.	H	α-helix	trans	-64.3	-34	176.3	0	0	0	0	0	111.9	D436 R443	D436-A439 PolarHBondContact O-N 2.97Å; D436-A439 VanDerWaalsContact O-N 3.13Å; A439-R443 PolarHBondContact O-NE 3Å; A439-R443 PolarHBondContact O-NH2 2.77Å
440	R	97.6	Very high	95.9	Very high	82 Å²	82	58.5 Å²	58.5	31%	0.309	30%	0.296	S	S	.	.	H	α-helix	trans	-70.8	-43	171.8	-69.1	-167.6	-78.1	128.6	-0.1	111.9	F353 E357 D436 S437 Y438 L442 R443 S444	F353-R440 HydrophobicContact CE1-CB 4.46Å; F353-R440 HydrophobicContact CZ-CB 4.05Å; E357-R440 IonicContact OE1-NH1 3.48Å; E357-R440 PolarHBondContact OE1-NH1 2.87Å; E357-R440 IonicContact OE2-CZ 3.91Å; E357-R440 IonicContact OE2-NH1 3.02Å; E357-R440 PolarHBondContact OE2-NH1 3.18Å; E357-R440 IonicContact OE2-NH2 2.86Å; D436-R440 PolarHBondContact O-N 3.44Å; D436-R440 IonicContact OD1-CZ 3.6Å; D436-R440 IonicContact OD1-NE 2.75Å; D436-R440 PolarHBondContact OD1-NE 2.83Å; D436-R440 IonicContact OD1-NH2 3.04Å; D436-R440 IonicContact OD2-CZ 3.42Å; D436-R440 IonicContact OD2-NE 3.27Å; D436-R440 PolarHBondContact OD2-NE 3.32Å; D436-R440 IonicContact OD2-NH2 2.66Å; D436-R440 PolarHBondContact OD2-NH2 3.5Å; S437-R440 PolarHBondContact O-N 3.28Å; Y438-R440 VanDerWaalsContact C-N 3.28Å; Y438-R440 PolarHBondContact O-N 2.95Å; R440-L442 PolarHBondContact O-N 3.14Å; R440-R443 CarbonylContact O-C 3.4Å; R440-R443 PolarHBondContact O-N 2.87Å; R440-S444 PolarHBondContact O-N 3.36Å
441	F	97.9	Very high	95.6	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-55.4	-48.1	175.4	172.1	-102	0	0	0	112.3	I340 Q349 F350 F353 S437 Y438 R443 S444 Y447	I340-F441 HydrophobicContact CD1-CD1 3.73Å; I340-F441 HydrophobicContact CD1-CE1 3.22Å; I340-F441 HydrophobicContact CD1-CZ 3.83Å; Q349-F441 HydrophobicContact CB-CZ 4.39Å; F350-F441 HydrophobicContact CD2-CB 3.75Å; F350-F441 HydrophobicContact CD2-CD1 4.14Å; F350-F441 AromaticContact CD2-CD2 3.92Å; F350-F441 HydrophobicContact CD2-CD2 3.92Å; F350-F441 AromaticContact CD2-CG 3.66Å; F350-F441 HydrophobicContact CD2-CG 3.66Å; F350-F441 HydrophobicContact CE2-CB 3.75Å; F350-F441 HydrophobicContact CE2-CG 4.19Å; F353-F441 HydrophobicContact CB-CD2 3.71Å; F353-F441 HydrophobicContact CB-CE2 4.19Å; F353-F441 HydrophobicContact CD1-CB 3.79Å; F353-F441 AromaticContact CD1-CD2 3.92Å; F353-F441 HydrophobicContact CD1-CD2 3.92Å; F353-F441 HydrophobicContact CD1-CG 4.33Å; F353-F441 HydrophobicContact CD2-CD2 4.31Å; F353-F441 HydrophobicContact CE1-CB 3.83Å; F353-F441 HydrophobicContact CG-CB 4.34Å; F353-F441 AromaticContact CG-CD2 3.7Å; F353-F441 HydrophobicContact CG-CD2 3.7Å; F353-F441 HydrophobicContact CZ-CB 4.42Å; S437-F441 WeakPolarHBondContact O-CB 3.44Å; S437-F441 PolarHBondContact O-N 3.16Å; Y438-F441 WeakPolarHBondContact O-CB 3.32Å; Y438-F441 PolarHBondContact O-N 3.36Å; F441-R443 PolarHBondContact O-N 2.87Å; F441-R443 VanDerWaalsContact O-N 3.16Å; F441-S444 VanDerWaalsContact O-CB 3.29Å; F441-S444 WeakPolarHBondContact O-CB 3.42Å; F441-S444 PolarHBondContact O-N 3.19Å; F441-S444 PolarHBondContact O-OG 3.06Å; F441-Y447 HydrophobicContact CD1-CD2 4.44Å; F441-Y447 AromaticContact CE1-CD2 3.59Å; F441-Y447 HydrophobicContact CE1-CD2 3.59Å; F441-Y447 HydrophobicContact CE1-CE2 4.44Å; F441-Y447 HydrophobicContact CE1-CG 4.07Å; F441-Y447 AromaticContact CZ-CD2 3.96Å; F441-Y447 HydrophobicContact CZ-CD2 3.96Å; F441-Y447 HydrophobicContact CZ-CG 4.39Å; F441-Y447 VanDerWaalsContact O-CB 3.27Å; F441-Y447 WeakPolarHBondContact O-CB 3.37Å
