A0A087X3B9_POEFO Loading...

Bromodomain-containing protein 8

AlphaFold DB , UniProt , Accession A0A087X3B9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 774 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	34.1	Very low	36.8	Very low	251 Å²	251	148.2 Å²	148.2	100%	1.236	83%	0.828	S	S	*	*				0	166.5	0	-62	-179.7	-165.9	0	0	108.3
2	A	37.7	Very low	37.1	Very low	93 Å²	93	145.3 Å²	145.3	77%	0.769	81%	0.809	S	S	*	*			trans	-79.6	152.8	-177.4	0	0	0	0	0	112.5
3	S	32.1	Very low	37.7	Very low	118 Å²	118	144.1 Å²	144.1	83%	0.825	81%	0.808	S	S	*	*				157.1	108.8	118	-80.8	0	0	0	0	110.5
4	G	36.3	Very low	38.4	Very low	76 Å²	76	136.4 Å²	136.4	78%	0.784	78%	0.777	S	S	*	*			trans	-122.9	130.5	167.3	0	0	0	0	0	109.3
5	I	34.3	Very low	39.1	Very low	155 Å²	155	131.6 Å²	131.6	80%	0.795	75%	0.753	S	S	*	*			trans	-118.5	103.2	164	-71.5	82.2	0	0	0	106.5
6	G	32.8	Very low	40.3	Very low	55 Å²	55	132.8 Å²	132.8	57%	0.567	76%	0.764	S	S	*	*			trans	-73.7	125.2	169.4	0	0	0	0	0	109.6	H8	G6-H8 PolarHBondContact O-N 2.73Å
7	K	40.5	Very low	42.3	Very low	207 Å²	207	132.1 Å²	132.1	90%	0.9	75%	0.752	S	S	*	*			trans	-74.2	75.6	175.6	-68.1	-175.9	179.4	-178.9	0	110.5	K9	K7-K9 PolarHBondContact O-N 3.04Å
8	H	36.1	Very low	44.8	Very low	171 Å²	171	130.2 Å²	130.2	79%	0.792	75%	0.746	S	S	*	*			trans	-66.6	102	167.3	-76.1	-92.9	0	0	0	108.9	G6 I10	G6-H8 PolarHBondContact O-N 2.73Å; H8-I10 VanDerWaalsContact C-N 3.32Å; H8-I10 PolarHBondContact O-N 3.19Å
9	K	42.3	Very low	47.4	Very low	205 Å²	205	124.4 Å²	124.4	89%	0.891	71%	0.711	S	S	*	*			trans	-63.4	100.4	156.2	-78.5	-169.7	173.8	-171	0	106.8	K7 L11	K7-K9 PolarHBondContact O-N 3.04Å; K9-L11 PolarHBondContact O-N 2.78Å; K9-L11 VanDerWaalsContact O-N 3.14Å
10	I	39.6	Very low	49.7	Very low	142 Å²	142	119.4 Å²	119.4	73%	0.728	68%	0.683	S	S	*	*			trans	-63.3	112.9	164.8	-66.6	172.7	0	0	0	105.8	H8 N12	H8-I10 VanDerWaalsContact C-N 3.32Å; H8-I10 PolarHBondContact O-N 3.19Å; I10-N12 PolarHBondContact O-N 3.15Å; I10-N12 VanDerWaalsContact O-N 3.07Å
11	L	39.5	Very low	51.8	Low	157 Å²	157	115.5 Å²	115.5	82%	0.822	66%	0.66	S	S	*	*			trans	-63.1	107.7	161.4	-83	161.1	0	0	0	105.7	K9 V13	K9-L11 PolarHBondContact O-N 2.78Å; K9-L11 VanDerWaalsContact O-N 3.14Å; L11-V13 PolarHBondContact O-N 3Å
12	N	39.5	Very low	54.8	Low	113 Å²	113	107 Å²	107	60%	0.604	61%	0.614	S	S	*	*			trans	-78	74.5	-173.7	-165.8	100.4	0	0	0	108.9	I10 G14	I10-N12 PolarHBondContact O-N 3.15Å; I10-N12 VanDerWaalsContact O-N 3.07Å; N12-G14 PolarHBondContact O-N 3.03Å
13	V	46	Very low	57.5	Low	130 Å²	130	102.6 Å²	102.6	79%	0.788	58%	0.578	S	S	*	*			trans	-68	83.6	170	-176	0	0	0	0	107.4	L11	L11-V13 PolarHBondContact O-N 3Å
14	G	47	Very low	60.6	Low	36 Å²	36	99.3 Å²	99.3	37%	0.371	55%	0.549	S	S	.	.			trans	-65	157.8	159.3	0	0	0	0	0	109.6	N12	N12-G14 PolarHBondContact O-N 3.03Å
15	P	49.3	Very low	63.4	Low	65 Å²	65	96.7 Å²	96.7	42%	0.422	52%	0.516	S	S	.	.			trans	-52.5	144.9	173.1	-28.3	37.4	0	0	0	112.2	E17 P55 W58	P15-E17 PolarHBondContact O-N 3.3Å; P15-P55 HydrophobicContact CG-CG 3.87Å; P15-W58 HydrophobicContact CB-CE3 4.25Å; P15-W58 HydrophobicContact CB-CZ3 3.72Å; P15-W58 HydrophobicContact CG-CE3 3.76Å; P15-W58 HydrophobicContact CG-CZ3 3.63Å
16	T	58.5	Low	66.4	Low	151 Å²	151	90.2 Å²	90.2	93%	0.926	49%	0.485	S	S	*	.	S	Bend	trans	-77	16.8	-168.5	43.6	0	0	0	0	114.8
17	E	73	Confident	69.5	Low	120 Å²	120	87.6 Å²	87.6	56%	0.561	46%	0.458	S	S	*	.	S	Bend	trans	-137.3	135.1	-167.9	-173.3	173.1	-122	0	0	108.8	P15 R54 W58	P15-E17 PolarHBondContact O-N 3.3Å; E17-R54 IonicContact OE2-CZ 2.75Å; E17-R54 IonicContact OE2-NH1 3.13Å; E17-R54 PolarHBondContact OE2-NH1 3.28Å; E17-W58 WeakPolarHBondContact O-CH2 3.32Å
18	P	88.4	Confident	72.1	Confident	99 Å²	99	77.9 Å²	77.9	64%	0.643	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-71.7	159.8	-178.2	30.2	-35.5	0	0	0	112.1	R54	P18-R54 PolarHBondContact O-NH2 3.22Å
19	W	92.7	Very high	75	Confident	20 Å²	20	71.7 Å²	71.7	8%	0.076	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-66.1	134	164.9	-74.6	51	0	0	0	109.9	E23 K24 L27 I46 W58 F59 H63 Q67	W19-E23 WeakPolarHBondContact CA-OE2 3.17Å; W19-E23 HydrophobicContact CB-CB 4.49Å; W19-E23 HydrophobicContact CE3-CB 3.88Å; W19-K24 HydrophobicContact CB-CG 4.13Å; W19-K24 WeakPolarHBondContact O-CE 3.28Å; W19-K24 PolarHBondContact O-NZ 3.04Å; W19-L27 HydrophobicContact CE3-CD2 4.45Å; W19-L27 HydrophobicContact CH2-CD2 4.22Å; W19-L27 HydrophobicContact CZ3-CB 4.13Å; W19-L27 HydrophobicContact CZ3-CD2 3.82Å; W19-L27 HydrophobicContact CZ3-CG 4.43Å; W19-I46 HydrophobicContact CH2-CD1 4.01Å; W19-I46 HydrophobicContact CZ3-CD1 4.06Å; W19-W58 AromaticContact CD1-CH2 3.37Å; W19-W58 AromaticContact CD1-CZ2 3.28Å; W19-W58 HydrophobicContact CD2-CZ2 4.38Å; W19-W58 HydrophobicContact CG-CH2 4.33Å; W19-W58 AromaticContact CG-CZ2 3.84Å; W19-W58 HydrophobicContact CG-CZ2 3.84Å; W19-W58 AromaticContact NE1-CE2 3.85Å; W19-W58 AromaticContact NE1-CH2 3.55Å; W19-W58 AromaticContact NE1-CZ2 3.5Å; W19-W58 AromaticContact NE1-CZ3 3.93Å; W19-F59 HydrophobicContact CE3-CE1 4.11Å; W19-F59 AromaticContact CH2-CD1 3.49Å; W19-F59 HydrophobicContact CH2-CD1 3.49Å; W19-F59 VanDerWaalsContact CH2-CD1 3.49Å; W19-F59 AromaticContact CH2-CE1 3.82Å; W19-F59 HydrophobicContact CH2-CE1 3.82Å; W19-F59 AromaticContact CZ2-CD1 3.9Å; W19-F59 HydrophobicContact CZ2-CD1 3.9Å; W19-F59 HydrophobicContact CZ2-CE1 4.25Å; W19-F59 AromaticContact CZ3-CD1 3.87Å; W19-F59 HydrophobicContact CZ3-CD1 3.87Å; W19-F59 AromaticContact CZ3-CE1 3.72Å; W19-F59 HydrophobicContact CZ3-CE1 3.72Å; W19-H63 HydrophobicContact CZ2-CB 4.24Å; W19-Q67 VanDerWaalsContact CD1-OE1 3.3Å; W19-Q67 HydrophobicContact CD2-CB 4.4Å; W19-Q67 HydrophobicContact CD2-CG 3.72Å; W19-Q67 HydrophobicContact CE3-CG 3.82Å; W19-Q67 HydrophobicContact CG-CG 4.12Å; W19-Q67 HydrophobicContact CH2-CB 4.29Å; W19-Q67 HydrophobicContact CH2-CG 4.41Å; W19-Q67 HydrophobicContact CZ2-CB 4.13Å; W19-Q67 HydrophobicContact CZ2-CG 4.34Å; W19-Q67 HydrophobicContact CZ3-CG 4.18Å
20	S	94.3	Very high	77.6	Confident	24 Å²	24	62.2 Å²	62.2	17%	0.168	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-72.8	168.4	177.7	75.8	0	0	0	0	112.4	R22 E23 K24 E51	S20-R22 VanDerWaalsContact C-N 3.29Å; S20-R22 PolarHBondContact O-N 3.04Å; S20-E23 PolarHBondContact N-OE2 2.66Å; S20-E23 PolarHBondContact O-N 2.9Å; S20-E23 WeakPolarHBondContact OG-CG 3.46Å; S20-E23 PolarHBondContact OG-N 3.19Å; S20-E23 VanDerWaalsContact OG-N 3.13Å; S20-K24 WeakPolarHBondContact O-CB 3.39Å; S20-K24 WeakPolarHBondContact O-CD 3.45Å; S20-K24 WeakPolarHBondContact O-CG 3.22Å; S20-K24 PolarHBondContact O-N 3.35Å; S20-E51 WeakPolarHBondContact CB-OE1 3.15Å; S20-E51 PolarHBondContact OG-OE1 2.89Å
21	I	94.8	Very high	80.3	Confident	37 Å²	37	55.4 Å²	55.4	19%	0.19	32%	0.317	C	S	.	.	H	α-helix	trans	-63.2	-40.7	177.1	-55.9	172.7	0	0	0	109.6	K24 L25 L100 E103 R104 E107	I21-K24 PolarHBondContact O-N 3.19Å; I21-L25 WeakPolarHBondContact O-CB 3.35Å; I21-L25 PolarHBondContact O-N 3.08Å; I21-L100 HydrophobicContact CG2-CD2 4.43Å; I21-E103 HydrophobicContact CD1-CB 4.26Å; I21-E103 HydrophobicContact CG2-CB 3.87Å; I21-R104 HydrophobicContact CG2-CB 3.96Å; I21-E107 HydrophobicContact CD1-CB 4.13Å; I21-E107 HydrophobicContact CD1-CG 4.46Å
22	R	95.5	Very high	82.8	Confident	73 Å²	73	51.9 Å²	51.9	28%	0.275	30%	0.297	S	S	.	.	H	α-helix	trans	-60	-46.6	174	-174.6	174.8	171	-80.1	3.4	112.5	S20 L25 C26 F49	S20-R22 VanDerWaalsContact C-N 3.29Å; S20-R22 PolarHBondContact O-N 3.04Å; R22-L25 PolarHBondContact O-N 3.13Å; R22-C26 WeakPolarHBondContact O-CB 3.37Å; R22-C26 PolarHBondContact O-N 2.79Å; R22-C26 PolarHBondContact O-SG 3.42Å; R22-F49 PolarHBondContact NH1-O 3.25Å
23	E	95.7	Very high	85.3	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-63.4	-41.3	176.4	-69.5	-177.9	139	0	0	112.2	W19 S20 C26 L27 R54 W58 F59	W19-E23 WeakPolarHBondContact CA-OE2 3.17Å; W19-E23 HydrophobicContact CB-CB 4.49Å; W19-E23 HydrophobicContact CE3-CB 3.88Å; S20-E23 PolarHBondContact N-OE2 2.66Å; S20-E23 PolarHBondContact O-N 2.9Å; S20-E23 WeakPolarHBondContact OG-CG 3.46Å; S20-E23 PolarHBondContact OG-N 3.19Å; S20-E23 VanDerWaalsContact OG-N 3.13Å; E23-C26 PolarHBondContact O-N 3Å; E23-L27 PolarHBondContact O-N 3.39Å; E23-R54 IonicContact OE1-CZ 2.74Å; E23-R54 IonicContact OE1-NE 2.8Å; E23-R54 PolarHBondContact OE1-NE 2.82Å; E23-R54 IonicContact OE1-NH2 3.22Å; E23-R54 IonicContact OE2-CZ 2.69Å; E23-R54 IonicContact OE2-NE 2.81Å; E23-R54 IonicContact OE2-NH2 2.81Å; E23-R54 PolarHBondContact OE2-NH2 3.42Å; E23-R54 VanDerWaalsContact OE2-NH2 3.09Å; E23-W58 PolarHBondContact OE1-NE1 2.88Å; E23-W58 PolarHBondContact OE2-NE1 2.81Å; E23-F59 HydrophobicContact CB-CE1 4.46Å; E23-F59 HydrophobicContact CB-CZ 4.48Å; E23-F59 HydrophobicContact CG-CE1 4.32Å; E23-F59 HydrophobicContact CG-CZ 3.97Å; E23-F59 WeakPolarHBondContact OE1-CZ 3.42Å
24	K	96.1	Very high	87.6	Confident	49 Å²	49	51 Å²	51	21%	0.213	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-43.3	176.1	-74.8	162.2	174.6	147.2	0	112.6	W19 S20 I21 L27 A28 L71 L100	W19-K24 HydrophobicContact CB-CG 4.13Å; W19-K24 WeakPolarHBondContact O-CE 3.28Å; W19-K24 PolarHBondContact O-NZ 3.04Å; S20-K24 WeakPolarHBondContact O-CB 3.39Å; S20-K24 WeakPolarHBondContact O-CD 3.45Å; S20-K24 WeakPolarHBondContact O-CG 3.22Å; S20-K24 PolarHBondContact O-N 3.35Å; I21-K24 PolarHBondContact O-N 3.19Å; K24-L27 WeakPolarHBondContact O-CB 3.44Å; K24-L27 PolarHBondContact O-N 3.41Å; K24-A28 PolarHBondContact O-N 3.2Å; K24-L71 HydrophobicContact CB-CD1 4.42Å; K24-L71 HydrophobicContact CG-CD2 4.5Å; K24-L100 HydrophobicContact CB-CD1 4.05Å; K24-L100 HydrophobicContact CB-CD2 3.96Å
25	L	96.5	Very high	89.7	Confident	20 Å²	20	50.8 Å²	50.8	11%	0.105	27%	0.274	C	S	.	.	H	α-helix	trans	-62.7	-45.8	176.7	-179.6	56	0	0	0	110.6	I21 R22 L27 A28 S29 V97 L100 R104	I21-L25 WeakPolarHBondContact O-CB 3.35Å; I21-L25 PolarHBondContact O-N 3.08Å; R22-L25 PolarHBondContact O-N 3.13Å; L25-L27 VanDerWaalsContact C-N 3.29Å; L25-L27 PolarHBondContact O-N 2.57Å; L25-A28 PolarHBondContact O-N 3.48Å; L25-S29 WeakPolarHBondContact O-CB 3.24Å; L25-S29 PolarHBondContact O-N 3.48Å; L25-S29 PolarHBondContact O-OG 3.29Å; L25-S29 VanDerWaalsContact O-OG 3.05Å; L25-V97 HydrophobicContact CD1-CG1 4.2Å; L25-L100 HydrophobicContact CB-CB 4.11Å; L25-L100 HydrophobicContact CD1-CB 3.88Å; L25-R104 HydrophobicContact CD2-CB 4.18Å; L25-R104 HydrophobicContact CD2-CG 4.34Å
26	C	96.7	Very high	91.6	Very high	20 Å²	20	50.8 Å²	50.8	14%	0.135	27%	0.27	C	S	.	.	H	α-helix	trans	-59.3	-39	175.4	-67.4	0	0	0	0	112.4	R22 E23 S30 I46 F49	R22-C26 WeakPolarHBondContact O-CB 3.37Å; R22-C26 PolarHBondContact O-N 2.79Å; R22-C26 PolarHBondContact O-SG 3.42Å; E23-C26 PolarHBondContact O-N 3Å; C26-S30 WeakPolarHBondContact O-CB 3.46Å; C26-S30 PolarHBondContact O-N 2.89Å; C26-S30 PolarHBondContact O-OG 3.25Å; C26-I46 HydrophobicContact CB-CB 4.49Å; C26-I46 HydrophobicContact CB-CG2 4.07Å; C26-I46 WeakPolarHBondContact O-CG2 3.42Å; C26-F49 HydrophobicContact CB-CB 4.36Å; C26-F49 HydrophobicContact CB-CG 4.36Å; C26-F49 VanDerWaalsContact SG-CG 3.59Å
27	L	96.9	Very high	93.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-54.2	174.1	175.2	64.9	0	0	0	111.6	W19 E23 K24 L25 S29 S30 V31 W39 V42 I46 C64 Q67 L71	W19-L27 HydrophobicContact CE3-CD2 4.45Å; W19-L27 HydrophobicContact CH2-CD2 4.22Å; W19-L27 HydrophobicContact CZ3-CB 4.13Å; W19-L27 HydrophobicContact CZ3-CD2 3.82Å; W19-L27 HydrophobicContact CZ3-CG 4.43Å; E23-L27 PolarHBondContact O-N 3.39Å; K24-L27 WeakPolarHBondContact O-CB 3.44Å; K24-L27 PolarHBondContact O-N 3.41Å; L25-L27 VanDerWaalsContact C-N 3.29Å; L25-L27 PolarHBondContact O-N 2.57Å; L27-S29 PolarHBondContact O-N 3.42Å; L27-S30 PolarHBondContact O-N 2.95Å; L27-V31 HydrophobicContact CD1-CG2 4.33Å; L27-V31 WeakPolarHBondContact O-CG2 3.25Å; L27-V31 PolarHBondContact O-N 2.86Å; L27-W39 HydrophobicContact CD1-CZ3 4.47Å; L27-V42 HydrophobicContact CD1-CG1 3.62Å; L27-I46 HydrophobicContact CD1-CD1 4.29Å; L27-C64 HydrophobicContact CD1-CB 3.83Å; L27-Q67 HydrophobicContact CD2-CB 3.71Å; L27-Q67 HydrophobicContact CD2-CG 3.68Å; L27-L71 HydrophobicContact CD2-CD1 4.4Å
28	A	96.3	Very high	94.3	Very high	2 Å²	2	48.5 Å²	48.5	2%	0.017	25%	0.252	C	S	.	.	H	α-helix	trans	-59.5	-48.5	-178.8	0	0	0	0	0	112	K24 L25 S30 V31 M32 I96 V97 L100	K24-A28 PolarHBondContact O-N 3.2Å; L25-A28 PolarHBondContact O-N 3.48Å; A28-S30 VanDerWaalsContact C-N 3.29Å; A28-S30 PolarHBondContact O-N 2.84Å; A28-V31 PolarHBondContact O-N 2.86Å; A28-M32 WeakPolarHBondContact O-CB 3.44Å; A28-M32 PolarHBondContact O-N 2.94Å; A28-I96 HydrophobicContact CB-CG2 3.71Å; A28-V97 HydrophobicContact CB-CG2 3.8Å; A28-L100 HydrophobicContact CB-CD1 3.99Å
29	S	96.3	Very high	94.7	Very high	42 Å²	42	46.3 Å²	46.3	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-63.4	-33.8	176.7	-54.9	0	0	0	0	112.7	L25 L27 R33	L25-S29 WeakPolarHBondContact O-CB 3.24Å; L25-S29 PolarHBondContact O-N 3.48Å; L25-S29 PolarHBondContact O-OG 3.29Å; L25-S29 VanDerWaalsContact O-OG 3.05Å; L27-S29 PolarHBondContact O-N 3.42Å; S29-R33 PolarHBondContact O-N 3.04Å
30	S	96.6	Very high	94.8	Very high	5 Å²	5	48.3 Å²	48.3	4%	0.035	24%	0.244	C	C	.	.	H	α-helix	trans	-71.3	-35.7	175.6	-67.1	0	0	0	0	112.8	C26 L27 A28 S34 I46	C26-S30 WeakPolarHBondContact O-CB 3.46Å; C26-S30 PolarHBondContact O-N 2.89Å; C26-S30 PolarHBondContact O-OG 3.25Å; L27-S30 PolarHBondContact O-N 2.95Å; A28-S30 VanDerWaalsContact C-N 3.29Å; A28-S30 PolarHBondContact O-N 2.84Å; S30-S34 WeakPolarHBondContact O-CB 3.45Å; S30-S34 PolarHBondContact O-N 3.17Å; S30-S34 VanDerWaalsContact O-N 3.1Å; S30-S34 PolarHBondContact O-OG 3.08Å; S30-I46 WeakPolarHBondContact OG-CG2 2.88Å
31	V	96	Very high	94.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-50.1	172.7	173.7	0	0	0	0	110.3	L27 A28 R33 S34 G35 D36 W39 V42 Y68	L27-V31 HydrophobicContact CD1-CG2 4.33Å; L27-V31 WeakPolarHBondContact O-CG2 3.25Å; L27-V31 PolarHBondContact O-N 2.86Å; A28-V31 PolarHBondContact O-N 2.86Å; V31-R33 PolarHBondContact O-N 2.99Å; V31-R33 VanDerWaalsContact O-N 3.09Å; V31-S34 PolarHBondContact O-N 3.22Å; V31-G35 WeakPolarHBondContact O-CA 3.25Å; V31-G35 PolarHBondContact O-N 3.21Å; V31-D36 HydrophobicContact CG1-CB 3.97Å; V31-W39 HydrophobicContact CG2-CH2 3.95Å; V31-W39 HydrophobicContact CG2-CZ3 3.67Å; V31-V42 HydrophobicContact CG2-CG1 3.95Å; V31-V42 HydrophobicContact CG2-CG2 4Å; V31-Y68 HydrophobicContact CB-CD2 4.27Å; V31-Y68 HydrophobicContact CB-CE2 4.01Å; V31-Y68 HydrophobicContact CG1-CD1 4.25Å; V31-Y68 HydrophobicContact CG1-CD2 4.45Å; V31-Y68 HydrophobicContact CG1-CE1 3.74Å; V31-Y68 HydrophobicContact CG1-CE2 3.99Å; V31-Y68 HydrophobicContact CG2-CD1 4.42Å; V31-Y68 HydrophobicContact CG2-CD2 3.94Å; V31-Y68 HydrophobicContact CG2-CE2 4.2Å; V31-Y68 HydrophobicContact CG2-CG 4.08Å
32	M	92.8	Very high	95	Very high	83 Å²	83	47.7 Å²	47.7	41%	0.409	24%	0.243	S	C	.	.	H	α-helix	trans	-54.3	-32.4	177.9	-173.2	177.2	69.4	0	0	113	A28 E93 V97	A28-M32 WeakPolarHBondContact O-CB 3.44Å; A28-M32 PolarHBondContact O-N 2.94Å; M32-E93 HydrophobicContact CB-CB 4.5Å; M32-E93 HydrophobicContact CG-CB 4.33Å; M32-V97 HydrophobicContact CE-CG1 4.34Å; M32-V97 HydrophobicContact CE-CG2 4.2Å; M32-V97 HydrophobicContact SD-CB 4.5Å; M32-V97 HydrophobicContact SD-CG2 3.99Å
33	R	92.7	Very high	95	Very high	188 Å²	188	44.8 Å²	44.8	71%	0.709	24%	0.235	S	C	*	.	H	α-helix	trans	-83	-29.1	174.8	-179.4	173.1	58.6	-174.7	-7.9	114.7	S29 V31	S29-R33 PolarHBondContact O-N 3.04Å; V31-R33 PolarHBondContact O-N 2.99Å; V31-R33 VanDerWaalsContact O-N 3.09Å
34	S	92.8	Very high	95	Very high	36 Å²	36	53.7 Å²	53.7	25%	0.252	27%	0.268	S	S	.	.	H	α-helix	trans	-114.5	-13	-165.9	-43.7	0	0	0	0	114.8	S30 V31 N38	S30-S34 WeakPolarHBondContact O-CB 3.45Å; S30-S34 PolarHBondContact O-N 3.17Å; S30-S34 VanDerWaalsContact O-N 3.1Å; S30-S34 PolarHBondContact O-OG 3.08Å; V31-S34 PolarHBondContact O-N 3.22Å; S34-N38 WeakPolarHBondContact O-CB 3.48Å
35	G	91.6	Very high	94.9	Very high	31 Å²	31	52.6 Å²	52.6	32%	0.32	27%	0.268	S	S	.	.			trans	77.1	145.7	-166.3	0	0	0	0	0	113.3	V31 Q37 N38	V31-G35 WeakPolarHBondContact O-CA 3.25Å; V31-G35 PolarHBondContact O-N 3.21Å; G35-Q37 PolarHBondContact O-N 2.92Å; G35-Q37 VanDerWaalsContact O-N 3.1Å; G35-N38 PolarHBondContact O-N 3.45Å; G35-N38 VanDerWaalsContact O-N 3.09Å
36	D	89.9	Confident	94.8	Very high	65 Å²	65	51.7 Å²	51.7	35%	0.348	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-5	173	78.1	-34.3	0	0	0	113.4	V31 W39 Y68	V31-D36 HydrophobicContact CG1-CB 3.97Å; D36-W39 HydrophobicContact CB-CH2 4.34Å; D36-W39 HydrophobicContact CB-CZ2 4.02Å; D36-W39 WeakPolarHBondContact O-CZ2 3.2Å; D36-W39 PolarHBondContact O-NE1 3.3Å; D36-Y68 HydrophobicContact CB-CE1 4.45Å