442	L	97.1	Very high	95.3	Very high	36 Å²	36	58.8 Å²	58.8	19%	0.188	30%	0.304	C	S	.	.	H	α-helix	trans	-62.7	-23.9	179.1	-66.2	-174.9	0	0	0	113.8	Y438 R440 Y447 Q448	Y438-L442 HydrophobicContact CD2-CG 4.37Å; Y438-L442 HydrophobicContact CE1-CD1 3.81Å; Y438-L442 HydrophobicContact CE1-CG 4.41Å; Y438-L442 HydrophobicContact CE2-CD1 4.11Å; Y438-L442 HydrophobicContact CE2-CD2 3.88Å; Y438-L442 HydrophobicContact CE2-CG 3.94Å; Y438-L442 WeakPolarHBondContact O-CG 3.41Å; Y438-L442 PolarHBondContact O-N 3.13Å; R440-L442 PolarHBondContact O-N 3.14Å; L442-Y447 HydrophobicContact CB-CD1 4.49Å; L442-Y447 HydrophobicContact CD2-CD1 4.18Å; L442-Y447 HydrophobicContact CD2-CD2 4.2Å; L442-Y447 HydrophobicContact CD2-CE1 3.93Å; L442-Y447 HydrophobicContact CD2-CE2 3.97Å; L442-Y447 HydrophobicContact CD2-CG 4.29Å; L442-Y447 VanDerWaalsContact O-CD1 3.24Å; L442-Y447 WeakPolarHBondContact O-CD1 3.25Å; L442-Q448 PolarHBondContact O-NE2 3.14Å
443	R	96.5	Very high	94.5	Very high	178 Å²	178	58.8 Å²	58.8	67%	0.672	31%	0.313	S	S	*	.	H	α-helix	trans	-93.4	-8.6	175.8	-68.3	180	-68.4	-146.3	0.1	113.1	A439 R440 F441	A439-R443 PolarHBondContact O-NE 3Å; A439-R443 PolarHBondContact O-NH2 2.77Å; R440-R443 CarbonylContact O-C 3.4Å; R440-R443 PolarHBondContact O-N 2.87Å; F441-R443 PolarHBondContact O-N 2.87Å; F441-R443 VanDerWaalsContact O-N 3.16Å
444	S	96.4	Very high	92.8	Very high	18 Å²	18	66.9 Å²	66.9	13%	0.126	35%	0.348	C	S	.	.	S	Bend	trans	-72.7	151.5	-177.9	75.8	0	0	0	0	111.7	R440 F441 A446 Y447 Q448	R440-S444 PolarHBondContact O-N 3.36Å; F441-S444 VanDerWaalsContact O-CB 3.29Å; F441-S444 WeakPolarHBondContact O-CB 3.42Å; F441-S444 PolarHBondContact O-N 3.19Å; F441-S444 PolarHBondContact O-OG 3.06Å; S444-A446 PolarHBondContact O-N 3.48Å; S444-Y447 PolarHBondContact O-N 3.33Å; S444-Y447 PolarHBondContact OG-N 2.96Å; S444-Q448 WeakPolarHBondContact O-CG 3.47Å; S444-Q448 PolarHBondContact O-N 2.94Å; S444-Q448 VanDerWaalsContact O-N 3.09Å
445	N	94.4	Very high	90.8	Very high	122 Å²	122	69.6 Å²	69.6	65%	0.652	36%	0.36	S	S	*	.	H	α-helix	trans	-58.7	-33.4	172.7	-66.1	-20	0	0	0	111.4	Y447 Q448 D449	N445-Y447 VanDerWaalsContact C-N 3.32Å; N445-Y447 PolarHBondContact O-N 3.49Å; N445-Q448 PolarHBondContact O-N 2.85Å; N445-D449 VanDerWaalsContact O-CB 3.24Å; N445-D449 WeakPolarHBondContact O-CB 3.28Å; N445-D449 PolarHBondContact O-N 3.09Å
446	A	92.3	Very high	87.9	Confident	49 Å²	49	74.5 Å²	74.5	41%	0.405	37%	0.37	S	S	.	.	H	α-helix	trans	-57.2	-42.6	178.4	0	0	0	0	0	112.8	S444 L450	S444-A446 PolarHBondContact O-N 3.48Å; A446-L450 WeakPolarHBondContact O-CD1 3.34Å; A446-L450 VanDerWaalsContact O-CG 3.31Å; A446-L450 WeakPolarHBondContact O-CG 3.35Å
447	Y	95.8	Very high	85.1	Confident	13 Å²	13	77.1 Å²	77.1	5%	0.051	39%	0.39	C	S	.	.	H	α-helix	trans	-77.4	-43.2	175.7	175.8	-101.8	0	0	0	112.2	V330 W333 F441 L442 S444 N445 D449 L450 L451	V330-Y447 HydrophobicContact CG1-CD2 4.17Å; V330-Y447 HydrophobicContact CG1-CE2 3.72Å; V330-Y447 PolarHBondContact O-OH 3.16Å; W333-Y447 HydrophobicContact CB-CE2 4.39Å; W333-Y447 HydrophobicContact CE3-CE2 4.41Å; F441-Y447 HydrophobicContact CD1-CD2 4.44Å; F441-Y447 AromaticContact CE1-CD2 3.59Å; F441-Y447 HydrophobicContact CE1-CD2 3.59Å; F441-Y447 HydrophobicContact CE1-CE2 4.44Å; F441-Y447 HydrophobicContact CE1-CG 4.07Å; F441-Y447 AromaticContact CZ-CD2 3.96Å; F441-Y447 HydrophobicContact CZ-CD2 3.96Å; F441-Y447 HydrophobicContact CZ-CG 4.39Å; F441-Y447 VanDerWaalsContact O-CB 3.27Å; F441-Y447 WeakPolarHBondContact O-CB 3.37Å; L442-Y447 