37	Q	94.1	Very high	94.6	Very high	159 Å²	159	55.3 Å²	55.3	74%	0.743	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-14.4	173.6	-54.2	-53.6	-59.5	0	0	112.8	G35	G35-Q37 PolarHBondContact O-N 2.92Å; G35-Q37 VanDerWaalsContact O-N 3.1Å
38	N	94.1	Very high	94.4	Very high	65 Å²	65	60.2 Å²	60.2	35%	0.348	31%	0.308	S	S	.	.			trans	-111.9	54.7	-171.7	-161.3	-8.8	0	0	0	113.6	S34 G35 V40 S41 V42	S34-N38 WeakPolarHBondContact O-CB 3.48Å; G35-N38 PolarHBondContact O-N 3.45Å; G35-N38 VanDerWaalsContact O-N 3.09Å; N38-V40 PolarHBondContact O-N 2.92Å; N38-S41 PolarHBondContact ND2-OG 3.22Å; N38-S41 PolarHBondContact O-N 3.18Å; N38-S41 PolarHBondContact OD1-N 3.49Å; N38-S41 PolarHBondContact OD1-OG 3.4Å; N38-V42 WeakPolarHBondContact O-CG2 3.29Å; N38-V42 PolarHBondContact O-N 3.19Å; N38-V42 VanDerWaalsContact O-N 3.08Å
39	W	95.9	Very high	94.1	Very high	53 Å²	53	64.1 Å²	64.1	20%	0.201	33%	0.325	C	S	.	.	H	α-helix	trans	-55.9	-24.1	179.2	-61.2	111.4	0	0	0	114.4	L27 V31 D36 V42 S43 Q61 C64 A65 Y68	L27-W39 HydrophobicContact CD1-CZ3 4.47Å; V31-W39 HydrophobicContact CG2-CH2 3.95Å; V31-W39 HydrophobicContact CG2-CZ3 3.67Å; D36-W39 HydrophobicContact CB-CH2 4.34Å; D36-W39 HydrophobicContact CB-CZ2 4.02Å; D36-W39 WeakPolarHBondContact O-CZ2 3.2Å; D36-W39 PolarHBondContact O-NE1 3.3Å; W39-V42 HydrophobicContact CE3-CB 4.27Å; W39-V42 HydrophobicContact CE3-CG1 4.2Å; W39-V42 HydrophobicContact CE3-CG2 4.49Å; W39-V42 HydrophobicContact CZ3-CG1 4.25Å; W39-S43 WeakPolarHBondContact O-CB 3.31Å; W39-S43 PolarHBondContact O-N 3.04Å; W39-Q61 HydrophobicContact CB-CB 3.87Å; W39-Q61 HydrophobicContact CB-CG 4.23Å; W39-C64 HydrophobicContact CE3-CB 3.79Å; W39-C64 HydrophobicContact CZ3-CB 4.16Å; W39-A65 HydrophobicContact CD2-CB 3.76Å; W39-A65 HydrophobicContact CE3-CB 4.17Å; W39-A65 HydrophobicContact CG-CB 4.3Å; W39-A65 HydrophobicContact CH2-CB 4.28Å; W39-A65 HydrophobicContact CZ2-CB 3.84Å; W39-A65 HydrophobicContact CZ3-CB 4.41Å; W39-Y68 AromaticContact CH2-CD1 3.79Å; W39-Y68 HydrophobicContact CH2-CD1 3.79Å; W39-Y68 AromaticContact CH2-CG 3.98Å; W39-Y68 HydrophobicContact CH2-CG 3.98Å
40	V	95.4	Very high	93.8	Very high	61 Å²	61	65 Å²	65	37%	0.37	33%	0.332	S	S	.	.	H	α-helix	trans	-65.1	-46.6	174.8	-170.9	0	0	0	0	111	N38 R44	N38-V40 PolarHBondContact O-N 2.92Å; V40-R44 VanDerWaalsContact O-CG 3.32Å; V40-R44 WeakPolarHBondContact O-CG 3.37Å; V40-R44 PolarHBondContact O-N 2.98Å
41	S	95.6	Very high	93.4	Very high	48 Å²	48	67.4 Å²	67.4	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-70.7	-43.1	176.6	-69.3	0	0	0	0	111.8	N38 S43 R44 A45	N38-S41 PolarHBondContact ND2-OG 3.22Å; N38-S41 PolarHBondContact O-N 3.18Å; N38-S41 PolarHBondContact OD1-N 3.49Å; N38-S41 PolarHBondContact OD1-OG 3.4Å; S41-S43 PolarHBondContact O-N 2.96Å; S41-R44 PolarHBondContact O-N 2.81Å; S41-R44 VanDerWaalsContact O-N 3.16Å; S41-A45 WeakPolarHBondContact O-CB 3.29Å; S41-A45 PolarHBondContact O-N 3.35Å
42	V	96.6	Very high	93	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-57.9	-50	176.9	176.2	0	0	0	0	111.1	L27 V31 N38 W39 R44 A45 I46 C64	L27-V42 HydrophobicContact CD1-CG1 3.62Å; V31-V42 HydrophobicContact CG2-CG1 3.95Å; V31-V42 HydrophobicContact CG2-CG2 4Å; N38-V42 WeakPolarHBondContact O-CG2 3.29Å; N38-V42 PolarHBondContact O-N 3.19Å; N38-V42 VanDerWaalsContact O-N 3.08Å; W39-V42 HydrophobicContact CE3-CB 4.27Å; W39-V42 HydrophobicContact CE3-CG1 4.2Å; W39-V42 HydrophobicContact CE3-CG2 4.49Å; W39-V42 HydrophobicContact CZ3-CG1 4.25Å; V42-R44 VanDerWaalsContact C-N 3.26Å; V42-R44 PolarHBondContact O-N 2.87Å; V42-A45 PolarHBondContact O-N 2.68Å; V42-A45 VanDerWaalsContact O-N 3.13Å; V42-I46 PolarHBondContact O-N 3.5Å; V42-I46 VanDerWaalsContact O-N 3.11Å; V42-C64 HydrophobicContact CG1-CB 4.42Å
43	S	96.5	Very high	92.6	Very high	13 Å²	13	73.9 Å²	73.9	9%	0.091	41%	0.406	C	S	.	.	H	α-helix	trans	-58.4	-33	176.8	171.6	0	0	0	0	113.4	W39 S41 K47 F59	W39-S43 WeakPolarHBondContact O-CB 3.31Å; W39-S43 PolarHBondContact O-N 3.04Å; S41-S43 PolarHBondContact O-N 2.96Å; S43-K47 WeakPolarHBondContact O-CD 3.39Å; S43-K47 VanDerWaalsContact O-CG 3.31Å; S43-K47 WeakPolarHBondContact O-CG 3.46Å; S43-F59 WeakPolarHBondContact CB-O 3.38Å; S43-F59 PolarHBondContact OG-O 2.79Å
44	R	95.3	Very high	92.5	Very high	188 Å²	188	66.5 Å²	66.5	71%	0.709	38%	0.378	S	S	*	.	H	α-helix	trans	-77.7	-40.1	174.8	-71.8	173.9	-178.2	-146.8	1.6	112.2	V40 S41 V42 I46 K47	V40-R44 VanDerWaalsContact O-CG 3.32Å; V40-R44 WeakPolarHBondContact O-CG 3.37Å; V40-R44 PolarHBondContact O-N 2.98Å; S41-R44 PolarHBondContact O-N 2.81Å; S41-R44 VanDerWaalsContact O-N 3.16Å; V42-R44 VanDerWaalsContact C-N 3.26Å; V42-R44 PolarHBondContact O-N 2.87Å; R44-I46 PolarHBondContact O-N 3.49Å; R44-K47 PolarHBondContact O-N 3.35Å
45	A	94.6	Very high	92.3	Very high	25 Å²	25	67 Å²	67	21%	0.207	38%	0.38	C	S	.	.	H	α-helix	trans	-66.6	-34.7	-176.9	0	0	0	0	0	113.1	S41 V42 P48 F49	S41-A45 WeakPolarHBondContact O-CB 3.29Å; S41-A45 PolarHBondContact O-N 3.35Å; V42-A45 PolarHBondContact O-N 2.68Å; V42-A45 VanDerWaalsContact O-N 3.13Å; A45-P48 WeakPolarHBondContact O-CD 3.34Å; A45-F49 WeakPolarHBondContact O-CD2 3.38Å; A45-F49 WeakPolarHBondContact O-CE2 3.37Å
46	I	94.9	Very high	91.8	Very high	1 Å²	1	71.2 Å²	71.2	1%	0.005	40%	0.402	C	S	.	.	S	Bend	trans	-85.2	-15.1	179.8	68.7	178.2	0	0	0	114.4	W19 C26 L27 S30 V42 R44 F49 F59	W19-I46 HydrophobicContact CH2-CD1 4.01Å; W19-I46 HydrophobicContact CZ3-CD1 4.06Å; C26-I46 HydrophobicContact CB-CB 4.49Å; C26-I46 HydrophobicContact CB-CG2 4.07Å; C26-I46 WeakPolarHBondContact O-CG2 3.42Å; L27-I46 HydrophobicContact CD1-CD1 4.29Å; S30-I46 WeakPolarHBondContact OG-CG2 2.88Å; V42-I46 PolarHBondContact O-N 3.5Å; V42-I46 VanDerWaalsContact O-N 3.11Å; R44-I46 PolarHBondContact O-N 3.49Å; I46-F49 WeakPolarHBondContact O-CB 3.33Å; I46-F49 PolarHBondContact O-N 3.36Å; I46-F59 HydrophobicContact CD1-CB 3.87Å; I46-F59 HydrophobicContact CD1-CD1 3.5Å; I46-F59 HydrophobicContact CD1-CD2 4.24Å; I46-F59 HydrophobicContact CD1-CE1 4.03Å; I46-F59 HydrophobicContact CD1-CG 3.62Å; I46-F59 HydrophobicContact CG1-CB 3.92Å; I46-F59 HydrophobicContact CG1-CD1 4.07Å; I46-F59 HydrophobicContact CG1-CD2 3.86Å; I46-F59 HydrophobicContact CG1-CE2 4.32Å; I46-F59 HydrophobicContact CG1-CG 3.7Å; I46-F59 WeakPolarHBondContact O-CE2 3.45Å
47	K	92.1	Very high	91.7	Very high	96 Å²	96	72.6 Å²	72.6	42%	0.417	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-59.1	-38.1	-177.4	-91.3	173.7	-179.3	-117.8	0	115.8	S43 R44 F49 S50 P56 F59	S43-K47 WeakPolarHBondContact O-CD 3.39Å; S43-K47 VanDerWaalsContact O-CG 3.31Å; S43-K47 WeakPolarHBondContact O-CG 3.46Å; R44-K47 PolarHBondContact O-N 3.35Å; K47-F49 PolarHBondContact O-N 2.83Å; K47-F49 VanDerWaalsContact O-N 3.15Å; K47-S50 PolarHBondContact O-N 2.86Å; K47-S50 PolarHBondContact O-OG 2.85Å; K47-P56 PolarHBondContact NZ-O 2.98Å; K47-F59 HydrophobicContact CG-CB 4.26Å; K47-F59 HydrophobicContact CG-CD2 3.96Å
48	P	92.6	Very high	91.6	Very high	103 Å²	103	65.5 Å²	65.5	67%	0.669	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-61.5	-16.9	172.9	-24.8	35.9	0	0	0	114.3	A45	A45-P48 WeakPolarHBondContact O-CD 3.34Å
49	F	89.9	Confident	91.6	Very high	85 Å²	85	62.8 Å²	62.8	37%	0.373	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-98.7	8.2	-177.7	-54.8	-90.2	0	0	0	112.9	R22 C26 A45 I46 K47	R22-F49 PolarHBondContact NH1-O 3.25Å; C26-F49 HydrophobicContact CB-CB 4.36Å; C26-F49 HydrophobicContact CB-CG 4.36Å; C26-F49 VanDerWaalsContact SG-CG 3.59Å; A45-F49 WeakPolarHBondContact O-CD2 3.38Å; A45-F49 WeakPolarHBondContact O-CE2 3.37Å; I46-F49 WeakPolarHBondContact O-CB 3.33Å; I46-F49 PolarHBondContact O-N 3.36Å; K47-F49 PolarHBondContact O-N 2.83Å; K47-F49 VanDerWaalsContact O-N 3.15Å
50	S	90.1	Very high	91.6	Very high	61 Å²	61	61.7 Å²	61.7	43%	0.427	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-60.9	135.2	177.5	59.4	0	0	0	0	112.4	K47	K47-S50 PolarHBondContact O-N 2.86Å; K47-S50 PolarHBondContact O-OG 2.85Å
51	E	88.8	Confident	91.6	Very high	54 Å²	54	63.5 Å²	63.5	25%	0.252	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-67.9	153.4	168.2	-76.9	151.8	-169.7	0	0	111.9	S20 G53 R54	S20-E51 WeakPolarHBondContact CB-OE1 3.15Å; S20-E51 PolarHBondContact OG-OE1 2.89Å; E51-G53 PolarHBondContact O-N 2.9Å; E51-R54 HydrophobicContact CB-CG 4Å; E51-R54 VanDerWaalsContact O-CG 3.26Å; E51-R54 WeakPolarHBondContact O-CG 3.3Å; E51-R54 PolarHBondContact O-N 3.39Å; E51-R54 IonicContact OE2-CZ 2.72Å; E51-R54 IonicContact OE2-NE 3.57Å; E51-R54 PolarHBondContact OE2-NE 2.98Å; E51-R54 IonicContact OE2-NH2 3.57Å; E51-R54 PolarHBondContact OE2-NH2 2.88Å
52	P	86.3	Confident	91.5	Very high	134 Å²	134	67.9 Å²	67.9	87%	0.87	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	135.6	176.5	-24.8	35.1	0	0	0	112.1	R54	P52-R54 PolarHBondContact O-N 3.1Å
53	G	85.8	Confident	91.4	Very high	85 Å²	85	70.1 Å²	70.1	88%	0.876	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-6.4	177.6	0	0	0	0	0	116.1	E51	E51-G53 PolarHBondContact O-N 2.9Å
54	R	88.8	Confident	91.3	Very high	34 Å²	34	69.5 Å²	69.5	13%	0.128	39%	0.385	C	S	.	.			trans	-60.2	139	172.8	-62.6	-58.8	-166	-177.9	7.3	111.3	E17 P18 E23 E51 P52 W58	E17-R54 IonicContact OE2-CZ 2.75Å; E17-R54 IonicContact OE2-NH1 3.13Å; E17-R54 PolarHBondContact OE2-NH1 3.28Å; P18-R54 PolarHBondContact O-NH2 3.22Å; E23-R54 IonicContact OE1-CZ 2.74Å; E23-R54 IonicContact OE1-NE 2.8Å; E23-R54 PolarHBondContact OE1-NE 2.82Å; E23-R54 IonicContact OE1-NH2 3.22Å; E23-R54 IonicContact OE2-CZ 2.69Å; E23-R54 IonicContact OE2-NE 2.81Å; E23-R54 IonicContact OE2-NH2 2.81Å; E23-R54 PolarHBondContact OE2-NH2 3.42Å; E23-R54 VanDerWaalsContact OE2-NH2 3.09Å; E51-R54 HydrophobicContact CB-CG 4Å; E51-R54 VanDerWaalsContact O-CG 3.26Å; E51-R54 WeakPolarHBondContact O-CG 3.3Å; E51-R54 PolarHBondContact O-N 3.39Å; E51-R54 IonicContact OE2-CZ 2.72Å; E51-R54 IonicContact OE2-NE 3.57Å; E51-R54 PolarHBondContact OE2-NE 2.98Å; E51-R54 IonicContact OE2-NH2 3.57Å; E51-R54 PolarHBondContact OE2-NH2 2.88Å; P52-R54 PolarHBondContact O-N 3.1Å; R54-W58 HydrophobicContact CB-CB 4.17Å; R54-W58 HydrophobicContact CB-CG 3.92Å; R54-W58 HydrophobicContact CG-CG 4.29Å; R54-W58 VanDerWaalsContact CZ-CZ2 3.49Å
55	P	89.1	Confident	91.4	Very high	46 Å²	46	61.6 Å²	61.6	30%	0.299	36%	0.36	S	S	.	.			trans	-70.7	157.5	-176.1	26.6	-33.9	0	0	0	113.3	P15 D57 W58	P15-P55 HydrophobicContact CG-CG 3.87Å; P55-D57 PolarHBondContact O-N 3.29Å; P55-W58 HydrophobicContact CG-CB 4.02Å; P55-W58 HydrophobicContact CG-CE3 4.46Å; P55-W58 WeakPolarHBondContact O-CB 3.39Å; P55-W58 PolarHBondContact O-N 2.92Å
56	P	82.1	Confident	91.4	Very high	119 Å²	119	64.2 Å²	64.2	77%	0.773	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23	-173.4	-25.9	35.7	0	0	0	115.9	K47	K47-P56 PolarHBondContact NZ-O 2.98Å
57	D	87.4	Confident	91.4	Very high	94 Å²	94	65.1 Å²	65.1	50%	0.503	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	7.6	177	69.8	-43.4	0	0	0	113.8	P55 F59 S60 H63	P55-D57 PolarHBondContact O-N 3.29Å; D57-F59 PolarHBondContact O-N 3.41Å; D57-S60 VanDerWaalsContact O-CB 3.22Å; D57-S60 WeakPolarHBondContact O-CB 3.37Å; D57-S60 PolarHBondContact O-N 3.31Å; D57-H63 PolarHBondContact O-CE1 2.73Å; D57-H63 PolarHBondContact O-ND1 3.3Å
58	W	92.4	Very high	91.6	Very high	11 Å²	11	60.8 Å²	60.8	4%	0.042	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-60.5	174.9	-176.4	-129	0	0	0	111	P15 E17 W19 E23 R54 P55 S60 H63	P15-W58 HydrophobicContact CB-CE3 4.25Å; P15-W58 HydrophobicContact CB-CZ3 3.72Å; P15-W58 HydrophobicContact CG-CE3 3.76Å; P15-W58 HydrophobicContact CG-CZ3 3.63Å; E17-W58 WeakPolarHBondContact O-CH2 3.32Å; W19-W58 AromaticContact CD1-CH2 3.37Å; W19-W58 AromaticContact CD1-CZ2 3.28Å; W19-W58 HydrophobicContact CD2-CZ2 4.38Å; W19-W58 HydrophobicContact CG-CH2 4.33Å; W19-W58 AromaticContact CG-CZ2 3.84Å; W19-W58 HydrophobicContact CG-CZ2 3.84Å; W19-W58 AromaticContact NE1-CE2 3.85Å; W19-W58 AromaticContact NE1-CH2 3.55Å; W19-W58 AromaticContact NE1-CZ2 3.5Å; W19-W58 AromaticContact NE1-CZ3 3.93Å; E23-W58 PolarHBondContact OE1-NE1 2.88Å; E23-W58 PolarHBondContact OE2-NE1 2.81Å; R54-W58 HydrophobicContact CB-CB 4.17Å; R54-W58 HydrophobicContact CB-CG 3.92Å; R54-W58 HydrophobicContact CG-CG 4.29Å; R54-W58 VanDerWaalsContact CZ-CZ2 3.49Å; P55-W58 HydrophobicContact CG-CB 4.02Å; P55-W58 HydrophobicContact CG-CE3 4.46Å; P55-W58 WeakPolarHBondContact O-CB 3.39Å; P55-W58 PolarHBondContact O-N 2.92Å; W58-S60 PolarHBondContact O-N 3.1Å; W58-S60 VanDerWaalsContact O-N 3.1Å; W58-H63 WeakPolarHBondContact O-CB 3.23Å; W58-H63 PolarHBondContact O-ND1 2.81Å
59	F	94.2	Very high	91.7	Very high	7 Å²	7	58.7 Å²	58.7	3%	0.031	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	43.4	172.5	-56.3	-38.2	0	0	0	113.1	W19 E23 S43 I46 K47 D57	W19-F59 HydrophobicContact CE3-CE1 4.11Å; W19-F59 AromaticContact CH2-CD1 3.49Å; W19-F59 HydrophobicContact CH2-CD1 3.49Å; W19-F59 VanDerWaalsContact CH2-CD1 3.49Å; W19-F59 AromaticContact CH2-CE1 3.82Å; W19-F59 HydrophobicContact CH2-CE1 3.82Å; W19-F59 AromaticContact CZ2-CD1 3.9Å; W19-F59 HydrophobicContact CZ2-CD1 3.9Å; W19-F59 HydrophobicContact CZ2-CE1 4.25Å; W19-F59 AromaticContact CZ3-CD1 3.87Å; W19-F59 HydrophobicContact CZ3-CD1 3.87Å; W19-F59 AromaticContact CZ3-CE1 3.72Å; W19-F59 HydrophobicContact CZ3-CE1 3.72Å; E23-F59 HydrophobicContact CB-CE1 4.46Å; E23-F59 HydrophobicContact CB-CZ 4.48Å; E23-F59 HydrophobicContact CG-CE1 4.32Å; E23-F59 HydrophobicContact CG-CZ 3.97Å; E23-F59 WeakPolarHBondContact OE1-CZ 3.42Å; S43-F59 WeakPolarHBondContact CB-O 3.38Å; S43-F59 PolarHBondContact OG-O 2.79Å; I46-F59 HydrophobicContact CD1-CB 3.87Å; I46-F59 HydrophobicContact CD1-CD1 3.5Å; I46-F59 HydrophobicContact CD1-CD2 4.24Å; I46-F59 HydrophobicContact CD1-CE1 4.03Å; I46-F59 HydrophobicContact CD1-CG 3.62Å; I46-F59 HydrophobicContact CG1-CB 3.92Å; I46-F59 HydrophobicContact CG1-CD1 4.07Å; I46-F59 HydrophobicContact CG1-CD2 3.86Å; I46-F59 HydrophobicContact CG1-CE2 4.32Å; I46-F59 HydrophobicContact CG1-CG 3.7Å; I46-F59 WeakPolarHBondContact O-CE2 3.45Å; K47-F59 HydrophobicContact CG-CB 4.26Å; K47-F59 HydrophobicContact CG-CD2 3.96Å; D57-F59 PolarHBondContact O-N 3.41Å
60	S	94.6	Very high	91.9	Very high	31 Å²	31	60 Å²	60	22%	0.217	36%	0.357	C	S	.	.			trans	-63.1	151.6	167.7	78.1	0	0	0	0	110.3	D57 W58 K62 H63 C64	D57-S60 VanDerWaalsContact O-CB 3.22Å; D57-S60 WeakPolarHBondContact O-CB 3.37Å; D57-S60 PolarHBondContact O-N 3.31Å; W58-S60 PolarHBondContact O-N 3.1Å; W58-S60 VanDerWaalsContact O-N 3.1Å; S60-K62 PolarHBondContact O-N 2.98Å; S60-K62 VanDerWaalsContact O-N 3.14Å; S60-H63 PolarHBondContact O-N 3.22Å; S60-H63 PolarHBondContact OG-N 2.69Å; S60-H63 VanDerWaalsContact OG-N 3.15Å; S60-H63 PolarHBondContact OG-ND1 3.21Å; S60-H63 VanDerWaalsContact OG-ND1 3.11Å; S60-C64 PolarHBondContact O-N 2.81Å; S60-C64 PolarHBondContact O-SG 3.35Å
61	Q	95.6	Very high	92.1	Very high	98 Å²	98	58 Å²	58	46%	0.458	34%	0.341	S	S	.	.	H	α-helix	trans	-52.8	-37.8	177.5	-62.7	169.9	25.5	0	0	112	W39 A65	W39-Q61 HydrophobicContact CB-CB 3.87Å; W39-Q61 HydrophobicContact CB-CG 4.23Å; Q61-A65 WeakPolarHBondContact O-CB 3.45Å; Q61-A65 PolarHBondContact O-N 3.11Å
62	K	94.4	Very high	92.2	Very high	140 Å²	140	58.3 Å²	58.3	61%	0.609	35%	0.345	S	S	*	.	H	α-helix	trans	-67.3	-41.8	176.7	-173.9	-166.3	171.4	-155.3	0	112.2	S60 S66	S60-K62 PolarHBondContact O-N 2.98Å; S60-K62 VanDerWaalsContact O-N 3.14Å; K62-S66 WeakPolarHBondContact O-CB 3.14Å; K62-S66 PolarHBondContact O-N 3.44Å
63	H	93.7	Very high	92.5	Very high	47 Å²	47	60.2 Å²	60.2	22%	0.218	34%	0.342	C	S	.	.	H	α-helix	trans	-70.2	-40.9	177.8	-60.4	157.2	0	0	0	111.2	W19 D57 W58 S60 A65 S66 Q67	W19-H63 HydrophobicContact CZ2-CB 4.24Å; D57-H63 PolarHBondContact O-CE1 2.73Å; D57-H63 PolarHBondContact O-ND1 3.3Å; W58-H63 WeakPolarHBondContact O-CB 3.23Å; W58-H63 PolarHBondContact O-ND1 2.81Å; S60-H63 PolarHBondContact O-N 3.22Å; S60-H63 PolarHBondContact OG-N 2.69Å; S60-H63 VanDerWaalsContact OG-N 3.15Å; S60-H63 PolarHBondContact OG-ND1 3.21Å; S60-H63 VanDerWaalsContact OG-ND1 3.11Å; H63-A65 PolarHBondContact O-N 3.22Å; H63-S66 PolarHBondContact O-N 3.18Å; H63-Q67 VanDerWaalsContact O-CB 3.29Å; H63-Q67 WeakPolarHBondContact O-CB 3.5Å; H63-Q67 PolarHBondContact O-N 2.97Å