HydrophobicContact CB-CD1 4.49Å; L442-Y447 HydrophobicContact CD2-CD1 4.18Å; L442-Y447 HydrophobicContact CD2-CD2 4.2Å; L442-Y447 HydrophobicContact CD2-CE1 3.93Å; L442-Y447 HydrophobicContact CD2-CE2 3.97Å; L442-Y447 HydrophobicContact CD2-CG 4.29Å; L442-Y447 VanDerWaalsContact O-CD1 3.24Å; L442-Y447 WeakPolarHBondContact O-CD1 3.25Å; S444-Y447 PolarHBondContact O-N 3.33Å; S444-Y447 PolarHBondContact OG-N 2.96Å; N445-Y447 VanDerWaalsContact C-N 3.32Å; N445-Y447 PolarHBondContact O-N 3.49Å; Y447-D449 VanDerWaalsContact C-N 3.33Å; Y447-D449 PolarHBondContact O-N 3.31Å; Y447-L450 PolarHBondContact O-N 3.41Å; Y447-L451 HydrophobicContact CE1-CD2 4.05Å; Y447-L451 WeakPolarHBondContact O-CB 3.24Å; Y447-L451 PolarHBondContact O-N 3.09Å
448	Q	95.8	Very high	82.1	Confident	70 Å²	70	85.7 Å²	85.7	33%	0.327	43%	0.43	S	S	.	.	H	α-helix	trans	-63.4	-39.1	-177.9	-65.2	-61.8	-36.6	0	0	112.1	L442 S444 N445 L451 L452	L442-Q448 PolarHBondContact O-NE2 3.14Å; S444-Q448 WeakPolarHBondContact O-CG 3.47Å; S444-Q448 PolarHBondContact O-N 2.94Å; S444-Q448 VanDerWaalsContact O-N 3.09Å; N445-Q448 PolarHBondContact O-N 2.85Å; Q448-L451 PolarHBondContact O-N 3.27Å; Q448-L452 WeakPolarHBondContact O-CB 3.39Å; Q448-L452 VanDerWaalsContact O-CG 3.26Å; Q448-L452 WeakPolarHBondContact O-CG 3.33Å; Q448-L452 PolarHBondContact O-N 3.49Å
449	D	93.3	Very high	79	Confident	106 Å²	106	88.9 Å²	88.9	57%	0.567	46%	0.455	S	S	*	.	H	α-helix	trans	-65	-40.8	176.7	-67.7	-21.2	0	0	0	111.3	N445 Y447 L451 L452 A453	N445-D449 VanDerWaalsContact O-CB 3.24Å; N445-D449 WeakPolarHBondContact O-CB 3.28Å; N445-D449 PolarHBondContact O-N 3.09Å; Y447-D449 VanDerWaalsContact C-N 3.33Å; Y447-D449 PolarHBondContact O-N 3.31Å; D449-L451 VanDerWaalsContact C-N 3.35Å; D449-L452 PolarHBondContact O-N 3.16Å; D449-A453 VanDerWaalsContact O-CB 3.3Å; D449-A453 WeakPolarHBondContact O-CB 3.34Å; D449-A453 PolarHBondContact O-N 2.95Å
450	L	92.6	Very high	76.2	Confident	45 Å²	45	94.2 Å²	94.2	24%	0.236	48%	0.475	C	S	.	.	H	α-helix	trans	-65.7	-37.4	174.4	-71.3	173.1	0	0	0	112.2	V330 W333 Q349 A446 Y447 L452	V330-L450 HydrophobicContact CG1-CB 4.04Å; V330-L450 HydrophobicContact CG2-CB 4.41Å; W333-L450 HydrophobicContact CZ3-CD1 4.22Å; Q349-L450 HydrophobicContact CB-CD1 4.4Å; Q349-L450 HydrophobicContact CG-CD1 3.86Å; A446-L450 WeakPolarHBondContact O-CD1 3.34Å; A446-L450 VanDerWaalsContact O-CG 3.31Å; A446-L450 WeakPolarHBondContact O-CG 3.35Å; Y447-L450 PolarHBondContact O-N 3.41Å; L450-L452 VanDerWaalsContact C-N 3.35Å
451	L	92.1	Very high	73.3	Confident	37 Å²	37	98.8 Å²	98.8	19%	0.194	50%	0.5	C	S	.	.	H	α-helix	trans	-70.5	-32.7	177.8	-172.9	64.6	0	0	0	112	Q327 V330 K331 Y447 Q448 D449	Q327-L451 WeakPolarHBondContact CG-O 3.33Å; Q327-L451 PolarHBondContact NE2-O 2.72Å; V330-L451 HydrophobicContact CG1-CB 4.29Å; V330-L451 HydrophobicContact CG1-CD1 4.3Å; K331-L451 HydrophobicContact CB-CD1 3.89Å; Y447-L451 HydrophobicContact CE1-CD2 4.05Å; Y447-L451 WeakPolarHBondContact O-CB 3.24Å; Y447-L451 PolarHBondContact O-N 3.09Å; Q448-L451 PolarHBondContact O-N 3.27Å; D449-L451 VanDerWaalsContact C-N 3.35Å
452	L	88.7	Confident	70.5	Confident	120 Å²	120	102.1 Å²	102.1	63%	0.628	53%	0.534	S	S	*	.	H	α-helix	trans	-89.3	-14.4	179.8	-68	174.1	0	0	0	113.6	Q448 D449 L450 K454	Q448-L452 WeakPolarHBondContact O-CB 3.39Å; Q448-L452 VanDerWaalsContact O-CG 3.26Å; Q448-L452 WeakPolarHBondContact O-CG 3.33Å; Q448-L452 PolarHBondContact O-N 3.49Å; D449-L452 PolarHBondContact O-N 3.16Å; L450-L452 VanDerWaalsContact C-N 3.35Å; L452-K454 VanDerWaalsContact C-N 3.26Å; L452-K454 PolarHBondContact O-N 2.66Å
453	A	78.1	Confident	67.9	Low	61 Å²	61	112 Å²	112	50%	0.504	57%	0.569	S	S	.	*			trans	-62.6	84.5	177	0	0	0	0	0	110.9	D449 K455	D449-A453 VanDerWaalsContact O-CB 3.3Å; D449-A453 WeakPolarHBondContact O-CB 3.34Å; D449-A453 PolarHBondContact O-N 2.95Å; A453-K455 PolarHBondContact O-N 2.95Å
454	K	60.8	Low	65.2	Low	169 Å²	169	108.7 Å²	108.7	74%	0.735	56%	0.557	S	S	*	*			trans	-67.9	125	166	-71.2	-172.4	176.6	-175.8	0	107.6	L452 K456	L452-K454 VanDerWaalsContact C-N 3.26Å; L452-K454 PolarHBondContact O-N 2.66Å; K454-K456 PolarHBondContact O-N 3.37Å
455	K	55	Low	63.1	Low	149 Å²	149	112.4 Å²	112.4	65%	0.648	58%	0.579	S	S	*	*			trans	-53.5	113	156.6	-83.9	-171.2	174.3	-176.7	0	106.5	A453	A453-K455 PolarHBondContact O-N 2.95Å
456	K	33.6	Very low	61	Low	192 Å²	192	111.6 Å²	111.6	84%	0.835	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-55.6	126.9	153.7	-84.3	-178.8	177.1	175.8	0	104.3	K454 E458	K454-K456 PolarHBondContact O-N 3.37Å; K456-E458 PolarHBondContact O-N 3.34Å
457	P	36.7	Very low	58.8	Low	119 Å²	119	115.2 Å²	115.2	77%	0.773	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-54.8	118.7	165.5	23.8	-29.1	0	0	0	104.9	S459	P457-S459 PolarHBondContact O-N 3.02Å
458	E	33.9	Very low	56.6	Low	185 Å²	185	120 Å²	120	86%	0.864	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-51	117.7	163	-77.9	-172.3	148	0	0	104.8	K456 E460	K456-E458 PolarHBondContact O-N 3.34Å; E458-E460 PolarHBondContact O-N 2.84Å; E458-E460 VanDerWaalsContact O-N 3.13Å
459	S	33.4	Very low	54.5	Low	86 Å²	86	123.1 Å²	123.1	60%	0.601	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-53.5	126	171.6	43.4	0	0	0	0	106.5	P457 Q461	P457-S459 PolarHBondContact O-N 3.02Å; S459-Q461 PolarHBondContact O-N 3.17Å
460	E	38.1	Very low	52.7	Low	142 Å²	142	125 Å²	125	66%	0.664	63%	0.633	S	S	*	*	S	Bend	trans	-64.3	52.2	169.1	-71.2	-174.4	127.1	0	0	111	E458 R464	E458-E460 PolarHBondContact O-N 2.84Å; E458-E460 VanDerWaalsContact O-N 3.13Å; E460-R464 VanDerWaalsContact CD-NH2 3.33Å; E460-R464 IonicContact OE1-CZ 3.45Å; E460-R464 IonicContact OE1-NH2 3.4Å; E460-R464 PolarHBondContact OE1-NH2 3.06Å; E460-R464 IonicContact OE2-CZ 3.67Å; E460-R464 VanDerWaalsContact OE2-CZ 3.3Å; E460-R464 IonicContact OE2-NH1 2.91Å; E460-R464 PolarHBondContact OE2-NH1 3.24Å; E460-R464 IonicContact OE2-NH2 3.74Å; E460-R464 PolarHBondContact OE2-NH2 2.92Å
461	Q	37.4	Very low	51.1	Low	177 Å²	177	126.6 Å²	126.6	83%	0.827	65%	0.645	S	S	*	*			trans	-110	66.8	170.6	-90.1	159.3	-31.1	0	0	107.5	S459	S459-Q461 PolarHBondContact O-N 3.17Å
462	G	38.6	Very low	49.3	Very low	70 Å²	70	133.1 Å²	133.1	72%	0.722	67%	0.667	S	S	*	*	S	Bend	trans	-172.2	-23.8	176	0	0	0	0	0	118.2
463	R	42.3	Very low	48.1	Very low	245 Å²	245	130.5 Å²	130.5	93%	0.925	66%	0.658	S	S	*	*			trans	-145.2	67.5	-178.3	-77.7	-175.5	174.6	160	-2.5	113.3
464	R	40.1	Very low	47.4	Very low	108 Å²	108	130.2 Å²	130.2	41%	0.408	65%	0.65	S	S	.	*			trans	-114.6	110.2	154.4	-82.5	-176	176.9	129.4	9.3	107.5	E460	E460-R464 VanDerWaalsContact CD-NH2 3.33Å; E460-R464 IonicContact OE1-CZ 3.45Å; E460-R464 IonicContact OE1-NH2 3.4Å; E460-R464 PolarHBondContact OE1-NH2 3.06Å; E460-R464 IonicContact OE2-CZ 3.67Å; E460-R464 VanDerWaalsContact OE2-CZ 3.3Å; E460-R464 IonicContact OE2-NH1 2.91Å; E460-R464 PolarHBondContact OE2-NH1 3.24Å; E460-R464 IonicContact OE2-NH2 3.74Å; E460-R464 PolarHBondContact OE2-NH2 2.92Å