64	C	95.6	Very high	92.5	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-56.8	-49.3	173.3	-57.9	0	0	0	0	111.3	L27 W39 V42 S60 Y68	L27-C64 HydrophobicContact CD1-CB 3.83Å; W39-C64 HydrophobicContact CE3-CB 3.79Å; W39-C64 HydrophobicContact CZ3-CB 4.16Å; V42-C64 HydrophobicContact CG1-CB 4.42Å; S60-C64 PolarHBondContact O-N 2.81Å; S60-C64 PolarHBondContact O-SG 3.35Å; C64-Y68 WeakPolarHBondContact O-CB 3.18Å; C64-Y68 PolarHBondContact O-N 3.38Å
65	A	95.6	Very high	92.4	Very high	22 Å²	22	58.2 Å²	58.2	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-61.3	-47.9	177.5	0	0	0	0	0	112	W39 Q61 H63 Q67 Y68 S69	W39-A65 HydrophobicContact CD2-CB 3.76Å; W39-A65 HydrophobicContact CE3-CB 4.17Å; W39-A65 HydrophobicContact CG-CB 4.3Å; W39-A65 HydrophobicContact CH2-CB 4.28Å; W39-A65 HydrophobicContact CZ2-CB 3.84Å; W39-A65 HydrophobicContact CZ3-CB 4.41Å; Q61-A65 WeakPolarHBondContact O-CB 3.45Å; Q61-A65 PolarHBondContact O-N 3.11Å; H63-A65 PolarHBondContact O-N 3.22Å; A65-Q67 PolarHBondContact O-N 3.28Å; A65-Y68 PolarHBondContact O-N 2.8Å; A65-S69 PolarHBondContact O-N 3.03Å; A65-S69 PolarHBondContact O-OG 3.33Å; A65-S69 VanDerWaalsContact O-OG 3.13Å
66	S	95.3	Very high	92	Very high	80 Å²	80	62.8 Å²	62.8	56%	0.559	34%	0.34	S	S	*	.	H	α-helix	trans	-62.7	-42.4	-179.9	-164.9	0	0	0	0	112.7	K62 H63 Y68 S69 E70	K62-S66 WeakPolarHBondContact O-CB 3.14Å; K62-S66 PolarHBondContact O-N 3.44Å; H63-S66 PolarHBondContact O-N 3.18Å; S66-Y68 VanDerWaalsContact C-N 3.34Å; S66-S69 PolarHBondContact O-N 2.84Å; S66-E70 PolarHBondContact O-N 3.37Å; S66-E70 VanDerWaalsContact O-N 3.17Å
67	Q	95.2	Very high	91.3	Very high	21 Å²	21	60.2 Å²	60.2	10%	0.098	33%	0.328	C	S	.	.	H	α-helix	trans	-70.6	-32.9	179.7	-174.1	62.2	83.3	0	0	111.6	W19 L27 H63 A65 E70 L71	W19-Q67 VanDerWaalsContact CD1-OE1 3.3Å; W19-Q67 HydrophobicContact CD2-CB 4.4Å; W19-Q67 HydrophobicContact CD2-CG 3.72Å; W19-Q67 HydrophobicContact CE3-CG 3.82Å; W19-Q67 HydrophobicContact CG-CG 4.12Å; W19-Q67 HydrophobicContact CH2-CB 4.29Å; W19-Q67 HydrophobicContact CH2-CG 4.41Å; W19-Q67 HydrophobicContact CZ2-CB 4.13Å; W19-Q67 HydrophobicContact CZ2-CG 4.34Å; W19-Q67 HydrophobicContact CZ3-CG 4.18Å; L27-Q67 HydrophobicContact CD2-CB 3.71Å; L27-Q67 HydrophobicContact CD2-CG 3.68Å; H63-Q67 VanDerWaalsContact O-CB 3.29Å; H63-Q67 WeakPolarHBondContact O-CB 3.5Å; H63-Q67 PolarHBondContact O-N 2.97Å; A65-Q67 PolarHBondContact O-N 3.28Å; Q67-E70 PolarHBondContact NE2-OE2 3.35Å; Q67-E70 PolarHBondContact O-N 3.48Å; Q67-L71 WeakPolarHBondContact O-CG 3.1Å; Q67-L71 PolarHBondContact O-N 3.32Å
68	Y	95.9	Very high	90.2	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-73.5	-36.1	174.9	-170.5	-104.7	0	0	0	112.4	V31 D36 W39 C64 A65 S66 E70 L71 L72 E93	V31-Y68 HydrophobicContact CB-CD2 4.27Å; V31-Y68 HydrophobicContact CB-CE2 4.01Å; V31-Y68 HydrophobicContact CG1-CD1 4.25Å; V31-Y68 HydrophobicContact CG1-CD2 4.45Å; V31-Y68 HydrophobicContact CG1-CE1 3.74Å; V31-Y68 HydrophobicContact CG1-CE2 3.99Å; V31-Y68 HydrophobicContact CG2-CD1 4.42Å; V31-Y68 HydrophobicContact CG2-CD2 3.94Å; V31-Y68 HydrophobicContact CG2-CE2 4.2Å; V31-Y68 HydrophobicContact CG2-CG 4.08Å; D36-Y68 HydrophobicContact CB-CE1 4.45Å; W39-Y68 AromaticContact CH2-CD1 3.79Å; W39-Y68 HydrophobicContact CH2-CD1 3.79Å; W39-Y68 AromaticContact CH2-CG 3.98Å; W39-Y68 HydrophobicContact CH2-CG 3.98Å; C64-Y68 WeakPolarHBondContact O-CB 3.18Å; C64-Y68 PolarHBondContact O-N 3.38Å; A65-Y68 PolarHBondContact O-N 2.8Å; S66-Y68 VanDerWaalsContact C-N 3.34Å; Y68-E70 VanDerWaalsContact C-N 3.3Å; Y68-E70 PolarHBondContact O-N 3.32Å; Y68-L71 HydrophobicContact CD2-CD1 4.42Å; Y68-L71 PolarHBondContact O-N 3.19Å; Y68-L72 HydrophobicContact CD1-CD1 3.85Å; Y68-L72 HydrophobicContact CD1-CG 4.26Å; Y68-L72 HydrophobicContact CE1-CD1 3.59Å; Y68-L72 HydrophobicContact CE1-CD2 4.19Å; Y68-L72 HydrophobicContact CE1-CG 3.87Å; Y68-L72 WeakPolarHBondContact O-CG 3.38Å; Y68-L72 PolarHBondContact O-N 3.42Å; Y68-E93 WeakPolarHBondContact OH-CG 3.29Å
69	S	94.4	Very high	88.4	Confident	59 Å²	59	64.8 Å²	64.8	41%	0.413	35%	0.349	S	S	.	.	H	α-helix	trans	-58	-41.9	169	-62	0	0	0	0	112	A65 S66 L71 L72 E73	A65-S69 PolarHBondContact O-N 3.03Å; A65-S69 PolarHBondContact O-OG 3.33Å; A65-S69 VanDerWaalsContact O-OG 3.13Å; S66-S69 PolarHBondContact O-N 2.84Å; S69-L71 PolarHBondContact O-N 2.98Å; S69-L72 PolarHBondContact O-N 2.83Å; S69-E73 WeakPolarHBondContact O-CG 3.05Å; S69-E73 PolarHBondContact O-N 3.42Å
70	E	94.3	Very high	86.6	Confident	113 Å²	113	74.5 Å²	74.5	53%	0.528	39%	0.386	S	S	.	.	H	α-helix	trans	-62.8	-39.2	175.3	-171.9	-178.9	-174.6	0	0	112.3	S66 Q67 Y68 E73 A74	S66-E70 PolarHBondContact O-N 3.37Å; S66-E70 VanDerWaalsContact O-N 3.17Å; Q67-E70 PolarHBondContact NE2-OE2 3.35Å; Q67-E70 PolarHBondContact O-N 3.48Å; Y68-E70 VanDerWaalsContact C-N 3.3Å; Y68-E70 PolarHBondContact O-N 3.32Å; E70-E73 PolarHBondContact O-N 3.17Å; E70-A74 WeakPolarHBondContact O-CB 3.5Å; E70-A74 PolarHBondContact O-N 3.14Å
71	L	94.1	Very high	84.5	Confident	18 Å²	18	82.3 Å²	82.3	9%	0.094	42%	0.416	C	S	.	.	H	α-helix	trans	-66.1	-35.7	175.4	-68.8	172.4	0	0	0	112.8	K24 L27 Q67 Y68 S69 T75 I96 L100	K24-L71 HydrophobicContact CB-CD1 4.42Å; K24-L71 HydrophobicContact CG-CD2 4.5Å; L27-L71 HydrophobicContact CD2-CD1 4.4Å; Q67-L71 WeakPolarHBondContact O-CG 3.1Å; Q67-L71 PolarHBondContact O-N 3.32Å; Y68-L71 HydrophobicContact CD2-CD1 4.42Å; Y68-L71 PolarHBondContact O-N 3.19Å; S69-L71 PolarHBondContact O-N 2.98Å; L71-T75 WeakPolarHBondContact O-CB 3.43Å; L71-T75 PolarHBondContact O-N 3.47Å; L71-T75 PolarHBondContact O-OG1 2.91Å; L71-I96 HydrophobicContact CB-CD1 4.3Å; L71-I96 HydrophobicContact CB-CG2 4.19Å; L71-I96 HydrophobicContact CD1-CG2 4.3Å; L71-L100 HydrophobicContact CD1-CD1 4.11Å; L71-L100 HydrophobicContact CD2-CD1 4.18Å; L71-L100 HydrophobicContact CD2-CD2 4.46Å
72	L	92.3	Very high	82.4	Confident	62 Å²	62	89.9 Å²	89.9	33%	0.325	44%	0.44	S	S	.	.	H	α-helix	trans	-68.1	-43.2	172.5	-70.9	168.3	0	0	0	111.8	Y68 S69 A74 T75 I92 I96	Y68-L72 HydrophobicContact CD1-CD1 3.85Å; Y68-L72 HydrophobicContact CD1-CG 4.26Å; Y68-L72 HydrophobicContact CE1-CD1 3.59Å; Y68-L72 HydrophobicContact CE1-CD2 4.19Å; Y68-L72 HydrophobicContact CE1-CG 3.87Å; Y68-L72 WeakPolarHBondContact O-CG 3.38Å; Y68-L72 PolarHBondContact O-N 3.42Å; S69-L72 PolarHBondContact O-N 2.83Å; L72-A74 VanDerWaalsContact C-N 3.32Å; L72-A74 PolarHBondContact O-N 2.83Å; L72-T75 PolarHBondContact O-N 2.83Å; L72-I92 HydrophobicContact CD2-CB 4.44Å; L72-I92 HydrophobicContact CD2-CG1 3.73Å; L72-I92 HydrophobicContact CD2-CG2 3.79Å; L72-I96 HydrophobicContact CD2-CD1 3.77Å; L72-I96 HydrophobicContact CG-CD1 4.23Å
73	E	91.2	Very high	80.1	Confident	173 Å²	173	86 Å²	86	81%	0.808	44%	0.439	S	S	*	.	H	α-helix	trans	-66.8	-32.4	176.8	-73.3	179	-168.2	0	0	112.4	S69 E70 T75	S69-E73 WeakPolarHBondContact O-CG 3.05Å; S69-E73 PolarHBondContact O-N 3.42Å; E70-E73 PolarHBondContact O-N 3.17Å; E73-T75 VanDerWaalsContact C-N 3.3Å; E73-T75 PolarHBondContact O-N 3.4Å
74	A	87.3	Confident	77.8	Confident	60 Å²	60	91.9 Å²	91.9	50%	0.496	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	4.6	178.4	0	0	0	0	0	114.9	E70 L72 R99	E70-A74 WeakPolarHBondContact O-CB 3.5Å; E70-A74 PolarHBondContact O-N 3.14Å; L72-A74 VanDerWaalsContact C-N 3.32Å; L72-A74 PolarHBondContact O-N 2.83Å; A74-R99 PolarHBondContact O-NH1 2.85Å; A74-R99 VanDerWaalsContact O-NH1 3.14Å
75	T	86.9	Confident	75.6	Confident	17 Å²	17	101.1 Å²	101.1	10%	0.104	51%	0.508	C	S	.	.	S	Bend	trans	-127.4	118.7	-175.2	-56.1	0	0	0	0	111.3	L71 L72 E73 A77 I92 V95 I96	L71-T75 WeakPolarHBondContact O-CB 3.43Å; L71-T75 PolarHBondContact O-N 3.47Å; L71-T75 PolarHBondContact O-OG1 2.91Å; L72-T75 PolarHBondContact O-N 2.83Å; E73-T75 VanDerWaalsContact C-N 3.3Å; E73-T75 PolarHBondContact O-N 3.4Å; T75-A77 PolarHBondContact O-N 2.96Å; T75-I92 HydrophobicContact CG2-CD1 3.79Å; T75-V95 HydrophobicContact CG2-CB 4.11Å; T75-V95 HydrophobicContact CG2-CG1 3.48Å; T75-V95 VanDerWaalsContact CG2-CG1 3.48Å; T75-I96 HydrophobicContact CG2-CG1 3.99Å; T75-I96 WeakPolarHBondContact OG1-CG1 3.24Å
76	E	79.8	Confident	73.8	Confident	143 Å²	143	103.8 Å²	103.8	67%	0.668	54%	0.537	S	S	*	.			trans	-70.3	128.1	177.2	-162.8	-172.8	-163.3	0	0	110.8	K79	E76-K79 WeakPolarHBondContact OE1-CE 3.36Å; E76-K79 IonicContact OE1-NZ 3.54Å; E76-K79 PolarHBondContact OE1-NZ 2.69Å; E76-K79 IonicContact OE2-NZ 3.66Å; E76-K79 PolarHBondContact OE2-NZ 3.34Å
77	A	67.9	Low	71.7	Confident	64 Å²	64	107.5 Å²	107.5	53%	0.529	55%	0.546	S	S	.	.			trans	-64.6	135.8	-177.7	0	0	0	0	0	112.6	T75 K79 I92	T75-A77 PolarHBondContact O-N 2.96Å; A77-K79 PolarHBondContact O-N 3.18Å; A77-I92 HydrophobicContact CB-CD1 4.29Å
78	P	64.5	Low	69.8	Low	52 Å²	52	112.8 Å²	112.8	34%	0.338	58%	0.579	S	S	.	*			trans	-48.4	114	177.1	-33.1	37.4	0	0	0	113.5	R80 V95	P78-R80 PolarHBondContact O-N 3.49Å; P78-V95 HydrophobicContact CG-CG2 3.62Å
79	K	54.1	Low	68.2	Low	149 Å²	149	117.1 Å²	117.1	65%	0.648	61%	0.605	S	S	*	*			trans	-66.7	100.2	-179.8	-66.5	-174.8	176.1	95.4	0	109.4	E76 A77 K81	E76-K79 WeakPolarHBondContact OE1-CE 3.36Å; E76-K79 IonicContact OE1-NZ 3.54Å; E76-K79 PolarHBondContact OE1-NZ 2.69Å; E76-K79 IonicContact OE2-NZ 3.66Å; E76-K79 PolarHBondContact OE2-NZ 3.34Å; A77-K79 PolarHBondContact O-N 3.18Å; K79-K81 PolarHBondContact O-N 3.23Å
80	R	56.4	Low	67.2	Low	211 Å²	211	117.7 Å²	117.7	80%	0.796	60%	0.602	S	S	*	*			trans	-52.8	90.2	-174.3	-62.3	-179.7	72.6	90.8	0.5	112.9	P78 R82	P78-R80 PolarHBondContact O-N 3.49Å; R80-R82 PolarHBondContact O-N 3.14Å
81	K	49.8	Very low	66.9	Low	195 Å²	195	115.1 Å²	115.1	85%	0.848	59%	0.594	S	S	*	*			trans	-66.8	121.5	165.5	-74.9	-175	178.1	176.4	0	108.2	K79 G83	K79-K81 PolarHBondContact O-N 3.23Å; K81-G83 PolarHBondContact O-N 3.49Å
82	R	50.9	Low	66.5	Low	258 Å²	258	116.5 Å²	116.5	97%	0.974	60%	0.601	S	S	*	*			trans	-80.7	68	174.7	-172.4	-179.9	174.6	-176.5	-2.5	109	R80	R80-R82 PolarHBondContact O-N 3.14Å
83	G	46.6	Very low	66.4	Low	57 Å²	57	116.3 Å²	116.3	59%	0.588	60%	0.598	S	S	*	*			trans	-91.6	-179.8	-179.5	0	0	0	0	0	113.9	K81	K81-G83 PolarHBondContact O-N 3.49Å
84	E	46.6	Very low	66.3	Low	171 Å²	171	110.8 Å²	110.8	80%	0.799	58%	0.575	S	S	*	*	S	Bend	trans	-80.8	168.6	-168.5	-157.3	161.7	154.1	0	0	114.1	G86	E84-G86 PolarHBondContact O-N 3.31Å
85	K	48.9	Very low	66.5	Low	195 Å²	195	109.4 Å²	109.4	85%	0.848	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-28.8	120.7	-175.2	-68.3	168.4	176.4	164.1	0	116.7
86	G	56.9	Low	66.8	Low	78 Å²	78	108.8 Å²	108.8	80%	0.804	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	96.7	-8.2	145.9	0	0	0	0	0	116.8	E84 V88	E84-G86 PolarHBondContact O-N 3.31Å; G86-V88 PolarHBondContact O-N 2.8Å
87	E	50.9	Low	67.6	Low	158 Å²	158	102.9 Å²	102.9	74%	0.738	53%	0.53	S	S	*	.			trans	-58.5	132.3	171.7	-168.6	172.8	-144.5	0	0	110.8	V89	E87-V89 PolarHBondContact O-N 3.49Å
88	V	55.6	Low	68.8	Low	132 Å²	132	105.9 Å²	105.9	80%	0.8	53%	0.527	S	S	*	.			trans	-74.5	108.5	176.2	177.1	0	0	0	0	107.5	G86 E90	G86-V88 PolarHBondContact O-N 2.8Å; V88-E90 PolarHBondContact O-N 3.11Å
89	V	61.9	Low	70.2	Confident	94 Å²	94	108.9 Å²	108.9	57%	0.57	53%	0.532	S	S	*	.			trans	-64.2	106.1	175.3	178.5	0	0	0	0	108.9	E87	E87-V89 PolarHBondContact O-N 3.49Å
90	E	74.6	Confident	72.2	Confident	71 Å²	71	102 Å²	102	33%	0.332	50%	0.502	S	S	.	.			trans	-51.6	135.3	175.2	-170.4	-176.4	168.9	0	0	111.7	V88 D94 V95 R98	V88-E90 PolarHBondContact O-N 3.11Å; E90-D94 HydrophobicContact CG-CB 3.62Å; E90-V95 HydrophobicContact CG-CG2 4.23Å; E90-V95 WeakPolarHBondContact OE1-CG2 3.26Å; E90-V95 PolarHBondContact OE1-N 3.3Å; E90-R98 VanDerWaalsContact CD-NH2 3.28Å; E90-R98 IonicContact OE1-CZ 3.92Å; E90-R98 IonicContact OE1-NH1 2.67Å; E90-R98 PolarHBondContact OE1-NH1 3.4Å; E90-R98 IonicContact OE1-NH2 3.34Å; E90-R98 PolarHBondContact OE1-NH2 3.05Å; E90-R98 IonicContact OE2-NH1 2.67Å; E90-R98 IonicContact OE2-NH2 3.22Å
91	T	86.8	Confident	74.1	Confident	60 Å²	60	93.4 Å²	93.4	37%	0.368	47%	0.473	S	S	.	.			trans	-90	164	179.4	71.1	0	0	0	0	111.8	E93 D94 V95	T91-E93 PolarHBondContact O-N 3.49Å; T91-E93 PolarHBondContact OG1-N 2.98Å; T91-D94 VanDerWaalsContact CB-OD2 3.3Å; T91-D94 WeakPolarHBondContact CB-OD2 3.43Å; T91-D94 WeakPolarHBondContact CG2-OD2 3.29Å; T91-D94 PolarHBondContact N-OD2 3.1Å; T91-D94 PolarHBondContact O-N 2.91Å; T91-D94 PolarHBondContact OG1-N 3.18Å; T91-D94 VanDerWaalsContact OG1-N 3.14Å; T91-D94 PolarHBondContact OG1-OD2 3.22Å; T91-V95 WeakPolarHBondContact O-CG2 3.45Å; T91-V95 PolarHBondContact O-N 2.96Å
92	I	87.3	Confident	76.3	Confident	47 Å²	47	87.4 Å²	87.4	24%	0.241	45%	0.453	C	S	.	.	H	α-helix	trans	-60.6	-30	171.8	-166.5	73	0	0	0	111.8	L72 T75 A77 I96	L72-I92 HydrophobicContact CD2-CB 4.44Å; L72-I92 HydrophobicContact CD2-CG1 3.73Å; L72-I92 HydrophobicContact CD2-CG2 3.79Å; T75-I92 HydrophobicContact CG2-CD1 3.79Å; A77-I92 HydrophobicContact CB-CD1 4.29Å; I92-I96 HydrophobicContact CG1-CD1 4.19Å; I92-I96 VanDerWaalsContact O-CG1 3.28Å; I92-I96 WeakPolarHBondContact O-CG1 3.33Å; I92-I96 PolarHBondContact O-N 3.43Å; I92-I96 VanDerWaalsContact O-N 3.1Å
93	E	89.4	Confident	78.5	Confident	57 Å²	57	77.8 Å²	77.8	27%	0.266	42%	0.419	S	S	.	.	H	α-helix	trans	-65.9	-46.2	175.6	-77.6	155.8	-167.4	0	0	111.5	M32 Y68 T91 V95 I96 V97	M32-E93 HydrophobicContact CB-CB 4.5Å; M32-E93 HydrophobicContact CG-CB 4.33Å; Y68-E93 WeakPolarHBondContact OH-CG 3.29Å; T91-E93 PolarHBondContact O-N 3.49Å; T91-E93 PolarHBondContact OG1-N 2.98Å; E93-V95 VanDerWaalsContact C-N 3.34Å; E93-V95 PolarHBondContact O-N 2.96Å; E93-I96 PolarHBondContact O-N 3.35Å; E93-V97 WeakPolarHBondContact O-CG2 3.29Å; E93-V97 PolarHBondContact O-N 3.14Å
94	D	89.5	Confident	80.9	Confident	58 Å²	58	75.8 Å²	75.8	31%	0.31	39%	0.393	S	S	.	.	H	α-helix	trans	-60.4	-41.7	176.8	-59.5	-62.4	0	0	0	111.8	E90 T91 R98	E90-D94 HydrophobicContact CG-CB 3.62Å; T91-D94 VanDerWaalsContact CB-OD2 3.3Å; T91-D94 WeakPolarHBondContact CB-OD2 3.43Å; T91-D94 WeakPolarHBondContact CG2-OD2 3.29Å; T91-D94 PolarHBondContact N-OD2 3.1Å; T91-D94 PolarHBondContact O-N 2.91Å; T91-D94 PolarHBondContact OG1-N 3.18Å; T91-D94 VanDerWaalsContact OG1-N 3.14Å; T91-D94 PolarHBondContact OG1-OD2 3.22Å; D94-R98 WeakPolarHBondContact O-CB 3.23Å; D94-R98 PolarHBondContact O-N 3.41Å
95	V	91.4	Very high	83.2	Confident	31 Å²	31	69.1 Å²	69.1	19%	0.188	36%	0.363	C	S	.	.	H	α-helix	trans	-62.3	-49.1	177	-179.5	0	0	0	0	110.8	T75 P78 E90 T91 E93 R98 R99	T75-V95 HydrophobicContact CG2-CB 4.11Å; T75-V95 HydrophobicContact CG2-CG1 3.48Å; T75-V95 VanDerWaalsContact CG2-CG1 3.48Å; P78-V95 HydrophobicContact CG-CG2 3.62Å; E90-V95 HydrophobicContact CG-CG2 4.23Å; E90-V95 WeakPolarHBondContact OE1-CG2 3.26Å; E90-V95 PolarHBondContact OE1-N 3.3Å; T91-V95 WeakPolarHBondContact O-CG2 3.45Å; T91-V95 PolarHBondContact O-N 2.96Å; E93-V95 VanDerWaalsContact C-N 3.34Å; E93-V95 PolarHBondContact O-N 2.96Å; V95-R98 PolarHBondContact O-N 3.19Å; V95-R99 VanDerWaalsContact O-CB 3.25Å; V95-R99 WeakPolarHBondContact O-CB 3.29Å; V95-R99 PolarHBondContact O-N 3.21Å
96	I	93.9	Very high	85.5	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.015	35%	0.35	C	S	.	.	H	α-helix	trans	-61.6	-47.1	-179.2	-71	167.3	0	0	0	110.3	A28 L71 L72 T75 I92 E93 L100	A28-I96 HydrophobicContact CB-CG2 3.71Å; L71-I96 HydrophobicContact CB-CD1 4.3Å; L71-I96 HydrophobicContact CB-CG2 4.19Å; L71-I96 HydrophobicContact CD1-CG2 4.3Å; L72-I96 HydrophobicContact CD2-CD1 3.77Å; L72-I96 HydrophobicContact CG-CD1 4.23Å; T75-I96 HydrophobicContact CG2-CG1 3.99Å; T75-I96 WeakPolarHBondContact OG1-CG1 3.24Å; I92-I96 HydrophobicContact CG1-CD1 4.19Å; I92-I96 VanDerWaalsContact O-CG1 3.28Å; I92-I96 WeakPolarHBondContact O-CG1 3.33Å; I92-I96 PolarHBondContact O-N 3.43Å; I92-I96 VanDerWaalsContact O-N 3.1Å; E93-I96 PolarHBondContact O-N 3.35Å; I96-L100 HydrophobicContact CG2-CD1 3.72Å; I96-L100 WeakPolarHBondContact O-CB 3.38Å; I96-L100 VanDerWaalsContact O-CG 3.31Å; I96-L100 WeakPolarHBondContact O-CG 3.49Å; I96-L100 PolarHBondContact O-N 3.33Å
97	V	94.8	Very high	87.4	Confident	20 Å²	20	63.5 Å²	63.5	12%	0.121	32%	0.319	C	S	.	.	H	α-helix	trans	-63.3	-50.3	179.9	172.4	0	0	0	0	110.6	L25 A28 M32 E93 R99 L100 T101	L25-V97 HydrophobicContact CD1-CG1 4.2Å; A28-V97 HydrophobicContact CB-CG2 3.8Å; M32-V97 HydrophobicContact CE-CG1 4.34Å; M32-V97 HydrophobicContact CE-CG2 4.2Å; M32-V97 HydrophobicContact SD-CB 4.5Å; M32-V97 HydrophobicContact SD-CG2 3.99Å; E93-V97 WeakPolarHBondContact O-CG2 3.29Å; E93-V97 PolarHBondContact O-N 3.14Å; V97-R99 PolarHBondContact O-N 3.45Å; V97-L100 PolarHBondContact O-N 3.44Å; V97-T101 PolarHBondContact O-N 3.25Å; V97-T101 PolarHBondContact O-OG1 3.38Å; V97-T101 VanDerWaalsContact O-OG1 3.08Å