465	T	51.5	Low	47.3	Very low	96 Å²	96	125.4 Å²	125.4	59%	0.589	64%	0.637	S	S	*	*			trans	-56.2	145.2	174.2	52.4	0	0	0	0	108.9	L467 E468	T465-L467 PolarHBondContact O-N 2.87Å; T465-E468 PolarHBondContact O-N 3.48Å
466	S	50.8	Low	47.6	Very low	105 Å²	105	123 Å²	123	73%	0.734	63%	0.631	S	S	*	*	H	α-helix	trans	-55.2	-21.8	-176.9	54.9	0	0	0	0	113.5	F470	S466-F470 PolarHBondContact O-N 3.07Å
467	L	47	Very low	49	Very low	124 Å²	124	119.6 Å²	119.6	65%	0.649	62%	0.618	S	S	*	*	H	α-helix	trans	-69.6	-44.6	-179.6	-162.3	65.9	0	0	0	112.4	T465 K469 F470 T471	T465-L467 PolarHBondContact O-N 2.87Å; L467-K469 PolarHBondContact O-N 2.93Å; L467-F470 WeakPolarHBondContact O-CB 3.4Å; L467-F470 PolarHBondContact O-N 3.28Å; L467-F470 VanDerWaalsContact O-N 3.16Å; L467-T471 PolarHBondContact O-N 3.17Å; L467-T471 PolarHBondContact O-OG1 3.44Å
468	E	49.5	Very low	50.2	Low	113 Å²	113	119 Å²	119	53%	0.528	61%	0.608	S	S	.	*	H	α-helix	trans	-68	-35.3	-179.7	-71.4	-175	154.8	0	0	112.9	T465 F470 T471 R472	T465-E468 PolarHBondContact O-N 3.48Å; E468-F470 VanDerWaalsContact C-N 3.31Å; E468-T471 PolarHBondContact O-N 3.21Å; E468-R472 WeakPolarHBondContact O-CB 3.48Å; E468-R472 PolarHBondContact O-N 3.45Å
469	K	50.8	Low	51.4	Low	137 Å²	137	116.1 Å²	116.1	60%	0.596	60%	0.598	S	S	*	*	H	α-helix	trans	-64.7	-37.9	173.2	-69.7	-179.1	-178	173.5	0	111.2	L467 S473	L467-K469 PolarHBondContact O-N 2.93Å; K469-S473 WeakPolarHBondContact O-CB 3.27Å; K469-S473 PolarHBondContact O-N 3.37Å; K469-S473 VanDerWaalsContact O-N 3.11Å
470	F	54.9	Low	52.6	Low	145 Å²	145	118 Å²	118	64%	0.636	60%	0.595	S	S	*	*	H	α-helix	trans	-67.3	-48.4	176.1	-168.8	-99.5	0	0	0	111.5	S466 L467 E468 R472 S473 V474	S466-F470 PolarHBondContact O-N 3.07Å; L467-F470 WeakPolarHBondContact O-CB 3.4Å; L467-F470 PolarHBondContact O-N 3.28Å; L467-F470 VanDerWaalsContact O-N 3.16Å; E468-F470 VanDerWaalsContact C-N 3.31Å; F470-R472 VanDerWaalsContact C-N 3.35Å; F470-R472 PolarHBondContact O-N 2.73Å; F470-S473 PolarHBondContact O-N 2.72Å; F470-V474 HydrophobicContact CD1-CG2 4.05Å; F470-V474 HydrophobicContact CE1-CG2 3.77Å; F470-V474 HydrophobicContact CE2-CG2 4.37Å; F470-V474 HydrophobicContact CG-CG2 4.47Å; F470-V474 HydrophobicContact CZ-CG2 3.95Å; F470-V474 WeakPolarHBondContact O-CB 3.4Å; F470-V474 VanDerWaalsContact O-CG2 3.3Å; F470-V474 WeakPolarHBondContact O-CG2 3.47Å; F470-V474 PolarHBondContact O-N 2.79Å
471	T	58.8	Low	53.7	Low	78 Å²	78	117.3 Å²	117.3	48%	0.479	59%	0.592	S	S	.	*	H	α-helix	trans	-64.3	-39.1	-178.4	-34.3	0	0	0	0	112	L467 E468 C475	L467-T471 PolarHBondContact O-N 3.17Å; L467-T471 PolarHBondContact O-OG1 3.44Å; E468-T471 PolarHBondContact O-N 3.21Å; T471-C475 VanDerWaalsContact O-CB 3.31Å; T471-C475 WeakPolarHBondContact O-CB 3.31Å; T471-C475 PolarHBondContact O-N 3.09Å
472	R	55.4	Low	54.7	Low	174 Å²	174	110.6 Å²	110.6	66%	0.657	57%	0.571	S	S	*	*	H	α-helix	trans	-69.9	-39.2	177.7	-139.8	174.8	-170.9	179.4	3.1	111.7	E468 F470 L476	E468-R472 WeakPolarHBondContact O-CB 3.48Å; E468-R472 PolarHBondContact O-N 3.45Å; F470-R472 VanDerWaalsContact C-N 3.35Å; F470-R472 PolarHBondContact O-N 2.73Å; R472-L476 WeakPolarHBondContact O-CB 3.41Å; R472-L476 PolarHBondContact O-N 3.06Å
473	S	63	Low	55.6	Low	65 Å²	65	114.2 Å²	114.2	46%	0.455	56%	0.563	S	S	.	*	H	α-helix	trans	-66.3	-43.1	176	-167.1	0	0	0	0	111.8	K469 F470 L476 Q477	K469-S473 WeakPolarHBondContact O-CB 3.27Å; K469-S473 PolarHBondContact O-N 3.37Å; K469-S473 VanDerWaalsContact O-N 3.11Å; F470-S473 PolarHBondContact O-N 2.72Å; S473-L476 PolarHBondContact O-N 3.1Å; S473-Q477 VanDerWaalsContact O-CB 3.32Å; S473-Q477 WeakPolarHBondContact O-CB 3.49Å; S473-Q477 PolarHBondContact O-N 3.23Å