98	R	93.4	Very high	89.5	Confident	127 Å²	127	56.5 Å²	56.5	48%	0.479	29%	0.287	S	S	.	.	H	α-helix	trans	-61	-44.2	-179.7	-166.1	-173.2	-46.2	97.1	19.4	112.1	E90 D94 V95 L100 T101 T102	E90-R98 VanDerWaalsContact CD-NH2 3.28Å; E90-R98 IonicContact OE1-CZ 3.92Å; E90-R98 IonicContact OE1-NH1 2.67Å; E90-R98 PolarHBondContact OE1-NH1 3.4Å; E90-R98 IonicContact OE1-NH2 3.34Å; E90-R98 PolarHBondContact OE1-NH2 3.05Å; E90-R98 IonicContact OE2-NH1 2.67Å; E90-R98 IonicContact OE2-NH2 3.22Å; D94-R98 WeakPolarHBondContact O-CB 3.23Å; D94-R98 PolarHBondContact O-N 3.41Å; V95-R98 PolarHBondContact O-N 3.19Å; R98-L100 PolarHBondContact O-N 3.27Å; R98-T101 PolarHBondContact O-N 2.98Å; R98-T102 PolarHBondContact O-N 2.99Å; R98-T102 PolarHBondContact O-OG1 2.83Å
99	R	94.6	Very high	91.4	Very high	115 Å²	115	56.1 Å²	56.1	43%	0.434	27%	0.274	S	S	.	.	H	α-helix	trans	-57.7	-49.1	176.8	178.1	-176.4	163.8	-168.5	-8.7	111.2	A74 V95 V97 T101 T102 E103	A74-R99 PolarHBondContact O-NH1 2.85Å; A74-R99 VanDerWaalsContact O-NH1 3.14Å; V95-R99 VanDerWaalsContact O-CB 3.25Å; V95-R99 WeakPolarHBondContact O-CB 3.29Å; V95-R99 PolarHBondContact O-N 3.21Å; V97-R99 PolarHBondContact O-N 3.45Å; R99-T101 VanDerWaalsContact C-N 3.32Å; R99-T101 PolarHBondContact O-N 2.96Å; R99-T102 PolarHBondContact O-N 3.49Å; R99-E103 IonicContact CZ-OE1 3.74Å; R99-E103 IonicContact NE-OE1 2.72Å; R99-E103 PolarHBondContact NE-OE1 3.47Å; R99-E103 IonicContact NH2-OE1 2.67Å; R99-E103 PolarHBondContact NH2-OE1 2.91Å; R99-E103 WeakPolarHBondContact O-CG 3.25Å; R99-E103 PolarHBondContact O-N 3.18Å
100	L	96.3	Very high	93.1	Very high	5 Å²	5	57.2 Å²	57.2	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-67.6	-31	179.8	-71.1	169.6	0	0	0	112.5	I21 K24 L25 A28 L71 I96 V97 R98 R104	I21-L100 HydrophobicContact CG2-CD2 4.43Å; K24-L100 HydrophobicContact CB-CD1 4.05Å; K24-L100 HydrophobicContact CB-CD2 3.96Å; L25-L100 HydrophobicContact CB-CB 4.11Å; L25-L100 HydrophobicContact CD1-CB 3.88Å; A28-L100 HydrophobicContact CB-CD1 3.99Å; L71-L100 HydrophobicContact CD1-CD1 4.11Å; L71-L100 HydrophobicContact CD2-CD1 4.18Å; L71-L100 HydrophobicContact CD2-CD2 4.46Å; I96-L100 HydrophobicContact CG2-CD1 3.72Å; I96-L100 WeakPolarHBondContact O-CB 3.38Å; I96-L100 VanDerWaalsContact O-CG 3.31Å; I96-L100 WeakPolarHBondContact O-CG 3.49Å; I96-L100 PolarHBondContact O-N 3.33Å; V97-L100 PolarHBondContact O-N 3.44Å; R98-L100 PolarHBondContact O-N 3.27Å; L100-R104 VanDerWaalsContact O-CB 3.24Å; L100-R104 WeakPolarHBondContact O-CB 3.41Å; L100-R104 PolarHBondContact O-N 2.82Å
101	T	96.6	Very high	94.1	Very high	30 Å²	30	57.2 Å²	57.2	18%	0.184	27%	0.27	C	S	.	.	H	α-helix	trans	-64.8	-44.9	169.4	-59.9	0	0	0	0	111.4	V97 R98 R99 R104 I105	V97-T101 PolarHBondContact O-N 3.25Å; V97-T101 PolarHBondContact O-OG1 3.38Å; V97-T101 VanDerWaalsContact O-OG1 3.08Å; R98-T101 PolarHBondContact O-N 2.98Å; R99-T101 VanDerWaalsContact C-N 3.32Å; R99-T101 PolarHBondContact O-N 2.96Å; T101-R104 PolarHBondContact O-N 2.96Å; T101-I105 HydrophobicContact CG2-CD1 3.88Å; T101-I105 HydrophobicContact CG2-CG1 4.49Å; T101-I105 WeakPolarHBondContact O-CG1 3.2Å; T101-I105 PolarHBondContact O-N 3.17Å
102	T	95.7	Very high	94.5	Very high	69 Å²	69	59.3 Å²	59.3	42%	0.423	28%	0.275	S	S	.	.	H	α-helix	trans	-61.8	-48.2	174.9	-56.5	0	0	0	0	111.6	R98 R99 R104 I105 E106	R98-T102 PolarHBondContact O-N 2.99Å; R98-T102 PolarHBondContact O-OG1 2.83Å; R99-T102 PolarHBondContact O-N 3.49Å; T102-R104 PolarHBondContact O-N 2.88Å; T102-I105 PolarHBondContact O-N 3.11Å; T102-E106 WeakPolarHBondContact O-CG 3.21Å; T102-E106 PolarHBondContact O-N 3.22Å
103	E	96.4	Very high	94.9	Very high	56 Å²	56	64.6 Å²	64.6	26%	0.262	29%	0.292	S	S	.	.	H	α-helix	trans	-58.5	-35.6	176.2	-71.9	-179.9	-173.1	0	0	111.8	I21 R99 E107	I21-E103 HydrophobicContact CD1-CB 4.26Å; I21-E103 HydrophobicContact CG2-CB 3.87Å; R99-E103 IonicContact CZ-OE1 3.74Å; R99-E103 IonicContact NE-OE1 2.72Å; R99-E103 PolarHBondContact NE-OE1 3.47Å; R99-E103 IonicContact NH2-OE1 2.67Å; R99-E103 PolarHBondContact NH2-OE1 2.91Å; R99-E103 WeakPolarHBondContact O-CG 3.25Å; R99-E103 PolarHBondContact O-N 3.18Å; E103-E107 WeakPolarHBondContact O-CB 3.29Å; E103-E107 PolarHBondContact O-N 2.69Å
104	R	96.8	Very high	95.3	Very high	14 Å²	14	65.1 Å²	65.1	5%	0.053	30%	0.297	C	S	.	.	H	α-helix	trans	-72.4	-41.4	176.6	-179.7	55.9	177.5	162	6.9	113	I21 L25 L100 T101 T102 E106 E107 L108 E388	I21-R104 HydrophobicContact CG2-CB 3.96Å; L25-R104 HydrophobicContact CD2-CB 4.18Å; L25-R104 HydrophobicContact CD2-CG 4.34Å; L100-R104 VanDerWaalsContact O-CB 3.24Å; L100-R104 WeakPolarHBondContact O-CB 3.41Å; L100-R104 PolarHBondContact O-N 2.82Å; T101-R104 PolarHBondContact O-N 2.96Å; T102-R104 PolarHBondContact O-N 2.88Å; R104-E106 VanDerWaalsContact C-N 3.3Å; R104-E106 PolarHBondContact O-N 2.72Å; R104-E107 WeakPolarHBondContact CD-OE2 3.4Å; R104-E107 IonicContact CZ-OE2 2.61Å; R104-E107 IonicContact NE-OE2 3.72Å; R104-E107 IonicContact NH1-OE2 2.71Å; R104-E107 PolarHBondContact NH1-OE2 3.41Å; R104-E107 WeakPolarHBondContact O-CB 3.14Å; R104-E107 PolarHBondContact O-N 2.82Å; R104-L108 HydrophobicContact CG-CD1 4.02Å; R104-L108 WeakPolarHBondContact O-CB 3.41Å; R104-L108 WeakPolarHBondContact O-CG 3.27Å; R104-L108 PolarHBondContact O-N 3.32Å; R104-E388 IonicContact CZ-OE1 2.76Å; R104-E388 IonicContact NH1-OE1 2.91Å; R104-E388 IonicContact NH2-OE1 3.95Å; R104-E388 PolarHBondContact NH2-OE1 3.24Å; R104-E388 IonicContact NH2-OE2 2.7Å; R104-E388 PolarHBondContact NH2-OE2 3.47Å
105	I	96.1	Very high	95.5	Very high	31 Å²	31	66.4 Å²	66.4	16%	0.159	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-38.7	174.8	-69.8	167.6	0	0	0	110.3	T101 T102 K109 E381	T101-I105 HydrophobicContact CG2-CD1 3.88Å; T101-I105 HydrophobicContact CG2-CG1 4.49Å; T101-I105 WeakPolarHBondContact O-CG1 3.2Å; T101-I105 PolarHBondContact O-N 3.17Å; T102-I105 PolarHBondContact O-N 3.11Å; I105-K109 HydrophobicContact CG2-CD 4.04Å; I105-K109 WeakPolarHBondContact O-CB 3.44Å; I105-K109 VanDerWaalsContact O-CG 3.26Å; I105-K109 WeakPolarHBondContact O-CG 3.09Å; I105-K109 PolarHBondContact O-N 3.47Å; I105-E381 WeakPolarHBondContact CG1-OE1 3.46Å
106	E	97.4	Very high	95.8	Very high	122 Å²	122	70.2 Å²	70.2	57%	0.57	32%	0.323	S	S	*	.	H	α-helix	trans	-67.9	-39.9	174.5	-72.6	178.8	-166.8	0	0	112.6	T102 R104 K109 R110	T102-E106 WeakPolarHBondContact O-CG 3.21Å; T102-E106 PolarHBondContact O-N 3.22Å; R104-E106 VanDerWaalsContact C-N 3.3Å; R104-E106 PolarHBondContact O-N 2.72Å; E106-K109 PolarHBondContact O-N 3.26Å; E106-R110 WeakPolarHBondContact O-CB 3.47Å; E106-R110 PolarHBondContact O-N 3.09Å
107	E	96.1	Very high	96	Very high	33 Å²	33	74.4 Å²	74.4	15%	0.154	34%	0.343	C	S	.	.	H	α-helix	trans	-59.5	-47.5	172.5	-178.8	178	-115.1	0	0	111.7	I21 E103 R104 R110 L111	I21-E107 HydrophobicContact CD1-CB 4.13Å; I21-E107 HydrophobicContact CD1-CG 4.46Å; E103-E107 WeakPolarHBondContact O-CB 3.29Å; E103-E107 PolarHBondContact O-N 2.69Å; R104-E107 WeakPolarHBondContact CD-OE2 3.4Å; R104-E107 IonicContact CZ-OE2 2.61Å; R104-E107 IonicContact NE-OE2 3.72Å; R104-E107 IonicContact NH1-OE2 2.71Å; R104-E107 PolarHBondContact NH1-OE2 3.41Å; R104-E107 WeakPolarHBondContact O-CB 3.14Å; R104-E107 PolarHBondContact O-N 2.82Å; E107-R110 WeakPolarHBondContact O-CB 3.34Å; E107-R110 PolarHBondContact O-N 2.64Å; E107-L111 HydrophobicContact CG-CD1 4.21Å; E107-L111 WeakPolarHBondContact O-CG 3.23Å; E107-L111 PolarHBondContact O-N 3.15Å
108	L	95.5	Very high	96.1	Very high	12 Å²	12	79.3 Å²	79.3	6%	0.063	36%	0.364	C	S	.	.	H	α-helix	trans	-64.5	-44.4	177.6	-74.6	164.2	0	0	0	112.1	R104 R110 L111 Q112 L384 E388	R104-L108 HydrophobicContact CG-CD1 4.02Å; R104-L108 WeakPolarHBondContact O-CB 3.41Å; R104-L108 WeakPolarHBondContact O-CG 3.27Å; R104-L108 PolarHBondContact O-N 3.32Å; L108-R110 PolarHBondContact O-N 2.78Å; L108-L111 PolarHBondContact O-N 3.48Å; L108-Q112 WeakPolarHBondContact O-CB 3.46Å; L108-Q112 PolarHBondContact O-N 3.25Å; L108-L384 HydrophobicContact CB-CD1 4.12Å; L108-L384 HydrophobicContact CD1-CB 4.02Å; L108-L384 HydrophobicContact CD1-CD1 3.76Å; L108-L384 HydrophobicContact CD1-CG 4.43Å; L108-E388 HydrophobicContact CD2-CG 4.42Å
109	K	95.6	Very high	96.2	Very high	123 Å²	123	81 Å²	81	54%	0.535	37%	0.372	S	S	.	.	H	α-helix	trans	-64.2	-23.6	173.8	-75.3	175.9	178.7	-178.2	0	113.5	I105 E106 R113	I105-K109 HydrophobicContact CG2-CD 4.04Å; I105-K109 WeakPolarHBondContact O-CB 3.44Å; I105-K109 VanDerWaalsContact O-CG 3.26Å; I105-K109 WeakPolarHBondContact O-CG 3.09Å; I105-K109 PolarHBondContact O-N 3.47Å; E106-K109 PolarHBondContact O-N 3.26Å; K109-R113 WeakPolarHBondContact O-CG 3.29Å; K109-R113 PolarHBondContact O-NE 3.36Å
110	R	96.6	Very high	96.3	Very high	118 Å²	118	81.7 Å²	81.7	45%	0.445	37%	0.374	S	S	.	.	H	α-helix	trans	-76.6	-51.9	170.3	-179.8	176.2	62.3	89.2	-1.1	110.6	E106 E107 L108 Q112 R113 D114	E106-R110 WeakPolarHBondContact O-CB 3.47Å; E106-R110 PolarHBondContact O-N 3.09Å; E107-R110 WeakPolarHBondContact O-CB 3.34Å; E107-R110 PolarHBondContact O-N 2.64Å; L108-R110 PolarHBondContact O-N 2.78Å; R110-Q112 VanDerWaalsContact C-N 3.28Å; R110-Q112 PolarHBondContact O-N 3.3Å; R110-R113 PolarHBondContact O-N 3.06Å; R110-R113 VanDerWaalsContact O-N 3.07Å; R110-D114 WeakPolarHBondContact CG-OD2 3.44Å; R110-D114 IonicContact NH1-OD2 3.93Å; R110-D114 VanDerWaalsContact O-CG 3.31Å; R110-D114 PolarHBondContact O-N 3.18Å
111	L	95.7	Very high	96.3	Very high	70 Å²	70	87.5 Å²	87.5	37%	0.366	40%	0.399	S	S	.	.	H	α-helix	trans	-56.3	-39.5	178.5	-71.7	168.5	0	0	0	112.9	E107 L108 D114 T115	E107-L111 HydrophobicContact CG-CD1 4.21Å; E107-L111 WeakPolarHBondContact O-CG 3.23Å; E107-L111 PolarHBondContact O-N 3.15Å; L108-L111 PolarHBondContact O-N 3.48Å; L111-D114 PolarHBondContact O-N 3.22Å; L111-T115 WeakPolarHBondContact O-CB 3.49Å; L111-T115 PolarHBondContact O-N 2.83Å; L111-T115 PolarHBondContact O-OG1 2.96Å
112	Q	94.9	Very high	96.3	Very high	104 Å²	104	91 Å²	91	49%	0.486	42%	0.416	S	S	.	.	H	α-helix	trans	-61.7	-45.5	175.7	-172.9	179.2	9.5	0	0	111.9	L108 R110 T115 Q116	L108-Q112 WeakPolarHBondContact O-CB 3.46Å; L108-Q112 PolarHBondContact O-N 3.25Å; R110-Q112 VanDerWaalsContact C-N 3.28Å; R110-Q112 PolarHBondContact O-N 3.3Å; Q112-T115 PolarHBondContact O-N 3Å; Q112-Q116 WeakPolarHBondContact O-CB 3.31Å; Q112-Q116 VanDerWaalsContact O-CG 3.26Å; Q112-Q116 WeakPolarHBondContact O-CG 3.38Å; Q112-Q116 PolarHBondContact O-N 2.82Å
113	R	97.1	Very high	96.3	Very high	158 Å²	158	93.4 Å²	93.4	60%	0.596	42%	0.421	S	S	*	.	H	α-helix	trans	-67.7	-42.5	177	-73.1	-179.7	-68.2	159.8	0.8	112.1	K109 R110 T115 Q116 E117	K109-R113 WeakPolarHBondContact O-CG 3.29Å; K109-R113 PolarHBondContact O-NE 3.36Å; R110-R113 PolarHBondContact O-N 3.06Å; R110-R113 VanDerWaalsContact O-N 3.07Å; R113-T115 VanDerWaalsContact C-N 3.3Å; R113-T115 PolarHBondContact O-N 2.9Å; R113-Q116 PolarHBondContact O-N 3.03Å; R113-E117 WeakPolarHBondContact O-CB 3.19Å; R113-E117 PolarHBondContact O-N 3.07Å
114	D	96.6	Very high	96.2	Very high	68 Å²	68	95.9 Å²	95.9	36%	0.364	43%	0.431	S	S	.	.	H	α-helix	trans	-62.5	-39.5	178.1	-66.1	-16.6	0	0	0	110.8	R110 L111 Q118	R110-D114 WeakPolarHBondContact CG-OD2 3.44Å; R110-D114 IonicContact NH1-OD2 3.93Å; R110-D114 VanDerWaalsContact O-CG 3.31Å; R110-D114 PolarHBondContact O-N 3.18Å; L111-D114 PolarHBondContact O-N 3.22Å; D114-Q118 VanDerWaalsContact O-CG 3.26Å; D114-Q118 WeakPolarHBondContact O-CG 3.39Å; D114-Q118 PolarHBondContact O-N 3.09Å; D114-Q118 PolarHBondContact O-NE2 3.14Å
115	T	95.2	Very high	96	Very high	86 Å²	86	99.4 Å²	99.4	53%	0.528	45%	0.448	S	S	.	.	H	α-helix	trans	-69.6	-42.9	174.7	-56.8	0	0	0	0	112.3	L111 Q112 R113 E117 Q118 Y119	L111-T115 WeakPolarHBondContact O-CB 3.49Å; L111-T115 PolarHBondContact O-N 2.83Å; L111-T115 PolarHBondContact O-OG1 2.96Å; Q112-T115 PolarHBondContact O-N 3Å; R113-T115 VanDerWaalsContact C-N 3.3Å; R113-T115 PolarHBondContact O-N 2.9Å; T115-E117 VanDerWaalsContact C-N 3.32Å; T115-E117 PolarHBondContact O-N 3.2Å; T115-Q118 PolarHBondContact O-N 2.83Å; T115-Y119 PolarHBondContact O-N 3.44Å
116	Q	96.3	Very high	95.9	Very high	110 Å²	110	101.4 Å²	101.4	51%	0.514	46%	0.461	S	S	.	.	H	α-helix	trans	-61.6	-39.8	175	-78.4	172	-20	0	0	111.8	Q112 R113 Y119 R120	Q112-Q116 WeakPolarHBondContact O-CB 3.31Å; Q112-Q116 VanDerWaalsContact O-CG 3.26Å; Q112-Q116 WeakPolarHBondContact O-CG 3.38Å; Q112-Q116 PolarHBondContact O-N 2.82Å; R113-Q116 PolarHBondContact O-N 3.03Å; Q116-Y119 PolarHBondContact O-N 3.35Å; Q116-R120 VanDerWaalsContact O-CB 3.3Å; Q116-R120 WeakPolarHBondContact O-CB 3.47Å; Q116-R120 PolarHBondContact O-N 2.85Å
117	E	97.7	Very high	95.8	Very high	92 Å²	92	100.8 Å²	100.8	43%	0.43	46%	0.458	S	S	.	.	H	α-helix	trans	-68	-41	176.6	-177.3	56	-157.3	0	0	112	R113 T115 R120 K121	R113-E117 WeakPolarHBondContact O-CB 3.19Å; R113-E117 PolarHBondContact O-N 3.07Å; T115-E117 VanDerWaalsContact C-N 3.32Å; T115-E117 PolarHBondContact O-N 3.2Å; E117-R120 PolarHBondContact O-N 3.12Å; E117-R120 IonicContact OE1-CZ 3.66Å; E117-R120 IonicContact OE1-NE 2.64Å; E117-R120 IonicContact OE1-NH2 3.65Å; E117-R120 PolarHBondContact OE1-NH2 3.29Å; E117-R120 IonicContact OE2-CZ 3.7Å; E117-R120 IonicContact OE2-NE 2.69Å; E117-R120 PolarHBondContact OE2-NE 2.92Å; E117-R120 IonicContact OE2-NH2 3.92Å; E117-R120 PolarHBondContact OE2-NH2 2.98Å; E117-K121 WeakPolarHBondContact O-CB 3.22Å; E117-K121 PolarHBondContact O-N 2.95Å
118	Q	96.7	Very high	95.5	Very high	122 Å²	122	102.5 Å²	102.5	57%	0.57	47%	0.468	S	S	*	.	H	α-helix	trans	-60.1	-47.7	172.5	-74	170.1	45	0	0	111.4	D114 T115 R120 K121 L122	D114-Q118 VanDerWaalsContact O-CG 3.26Å; D114-Q118 WeakPolarHBondContact O-CG 3.39Å; D114-Q118 PolarHBondContact O-N 3.09Å; D114-Q118 PolarHBondContact O-NE2 3.14Å; T115-Q118 PolarHBondContact O-N 2.83Å; Q118-R120 PolarHBondContact O-N 3.34Å; Q118-K121 PolarHBondContact O-N 3.38Å; Q118-L122 VanDerWaalsContact O-CD1 3.26Å; Q118-L122 WeakPolarHBondContact O-CD1 3.32Å; Q118-L122 PolarHBondContact O-N 3.39Å
119	Y	96	Very high	95.3	Very high	164 Å²	164	106.5 Å²	106.5	64%	0.643	49%	0.488	S	S	*	.	H	α-helix	trans	-59.4	-44.3	175.2	176.2	-99.9	0	0	0	112	T115 Q116 K121 L122 K123	T115-Y119 PolarHBondContact O-N 3.44Å; Q116-Y119 PolarHBondContact O-N 3.35Å; Y119-K121 VanDerWaalsContact C-N 3.31Å; Y119-K121 PolarHBondContact O-N 3.42Å; Y119-L122 PolarHBondContact O-N 3.31Å; Y119-K123 PolarHBondContact O-N 3.04Å
120	R	96.8	Very high	95.1	Very high	129 Å²	129	108 Å²	108	49%	0.487	50%	0.498	S	S	.	.	H	α-helix	trans	-61.7	-37.6	176.5	-170.5	178.7	75.1	121.2	3.2	112.3	Q116 E117 Q118 K124	Q116-R120 VanDerWaalsContact O-CB 3.3Å; Q116-R120 WeakPolarHBondContact O-CB 3.47Å; Q116-R120 PolarHBondContact O-N 2.85Å; E117-R120 PolarHBondContact O-N 3.12Å; E117-R120 IonicContact OE1-CZ 3.66Å; E117-R120 IonicContact OE1-NE 2.64Å; E117-R120 IonicContact OE1-NH2 3.65Å; E117-R120 PolarHBondContact OE1-NH2 3.29Å; E117-R120 IonicContact OE2-CZ 3.7Å; E117-R120 IonicContact OE2-NE 2.69Å; E117-R120 PolarHBondContact OE2-NE 2.92Å; E117-R120 IonicContact OE2-NH2 3.92Å; E117-R120 PolarHBondContact OE2-NH2 2.98Å; Q118-R120 PolarHBondContact O-N 3.34Å; R120-K124 WeakPolarHBondContact O-CG 3.19Å; R120-K124 PolarHBondContact O-N 3.18Å
121	K	97.1	Very high	94.9	Very high	127 Å²	127	107.1 Å²	107.1	55%	0.552	51%	0.505	S	S	*	.	H	α-helix	trans	-66.9	-49.9	173.1	-171.8	-165.3	169.8	-158.6	0	111	E117 Q118 Y119 K123 K124 E125	E117-K121 WeakPolarHBondContact O-CB 3.22Å; E117-K121 PolarHBondContact O-N 2.95Å; Q118-K121 PolarHBondContact O-N 3.38Å; Y119-K121 VanDerWaalsContact C-N 3.31Å; Y119-K121 PolarHBondContact O-N 3.42Å; K121-K123 VanDerWaalsContact C-N 3.34Å; K121-K123 PolarHBondContact O-N 2.95Å; K121-K124 PolarHBondContact O-N 3.33Å; K121-E125 IonicContact NZ-OE2 2.75Å; K121-E125 PolarHBondContact O-N 3.44Å
122	L	95.9	Very high	94.5	Very high	102 Å²	102	105.2 Å²	105.2	53%	0.534	50%	0.503	S	S	.	.	H	α-helix	trans	-62	-38.2	-180	-92.9	70.1	0	0	0	112.1	Q118 Y119 K124 E125 V126	Q118-L122 VanDerWaalsContact O-CD1 3.26Å; Q118-L122 WeakPolarHBondContact O-CD1 3.32Å; Q118-L122 PolarHBondContact O-N 3.39Å; Y119-L122 PolarHBondContact O-N 3.31Å; L122-K124 VanDerWaalsContact C-N 3.35Å; L122-K124 PolarHBondContact O-N 2.95Å; L122-E125 PolarHBondContact O-N 2.84Å; L122-V126 WeakPolarHBondContact O-CG2 3.46Å; L122-V126 PolarHBondContact O-N 3.35Å
123	K	95.6	Very high	94.2	Very high	120 Å²	120	105.2 Å²	105.2	52%	0.522	50%	0.502	S	S	.	.	H	α-helix	trans	-58.8	-45.3	174.4	-173.4	177.9	177.7	-177.3	0	111.3	Y119 K121 V126 E127	Y119-K123 PolarHBondContact O-N 3.04Å; K121-K123 VanDerWaalsContact C-N 3.34Å; K121-K123 PolarHBondContact O-N 2.95Å; K123-V126 PolarHBondContact O-N 3.29Å; K123-E127 WeakPolarHBondContact O-CB 3.12Å; K123-E127 PolarHBondContact O-N 3.49Å
124	K	95	Very high	93.6	Very high	109 Å²	109	99.3 Å²	99.3	47%	0.474	48%	0.482	S	S	.	.	H	α-helix	trans	-66.5	-36.1	175.6	-69.8	177.4	176.3	-171.9	0	113	R120 K121 L122 E127 L128	R120-K124 WeakPolarHBondContact O-CG 3.19Å; R120-K124 PolarHBondContact O-N 3.18Å; K121-K124 PolarHBondContact O-N 3.33Å; L122-K124 VanDerWaalsContact C-N 3.35Å; L122-K124 PolarHBondContact O-N 2.95Å; K124-E127 PolarHBondContact O-N 3.15Å; K124-L128 WeakPolarHBondContact O-CB 3.42Å; K124-L128 VanDerWaalsContact O-CG 3.26Å; K124-L128 WeakPolarHBondContact O-CG 3.47Å; K124-L128 PolarHBondContact O-N 3.26Å
125	E	92.8	Very high	93.1	Very high	88 Å²	88	101.6 Å²	101.6	41%	0.411	49%	0.494	S	S	.	.	H	α-helix	trans	-66	-43.2	176.3	-161.6	168.2	147.6	0	0	110.7	K121 L122 L128 I129	K121-E125 IonicContact NZ-OE2 2.75Å; K121-E125 PolarHBondContact O-N 3.44Å; L122-E125 PolarHBondContact O-N 2.84Å; E125-L128 PolarHBondContact O-N 3.18Å; E125-I129 VanDerWaalsContact O-CG1 3.26Å; E125-I129 WeakPolarHBondContact O-CG1 3.4Å; E125-I129 PolarHBondContact O-N 3.3Å
126	V	93.9	Very high	92.6	Very high	73 Å²	73	101.2 Å²	101.2	44%	0.442	50%	0.495	S	S	.	.	H	α-helix	trans	-63.1	-43.3	172.7	170	0	0	0	0	112	L122 K123 L128 I129 Q130	L122-V126 WeakPolarHBondContact O-CG2 3.46Å; L122-V126 PolarHBondContact O-N 3.35Å; K123-V126 PolarHBondContact O-N 3.29Å; V126-L128 PolarHBondContact O-N 2.98Å; V126-I129 PolarHBondContact O-N 3.19Å; V126-Q130 HydrophobicContact CG1-CG 4.27Å; V126-Q130 WeakPolarHBondContact O-CB 3.48Å; V126-Q130 VanDerWaalsContact O-CG 3.32Å; V126-Q130 WeakPolarHBondContact O-CG 3.37Å; V126-Q130 PolarHBondContact O-N 3.14Å
127	E	94	Very high	92.1	Very high	108 Å²	108	100.1 Å²	100.1	51%	0.505	49%	0.49	S	S	.	.	H	α-helix	trans	-61.2	-42.2	176	-176.2	-179.5	-175.3	0	0	112.1	K123 K124 I129 Q130 T131	K123-E127 WeakPolarHBondContact O-CB 3.12Å; K123-E127 PolarHBondContact O-N 3.49Å; K124-E127 PolarHBondContact O-N 3.15Å; E127-I129 VanDerWaalsContact C-N 3.31Å; E127-I129 PolarHBondContact O-N 3.48Å; E127-Q130 PolarHBondContact O-N 2.98Å; E127-T131 WeakPolarHBondContact O-CB 3.25Å; E127-T131 WeakPolarHBondContact O-CG2 3.35Å; E127-T131 PolarHBondContact O-N 2.96Å; E127-T131 PolarHBondContact O-OG1 3.09Å
128	L	91.8	Very high	91.5	Very high	69 Å²	69	100.8 Å²	100.8	36%	0.361	50%	0.496	S	S	.	.	H	α-helix	trans	-67.1	-28	174.7	-77	169.5	0	0	0	113.5	K124 E125 V126 T131 H133 M134	K124-L128 WeakPolarHBondContact O-CB 3.42Å; K124-L128 VanDerWaalsContact O-CG 3.26Å; K124-L128 WeakPolarHBondContact O-CG 3.47Å; K124-L128 PolarHBondContact O-N 3.26Å; E125-L128 PolarHBondContact O-N 3.18Å; V126-L128 PolarHBondContact O-N 2.98Å; L128-T131 WeakPolarHBondContact CA-OG1 3.22Å; L128-T131 PolarHBondContact O-OG1 3.01Å; L128-H133 HydrophobicContact CD2-CB 3.99Å; L128-H133 PolarHBondContact O-N 3.04Å; L128-H133 VanDerWaalsContact O-N 3.09Å; L128-M134 HydrophobicContact CB-CE 3.88Å; L128-M134 HydrophobicContact CB-CG 3.9Å; L128-M134 HydrophobicContact CB-SD 4.08Å; L128-M134 HydrophobicContact CD1-CE 4.19Å; L128-M134 HydrophobicContact CD2-CE 4.22Å; L128-M134 HydrophobicContact CG-CE 4.33Å; L128-M134 PolarHBondContact O-N 3.5Å; L128-M134 VanDerWaalsContact O-N 3.1Å
129	I	90.6	Very high	91.1	Very high	96 Å²	96	103 Å²	103	49%	0.492	50%	0.504	S	S	.	.	H	α-helix	trans	-74.6	-48.7	171.1	-67.1	164	0	0	0	110	E125 V126 E127 T131 G132 M134	E125-I129 VanDerWaalsContact O-CG1 3.26Å; E125-I129 WeakPolarHBondContact O-CG1 3.4Å; E125-I129 PolarHBondContact O-N 3.3Å; V126-I129 PolarHBondContact O-N 3.19Å; E127-I129 VanDerWaalsContact C-N 3.31Å; E127-I129 PolarHBondContact O-N 3.48Å; I129-T131 VanDerWaalsContact C-N 3.28Å; I129-T131 PolarHBondContact O-N 3.5Å; I129-G132 PolarHBondContact O-N 3.23Å; I129-M134 HydrophobicContact CG1-CB 4.06Å; I129-M134 HydrophobicContact CG1-CG 3.7Å
130	Q	90.1	Very high	90.7	Very high	156 Å²	156	100.8 Å²	100.8	73%	0.729	50%	0.503	S	S	*	.	H	α-helix	trans	-63	-32.1	-178.2	-74.7	173.9	-18.1	0	0	113.2	V126 E127 G132	V126-Q130 HydrophobicContact CG1-CG 4.27Å; V126-Q130 WeakPolarHBondContact O-CB 3.48Å; V126-Q130 VanDerWaalsContact O-CG 3.32Å; V126-Q130 WeakPolarHBondContact O-CG 3.37Å; V126-Q130 PolarHBondContact O-N 3.14Å; E127-Q130 PolarHBondContact O-N 2.98Å; Q130-G132 PolarHBondContact O-N 2.98Å
131	T	93.5	Very high	90.2	Very high	99 Å²	99	98.4 Å²	98.4	61%	0.607	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	3.1	174.1	51.3	0	0	0	0	113.9	E127 L128 I129 H133	E127-T131 WeakPolarHBondContact O-CB 3.25Å; E127-T131 WeakPolarHBondContact O-CG2 3.35Å; E127-T131 PolarHBondContact O-N 2.96Å; E127-T131 PolarHBondContact O-OG1 3.09Å; L128-T131 WeakPolarHBondContact CA-OG1 3.22Å; L128-T131 PolarHBondContact O-OG1 3.01Å; I129-T131 VanDerWaalsContact C-N 3.28Å; I129-T131 PolarHBondContact O-N 3.5Å; T131-H133 PolarHBondContact O-N 2.76Å; T131-H133 VanDerWaalsContact O-N 3.15Å
132	G	87.5	Confident	89.9	Confident	30 Å²	30	101.1 Å²	101.1	31%	0.309	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	70	1.6	-178.2	0	0	0	0	0	114.7	I129 Q130 M134 D135	I129-G132 PolarHBondContact O-N 3.23Å; Q130-G132 PolarHBondContact O-N 2.98Å; G132-M134 VanDerWaalsContact C-N 3.26Å; G132-M134 PolarHBondContact O-N 3.47Å; G132-D135 WeakPolarHBondContact O-CB 3.24Å; G132-D135 PolarHBondContact O-N 2.98Å
133	H	87.8	Confident	89.7	Confident	104 Å²	104	98.6 Å²	98.6	48%	0.481	50%	0.501	S	S	.	.	H	α-helix	trans	-63.9	-33.2	-177.1	-166.6	-66.7	0	0	0	111.8	L128 T131 D135 S136	L128-H133 HydrophobicContact CD2-CB 3.99Å; L128-H133 PolarHBondContact O-N 3.04Å; L128-H133 VanDerWaalsContact O-N 3.09Å; T131-H133 PolarHBondContact O-N 2.76Å; T131-H133 VanDerWaalsContact O-N 3.15Å; H133-D135 PolarHBondContact O-N 3.01Å; H133-S136 PolarHBondContact O-N 3.07Å; H133-S136 PolarHBondContact O-OG 3.06Å
134	M	85.4	Confident	89.6	Confident	34 Å²	34	98.9 Å²	98.9	17%	0.167	50%	0.504	C	S	.	.	H	α-helix	trans	-70.8	-24.1	177.1	-63.3	-59	83.5	0	0	114.4	L128 I129 G132 S136 Q137 L138	L128-M134 HydrophobicContact CB-CE 3.88Å; L128-M134 HydrophobicContact CB-CG 3.9Å; L128-M134 HydrophobicContact CB-SD 4.08Å; L128-M134 HydrophobicContact CD1-CE 4.19Å; L128-M134 HydrophobicContact CD2-CE 4.22Å; L128-M134 HydrophobicContact CG-CE 4.33Å; L128-M134 PolarHBondContact O-N 3.5Å; L128-M134 VanDerWaalsContact O-N 3.1Å; I129-M134 HydrophobicContact CG1-CB 4.06Å; I129-M134 HydrophobicContact CG1-CG 3.7Å; G132-M134 VanDerWaalsContact C-N 3.26Å; G132-M134 PolarHBondContact O-N 3.47Å; M134-S136 PolarHBondContact O-N 3.47Å; M134-Q137 HydrophobicContact CE-CG 4.44Å; M134-Q137 PolarHBondContact O-N 2.82Å; M134-L138 PolarHBondContact O-N 2.99Å
135	D	86.5	Confident	89.5	Confident	115 Å²	115	99.1 Å²	99.1	62%	0.615	51%	0.509	S	S	*	.	H	α-helix	trans	-63.4	-29.1	177.7	-66.1	-37.8	0	0	0	111.9	G132 H133 Q137	G132-D135 WeakPolarHBondContact O-CB 3.24Å; G132-D135 PolarHBondContact O-N 2.98Å; H133-D135 PolarHBondContact O-N 3.01Å; D135-Q137 VanDerWaalsContact C-N 3.32Å; D135-Q137 PolarHBondContact O-N 2.85Å
136	S	84.6	Confident	89.5	Confident	79 Å²	79	98.2 Å²	98.2	55%	0.552	51%	0.51	S	S	*	.	H	α-helix	trans	-65.3	-34	172.7	75.5	0	0	0	0	112.8	H133 M134	H133-S136 PolarHBondContact O-N 3.07Å; H133-S136 PolarHBondContact O-OG 3.06Å; M134-S136 PolarHBondContact O-N 3.47Å
137	Q	84.9	Confident	89.5	Confident	86 Å²	86	100.5 Å²	100.5	40%	0.402	52%	0.516	S	S	.	.	H	α-helix	trans	-94.6	-13.9	-175.5	-54.3	-160.8	-87.1	0	0	113.3	M134 D135 K139 D140 L141	M134-Q137 HydrophobicContact CE-CG 4.44Å; M134-Q137 PolarHBondContact O-N 2.82Å; D135-Q137 VanDerWaalsContact C-N 3.32Å; D135-Q137 PolarHBondContact O-N 2.85Å; Q137-K139 PolarHBondContact O-N 2.92Å; Q137-K139 VanDerWaalsContact O-N 3.1Å; Q137-D140 PolarHBondContact O-N 2.9Å; Q137-L141 HydrophobicContact CB-CD1 4.41Å; Q137-L141 PolarHBondContact O-N 3.25Å
138	L	85.2	Confident	89.6	Confident	106 Å²	106	100.9 Å²	100.9	56%	0.555	52%	0.516	S	S	*	.	H	α-helix	trans	-53.9	-33.9	-176.2	-176.3	62.1	0	0	0	113.7	M134 W142	M134-L138 PolarHBondContact O-N 2.99Å; L138-W142 VanDerWaalsContact O-CB 3.31Å; L138-W142 WeakPolarHBondContact O-CB 3.45Å; L138-W142 PolarHBondContact O-N 3.48Å
139	K	87.6	Confident	89.7	Confident	169 Å²	169	104.6 Å²	104.6	74%	0.735	53%	0.529	S	S	*	.	H	α-helix	trans	-67.4	-42.2	177.1	-68.9	172.4	-176.4	164	0	112.5	Q137 W142 A143	Q137-K139 PolarHBondContact O-N 2.92Å; Q137-K139 VanDerWaalsContact O-N 3.1Å; K139-W142 PolarHBondContact O-N 3.14Å; K139-A143 PolarHBondContact O-N 3.24Å
140	D	89.1	Confident	89.9	Confident	118 Å²	118	106 Å²	106	63%	0.631	53%	0.531	S	S	*	.	H	α-helix	trans	-74.8	-40.1	-178.3	-62.1	-25.2	0	0	0	110.4	Q137 W142 A143 E144	Q137-D140 PolarHBondContact O-N 2.9Å; D140-W142 VanDerWaalsContact C-N 3.33Å; D140-W142 PolarHBondContact O-N 3.41Å; D140-A143 WeakPolarHBondContact O-CB 3.38Å; D140-A143 PolarHBondContact O-N 3.3Å; D140-E144 PolarHBondContact O-N 3Å
141	L	86.6	Confident	90.2	Very high	79 Å²	79	103.7 Å²	103.7	41%	0.414	52%	0.52	S	S	.	.	H	α-helix	trans	-58.9	-42.3	171.1	-68.7	170.6	0	0	0	111.9	Q137 E144 I145	Q137-L141 HydrophobicContact CB-CD1 4.41Å; Q137-L141 PolarHBondContact O-N 3.25Å; L141-E144 PolarHBondContact O-N 3.25Å; L141-I145 WeakPolarHBondContact O-CB 3.48Å; L141-I145 WeakPolarHBondContact O-CD1 3.31Å; L141-I145 VanDerWaalsContact O-CG1 3.25Å; L141-I145 WeakPolarHBondContact O-CG1 3.32Å; L141-I145 PolarHBondContact O-N 3.08Å
142	W	89.2	Confident	90.2	Very high	183 Å²	183	104 Å²	104	69%	0.693	52%	0.515	S	S	*	.	H	α-helix	trans	-67.6	-36.1	176.8	-169.3	86.6	0	0	0	112.6	L138 K139 D140 T146	L138-W142 VanDerWaalsContact O-CB 3.31Å; L138-W142 WeakPolarHBondContact O-CB 3.45Å; L138-W142 PolarHBondContact O-N 3.48Å; K139-W142 PolarHBondContact O-N 3.14Å; D140-W142 VanDerWaalsContact C-N 3.33Å; D140-W142 PolarHBondContact O-N 3.41Å; W142-T146 WeakPolarHBondContact O-CB 3.46Å; W142-T146 PolarHBondContact O-N 2.8Å; W142-T146 PolarHBondContact O-OG1 2.87Å
143	A	92.4	Very high	90.6	Very high	50 Å²	50	109.2 Å²	109.2	41%	0.413	53%	0.531	S	S	.	.	H	α-helix	trans	-64.9	-43.7	171.8	0	0	0	0	0	111.8	K139 D140 T146 Q147	K139-A143 PolarHBondContact O-N 3.24Å; D140-A143 WeakPolarHBondContact O-CB 3.38Å; D140-A143 PolarHBondContact O-N 3.3Å; A143-T146 PolarHBondContact O-N 3.29Å; A143-Q147 WeakPolarHBondContact O-CB 3.26Å; A143-Q147 PolarHBondContact O-N 3.3Å
144	E	93.6	Very high	90.9	Very high	126 Å²	126	108.7 Å²	108.7	59%	0.589	53%	0.529	S	S	*	.	H	α-helix	trans	-62.4	-47.7	176.2	-171.4	-176.7	175.4	0	0	111.7	D140 L141 T146 Q147 K148	D140-E144 PolarHBondContact O-N 3Å; L141-E144 PolarHBondContact O-N 3.25Å; E144-T146 VanDerWaalsContact C-N 3.26Å; E144-T146 PolarHBondContact O-N 2.72Å; E144-Q147 PolarHBondContact O-N 2.96Å; E144-K148 WeakPolarHBondContact O-CB 3.5Å; E144-K148 PolarHBondContact O-N 3.33Å
145	I	91.8	Very high	91.4	Very high	113 Å²	113	111.8 Å²	111.8	58%	0.579	54%	0.543	S	S	*	.	H	α-helix	trans	-57.1	-42.1	175.9	-70.4	164	0	0	0	110.7	L141 K149	L141-I145 WeakPolarHBondContact O-CB 3.48Å; L141-I145 WeakPolarHBondContact O-CD1 3.31Å; L141-I145 VanDerWaalsContact O-CG1 3.25Å; L141-I145 WeakPolarHBondContact O-CG1 3.32Å; L141-I145 PolarHBondContact O-N 3.08Å; I145-K149 VanDerWaalsContact O-CB 3.31Å; I145-K149 WeakPolarHBondContact O-CB 3.3Å; I145-K149 PolarHBondContact O-N 3.25Å
146	T	93.6	Very high	91.7	Very high	70 Å²	70	108.6 Å²	108.6	43%	0.429	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-43.4	177.9	-59.1	0	0	0	0	111.7	W142 A143 E144 K150	W142-T146 WeakPolarHBondContact O-CB 3.46Å; W142-T146 PolarHBondContact O-N 2.8Å; W142-T146 PolarHBondContact O-OG1 2.87Å; A143-T146 PolarHBondContact O-N 3.29Å; E144-T146 VanDerWaalsContact C-N 3.26Å; E144-T146 PolarHBondContact O-N 2.72Å; T146-K150 PolarHBondContact O-N 3.04Å; T146-K150 VanDerWaalsContact O-N 3.14Å
147	Q	94.5	Very high	92.2	Very high	121 Å²	121	109.1 Å²	109.1	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-65.9	-44.6	177	178.2	172.3	-29.2	0	0	111.9	A143 E144 K150 Q151	A143-Q147 WeakPolarHBondContact O-CB 3.26Å; A143-Q147 PolarHBondContact O-N 3.3Å; E144-Q147 PolarHBondContact O-N 2.96Å; Q147-K150 WeakPolarHBondContact O-CB 3.37Å; Q147-K150 PolarHBondContact O-N 2.89Å; Q147-Q151 WeakPolarHBondContact O-CG 3.48Å; Q147-Q151 PolarHBondContact O-N 3.16Å
148	K	94.6	Very high	92.6	Very high	116 Å²	116	110.7 Å²	110.7	50%	0.504	53%	0.534	S	S	.	.	H	α-helix	trans	-62.4	-46.2	177.9	179.3	174.5	173.4	178.1	0	111.4	E144 K150 Q151 E152	E144-K148 WeakPolarHBondContact O-CB 3.5Å; E144-K148 PolarHBondContact O-N 3.33Å; K148-K150 VanDerWaalsContact C-N 3.27Å; K148-K150 PolarHBondContact O-N 3.21Å; K148-Q151 WeakPolarHBondContact O-CB 3.34Å; K148-Q151 PolarHBondContact O-N 2.93Å; K148-E152 WeakPolarHBondContact CE-OE1 3.41Å; K148-E152 WeakPolarHBondContact O-CG 3.44Å; K148-E152 PolarHBondContact O-N 3.02Å
149	K	94.6	Very high	93.1	Very high	147 Å²	147	111 Å²	111	64%	0.639	53%	0.53	S	S	*	.	H	α-helix	trans	-57	-40.8	174.9	-177.1	177.2	179.2	179.8	0	112	I145 E152 E153	I145-K149 VanDerWaalsContact O-CB 3.31Å; I145-K149 WeakPolarHBondContact O-CB 3.3Å; I145-K149 PolarHBondContact O-N 3.25Å; K149-E152 PolarHBondContact O-N 2.94Å; K149-E153 WeakPolarHBondContact O-CB 3.39Å; K149-E153 PolarHBondContact O-N 3.44Å
150	K	95.4	Very high	93.4	Very high	126 Å²	126	112 Å²	112	55%	0.548	53%	0.53	S	S	.	.	H	α-helix	trans	-64.9	-42.1	174.5	-179.1	-176.8	166.6	-173.7	0	112.1	T146 Q147 K148 E153 E154	T146-K150 PolarHBondContact O-N 3.04Å; T146-K150 VanDerWaalsContact O-N 3.14Å; Q147-K150 WeakPolarHBondContact O-CB 3.37Å; Q147-K150 PolarHBondContact O-N 2.89Å; K148-K150 VanDerWaalsContact C-N 3.27Å; K148-K150 PolarHBondContact O-N 3.21Å; K150-E153 PolarHBondContact O-N 3.03Å; K150-E154 WeakPolarHBondContact CE-OE1 3.5Å; K150-E154 IonicContact NZ-OE1 3.34Å; K150-E154 WeakPolarHBondContact O-CB 3.42Å; K150-E154 WeakPolarHBondContact O-CG 3.41Å; K150-E154 PolarHBondContact O-N 3.45Å
151	Q	94.8	Very high	93.8	Very high	107 Å²	107	112 Å²	112	50%	0.5	52%	0.524	S	S	.	.	H	α-helix	trans	-63.6	-41.9	176	-71.7	173.5	-17.6	0	0	112	Q147 K148 E154 E155	Q147-Q151 WeakPolarHBondContact O-CG 3.48Å; Q147-Q151 PolarHBondContact O-N 3.16Å; K148-Q151 WeakPolarHBondContact O-CB 3.34Å; K148-Q151 PolarHBondContact O-N 2.93Å; Q151-E154 PolarHBondContact O-N 3.41Å; Q151-E155 WeakPolarHBondContact O-CB 3.44Å; Q151-E155 PolarHBondContact O-N 3.41Å
152	E	94.6	Very high	94.2	Very high	106 Å²	106	111 Å²	111	50%	0.495	53%	0.528	S	S	.	.	H	α-helix	trans	-64.7	-37.8	175.4	-71	174	-177.6	0	0	111.9	K148 K149 A156	K148-E152 WeakPolarHBondContact CE-OE1 3.41Å; K148-E152 WeakPolarHBondContact O-CG 3.44Å; K148-E152 PolarHBondContact O-N 3.02Å; K149-E152 PolarHBondContact O-N 2.94Å; E152-A156 WeakPolarHBondContact O-CB 3.37Å; E152-A156 PolarHBondContact O-N 2.84Å
153	E	95	Very high	94.4	Very high	139 Å²	139	106.7 Å²	106.7	65%	0.65	52%	0.521	S	S	*	.	H	α-helix	trans	-66.4	-45	173.2	-176	169.6	-165.5	0	0	112.2	K149 K150 E155 A156 E157	K149-E153 WeakPolarHBondContact O-CB 3.39Å; K149-E153 PolarHBondContact O-N 3.44Å; K150-E153 PolarHBondContact O-N 3.03Å; E153-E155 PolarHBondContact O-N 2.94Å; E153-A156 PolarHBondContact O-N 3.39Å; E153-E157 WeakPolarHBondContact O-CB 3.26Å; E153-E157 PolarHBondContact O-N 3.44Å
154	E	95.6	Very high	94.6	Very high	93 Å²	93	108.6 Å²	108.6	44%	0.435	52%	0.522	S	S	.	.	H	α-helix	trans	-63.8	-38.6	175.6	-74.6	178.7	-178	0	0	112	K150 Q151 Q158	K150-E154 WeakPolarHBondContact CE-OE1 3.5Å; K150-E154 IonicContact NZ-OE1 3.34Å; K150-E154 WeakPolarHBondContact O-CB 3.42Å; K150-E154 WeakPolarHBondContact O-CG 3.41Å; K150-E154 PolarHBondContact O-N 3.45Å; Q151-E154 PolarHBondContact O-N 3.41Å; E154-Q158 WeakPolarHBondContact O-CB 3.35Å; E154-Q158 VanDerWaalsContact O-CG 3.24Å; E154-Q158 WeakPolarHBondContact O-CG 3.45Å; E154-Q158 PolarHBondContact O-N 2.74Å; E154-Q158 PolarHBondContact O-NE2 2.68Å
155	E	94.8	Very high	94.6	Very high	98 Å²	98	109.1 Å²	109.1	46%	0.458	53%	0.526	S	S	.	.	H	α-helix	trans	-69.5	-40.5	175.1	-158.9	-150.9	177.1	0	0	111.5	Q151 E153 Q158 K159	Q151-E155 WeakPolarHBondContact O-CB 3.44Å; Q151-E155 PolarHBondContact O-N 3.41Å; E153-E155 PolarHBondContact O-N 2.94Å; E155-Q158 PolarHBondContact O-N 3.42Å; E155-K159 HydrophobicContact CG-CD 4.49Å; E155-K159 WeakPolarHBondContact O-CB 3.43Å; E155-K159 VanDerWaalsContact O-CG 3.31Å; E155-K159 WeakPolarHBondContact O-CG 3.31Å; E155-K159 PolarHBondContact O-N 3.1Å; E155-K159 WeakPolarHBondContact OE1-CE 3.5Å; E155-K159 IonicContact OE1-NZ 3.56Å; E155-K159 PolarHBondContact OE1-NZ 3Å; E155-K159 IonicContact OE2-NZ 3.87Å; E155-K159 PolarHBondContact OE2-NZ 3.1Å