474	V	63.9	Low	56.2	Low	55 Å²	55	106.6 Å²	106.6	33%	0.333	54%	0.54	S	S	.	.	H	α-helix	trans	-66.3	-42.7	178	173.8	0	0	0	0	111	F470 Q477 L478	F470-V474 HydrophobicContact CD1-CG2 4.05Å; F470-V474 HydrophobicContact CE1-CG2 3.77Å; F470-V474 HydrophobicContact CE2-CG2 4.37Å; F470-V474 HydrophobicContact CG-CG2 4.47Å; F470-V474 HydrophobicContact CZ-CG2 3.95Å; F470-V474 WeakPolarHBondContact O-CB 3.4Å; F470-V474 VanDerWaalsContact O-CG2 3.3Å; F470-V474 WeakPolarHBondContact O-CG2 3.47Å; F470-V474 PolarHBondContact O-N 2.79Å; V474-Q477 PolarHBondContact O-N 3.39Å; V474-L478 HydrophobicContact CG1-CD1 3.9Å; V474-L478 HydrophobicContact CG1-CG 4.39Å; V474-L478 WeakPolarHBondContact O-CB 3.32Å; V474-L478 VanDerWaalsContact O-CG 3.32Å; V474-L478 WeakPolarHBondContact O-CG 3.18Å; V474-L478 PolarHBondContact O-N 3.17Å
475	C	57.9	Low	56.8	Low	68 Å²	68	105.6 Å²	105.6	46%	0.459	55%	0.549	S	S	.	.	H	α-helix	trans	-64.1	-41.5	175.9	-84.6	0	0	0	0	112.9	T471 Q477 L478 L479	T471-C475 VanDerWaalsContact O-CB 3.31Å; T471-C475 WeakPolarHBondContact O-CB 3.31Å; T471-C475 PolarHBondContact O-N 3.09Å; C475-Q477 VanDerWaalsContact C-N 3.32Å; C475-Q477 PolarHBondContact O-N 2.97Å; C475-L478 PolarHBondContact O-N 3.22Å; C475-L479 WeakPolarHBondContact O-CB 3.46Å; C475-L479 VanDerWaalsContact O-CG 3.31Å; C475-L479 WeakPolarHBondContact O-CG 3.41Å; C475-L479 PolarHBondContact O-N 3.22Å
476	L	62.4	Low	57.1	Low	100 Å²	100	109 Å²	109	52%	0.524	56%	0.555	S	S	.	*	H	α-helix	trans	-63.6	-37.9	174.4	-96.4	143.9	0	0	0	111.9	R472 S473 L479 F480	R472-L476 WeakPolarHBondContact O-CB 3.41Å; R472-L476 PolarHBondContact O-N 3.06Å; S473-L476 PolarHBondContact O-N 3.1Å; L476-L479 PolarHBondContact O-N 3.33Å; L476-F480 WeakPolarHBondContact O-CB 3.22Å; L476-F480 PolarHBondContact O-N 3.46Å
477	Q	62.6	Low	57.4	Low	120 Å²	120	109.3 Å²	109.3	56%	0.561	54%	0.544	S	S	*	.	H	α-helix	trans	-71.2	-38	179	-147.2	153.4	-17.5	0	0	111.9	S473 V474 C475 F480 Q481	S473-Q477 VanDerWaalsContact O-CB 3.32Å; S473-Q477 WeakPolarHBondContact O-CB 3.49Å; S473-Q477 PolarHBondContact O-N 3.23Å; V474-Q477 PolarHBondContact O-N 3.39Å; C475-Q477 VanDerWaalsContact C-N 3.32Å; C475-Q477 PolarHBondContact O-N 2.97Å; Q477-F480 PolarHBondContact O-N 3.22Å; Q477-Q481 WeakPolarHBondContact O-CB 3.35Å; Q477-Q481 WeakPolarHBondContact O-CG 3.11Å; Q477-Q481 PolarHBondContact O-N 2.69Å
478	L	61.2	Low	57.8	Low	105 Å²	105	111.2 Å²	111.2	55%	0.55	55%	0.547	S	S	.	.	H	α-helix	trans	-67.6	-39	173.3	-72.6	170.2	0	0	0	112.2	V474 C475 Q481 G482	V474-L478 HydrophobicContact CG1-CD1 3.9Å; V474-L478 HydrophobicContact CG1-CG 4.39Å; V474-L478 WeakPolarHBondContact O-CB 3.32Å; V474-L478 VanDerWaalsContact O-CG 3.32Å; V474-L478 WeakPolarHBondContact O-CG 3.18Å; V474-L478 PolarHBondContact O-N 3.17Å; C475-L478 PolarHBondContact O-N 3.22Å; L478-Q481 PolarHBondContact O-N 3.31Å; L478-G482 PolarHBondContact O-N 3.03Å
479	L	60.4	Low	58.1	Low	126 Å²	126	113.1 Å²	113.1	66%	0.66	55%	0.553	S	S	*	*	H	α-helix	trans	-65.5	-41.2	174.1	-75.5	169.3	0	0	0	111.7	C475 L476 G482 W483	C475-L479 WeakPolarHBondContact O-CB 3.46Å; C475-L479 VanDerWaalsContact O-CG 3.31Å; C475-L479 WeakPolarHBondContact O-CG 3.41Å; C475-L479 PolarHBondContact O-N 3.22Å; L476-L479 PolarHBondContact O-N 3.33Å; L479-G482 PolarHBondContact O-N 2.92Å; L479-W483 WeakPolarHBondContact O-CB 3.4Å; L479-W483 PolarHBondContact O-N 3.26Å
480	F	58.1	Low	58.3	Low	126 Å²	126	113.7 Å²	113.7	55%	0.553	56%	0.556	S	S	*	*	H	α-helix	trans	-65.9	-39.6	174.7	-108.7	-88	0	0	0	112.7	L476 Q477 W483 N484	L476-F480 WeakPolarHBondContact O-CB 3.22Å; L476-F480 PolarHBondContact O-N 3.46Å; Q477-F480 PolarHBondContact O-N 3.22Å; F480-W483 PolarHBondContact O-N 3.31Å; F480-N484 WeakPolarHBondContact O-CB 3.41Å; F480-N484 PolarHBondContact O-N 3.01Å; F480-N484 PolarHBondContact O-ND2 2.9Å
481	Q	60.3	Low	58.4	Low	126 Å²	126	114.7 Å²	114.7	59%	0.589	56%	0.56	S	S	*	*	H	α-helix	trans	-65.9	-41.8	173.8	-76.9	-168.6	-6.5	0	0	111.7	Q477 L478 W483 N484 C485	Q477-Q481 WeakPolarHBondContact O-CB 3.35Å; Q477-Q481 WeakPolarHBondContact O-CG 3.11Å; Q477-Q481 PolarHBondContact O-N 2.69Å; L478-Q481 PolarHBondContact O-N 3.31Å; Q481-W483 VanDerWaalsContact C-N 3.35Å; Q481-W483 PolarHBondContact O-N 3.17Å; Q481-N484 PolarHBondContact O-N 3.14Å; Q481-C485 WeakPolarHBondContact O-CB 3.38Å; Q481-C485 PolarHBondContact O-N 3.13Å
482	G	59	Low	58.2	Low	37 Å²	37	119.5 Å²	119.5	38%	0.381	57%	0.574	S	S	.	*	H	α-helix	trans	-61.5	-40.2	174.8	0	0	0	0	0	112.9	L478 L479 C485 K486	L478-G482 PolarHBondContact O-N 3.03Å; L479-G482 PolarHBondContact O-N 2.92Å; G482-C485 PolarHBondContact O-N 2.75Å; G482-K486 PolarHBondContact O-N 3.08Å
483	W	56.7	Low	58.2	Low	146 Å²	146	118.3 Å²	118.3	55%	0.553	58%	0.576	S	S	*	*	H	α-helix	trans	-69	-41.6	177.2	-161.8	66	0	0	0	112.6	L479 F480 Q481 K486 K487	L479-W483 WeakPolarHBondContact O-CB 3.4Å; L479-W483 PolarHBondContact O-N 3.26Å; F480-W483 PolarHBondContact O-N 3.31Å; Q481-W483 VanDerWaalsContact C-N 3.35Å; Q481-W483 PolarHBondContact O-N 3.17Å; W483-K486 PolarHBondContact O-N 2.78Å; W483-K487 HydrophobicContact CZ3-CD 4.49Å; W483-K487 PolarHBondContact O-N 2.82Å
484	N	55.9	Low	57.7	Low	84 Å²	84	122.9 Å²	122.9	45%	0.449	59%	0.59	S	S	.	*	H	α-helix	trans	-67	-34.7	174.8	-84.5	-33.8	0	0	0	112.7	F480 Q481 K487 K488	F480-N484 WeakPolarHBondContact O-CB 3.41Å; F480-N484 PolarHBondContact O-N 3.01Å; F480-N484 PolarHBondContact O-ND2 2.9Å; Q481-N484 PolarHBondContact O-N 3.14Å; N484-K487 PolarHBondContact O-N 2.87Å; N484-K488 PolarHBondContact O-N 2.83Å
485	C	53.2	Low	57.2	Low	88 Å²	88	124 Å²	124	60%	0.595	61%	0.605	S	S	*	*	H	α-helix	trans	-67.5	-42	175.1	-153.1	0	0	0	0	111.3	Q481 G482 K487 K488 K489	Q481-C485 WeakPolarHBondContact O-CB 3.38Å; Q481-C485 PolarHBondContact O-N 3.13Å; G482-C485 PolarHBondContact O-N 2.75Å; C485-K487 PolarHBondContact O-N 3.23Å; C485-K488 PolarHBondContact O-N 3.38Å; C485-K489 PolarHBondContact O-N 3.49Å
486	K	56.6	Low	56.8	Low	167 Å²	167	124.6 Å²	124.6	73%	0.726	62%	0.615	S	S	*	*	H	α-helix	trans	-62.4	-40.2	172.3	-80.6	-175.8	176.9	179.6	0	112.6	G482 W483 K489 K490	G482-K486 PolarHBondContact O-N 3.08Å; W483-K486 PolarHBondContact O-N 2.78Å; K486-K489 PolarHBondContact O-N 3.31Å; K486-K490 PolarHBondContact O-N 2.65Å
487	K	57.9	Low	56.1	Low	112 Å²	112	125.6 Å²	125.6	49%	0.487	63%	0.627	S	S	.	*	H	α-helix	trans	-64.7	-40.4	174.1	-88.2	-172.2	174.2	176.6	0	112.9	W483 N484 C485 K490 K491	W483-K487 HydrophobicContact CZ3-CD 4.49Å; W483-K487 PolarHBondContact O-N 2.82Å; N484-K487 PolarHBondContact O-N 2.87Å; C485-K487 PolarHBondContact O-N 3.23Å; K487-K490 PolarHBondContact O-N 3.03Å; K487-K491 PolarHBondContact O-N 2.89Å; K487-K491 VanDerWaalsContact O-N 3.08Å