156	A	92.6	Very high	94.7	Very high	48 Å²	48	105.9 Å²	105.9	40%	0.397	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-40.3	174.3	0	0	0	0	0	111.7	E152 E153 K159 R160	E152-A156 WeakPolarHBondContact O-CB 3.37Å; E152-A156 PolarHBondContact O-N 2.84Å; E153-A156 PolarHBondContact O-N 3.39Å; A156-K159 PolarHBondContact O-N 3.02Å; A156-R160 WeakPolarHBondContact O-CG 3.36Å; A156-R160 PolarHBondContact O-N 3.23Å
157	E	95.1	Very high	94.7	Very high	90 Å²	90	108.1 Å²	108.1	42%	0.421	52%	0.517	S	S	.	.	H	α-helix	trans	-66.7	-40	175.6	-155	-142.6	-178.2	0	0	111.5	E153 R160 K161	E153-E157 WeakPolarHBondContact O-CB 3.26Å; E153-E157 PolarHBondContact O-N 3.44Å; E157-R160 PolarHBondContact O-N 3.44Å; E157-K161 HydrophobicContact CG-CD 4.5Å; E157-K161 WeakPolarHBondContact O-CB 3.48Å; E157-K161 WeakPolarHBondContact O-CG 3.25Å; E157-K161 PolarHBondContact O-N 3.34Å; E157-K161 WeakPolarHBondContact OE1-CE 3.48Å; E157-K161 IonicContact OE1-NZ 2.75Å; E157-K161 PolarHBondContact OE1-NZ 2.88Å; E157-K161 WeakPolarHBondContact OE2-CE 3.47Å; E157-K161 IonicContact OE2-NZ 2.65Å; E157-K161 PolarHBondContact OE2-NZ 3.21Å
158	Q	94.9	Very high	94.6	Very high	120 Å²	120	108 Å²	108	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-61.4	-45.8	171.4	-75.2	172.8	64.3	0	0	112.1	E154 E155 R160 K161 A162	E154-Q158 WeakPolarHBondContact O-CB 3.35Å; E154-Q158 VanDerWaalsContact O-CG 3.24Å; E154-Q158 WeakPolarHBondContact O-CG 3.45Å; E154-Q158 PolarHBondContact O-N 2.74Å; E154-Q158 PolarHBondContact O-NE2 2.68Å; E155-Q158 PolarHBondContact O-N 3.42Å; Q158-R160 VanDerWaalsContact C-N 3.31Å; Q158-R160 PolarHBondContact O-N 2.92Å; Q158-K161 PolarHBondContact O-N 2.85Å; Q158-A162 WeakPolarHBondContact O-CB 3.33Å; Q158-A162 PolarHBondContact O-N 2.93Å
159	K	94.6	Very high	94.5	Very high	111 Å²	111	104.6 Å²	104.6	48%	0.483	51%	0.511	S	S	.	.	H	α-helix	trans	-58.9	-40.3	174.4	-75.3	166.2	179.7	164.6	0	111.7	E155 A156 T163	E155-K159 HydrophobicContact CG-CD 4.49Å; E155-K159 WeakPolarHBondContact O-CB 3.43Å; E155-K159 VanDerWaalsContact O-CG 3.31Å; E155-K159 WeakPolarHBondContact O-CG 3.31Å; E155-K159 PolarHBondContact O-N 3.1Å; E155-K159 WeakPolarHBondContact OE1-CE 3.5Å; E155-K159 IonicContact OE1-NZ 3.56Å; E155-K159 PolarHBondContact OE1-NZ 3Å; E155-K159 IonicContact OE2-NZ 3.87Å; E155-K159 PolarHBondContact OE2-NZ 3.1Å; A156-K159 PolarHBondContact O-N 3.02Å; K159-T163 WeakPolarHBondContact O-CB 3.37Å; K159-T163 PolarHBondContact O-N 3Å; K159-T163 PolarHBondContact O-OG1 2.88Å
160	R	94.5	Very high	94.2	Very high	192 Å²	192	104.1 Å²	104.1	73%	0.725	51%	0.505	S	S	*	.	H	α-helix	trans	-66.3	-47	173.9	-71.8	-179.6	73.3	-144.6	0.7	112.1	A156 E157 Q158 A162 T163 E164	A156-R160 WeakPolarHBondContact O-CG 3.36Å; A156-R160 PolarHBondContact O-N 3.23Å; E157-R160 PolarHBondContact O-N 3.44Å; Q158-R160 VanDerWaalsContact C-N 3.31Å; Q158-R160 PolarHBondContact O-N 2.92Å; R160-A162 PolarHBondContact O-N 3.21Å; R160-T163 PolarHBondContact O-N 3.29Å; R160-E164 WeakPolarHBondContact O-CB 3.42Å; R160-E164 PolarHBondContact O-N 2.97Å
161	K	96	Very high	93.8	Very high	116 Å²	116	101 Å²	101	50%	0.504	49%	0.492	S	S	.	.	H	α-helix	trans	-59.5	-43.7	176.5	-76.6	168.5	173.9	167.7	0	112	E157 Q158 E164 M165	E157-K161 HydrophobicContact CG-CD 4.5Å; E157-K161 WeakPolarHBondContact O-CB 3.48Å; E157-K161 WeakPolarHBondContact O-CG 3.25Å; E157-K161 PolarHBondContact O-N 3.34Å; E157-K161 WeakPolarHBondContact OE1-CE 3.48Å; E157-K161 IonicContact OE1-NZ 2.75Å; E157-K161 PolarHBondContact OE1-NZ 2.88Å; E157-K161 WeakPolarHBondContact OE2-CE 3.47Å; E157-K161 IonicContact OE2-NZ 2.65Å; E157-K161 PolarHBondContact OE2-NZ 3.21Å; Q158-K161 PolarHBondContact O-N 2.85Å; K161-E164 PolarHBondContact O-N 2.88Å; K161-M165 VanDerWaalsContact O-CB 3.29Å; K161-M165 WeakPolarHBondContact O-CB 3.46Å; K161-M165 PolarHBondContact O-N 2.95Å
162	A	95.3	Very high	93.4	Very high	60 Å²	60	98.5 Å²	98.5	50%	0.496	49%	0.489	S	S	.	.	H	α-helix	trans	-65.2	-41.3	175.6	0	0	0	0	0	112.2	Q158 R160 M165 A166	Q158-A162 WeakPolarHBondContact O-CB 3.33Å; Q158-A162 PolarHBondContact O-N 2.93Å; R160-A162 PolarHBondContact O-N 3.21Å; A162-M165 PolarHBondContact O-N 3.24Å; A162-A166 VanDerWaalsContact O-CB 3.27Å; A162-A166 WeakPolarHBondContact O-CB 3.47Å; A162-A166 PolarHBondContact O-N 3.32Å
163	T	94.5	Very high	92.7	Very high	91 Å²	91	100.3 Å²	100.3	56%	0.558	50%	0.5	S	S	*	.	H	α-helix	trans	-63.7	-43.8	176.9	-60.6	0	0	0	0	111.8	K159 R160 A166 Y167	K159-T163 WeakPolarHBondContact O-CB 3.37Å; K159-T163 PolarHBondContact O-N 3Å; K159-T163 PolarHBondContact O-OG1 2.88Å; R160-T163 PolarHBondContact O-N 3.29Å; T163-A166 PolarHBondContact O-N 2.79Å; T163-Y167 WeakPolarHBondContact O-CB 3.46Å; T163-Y167 PolarHBondContact O-N 3.17Å
164	E	95.1	Very high	91.8	Very high	90 Å²	90	100.7 Å²	100.7	42%	0.421	50%	0.499	S	S	.	.	H	α-helix	trans	-67.7	-44.6	176.9	-179.5	53.9	-149.4	0	0	111.6	R160 K161 A166 Y167 Q168	R160-E164 WeakPolarHBondContact O-CB 3.42Å; R160-E164 PolarHBondContact O-N 2.97Å; K161-E164 PolarHBondContact O-N 2.88Å; E164-A166 VanDerWaalsContact C-N 3.32Å; E164-A166 PolarHBondContact O-N 3.06Å; E164-Y167 CarbonylContact O-C 3.54Å; E164-Y167 WeakPolarHBondContact O-CA 3.5Å; E164-Y167 WeakPolarHBondContact O-CB 3.42Å; E164-Y167 PolarHBondContact O-N 3.14Å; E164-Q168 WeakPolarHBondContact O-CG 3.45Å; E164-Q168 PolarHBondContact O-N 2.85Å; E164-Q168 WeakPolarHBondContact OE1-CG 3.22Å; E164-Q168 PolarHBondContact OE1-NE2 3.31Å
165	M	95.3	Very high	90.6	Very high	138 Å²	138	102.5 Å²	102.5	68%	0.68	51%	0.512	S	S	*	.	H	α-helix	trans	-58.9	-43.5	174.1	-173.3	-175.2	-65.6	0	0	111.5	K161 A162 Y167 Q168 A169	K161-M165 VanDerWaalsContact O-CB 3.29Å; K161-M165 WeakPolarHBondContact O-CB 3.46Å; K161-M165 PolarHBondContact O-N 2.95Å; A162-M165 PolarHBondContact O-N 3.24Å; M165-Y167 VanDerWaalsContact C-N 3.33Å; M165-Y167 PolarHBondContact O-N 2.89Å; M165-Q168 PolarHBondContact O-N 3.5Å; M165-A169 WeakPolarHBondContact O-CB 3.41Å; M165-A169 PolarHBondContact O-N 3.34Å
166	A	92.5	Very high	89.2	Confident	44 Å²	44	102 Å²	102	36%	0.364	52%	0.516	S	S	.	.	H	α-helix	trans	-66.1	-33.5	174.8	0	0	0	0	0	112.3	A162 T163 E164 R170	A162-A166 VanDerWaalsContact O-CB 3.27Å; A162-A166 WeakPolarHBondContact O-CB 3.47Å; A162-A166 PolarHBondContact O-N 3.32Å; T163-A166 PolarHBondContact O-N 2.79Å; E164-A166 VanDerWaalsContact C-N 3.32Å; E164-A166 PolarHBondContact O-N 3.06Å; A166-R170 WeakPolarHBondContact O-CB 3.32Å; A166-R170 VanDerWaalsContact O-CG 3.29Å; A166-R170 WeakPolarHBondContact O-CG 3.03Å; A166-R170 PolarHBondContact O-N 2.61Å; A166-R170 PolarHBondContact O-NE 3.22Å
167	Y	93.9	Very high	87.5	Confident	118 Å²	118	105.6 Å²	105.6	46%	0.463	54%	0.535	S	S	.	.	H	α-helix	trans	-65.6	-50.4	171.7	176.9	-110.4	0	0	0	111.3	T163 E164 M165 A169 R170 Q171	T163-Y167 WeakPolarHBondContact O-CB 3.46Å; T163-Y167 PolarHBondContact O-N 3.17Å; E164-Y167 CarbonylContact O-C 3.54Å; E164-Y167 WeakPolarHBondContact O-CA 3.5Å; E164-Y167 WeakPolarHBondContact O-CB 3.42Å; E164-Y167 PolarHBondContact O-N 3.14Å; M165-Y167 VanDerWaalsContact C-N 3.33Å; M165-Y167 PolarHBondContact O-N 2.89Å; Y167-A169 PolarHBondContact O-N 3.35Å; Y167-R170 CarbonylContact O-C 3.57Å; Y167-R170 WeakPolarHBondContact O-CB 2.86Å; Y167-R170 PolarHBondContact O-N 2.98Å; Y167-R170 VanDerWaalsContact O-N 3.1Å; Y167-Q171 HydrophobicContact CD1-CG 4.44Å; Y167-Q171 HydrophobicContact CD2-CG 4.45Å; Y167-Q171 HydrophobicContact CE1-CG 4.12Å; Y167-Q171 HydrophobicContact CE2-CG 4.12Å; Y167-Q171 WeakPolarHBondContact O-CG 3.42Å; Y167-Q171 PolarHBondContact O-N 2.91Å; Y167-Q171 PolarHBondContact OH-NE2 3.48Å
168	Q	93.5	Very high	85.7	Confident	117 Å²	117	111.1 Å²	111.1	55%	0.547	56%	0.558	S	S	.	*	H	α-helix	trans	-60.4	-42.2	178	-67.8	-177.2	19.1	0	0	112.4	E164 M165 R170 Q171 A172	E164-Q168 WeakPolarHBondContact O-CG 3.45Å; E164-Q168 PolarHBondContact O-N 2.85Å; E164-Q168 WeakPolarHBondContact OE1-CG 3.22Å; E164-Q168 PolarHBondContact OE1-NE2 3.31Å; M165-Q168 PolarHBondContact O-N 3.5Å; Q168-R170 VanDerWaalsContact C-N 3.34Å; Q168-R170 PolarHBondContact O-N 2.76Å; Q168-Q171 PolarHBondContact O-N 2.77Å; Q168-Q171 VanDerWaalsContact O-N 3.08Å; Q168-A172 PolarHBondContact O-N 3.23Å
169	A	91.4	Very high	83.9	Confident	46 Å²	46	117.2 Å²	117.2	38%	0.38	58%	0.575	S	S	.	*	H	α-helix	trans	-58.6	-43.5	173.2	0	0	0	0	0	112.1	M165 Y167 Q171 A172 M173	M165-A169 WeakPolarHBondContact O-CB 3.41Å; M165-A169 PolarHBondContact O-N 3.34Å; Y167-A169 PolarHBondContact O-N 3.35Å; A169-Q171 VanDerWaalsContact C-N 3.29Å; A169-Q171 PolarHBondContact O-N 3.39Å; A169-A172 PolarHBondContact O-N 3.37Å; A169-M173 WeakPolarHBondContact O-CG 3.02Å; A169-M173 PolarHBondContact O-N 3.27Å
170	R	88.5	Confident	81.7	Confident	136 Å²	136	119.4 Å²	119.4	51%	0.513	59%	0.592	S	S	.	*	H	α-helix	trans	-67.3	-24.7	175.1	-75	174.3	-70.3	-166.1	-0.6	113.4	A166 Y167 Q168 K174	A166-R170 WeakPolarHBondContact O-CB 3.32Å; A166-R170 VanDerWaalsContact O-CG 3.29Å; A166-R170 WeakPolarHBondContact O-CG 3.03Å; A166-R170 PolarHBondContact O-N 2.61Å; A166-R170 PolarHBondContact O-NE 3.22Å; Y167-R170 CarbonylContact O-C 3.57Å; Y167-R170 WeakPolarHBondContact O-CB 2.86Å; Y167-R170 PolarHBondContact O-N 2.98Å; Y167-R170 VanDerWaalsContact O-N 3.1Å; Q168-R170 VanDerWaalsContact C-N 3.34Å; Q168-R170 PolarHBondContact O-N 2.76Å; R170-K174 WeakPolarHBondContact O-CE 3.26Å; R170-K174 WeakPolarHBondContact O-CG 3.48Å
171	Q	87.6	Confident	79.6	Confident	61 Å²	61	115.9 Å²	115.9	29%	0.285	59%	0.594	S	S	.	*	H	α-helix	trans	-81	-39.7	172.4	-62.1	-71	72	0	0	111.4	Y167 Q168 A169 M173 K174 N175	Y167-Q171 HydrophobicContact CD1-CG 4.44Å; Y167-Q171 HydrophobicContact CD2-CG 4.45Å; Y167-Q171 HydrophobicContact CE1-CG 4.12Å; Y167-Q171 HydrophobicContact CE2-CG 4.12Å; Y167-Q171 WeakPolarHBondContact O-CG 3.42Å; Y167-Q171 PolarHBondContact O-N 2.91Å; Y167-Q171 PolarHBondContact OH-NE2 3.48Å; Q168-Q171 PolarHBondContact O-N 2.77Å; Q168-Q171 VanDerWaalsContact O-N 3.08Å; A169-Q171 VanDerWaalsContact C-N 3.29Å; A169-Q171 PolarHBondContact O-N 3.39Å; Q171-M173 VanDerWaalsContact C-N 3.34Å; Q171-M173 PolarHBondContact O-N 3.47Å; Q171-K174 WeakPolarHBondContact O-CB 3.42Å; Q171-K174 PolarHBondContact O-N 2.88Å; Q171-K174 VanDerWaalsContact O-N 3.07Å; Q171-N175 PolarHBondContact O-N 3.17Å; Q171-N175 VanDerWaalsContact O-N 3.16Å
172	A	85.4	Confident	77	Confident	54 Å²	54	116.2 Å²	116.2	45%	0.446	61%	0.611	S	S	.	*	H	α-helix	trans	-57.7	-45.4	174.2	0	0	0	0	0	111.7	Q168 A169 K174 N175 T176	Q168-A172 PolarHBondContact O-N 3.23Å; A169-A172 PolarHBondContact O-N 3.37Å; A172-K174 PolarHBondContact O-N 2.84Å; A172-N175 PolarHBondContact O-N 3.33Å; A172-T176 PolarHBondContact O-N 3.47Å
173	M	79.5	Confident	74.5	Confident	145 Å²	145	119 Å²	119	71%	0.714	62%	0.621	S	S	*	*	H	α-helix	trans	-62.6	-20.8	175.7	-69.2	177.4	-177.8	0	0	114.6	A169 Q171 T176	A169-M173 WeakPolarHBondContact O-CG 3.02Å; A169-M173 PolarHBondContact O-N 3.27Å; Q171-M173 VanDerWaalsContact C-N 3.34Å; Q171-M173 PolarHBondContact O-N 3.47Å; M173-T176 PolarHBondContact O-OG1 3.11Å; M173-T176 VanDerWaalsContact O-OG1 3.14Å
174	K	77.1	Confident	72.1	Confident	146 Å²	146	120.8 Å²	120.8	64%	0.635	63%	0.632	S	S	*	*	H	α-helix	trans	-84.7	-28.5	172.8	-66	169.7	-164.3	168.9	0	112.3	R170 Q171 A172	R170-K174 WeakPolarHBondContact O-CE 3.26Å; R170-K174 WeakPolarHBondContact O-CG 3.48Å; Q171-K174 WeakPolarHBondContact O-CB 3.42Å; Q171-K174 PolarHBondContact O-N 2.88Å; Q171-K174 VanDerWaalsContact O-N 3.07Å; A172-K174 PolarHBondContact O-N 2.84Å
175	N	71.3	Confident	69.3	Low	132 Å²	132	122.8 Å²	122.8	71%	0.706	65%	0.65	S	S	*	*	H	α-helix	trans	-91.5	-15.8	-175.7	-66.5	-11.9	0	0	0	113.2	Q171 A172	Q171-N175 PolarHBondContact O-N 3.17Å; Q171-N175 VanDerWaalsContact O-N 3.16Å; A172-N175 PolarHBondContact O-N 3.33Å
176	T	64	Low	66.6	Low	88 Å²	88	127.3 Å²	127.3	54%	0.54	66%	0.66	S	S	.	*	S	Bend	trans	-63.1	126.2	170.1	43.5	0	0	0	0	111.3	A172 M173 K178	A172-T176 PolarHBondContact O-N 3.47Å; M173-T176 PolarHBondContact O-OG1 3.11Å; M173-T176 VanDerWaalsContact O-OG1 3.14Å; T176-K178 PolarHBondContact O-N 3.47Å
177	P	58.3	Low	64	Low	123 Å²	123	130.6 Å²	130.6	80%	0.799	68%	0.68	S	S	*	*			trans	-58.7	132.3	178.9	-26	35	0	0	0	112.6	R179	P177-R179 PolarHBondContact O-N 3.43Å
178	K	55.7	Low	62.1	Low	205 Å²	205	130.6 Å²	130.6	89%	0.891	69%	0.694	S	S	*	*			trans	-65.2	95.9	176.7	-67.6	-179.6	-179.3	177.6	0	110.4	T176 L180	T176-K178 PolarHBondContact O-N 3.47Å; K178-L180 PolarHBondContact O-N 3.1Å
179	R	57.1	Low	59.3	Low	248 Å²	248	133.4 Å²	133.4	94%	0.936	71%	0.712	S	S	*	*			trans	-66.2	119.8	173.7	-149.8	173.8	-164.8	163.4	4	108.7	P177	P177-R179 PolarHBondContact O-N 3.43Å
180	L	49.9	Very low	56.4	Low	157 Å²	157	134.8 Å²	134.8	82%	0.822	73%	0.731	S	S	*	*			trans	-63.3	143.8	-179.1	-70.4	167.7	0	0	0	110.8	K178 S182	K178-L180 PolarHBondContact O-N 3.1Å; L180-S182 PolarHBondContact O-N 3.31Å; L180-S182 VanDerWaalsContact O-N 3.13Å
181	P	50	Low	53.7	Low	119 Å²	119	133.3 Å²	133.3	77%	0.773	75%	0.748	S	S	*	*			trans	-71.4	107	177.3	29	-33.3	0	0	0	110.3
182	S	41.3	Very low	51.3	Low	123 Å²	123	135.7 Å²	135.7	86%	0.86	77%	0.772	S	S	*	*			trans	-79.9	146.4	169.7	-164.8	0	0	0	0	110.5	L180	L180-S182 PolarHBondContact O-N 3.31Å; L180-S182 VanDerWaalsContact O-N 3.13Å
183	V	42.9	Very low	49.8	Very low	118 Å²	118	138.9 Å²	138.9	72%	0.715	79%	0.787	S	S	*	*			trans	-105.7	139.5	-168.4	169.1	0	0	0	0	111.3
184	T	43.4	Very low	47.5	Very low	129 Å²	129	137.7 Å²	137.7	79%	0.791	79%	0.793	S	S	*	*			trans	63.3	163	175.4	56	0	0	0	0	115.5
185	V	37	Very low	45.3	Very low	132 Å²	132	136.3 Å²	136.3	80%	0.8	80%	0.797	S	S	*	*			cis	-134.2	176.4	18.6	-177.4	0	0	0	0	111.2
186	R	38.1	Very low	43.7	Very low	233 Å²	233	137.7 Å²	137.7	88%	0.879	80%	0.799	S	S	*	*			trans	-50.2	160.6	177.8	-68.8	172	162.1	139.9	-8.1	117.2
187	S	37.6	Very low	42.2	Very low	113 Å²	113	139.9 Å²	139.9	79%	0.79	81%	0.808	S	S	*	*			trans	-54	173.1	162	-14	0	0	0	0	114.4
188	P	53.3	Low	41.1	Very low	117 Å²	117	138 Å²	138	76%	0.76	80%	0.803	S	S	*	*				-149.6	-166.4	50	44.1	-22.2	0	0	0	118.3
189	L	36	Very low	40.1	Very low	176 Å²	176	137 Å²	137	92%	0.921	80%	0.801	S	S	*	*			trans	-36	155.7	174	-73.1	55.5	0	0	0	117.7
190	G	29.7	Very low	39.1	Very low	75 Å²	75	128.7 Å²	128.7	77%	0.773	79%	0.786	S	S	*	*			trans	175	85.5	159.2	0	0	0	0	0	118.8
191	A	31.9	Very low	38.2	Very low	106 Å²	106	128.4 Å²	128.4	88%	0.876	79%	0.785	S	S	*	*			trans	50.4	144.2	146.3	0	0	0	0	0	124.6
192	S	37.3	Very low	37.7	Very low	111 Å²	111	127.8 Å²	127.8	78%	0.776	78%	0.784	S	S	*	*			trans	-75.3	-162.3	160.7	-32.4	0	0	0	0	111.6
193	P	54.3	Low	37.3	Very low	120 Å²	120	126.1 Å²	126.1	78%	0.779	78%	0.777	S	S	*	*			cis	-137	-174	-10.9	42.4	-25.6	0	0	0	114.6
194	S	30.5	Very low	36.9	Very low	120 Å²	120	126.3 Å²	126.3	84%	0.839	78%	0.778	S	S	*	*			trans	-160.4	164.8	138.7	56.9	0	0	0	0	112.2
195	T	32.3	Very low	37.1	Very low	117 Å²	117	126.1 Å²	126.1	72%	0.718	78%	0.779	S	S	*	*			trans	-136	-179.5	-170.4	48.1	0	0	0	0	111.7
196	H	36.7	Very low	37	Very low	162 Å²	162	125.2 Å²	125.2	75%	0.75	77%	0.774	S	S	*	*			trans	74.6	142.5	175.8	-65.7	-85.7	0	0	0	116
197	D	31.9	Very low	37.6	Very low	133 Å²	133	119.9 Å²	119.9	71%	0.711	77%	0.77	S	S	*	*			cis	-159.2	175.2	-8.9	-133.9	-28.1	0	0	0	114.5
198	A	36	Very low	38.7	Very low	84 Å²	84	119.6 Å²	119.6	69%	0.694	77%	0.765	S	S	*	*			trans	72	132.5	164.3	0	0	0	0	0	118.8
199	Q	35.3	Very low	37.8	Very low	184 Å²	184	121 Å²	121	86%	0.86	76%	0.763	S	S	*	*			cis	83	130.8	24.6	-168.2	178.2	-16	0	0	113.9
200	A	35.8	Very low	37.5	Very low	74 Å²	74	118.2 Å²	118.2	61%	0.612	75%	0.749	S	S	*	*			cis	-125.8	-158	-5.1	0	0	0	0	0	109.4
201	D	31.1	Very low	37.7	Very low	150 Å²	150	120.3 Å²	120.3	80%	0.802	75%	0.747	S	S	*	*			cis	-146.5	158.2	6	-102	-49.2	0	0	0	107.2
202	S	38.7	Very low	37.4	Very low	107 Å²	107	124.3 Å²	124.3	75%	0.748	75%	0.748	S	S	*	*			cis	85.7	134.4	48.9	-149.9	0	0	0	0	113.6
203	A	33.1	Very low	36.9	Very low	88 Å²	88	122.8 Å²	122.8	73%	0.727	75%	0.749	S	S	*	*			cis	-137.7	162.2	16.2	0	0	0	0	0	115
204	V	35.8	Very low	35.8	Very low	121 Å²	121	123.3 Å²	123.3	73%	0.733	75%	0.75	S	S	*	*			trans	-95.2	-171.3	165	-155.3	0	0	0	0	108.6	T206	V204-T206 HydrophobicContact CG1-CG2 4.49Å