488	K	55.8	Low	55.5	Low	164 Å²	164	125.9 Å²	125.9	71%	0.713	64%	0.642	S	S	*	*	H	α-helix	trans	-66.6	-36.5	175.8	-80	-173.4	177.5	-178.8	0	112.4	N484 C485 K491 K492	N484-K488 PolarHBondContact O-N 2.83Å; C485-K488 PolarHBondContact O-N 3.38Å; K488-K491 PolarHBondContact O-N 3.02Å; K488-K492 PolarHBondContact O-N 3.4Å; K488-K492 VanDerWaalsContact O-N 3.13Å
489	K	55.2	Low	54.7	Low	153 Å²	153	125.7 Å²	125.7	67%	0.665	66%	0.656	S	S	*	*	H	α-helix	trans	-65.9	-44	175.8	-138.1	178.5	-176.8	-174.6	0	111.6	C485 K486 K491 K492 E493	C485-K489 PolarHBondContact O-N 3.49Å; K486-K489 PolarHBondContact O-N 3.31Å; K489-K491 PolarHBondContact O-N 3.13Å; K489-K492 PolarHBondContact O-N 3.26Å; K489-K492 VanDerWaalsContact O-N 3.14Å; K489-E493 PolarHBondContact O-N 3.33Å; K489-E493 VanDerWaalsContact O-N 3.15Å
490	K	55.8	Low	54.1	Low	148 Å²	148	129 Å²	129	64%	0.643	67%	0.668	S	S	*	*	H	α-helix	trans	-64.8	-34.7	176.9	-134.7	179.3	-174.6	-176.5	0	113.4	K486 K487 Q494	K486-K490 PolarHBondContact O-N 2.65Å; K487-K490 PolarHBondContact O-N 3.03Å; K490-Q494 PolarHBondContact O-N 3.48Å
491	K	55.5	Low	53.3	Low	166 Å²	166	126.5 Å²	126.5	72%	0.722	68%	0.678	S	S	*	*	H	α-helix	trans	-72.3	-27.3	173.2	-94.2	-170.4	173	-172.5	0	113.7	K487 K488 K489	K487-K491 PolarHBondContact O-N 2.89Å; K487-K491 VanDerWaalsContact O-N 3.08Å; K488-K491 PolarHBondContact O-N 3.02Å; K489-K491 PolarHBondContact O-N 3.13Å
492	K	56.1	Low	52.3	Low	179 Å²	179	130.3 Å²	130.3	78%	0.778	72%	0.718	S	S	*	*	H	α-helix	trans	-76.5	-33.9	175.9	-108.1	-174.2	174.3	-172.8	0	112.5	K488 K489 Q494 A495	K488-K492 PolarHBondContact O-N 3.4Å; K488-K492 VanDerWaalsContact O-N 3.13Å; K489-K492 PolarHBondContact O-N 3.26Å; K489-K492 VanDerWaalsContact O-N 3.14Å; K492-Q494 VanDerWaalsContact C-N 3.33Å; K492-A495 PolarHBondContact O-N 2.97Å
493	E	54.5	Low	51.9	Low	150 Å²	150	135 Å²	135	70%	0.701	74%	0.735	S	S	*	*	H	α-helix	trans	-72.6	-24	175.1	-81.2	170.4	165.6	0	0	113.3	K489	K489-E493 PolarHBondContact O-N 3.33Å; K489-E493 VanDerWaalsContact O-N 3.15Å
494	Q	52.5	Low	51.7	Low	161 Å²	161	134.4 Å²	134.4	75%	0.752	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-0.2	176.5	-73.4	-179.4	-12.7	0	0	114.4	K490 K492	K490-Q494 PolarHBondContact O-N 3.48Å; K492-Q494 VanDerWaalsContact C-N 3.33Å
495	A	53.4	Low	51.4	Low	77 Å²	77	137.2 Å²	137.2	64%	0.636	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	19.9	-176.5	0	0	0	0	0	113.7	K492	K492-A495 PolarHBondContact O-N 2.97Å
496	A	49.1	Very low	51.3	Low	81 Å²	81	140.1 Å²	140.1	67%	0.669	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-84.9	120.9	171.1	0	0	0	0	0	109.9
497	P	48.4	Very low	51	Low	122 Å²	122	138.4 Å²	138.4	79%	0.792	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-79.7	137.9	179.3	31	-31	0	0	0	111.1
498	S	50.7	Low	50.6	Low	125 Å²	125	140.1 Å²	140.1	87%	0.874	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-64.1	122.9	162.8	26.8	0	0	0	0	110.1
499	A	44.3	Very low	50.2	Low	101 Å²	101	138.4 Å²	138.4	84%	0.835	80%	0.798	S	S	*	*			trans	-126	120.9	165.9	0	0	0	0	0	108.5
500	E	46.8	Very low	49.8	Very low	197 Å²	197	137.3 Å²	137.3	92%	0.921	81%	0.808	S	S	*	*			trans	-75.5	156.5	175.9	-65.6	174.2	143.7	0	0	112.2
501	G	42.8	Very low	49.3	Very low	73 Å²	73	136.4 Å²	136.4	75%	0.753	82%	0.822	S	S	*	*			trans	103.1	98.7	131.9	0	0	0	0	0	118.9
502	S	37.8	Very low	48.7	Very low	205 Å²	205	133.7 Å²	133.7	100%	1.434	83%	0.831	S	S	*	*				-167.6	0	116.1	-73.9	0	0	0	0	110.1

Retrieved 502 of 502 residues in 260.4 ms (Link to these results)

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