205	P	47.2	Very low	36.6	Very low	125 Å²	125	123.1 Å²	123.1	81%	0.812	75%	0.746	S	S	*	*				-146.7	135.7	94.1	35.5	-18	0	0	0	116.4
206	T	33.9	Very low	36.7	Very low	114 Å²	114	121.6 Å²	121.6	70%	0.699	74%	0.74	S	S	*	*			trans	-79.4	169.4	150	56.5	0	0	0	0	109.4	V204	V204-T206 HydrophobicContact CG1-CG2 4.49Å
207	P	50.5	Low	36.4	Very low	121 Å²	121	122.3 Å²	122.3	79%	0.786	74%	0.744	S	S	*	*				-149.7	174.1	78.9	36.1	-15.1	0	0	0	116.5
208	P	62.3	Low	36.3	Very low	106 Å²	106	122 Å²	122	69%	0.688	74%	0.742	S	S	*	*			trans	-121.7	-130.5	-178	37.1	-16.2	0	0	0	112.1
209	M	33.8	Very low	36	Very low	147 Å²	147	124.1 Å²	124.1	72%	0.724	75%	0.747	S	S	*	*			trans	85	148.4	173	-51.1	-33.6	-140.6	0	0	116.5
210	D	30.2	Very low	35.7	Very low	117 Å²	117	118.7 Å²	118.7	63%	0.626	73%	0.734	S	S	*	*			cis	-163.7	156.2	-12.7	-108	-22.3	0	0	0	113
211	T	32.4	Very low	35.4	Very low	120 Å²	120	121.9 Å²	121.9	74%	0.736	75%	0.745	S	S	*	*			trans	30.8	175.4	141.4	72.7	0	0	0	0	123.7
212	E	26.7	Very low	35.3	Very low	190 Å²	190	123.3 Å²	123.3	89%	0.888	75%	0.747	S	S	*	*			cis	-143.8	168.4	1.9	-90.6	-159.5	128.3	0	0	110.3
213	G	26.9	Very low	34.8	Very low	78 Å²	78	123.2 Å²	123.2	80%	0.804	75%	0.746	S	S	*	*			trans	147.3	115.1	151.8	0	0	0	0	0	118.4
214	V	31.1	Very low	34.6	Very low	131 Å²	131	123.2 Å²	123.2	79%	0.794	75%	0.746	S	S	*	*			trans	-139.2	153.6	172.9	-142.6	0	0	0	0	109.5
215	P	46.4	Very low	34.3	Very low	117 Å²	117	121.7 Å²	121.7	76%	0.76	75%	0.746	S	S	*	*				-131.5	150.7	92.8	6	18.2	0	0	0	113
216	S	34	Very low	33.5	Very low	85 Å²	85	125.4 Å²	125.4	59%	0.594	75%	0.753	S	S	*	*				69.3	145	70.7	-63.7	0	0	0	0	115
217	E	31.4	Very low	33.1	Very low	176 Å²	176	123.8 Å²	123.8	82%	0.822	76%	0.758	S	S	*	*			cis	-168.1	161	-6.1	-107.2	156.8	-118.5	0	0	106.3
218	D	30.7	Very low	32.1	Very low	127 Å²	127	125.4 Å²	125.4	68%	0.679	77%	0.765	S	S	*	*			cis	-158.5	170.7	-13.4	172.3	48.3	0	0	0	106.8	A220	D218-A220 PolarHBondContact OD2-N 3.18Å
219	T	29.2	Very low	30.5	Very low	129 Å²	129	124 Å²	124	79%	0.791	77%	0.77	S	S	*	*			trans	-173.4	97	135.5	-67.8	0	0	0	0	111.1
220	A	28.7	Very low	30.2	Very low	70 Å²	70	123.2 Å²	123.2	58%	0.579	77%	0.773	S	S	*	*				39.5	136.2	123.3	0	0	0	0	0	121.5	D218	D218-A220 PolarHBondContact OD2-N 3.18Å
221	V	28.5	Very low	30	Very low	141 Å²	141	127.2 Å²	127.2	86%	0.855	79%	0.785	S	S	*	*			cis	-151.3	155.5	4.9	-171.5	0	0	0	0	111.1
222	H	29.7	Very low	29.8	Very low	180 Å²	180	128.5 Å²	128.5	83%	0.833	79%	0.787	S	S	*	*			trans	-99.4	147.8	177.7	-86.7	-99.4	0	0	0	116.8
223	S	27.8	Very low	31.2	Very low	105 Å²	105	125 Å²	125	73%	0.734	78%	0.781	S	S	*	*				39.8	127.9	124.1	-141.6	0	0	0	0	124
224	A	29.6	Very low	31.1	Very low	88 Å²	88	126.1 Å²	126.1	73%	0.727	78%	0.783	S	S	*	*				62.1	131	128.6	0	0	0	0	0	125.2
225	A	29.3	Very low	31	Very low	89 Å²	89	124.1 Å²	124.1	74%	0.736	78%	0.78	S	S	*	*			trans	87.3	134	130.1	0	0	0	0	0	123.6
226	Q	30.2	Very low	30.2	Very low	203 Å²	203	127.1 Å²	127.1	95%	0.949	78%	0.784	S	S	*	*			trans	66.8	136.7	153.8	-65.8	-180	13.6	0	0	121.2
227	G	26.3	Very low	30.7	Very low	79 Å²	79	127.7 Å²	127.7	81%	0.814	79%	0.785	S	S	*	*			trans	170.5	135.7	169	0	0	0	0	0	113.2
228	V	29.9	Very low	31.4	Very low	155 Å²	155	124.5 Å²	124.5	94%	0.939	78%	0.78	S	S	*	*			trans	-130.4	132.9	-179.4	175.1	0	0	0	0	109.7
229	G	26.8	Very low	31.2	Very low	76 Å²	76	124.3 Å²	124.3	78%	0.784	78%	0.783	S	S	*	*			trans	-164.3	73.8	-171.9	0	0	0	0	0	117.6
230	V	28.3	Very low	31.2	Very low	131 Å²	131	123.5 Å²	123.5	79%	0.794	78%	0.783	S	S	*	*			trans	-5	133.1	155.9	179.7	0	0	0	0	119.5
231	F	25.1	Very low	31	Very low	201 Å²	201	123.5 Å²	123.5	88%	0.882	79%	0.789	S	S	*	*			trans	-155.6	147	136	-125.7	-81.2	0	0	0	114.2
232	L	30.1	Very low	31.8	Very low	147 Å²	147	122.3 Å²	122.3	77%	0.77	78%	0.784	S	S	*	*			trans	-166.8	171.4	178.1	-94.9	-178.5	0	0	0	107.7
233	P	56.1	Low	32.1	Very low	116 Å²	116	121.7 Å²	121.7	75%	0.753	78%	0.779	S	S	*	*			cis	-130.3	-175.6	-17.2	40.1	-24.6	0	0	0	113.2
234	A	24	Very low	32.3	Very low	103 Å²	103	122.8 Å²	122.8	85%	0.851	78%	0.777	S	S	*	*			trans	-152.1	150.9	151.9	0	0	0	0	0	111.3
235	A	29.2	Very low	32.4	Very low	88 Å²	88	122.5 Å²	122.5	73%	0.727	78%	0.782	S	S	*	*			trans	-121.1	164.5	174.7	0	0	0	0	0	109.6
236	E	29.4	Very low	32.4	Very low	181 Å²	181	121.8 Å²	121.8	85%	0.846	78%	0.784	S	S	*	*				-171	174.6	78.2	-97.1	-83	101.9	0	0	111
237	P	44.5	Very low	32.4	Very low	97 Å²	97	120.2 Å²	120.2	63%	0.63	78%	0.781	S	S	*	*			trans	-103.1	-149.6	-166	45.1	-39.9	0	0	0	112.5
238	P	45.6	Very low	32.6	Very low	108 Å²	108	120.9 Å²	120.9	70%	0.701	78%	0.779	S	S	*	*			cis	-144.8	-176.2	-5.5	40.6	-19	0	0	0	119.1
239	V	26.9	Very low	32.6	Very low	124 Å²	124	118.2 Å²	118.2	75%	0.752	77%	0.767	S	S	*	*			trans	84.7	121.4	139.7	151.8	0	0	0	0	123.4
240	S	29.5	Very low	32.7	Very low	112 Å²	112	122.5 Å²	122.5	78%	0.783	77%	0.771	S	S	*	*			trans	57.2	148.2	149.4	70.5	0	0	0	0	124.8
241	G	24.9	Very low	32.7	Very low	69 Å²	69	120.9 Å²	120.9	71%	0.711	77%	0.771	S	S	*	*			trans	-85.8	-134.7	164.1	0	0	0	0	0	113
242	P	45.2	Very low	32.7	Very low	116 Å²	116	120.4 Å²	120.4	75%	0.753	77%	0.772	S	S	*	*			cis	-146.8	-159.7	9.1	41.6	-18.9	0	0	0	116.1
243	K	35.1	Very low	32.4	Very low	167 Å²	167	121 Å²	121	73%	0.726	78%	0.776	S	S	*	*			trans	73.3	159.1	156	-73.3	-177.7	149.7	-68.7	0	119.1
244	D	32.8	Very low	31.5	Very low	128 Å²	128	119.8 Å²	119.8	68%	0.684	77%	0.77	S	S	*	*			cis	-152	166.5	-10.2	-103	-20.6	0	0	0	107
245	G	31.9	Very low	32.4	Very low	82 Å²	82	120.2 Å²	120.2	85%	0.845	76%	0.764	S	S	*	*				98.2	145.7	55.9	0	0	0	0	0	110.7
246	G	28.6	Very low	32.4	Very low	74 Å²	74	124 Å²	124	76%	0.763	77%	0.767	S	S	*	*			cis	-149.6	-165.7	-0.9	0	0	0	0	0	109.8
247	L	30.3	Very low	32.4	Very low	171 Å²	171	124.5 Å²	124.5	90%	0.895	77%	0.766	S	S	*	*			cis	-166.8	136.5	47.7	-76.7	170.4	0	0	0	109.8
248	A	31.1	Very low	31.6	Very low	92 Å²	92	131.2 Å²	131.2	76%	0.76	78%	0.779	S	S	*	*				88.9	144.4	97.5	0	0	0	0	0	116.1
249	S	30.1	Very low	30.8	Very low	99 Å²	99	134 Å²	134	69%	0.692	79%	0.787	S	S	*	*			cis	-170.8	-178.1	-8.7	51.1	0	0	0	0	112.8
250	L	27.4	Very low	31.5	Very low	167 Å²	167	133.2 Å²	133.2	87%	0.874	79%	0.785	S	S	*	*			trans	80.4	144.9	166.4	-59.2	166.8	0	0	0	118.1
251	A	28.9	Very low	31.4	Very low	96 Å²	96	135.1 Å²	135.1	79%	0.793	79%	0.791	S	S	*	*			cis	-159.8	177.9	-13.4	0	0	0	0	0	111.9
252	E	25.3	Very low	31.8	Very low	192 Å²	192	140.7 Å²	140.7	90%	0.897	80%	0.799	S	S	*	*			trans	-93.8	160.8	-171.2	-59.1	-175.8	92.9	0	0	116.9
253	D	24.5	Very low	31.2	Very low	160 Å²	160	144.6 Å²	144.6	86%	0.856	80%	0.804	S	S	*	*				-164.8	176.2	104.6	-159.1	8.2	0	0	0	112.5
254	S	35.9	Very low	31	Very low	90 Å²	90	141.6 Å²	141.6	63%	0.629	81%	0.81	S	S	*	*			trans	-110.5	-164	-161.9	-124.3	0	0	0	0	113.4
255	P	43.7	Very low	31.1	Very low	112 Å²	112	141.2 Å²	141.2	73%	0.727	81%	0.813	S	S	*	*			cis	-138.1	148.9	10.5	39.9	-19.6	0	0	0	120.1
256	Q	28.8	Very low	31.5	Very low	167 Å²	167	142.9 Å²	142.9	78%	0.78	81%	0.809	S	S	*	*			trans	23.1	126.7	138.4	-53.3	177.3	-2.6	0	0	122.7
257	K	29.4	Very low	32	Very low	192 Å²	192	145 Å²	145	84%	0.835	81%	0.809	S	S	*	*				-175.2	145.3	106.6	-112.3	166.7	-177.2	160.3	0	118
258	R	27.4	Very low	32.5	Very low	238 Å²	238	143 Å²	143	90%	0.898	81%	0.806	S	S	*	*			trans	77	150.8	160.1	-64.6	-167.5	-171.8	-128.9	6.9	120.8
259	L	28.4	Very low	33	Very low	165 Å²	165	144 Å²	144	86%	0.864	81%	0.807	S	S	*	*			trans	-133.6	179.8	178.9	-73.1	151.5	0	0	0	106.8
260	P	42.8	Very low	33.7	Very low	109 Å²	109	144.8 Å²	144.8	71%	0.708	81%	0.811	S	S	*	*				-134.2	173.1	-55.3	39.7	-25.1	0	0	0	112.4
261	T	27.2	Very low	34.6	Very low	151 Å²	151	143.8 Å²	143.8	93%	0.926	81%	0.805	S	S	*	*			trans	-159.9	176.8	158.7	-4.9	0	0	0	0	112.6
262	Q	33.5	Very low	35.1	Very low	186 Å²	186	146.8 Å²	146.8	87%	0.869	81%	0.807	S	S	*	*			trans	-118.5	138.4	-157.3	-62.1	176.9	-6.5	0	0	115.9
263	K	32.8	Very low	35.9	Very low	199 Å²	199	142.2 Å²	142.2	87%	0.865	80%	0.797	S	S	*	*			trans	23.7	122.4	138.6	-168.2	-179.7	-176.8	-178.5	0	120
264	A	30.8	Very low	36.7	Very low	103 Å²	103	142 Å²	142	85%	0.851	79%	0.79	S	S	*	*			trans	-142.9	162.5	155	0	0	0	0	0	111
265	T	35.1	Very low	37	Very low	120 Å²	120	145.2 Å²	145.2	74%	0.736	80%	0.8	S	S	*	*			trans	-123.9	143.6	-176.9	-47.2	0	0	0	0	109.3
266	P	38.7	Very low	36.9	Very low	117 Å²	117	147.9 Å²	147.9	76%	0.76	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-70	156.2	-179.9	27.8	-36.2	0	0	0	114
267	P	40.4	Very low	37.6	Very low	120 Å²	120	148.6 Å²	148.6	78%	0.779	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-89.7	163.1	-177.4	36.7	-36.6	0	0	0	114.2
268	P	40.4	Very low	38	Very low	127 Å²	127	148.9 Å²	148.9	83%	0.825	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-82	159.7	173	34.7	-35.5	0	0	0	113.4
269	S	40.7	Very low	38.3	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-81.7	156.2	177.8	-62	0	0	0	0	113.1
270	P	45.9	Very low	38.4	Very low	117 Å²	117	140.8 Å²	140.8	76%	0.76	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-77.8	163	-175.6	32.3	-36.5	0	0	0	114.2
271	L	45.4	Very low	38	Very low	145 Å²	145	143.7 Å²	143.7	76%	0.759	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-95	151.4	-178.3	-70	167.6	0	0	0	112.6	S273	L271-S273 PolarHBondContact O-N 3.35Å
272	L	41	Very low	38.2	Very low	159 Å²	159	143.7 Å²	143.7	83%	0.832	80%	0.803	S	S	*	*	G	3₁₀ helix	trans	-57.7	-13.4	-179.2	-88.1	161.3	0	0	0	115.7	E274	L272-E274 PolarHBondContact O-N 3.4Å
273	S	41.6	Very low	37.9	Very low	97 Å²	97	140.2 Å²	140.2	68%	0.678	80%	0.799	S	S	*	*	G	3₁₀ helix	trans	-68.8	-10	-175.7	-47.6	0	0	0	0	115.3	L271	L271-S273 PolarHBondContact O-N 3.35Å
274	E	41.7	Very low	37.6	Very low	155 Å²	155	135.4 Å²	135.4	72%	0.724	80%	0.796	S	S	*	*	G	3₁₀ helix	trans	-93.6	-23.6	-174.2	-160.1	163.8	-167.5	0	0	113.9	L272	L272-E274 PolarHBondContact O-N 3.4Å
275	L	41.5	Very low	37.7	Very low	158 Å²	158	136 Å²	136	83%	0.827	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-73.6	-32.7	180	-123.8	83.4	0	0	0	113.3	K277	L275-K277 PolarHBondContact O-N 3.04Å
276	L	42.4	Very low	37.8	Very low	167 Å²	167	135.8 Å²	135.8	87%	0.874	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-79.8	7.4	-175.3	-71.3	168.3	0	0	0	114.3
277	K	41.8	Very low	37.4	Very low	182 Å²	182	141.3 Å²	141.3	79%	0.791	80%	0.801	S	S	*	*	G	3₁₀ helix	trans	-116	12.9	-168.8	-137.4	167.7	-172.9	172	0	115.7	L275	L275-K277 PolarHBondContact O-N 3.04Å
278	K	39.3	Very low	36.9	Very low	199 Å²	199	143.3 Å²	143.3	87%	0.865	80%	0.804	S	S	*	*	S	Bend	trans	-139.3	113.6	168.7	-67.3	-180	-178.6	172	0	108.5
279	G	33	Very low	36.2	Very low	74 Å²	74	142.9 Å²	142.9	76%	0.763	80%	0.799	S	S	*	*			trans	-118	179.2	-170.7	0	0	0	0	0	115.3
280	N	31.1	Very low	35.4	Very low	158 Å²	158	142.5 Å²	142.5	85%	0.845	80%	0.797	S	S	*	*			trans	41.1	108.7	163.7	-75.9	14.9	0	0	0	120
281	L	33.6	Very low	34.4	Very low	170 Å²	170	145.6 Å²	145.6	89%	0.89	80%	0.801	S	S	*	*			trans	-136.1	96.2	139.9	-81.6	-178.6	0	0	0	111.7
282	I	31.3	Very low	33.5	Very low	151 Å²	151	141.8 Å²	141.8	77%	0.774	80%	0.796	S	S	*	*			trans	25.7	120.5	138.8	-53.6	172.6	0	0	0	118.9
283	S	27.5	Very low	32.8	Very low	113 Å²	113	143 Å²	143	79%	0.79	80%	0.798	S	S	*	*			trans	16.2	125.3	142.5	-168.3	0	0	0	0	120.7
284	A	26.8	Very low	32.1	Very low	98 Å²	98	143.8 Å²	143.8	81%	0.81	80%	0.799	S	S	*	*			trans	-154.6	139.2	133.8	0	0	0	0	0	111.7
285	S	31.8	Very low	31.4	Very low	116 Å²	116	141.5 Å²	141.5	81%	0.811	80%	0.795	S	S	*	*			trans	-138.5	129.5	156.2	-178.8	0	0	0	0	108.4
286	P	38.5	Very low	30.8	Very low	116 Å²	116	140.4 Å²	140.4	75%	0.753	80%	0.795	S	S	*	*			trans	-131.5	151.2	151.9	36	-24.2	0	0	0	112.9
287	R	29.2	Very low	29.9	Very low	233 Å²	233	138 Å²	138	88%	0.879	79%	0.792	S	S	*	*			trans	-80.4	173.4	161.7	-67.2	174.3	170.3	169.3	-4.9	110.3
288	L	30.4	Very low	29.3	Very low	161 Å²	161	136.7 Å²	136.7	84%	0.843	79%	0.793	S	S	*	*			trans	129.2	152.2	154.9	-70.6	177.3	0	0	0	111.7
289	V	26.3	Very low	28.9	Very low	118 Å²	118	133.1 Å²	133.1	72%	0.715	79%	0.788	S	S	*	*			cis	172.1	144.4	-39.3	132.4	0	0	0	0	107.4
290	S	23.6	Very low	28.7	Very low	106 Å²	106	137.2 Å²	137.2	74%	0.741	79%	0.793	S	S	*	*			trans	67.2	158.5	167.5	-105.8	0	0	0	0	116.3
291	E	25.6	Very low	28.4	Very low	182 Å²	182	133.1 Å²	133.1	85%	0.85	79%	0.788	S	S	*	*			cis	-136.9	174.7	-0.9	-57	-170.7	133.1	0	0	108.4
292	G	26.4	Very low	28.1	Very low	64 Å²	64	132.2 Å²	132.2	66%	0.66	79%	0.789	S	S	*	*			cis	169	164.5	-3.8	0	0	0	0	0	112.4
293	E	26	Very low	28	Very low	186 Å²	186	132.8 Å²	132.8	87%	0.869	79%	0.788	S	S	*	*			trans	48.3	149.9	141.9	-56.7	-163.1	100.5	0	0	122.7
294	T	26.3	Very low	28	Very low	113 Å²	113	133.3 Å²	133.3	69%	0.693	79%	0.787	S	S	*	*			cis	-143.5	-161	9.6	56.4	0	0	0	0	109.3
295	T	27.2	Very low	28.1	Very low	106 Å²	106	133.2 Å²	133.2	65%	0.65	79%	0.786	S	S	*	*			cis	-158.9	155.3	-3.5	-2.9	0	0	0	0	110.6
296	T	28.3	Very low	27.8	Very low	135 Å²	135	132.2 Å²	132.2	83%	0.828	79%	0.785	S	S	*	*			trans	63.8	152.5	156.6	59.2	0	0	0	0	119.8
297	S	24.9	Very low	27.2	Very low	116 Å²	116	131.4 Å²	131.4	81%	0.811	79%	0.788	S	S	*	*			cis	-138.1	-169.8	11.2	-158.9	0	0	0	0	113.8
298	L	29.3	Very low	27.1	Very low	156 Å²	156	125.6 Å²	125.6	82%	0.817	79%	0.79	S	S	*	*			trans	-117.8	-176.4	-152.3	-74.4	165.7	0	0	0	117.1
299	T	29.6	Very low	27.2	Very low	124 Å²	124	122.2 Å²	122.2	76%	0.761	79%	0.785	S	S	*	*			trans	99.8	137.7	171	68.9	0	0	0	0	115.6
300	N	28.7	Very low	27.3	Very low	160 Å²	160	123.2 Å²	123.2	86%	0.856	79%	0.791	S	S	*	*			cis	-152.8	167.9	-8.2	-101.2	-14.5	0	0	0	109.6
301	G	26.1	Very low	27.5	Very low	72 Å²	72	125.5 Å²	125.5	74%	0.742	79%	0.794	S	S	*	*			trans	-162.9	157.5	174.7	0	0	0	0	0	115.8
302	V	26.5	Very low	28	Very low	150 Å²	150	123.1 Å²	123.1	91%	0.909	79%	0.792	S	S	*	*			trans	-143.3	167.8	176.1	178.8	0	0	0	0	109.3
303	Q	29.1	Very low	29.2	Very low	163 Å²	163	125.9 Å²	125.9	76%	0.762	80%	0.798	S	S	*	*			trans	-117.1	179	-156.5	-47.6	172.3	4.4	0	0	115.4
304	T	28.5	Very low	29.4	Very low	124 Å²	124	120 Å²	120	76%	0.761	79%	0.788	S	S	*	*			trans	78.3	116.7	142.5	41.4	0	0	0	0	123.4
305	A	27.3	Very low	29.6	Very low	97 Å²	97	122.7 Å²	122.7	80%	0.802	79%	0.792	S	S	*	*				109.6	145.6	111.6	0	0	0	0	0	122.9
306	A	26.3	Very low	29.6	Very low	94 Å²	94	124.8 Å²	124.8	78%	0.777	79%	0.794	S	S	*	*			trans	77.3	99.4	143.7	0	0	0	0	0	122.9
307	A	25.8	Very low	29.7	Very low	100 Å²	100	124.2 Å²	124.2	83%	0.826	79%	0.79	S	S	*	*				69	153.1	109	0	0	0	0	0	124.3
308	A	27.1	Very low	29.9	Very low	110 Å²	110	126.9 Å²	126.9	91%	0.909	79%	0.788	S	S	*	*			trans	84.2	149.9	155.7	0	0	0	0	0	119.8
309	A	32.5	Very low	30	Very low	91 Å²	91	126.3 Å²	126.3	75%	0.752	79%	0.791	S	S	*	*			trans	-128.8	158	-169.4	0	0	0	0	0	113
310	V	27.8	Very low	30.2	Very low	138 Å²	138	129.1 Å²	129.1	84%	0.836	80%	0.796	S	S	*	*			trans	-152.3	117.2	180	173.2	0	0	0	0	104.5
311	L	28.1	Very low	30.3	Very low	154 Å²	154	125.5 Å²	125.5	81%	0.806	80%	0.796	S	S	*	*			cis	63.9	119.7	42.1	-69.4	169.4	0	0	0	112.7
312	V	35.9	Very low	30.5	Very low	132 Å²	132	129.9 Å²	129.9	80%	0.8	80%	0.802	S	S	*	*			cis	-163.5	170.2	47.4	104.5	0	0	0	0	111.2
313	P	51.9	Low	30.9	Very low	122 Å²	122	126.9 Å²	126.9	79%	0.792	79%	0.793	S	S	*	*			trans	-123.7	-167.4	-164.9	45.2	-33.2	0	0	0	116.4
314	G	30	Very low	30.9	Very low	63 Å²	63	126.3 Å²	126.3	65%	0.649	80%	0.795	S	S	*	*			trans	172.2	166.5	160.1	0	0	0	0	0	110.8
315	H	31.5	Very low	31	Very low	169 Å²	169	125.2 Å²	125.2	78%	0.782	80%	0.799	S	S	*	*			cis	-177.7	163.6	-10.9	-104.8	-154	0	0	0	105.6
316	E	26.8	Very low	31.1	Very low	150 Å²	150	125 Å²	125	70%	0.701	80%	0.798	S	S	*	*			cis	-158.1	129.5	-0.5	-107.2	167.9	-87.2	0	0	107.3
317	V	30.6	Very low	31.2	Very low	123 Å²	123	127 Å²	127	75%	0.745	80%	0.8	S	S	*	*				101.4	135.1	104.6	168.9	0	0	0	0	118.3
318	F	28.3	Very low	31.4	Very low	172 Å²	172	130 Å²	130	75%	0.754	79%	0.794	S	S	*	*			trans	-13.3	151.6	163.3	-76	-102.1	0	0	0	123.3
319	T	31.1	Very low	31.7	Very low	144 Å²	144	128.2 Å²	128.2	88%	0.883	78%	0.779	S	S	*	*				-154.8	150.3	105.6	40.3	0	0	0	0	112.4
320	E	35.2	Very low	31.5	Very low	184 Å²	184	131.1 Å²	131.1	86%	0.86	78%	0.777	S	S	*	*			trans	-91.4	168.8	173.6	-63.3	171.3	111.4	0	0	112.9
321	G	29.2	Very low	31.6	Very low	83 Å²	83	131.1 Å²	131.1	86%	0.856	77%	0.772	S	S	*	*			trans	-178.2	112.2	167.3	0	0	0	0	0	113.2
322	D	30.9	Very low	31.5	Very low	164 Å²	164	128.8 Å²	128.8	88%	0.877	77%	0.768	S	S	*	*			trans	-114.3	155.1	-179.8	177.5	35.7	0	0	0	111.2
323	A	34.6	Very low	31.4	Very low	88 Å²	88	130.8 Å²	130.8	73%	0.727	77%	0.769	S	S	*	*			trans	159.9	93.5	153.6	0	0	0	0	0	113.6
324	D	30	Very low	30.5	Very low	150 Å²	150	132.9 Å²	132.9	80%	0.802	77%	0.768	S	S	*	*				17.5	128.6	126.6	-165.9	11.3	0	0	0	121
325	A	29.2	Very low	30.5	Very low	102 Å²	102	136.1 Å²	136.1	84%	0.843	78%	0.776	S	S	*	*			trans	-168.1	130.5	139	0	0	0	0	0	112.3
326	A	29.9	Very low	30.2	Very low	93 Å²	93	131.8 Å²	131.8	77%	0.769	78%	0.777	S	S	*	*			trans	-120.2	156.3	177.4	0	0	0	0	0	113.8
327	V	28.7	Very low	30.6	Very low	135 Å²	135	133.5 Å²	133.5	82%	0.818	79%	0.789	S	S	*	*			trans	-166.7	108.7	152.1	134.7	0	0	0	0	107.6
328	K	29.8	Very low	30.7	Very low	163 Å²	163	132.3 Å²	132.3	71%	0.709	79%	0.793	S	S	*	*				72.5	113.3	94.3	-110.6	-143.2	168.1	-114.4	0	113.4	E330	K328-E330 IonicContact NZ-OE1 2.73Å; K328-E330 PolarHBondContact NZ-OE1 3.47Å
329	A	33.8	Very low	31.6	Very low	72 Å²	72	132.8 Å²	132.8	60%	0.595	80%	0.797	S	S	*	*				107	149.2	78.5	0	0	0	0	0	110.3
330	E	29.1	Very low	32.2	Very low	152 Å²	152	135.3 Å²	135.3	71%	0.71	80%	0.799	S	S	*	*			cis	-150.1	154.4	-8.1	-99.6	145.5	-142.3	0	0	105.2	K328	K328-E330 IonicContact NZ-OE1 2.73Å; K328-E330 PolarHBondContact NZ-OE1 3.47Å
331	L	29.1	Very low	32.2	Very low	138 Å²	138	133.1 Å²	133.1	72%	0.723	79%	0.793	S	S	*	*			cis	98	106.3	30.3	-157.5	171.6	0	0	0	114	E333	L331-E333 HydrophobicContact CD2-CG 4.05Å
332	S	26.8	Very low	32.4	Very low	106 Å²	106	137.1 Å²	137.1	74%	0.741	79%	0.794	S	S	*	*			trans	-164.1	116.9	156.3	55.7	0	0	0	0	105.8
333	E	33	Very low	32.4	Very low	174 Å²	174	135 Å²	135	81%	0.813	79%	0.787	S	S	*	*				54.3	132	66.7	-61.4	-171.5	152.3	0	0	112.1	L331	L331-E333 HydrophobicContact CD2-CG 4.05Å
334	E	32.2	Very low	32.3	Very low	166 Å²	166	135.1 Å²	135.1	78%	0.776	79%	0.788	S	S	*	*			cis	-152.4	154.7	28	-157.9	-163.5	145.8	0	0	113.5
335	T	29.7	Very low	32.3	Very low	131 Å²	131	134.5 Å²	134.5	80%	0.804	79%	0.789	S	S	*	*			trans	55.1	133.7	158.3	44.7	0	0	0	0	122.9
336	G	25.8	Very low	32.3	Very low	78 Å²	78	134.3 Å²	134.3	80%	0.804	78%	0.782	S	S	*	*			trans	177.6	119.5	157.3	0	0	0	0	0	112.1
337	L	35.8	Very low	32.3	Very low	185 Å²	185	140 Å²	140	97%	0.969	79%	0.785	S	S	*	*			trans	-100.1	129.4	174.2	-71.7	170.9	0	0	0	110.1
338	A	32.8	Very low	32.7	Very low	99 Å²	99	140.9 Å²	140.9	82%	0.818	78%	0.782	S	S	*	*			trans	-154.5	140.2	161.8	0	0	0	0	0	109.7
339	E	46	Very low	33	Very low	182 Å²	182	135 Å²	135	85%	0.85	77%	0.767	S	S	*	*			trans	-91.5	-170.8	156.5	-62.5	-175.5	128.6	0	0	108.3
340	E	44.7	Very low	33.6	Very low	197 Å²	197	138.7 Å²	138.7	92%	0.921	78%	0.777	S	S	*	*			trans	72.4	123.7	-177.2	-50.8	174.3	179.7	0	0	112.3
341	D	34.4	Very low	34.7	Very low	137 Å²	137	139.4 Å²	139.4	73%	0.733	78%	0.78	S	S	*	*				-148.7	143.9	67.4	-162.1	-3.1	0	0	0	113
342	L	33.5	Very low	35.6	Very low	167 Å²	167	138.6 Å²	138.6	87%	0.874	78%	0.776	S	S	*	*			trans	-107.9	86.5	174.9	-89.6	170.7	0	0	0	108.7	A344	L342-A344 VanDerWaalsContact C-N 3.32Å; L342-A344 PolarHBondContact O-N 3.18Å
343	V	32.3	Very low	37	Very low	121 Å²	121	138 Å²	138	73%	0.733	76%	0.764	S	S	*	*			trans	-68.1	88.9	179.8	-175.5	0	0	0	0	110.4	V345	V343-V345 PolarHBondContact O-N 3.28Å
344	A	31.6	Very low	37.9	Very low	89 Å²	89	137.3 Å²	137.3	74%	0.736	77%	0.766	S	S	*	*			trans	-63.9	114.9	167.1	0	0	0	0	0	108.8	L342 S346	L342-A344 VanDerWaalsContact C-N 3.32Å; L342-A344 PolarHBondContact O-N 3.18Å; A344-S346 VanDerWaalsContact C-N 3.27Å; A344-S346 PolarHBondContact O-N 3.5Å
345	V	31	Very low	39.2	Very low	138 Å²	138	137 Å²	137	84%	0.836	76%	0.764	S	S	*	*			trans	-70.7	88.4	174.9	-178.8	0	0	0	0	108.4	V343 Y347	V343-V345 PolarHBondContact O-N 3.28Å; V345-Y347 PolarHBondContact O-N 3.45Å
346	S	29.1	Very low	40.8	Very low	98 Å²	98	133.5 Å²	133.5	69%	0.685	74%	0.743	S	S	*	*			trans	-60.2	122.5	170.5	-171.9	0	0	0	0	108.8	A344 M348	A344-S346 VanDerWaalsContact C-N 3.27Å; A344-S346 PolarHBondContact O-N 3.5Å; S346-M348 PolarHBondContact O-N 3.13Å
347	Y	29.1	Very low	42.4	Very low	211 Å²	211	132.1 Å²	132.1	83%	0.827	72%	0.719	S	S	*	*			trans	-66.3	102.1	171.4	179.2	-92.6	0	0	0	108	V345 G349	V345-Y347 PolarHBondContact O-N 3.45Å; Y347-G349 PolarHBondContact O-N 3.4Å
348	M	37.2	Very low	43.6	Very low	155 Å²	155	124.9 Å²	124.9	76%	0.764	69%	0.689	S	S	*	*			trans	-62.9	89.7	166.4	-77.7	-68.8	-63.1	0	0	108	S346 D350	S346-M348 PolarHBondContact O-N 3.13Å; M348-D350 PolarHBondContact O-N 3.32Å
349	G	37	Very low	44.7	Very low	39 Å²	39	125.1 Å²	125.1	40%	0.402	68%	0.676	S	S	.	*			trans	-69.8	109.3	161.5	0	0	0	0	0	107.6	Y347 E351	Y347-G349 PolarHBondContact O-N 3.4Å; G349-E351 PolarHBondContact O-N 2.87Å
350	D	46	Very low	45.3	Very low	150 Å²	150	120.3 Å²	120.3	80%	0.802	66%	0.656	S	S	*	*			trans	-66	77.9	160	-67.6	-32.3	0	0	0	107.5	M348 L352	M348-D350 PolarHBondContact O-N 3.32Å; D350-L352 PolarHBondContact O-N 3.39Å
351	E	52.4	Low	45.9	Very low	166 Å²	166	114.8 Å²	114.8	78%	0.776	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-58.1	124.9	165.7	-72.8	-169.6	149.1	0	0	107.1	G349 D353	G349-E351 PolarHBondContact O-N 2.87Å; E351-D353 PolarHBondContact O-N 3.32Å; E351-D353 VanDerWaalsContact O-N 3.09Å
352	L	47.2	Very low	47.2	Very low	121 Å²	121	110.7 Å²	110.7	63%	0.634	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-54.5	119.9	167.8	-72.2	166.4	0	0	0	107.3	D350 T356 V357	D350-L352 PolarHBondContact O-N 3.39Å; L352-T356 HydrophobicContact CD2-CG2 4.29Å; L352-V357 HydrophobicContact CB-CG2 3.62Å; L352-V357 WeakPolarHBondContact O-CG2 3.44Å
353	D	55.5	Low	48.4	Very low	93 Å²	93	107 Å²	107	50%	0.497	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-61.1	152.3	-175.6	58.3	35.2	0	0	0	111.3	E351 E355 T356 V357	E351-D353 PolarHBondContact O-N 3.32Å; E351-D353 VanDerWaalsContact O-N 3.09Å; D353-E355 PolarHBondContact O-N 3.45Å; D353-T356 PolarHBondContact O-N 3.41Å; D353-T356 VanDerWaalsContact O-N 3.11Å; D353-T356 WeakPolarHBondContact OD1-CB 3.41Å; D353-T356 PolarHBondContact OD1-N 3.39Å; D353-T356 PolarHBondContact OD1-OG1 3.19Å; D353-V357 WeakPolarHBondContact O-CG2 3.36Å; D353-V357 PolarHBondContact O-N 3.45Å
354	L	53.6	Low	49.3	Very low	160 Å²	160	105.8 Å²	105.8	84%	0.838	59%	0.585	S	S	*	*	H	α-helix	trans	-62.9	-15.8	-173.8	-68.5	166.8	0	0	0	112.7	G358	L354-G358 PolarHBondContact O-N 3.36Å
355	E	58.8	Low	50.2	Low	160 Å²	160	107.7 Å²	107.7	75%	0.748	58%	0.579	S	S	*	*	H	α-helix	trans	-81.1	-48.5	175.4	-153.6	149.3	-148.6	0	0	110.2	D353 V357 G358 D359	D353-E355 PolarHBondContact O-N 3.45Å; E355-V357 PolarHBondContact O-N 3.18Å; E355-G358 WeakPolarHBondContact O-CA 3.45Å; E355-G358 PolarHBondContact O-N 3.26Å; E355-G358 VanDerWaalsContact O-N 3.15Å; E355-D359 PolarHBondContact O-N 3.32Å
356	T	63.9	Low	51	Low	57 Å²	57	108.5 Å²	108.5	35%	0.35	57%	0.574	S	S	.	*	H	α-helix	trans	-61.2	-40.7	170.9	-57.7	0	0	0	0	112.2	L352 D353 G358 I360	L352-T356 HydrophobicContact CD2-CG2 4.29Å; D353-T356 PolarHBondContact O-N 3.41Å; D353-T356 VanDerWaalsContact O-N 3.11Å; D353-T356 WeakPolarHBondContact OD1-CB 3.41Å; D353-T356 PolarHBondContact OD1-N 3.39Å; D353-T356 PolarHBondContact OD1-OG1 3.19Å; T356-G358 VanDerWaalsContact C-N 3.35Å; T356-I360 HydrophobicContact CG2-CD1 3.98Å; T356-I360 WeakPolarHBondContact O-CB 3.46Å; T356-I360 WeakPolarHBondContact O-CD1 2.97Å; T356-I360 VanDerWaalsContact O-CG1 3.24Å; T356-I360 WeakPolarHBondContact O-CG1 3.26Å; T356-I360 PolarHBondContact O-N 2.9Å
357	V	58.4	Low	51.9	Low	49 Å²	49	110.1 Å²	110.1	30%	0.297	57%	0.568	S	S	.	*	H	α-helix	trans	-67.4	-37.9	174.9	177	0	0	0	0	110.9	L352 D353 E355 I360 I361	L352-V357 HydrophobicContact CB-CG2 3.62Å; L352-V357 WeakPolarHBondContact O-CG2 3.44Å; D353-V357 WeakPolarHBondContact O-CG2 3.36Å; D353-V357 PolarHBondContact O-N 3.45Å; E355-V357 PolarHBondContact O-N 3.18Å; V357-I360 PolarHBondContact O-N 2.87Å; V357-I361 HydrophobicContact CG1-CD1 3.92Å; V357-I361 VanDerWaalsContact O-CG1 3.28Å; V357-I361 WeakPolarHBondContact O-CG1 3.12Å; V357-I361 PolarHBondContact O-N 3.26Å
358	G	61.9	Low	52.6	Low	34 Å²	34	103.3 Å²	103.3	35%	0.351	55%	0.549	S	S	.	.	H	α-helix	trans	-61.6	-48.2	173.7	0	0	0	0	0	112.6	L354 E355 T356 I360 I361 A362	L354-G358 PolarHBondContact O-N 3.36Å; E355-G358 WeakPolarHBondContact O-CA 3.45Å; E355-G358 PolarHBondContact O-N 3.26Å; E355-G358 VanDerWaalsContact O-N 3.15Å; T356-G358 VanDerWaalsContact C-N 3.35Å; G358-I360 PolarHBondContact O-N 3.22Å; G358-I361 PolarHBondContact O-N 2.98Å; G358-A362 WeakPolarHBondContact O-CB 3.39Å; G358-A362 PolarHBondContact O-N 3.27Å
359	D	54.2	Low	52.7	Low	103 Å²	103	102.9 Å²	102.9	55%	0.551	55%	0.549	S	S	*	.	H	α-helix	trans	-61.4	-42.8	176	-82.9	-8	0	0	0	111.8	E355 I361 A362 I363	E355-D359 PolarHBondContact O-N 3.32Å; D359-I361 VanDerWaalsContact C-N 3.34Å; D359-I361 PolarHBondContact O-N 2.77Å; D359-A362 PolarHBondContact O-N 3.46Å; D359-I363 VanDerWaalsContact O-CB 3.27Å; D359-I363 WeakPolarHBondContact O-CB 3.26Å; D359-I363 WeakPolarHBondContact O-CD1 3.45Å; D359-I363 WeakPolarHBondContact O-CG1 3.46Å; D359-I363 PolarHBondContact O-N 3.33Å
360	I	59	Low	53	Low	82 Å²	82	109.2 Å²	109.2	42%	0.421	57%	0.574	S	S	.	*	H	α-helix	trans	-62.1	-42.2	175.7	-72	166.8	0	0	0	111	T356 V357 G358 I364	T356-I360 HydrophobicContact CG2-CD1 3.98Å; T356-I360 WeakPolarHBondContact O-CB 3.46Å; T356-I360 WeakPolarHBondContact O-CD1 2.97Å; T356-I360 VanDerWaalsContact O-CG1 3.24Å; T356-I360 WeakPolarHBondContact O-CG1 3.26Å; T356-I360 PolarHBondContact O-N 2.9Å; V357-I360 PolarHBondContact O-N 2.87Å; G358-I360 PolarHBondContact O-N 3.22Å; I360-I364 HydrophobicContact CG2-CD1 3.92Å; I360-I364 WeakPolarHBondContact O-CD1 3.31Å; I360-I364 VanDerWaalsContact O-CG1 3.23Å; I360-I364 WeakPolarHBondContact O-CG1 3.47Å; I360-I364 PolarHBondContact O-N 2.87Å; I360-I364 VanDerWaalsContact O-N 3.13Å
361	I	57.5	Low	52.8	Low	81 Å²	81	106.3 Å²	106.3	42%	0.415	57%	0.565	S	S	.	*	H	α-helix	trans	-65.4	-46.3	176.2	-70.4	167.2	0	0	0	110.4	V357 G358 D359 I363 I364 E365	V357-I361 HydrophobicContact CG1-CD1 3.92Å; V357-I361 VanDerWaalsContact O-CG1 3.28Å; V357-I361 WeakPolarHBondContact O-CG1 3.12Å; V357-I361 PolarHBondContact O-N 3.26Å; G358-I361 PolarHBondContact O-N 2.98Å; D359-I361 VanDerWaalsContact C-N 3.34Å; D359-I361 PolarHBondContact O-N 2.77Å; I361-I363 PolarHBondContact O-N 3.44Å; I361-I364 CarbonylContact O-C 3.59Å; I361-I364 WeakPolarHBondContact O-CB 3.34Å; I361-I364 PolarHBondContact O-N 3.5Å; I361-I364 VanDerWaalsContact O-N 3.09Å; I361-E365 HydrophobicContact CG2-CG 4.22Å; I361-E365 WeakPolarHBondContact O-CG 3.24Å; I361-E365 PolarHBondContact O-N 3.24Å
362	A	62.6	Low	52.5	Low	50 Å²	50	103.8 Å²	103.8	41%	0.413	56%	0.561	S	S	.	*	H	α-helix	trans	-61.2	-41.9	178.1	0	0	0	0	0	112.5	G358 D359 I364 E365 E366	G358-A362 WeakPolarHBondContact O-CB 3.39Å; G358-A362 PolarHBondContact O-N 3.27Å; D359-A362 PolarHBondContact O-N 3.46Å; A362-I364 PolarHBondContact O-N 3.39Å; A362-E365 PolarHBondContact O-N 3.15Å; A362-E366 VanDerWaalsContact O-CB 3.25Å; A362-E366 WeakPolarHBondContact O-CB 3.31Å; A362-E366 PolarHBondContact O-N 3.26Å
363	I	57.7	Low	52.4	Low	91 Å²	91	107.4 Å²	107.4	47%	0.467	58%	0.575	S	S	.	*	H	α-helix	trans	-65.5	-26.2	176.3	-72.9	166.8	0	0	0	112.3	D359 I361 K367	D359-I363 VanDerWaalsContact O-CB 3.27Å; D359-I363 WeakPolarHBondContact O-CB 3.26Å; D359-I363 WeakPolarHBondContact O-CD1 3.45Å; D359-I363 WeakPolarHBondContact O-CG1 3.46Å; D359-I363 PolarHBondContact O-N 3.33Å; I361-I363 PolarHBondContact O-N 3.44Å; I363-K367 WeakPolarHBondContact O-CG 3.44Å; I363-K367 PolarHBondContact O-NZ 2.69Å
364	I	50.8	Low	52.1	Low	94 Å²	94	107.4 Å²	107.4	48%	0.482	59%	0.588	S	S	.	*	H	α-helix	trans	-80.7	-49.3	173.4	-71.3	166	0	0	0	110.2	I360 I361 A362 E366 K367 V368	I360-I364 HydrophobicContact CG2-CD1 3.92Å; I360-I364 WeakPolarHBondContact O-CD1 3.31Å; I360-I364 VanDerWaalsContact O-CG1 3.23Å; I360-I364 WeakPolarHBondContact O-CG1 3.47Å; I360-I364 PolarHBondContact O-N 2.87Å; I360-I364 VanDerWaalsContact O-N 3.13Å; I361-I364 CarbonylContact O-C 3.59Å; I361-I364 WeakPolarHBondContact O-CB 3.34Å; I361-I364 PolarHBondContact O-N 3.5Å; I361-I364 VanDerWaalsContact O-N 3.09Å; A362-I364 PolarHBondContact O-N 3.39Å; I364-E366 PolarHBondContact O-N 2.91Å; I364-K367 CarbonylContact O-C 3.46Å; I364-K367 PolarHBondContact O-N 3.05Å; I364-V368 HydrophobicContact CG2-CG2 4.01Å; I364-V368 WeakPolarHBondContact O-CB 3.33Å; I364-V368 VanDerWaalsContact O-CG2 3.24Å; I364-V368 WeakPolarHBondContact O-CG2 3.34Å; I364-V368 PolarHBondContact O-N 2.87Å
365	E	50.3	Low	51.8	Low	129 Å²	129	107.9 Å²	107.9	60%	0.603	59%	0.59	S	S	*	*	H	α-helix	trans	-61.7	-44.9	-179.6	-70.4	-177.8	161.6	0	0	111.5	I361 A362 K367 V368	I361-E365 HydrophobicContact CG2-CG 4.22Å; I361-E365 WeakPolarHBondContact O-CG 3.24Å; I361-E365 PolarHBondContact O-N 3.24Å; A362-E365 PolarHBondContact O-N 3.15Å; E365-K367 PolarHBondContact O-N 2.72Å; E365-V368 PolarHBondContact O-N 3.38Å
366	E	49.5	Very low	51.4	Low	155 Å²	155	105.7 Å²	105.7	72%	0.724	58%	0.584	S	S	*	*	H	α-helix	trans	-58.7	-21.5	173.8	-169.8	-171.2	-143.1	0	0	113.2	A362 I364	A362-E366 VanDerWaalsContact O-CB 3.25Å; A362-E366 WeakPolarHBondContact O-CB 3.31Å; A362-E366 PolarHBondContact O-N 3.26Å; I364-E366 PolarHBondContact O-N 2.91Å
367	K	46.5	Very low	50.6	Low	133 Å²	133	105.1 Å²	105.1	58%	0.578	59%	0.585	S	S	*	*	H	α-helix	trans	-106.6	-1	178.2	-68.9	179.7	-172.5	65.3	0	114.1	I363 I364 E365	I363-K367 WeakPolarHBondContact O-CG 3.44Å; I363-K367 PolarHBondContact O-NZ 2.69Å; I364-K367 CarbonylContact O-C 3.46Å; I364-K367 PolarHBondContact O-N 3.05Å; E365-K367 PolarHBondContact O-N 2.72Å
368	V	44.6	Very low	50	Low	68 Å²	68	104.8 Å²	104.8	41%	0.412	59%	0.587	S	S	.	*	H	α-helix	trans	-92.4	-33.3	-179.5	157.6	0	0	0	0	111.8	I364 E365 D370 S371 V372	I364-V368 HydrophobicContact CG2-CG2 4.01Å; I364-V368 WeakPolarHBondContact O-CB 3.33Å; I364-V368 VanDerWaalsContact O-CG2 3.24Å; I364-V368 WeakPolarHBondContact O-CG2 3.34Å; I364-V368 PolarHBondContact O-N 2.87Å; E365-V368 PolarHBondContact O-N 3.38Å; V368-D370 PolarHBondContact O-N 2.92Å; V368-D370 VanDerWaalsContact O-N 3.12Å; V368-S371 PolarHBondContact O-N 3.37Å; V368-V372 HydrophobicContact CG1-CG2 3.63Å; V368-V372 VanDerWaalsContact O-CG2 3.3Å; V368-V372 WeakPolarHBondContact O-CG2 3.35Å
369	D	38.9	Very low	49.1	Very low	145 Å²	145	106 Å²	106	78%	0.775	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-29.6	-177.7	-85.7	-18.7	0	0	0	114.1	S371	D369-S371 VanDerWaalsContact C-N 3.31Å; D369-S371 PolarHBondContact O-N 2.85Å
370	D	43.7	Very low	49.2	Very low	172 Å²	172	104.1 Å²	104.1	92%	0.92	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	3.5	177.7	-97.9	-9.5	0	0	0	114.5	V368	V368-D370 PolarHBondContact O-N 2.92Å; V368-D370 VanDerWaalsContact O-N 3.12Å
371	S	41.4	Very low	48.9	Very low	89 Å²	89	102.7 Å²	102.7	62%	0.622	58%	0.578	S	S	*	*			trans	-142.4	10	-173.4	-167.1	0	0	0	0	117.2	V368 D369 E373	V368-S371 PolarHBondContact O-N 3.37Å; D369-S371 VanDerWaalsContact C-N 3.31Å; D369-S371 PolarHBondContact O-N 2.85Å; S371-E373 VanDerWaalsContact C-N 3.32Å; S371-E373 PolarHBondContact O-N 3.35Å
372	V	47.2	Very low	48.6	Very low	113 Å²	113	99.9 Å²	99.9	69%	0.685	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	66.2	179.8	-164.1	0	0	0	0	113.1	V368	V368-V372 HydrophobicContact CG1-CG2 3.63Å; V368-V372 VanDerWaalsContact O-CG2 3.3Å; V368-V372 WeakPolarHBondContact O-CG2 3.35Å
373	E	45.3	Very low	47.6	Very low	197 Å²	197	100.1 Å²	100.1	92%	0.921	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141	5.5	169.9	-140.1	177.4	-154.9	0	0	115.3	S371	S371-E373 VanDerWaalsContact C-N 3.32Å; S371-E373 PolarHBondContact O-N 3.35Å
374	A	47.8	Very low	47	Very low	93 Å²	93	97.4 Å²	97.4	77%	0.769	56%	0.555	S	S	*	*			trans	-140.3	25.8	-169.3	0	0	0	0	0	117.1
375	L	47.5	Very low	47.2	Very low	170 Å²	170	96 Å²	96	89%	0.89	55%	0.554	S	S	*	*			trans	-99.7	111.1	170.7	-83.9	166.6	0	0	0	111.3
376	D	50.7	Low	46.8	Very low	114 Å²	114	94.5 Å²	94.5	61%	0.61	55%	0.549	S	S	*	.			trans	-68.5	128.3	-179	-174.9	-2.1	0	0	0	111.6	A378 A379	D376-A378 PolarHBondContact O-N 3.25Å; D376-A378 VanDerWaalsContact O-N 3.13Å; D376-A378 PolarHBondContact OD1-N 2.97Å; D376-A379 WeakPolarHBondContact O-CB 3.43Å; D376-A379 PolarHBondContact O-N 2.73Å
377	A	47.5	Very low	46.4	Very low	45 Å²	45	91 Å²	91	37%	0.372	54%	0.54	S	S	.	.	H	α-helix	trans	-57.3	-26.7	177.5	0	0	0	0	0	112.9	A379 V380 E381	A377-A379 VanDerWaalsContact C-N 3.25Å; A377-A379 PolarHBondContact O-N 3.24Å; A377-V380 PolarHBondContact O-N 3.39Å; A377-E381 PolarHBondContact O-N 3.3Å
378	A	45.2	Very low	46.2	Very low	43 Å²	43	87.7 Å²	87.7	36%	0.355	53%	0.527	S	S	.	.	H	α-helix	trans	-60.6	-32.3	174.4	0	0	0	0	0	113.1	D376 A382	D376-A378 PolarHBondContact O-N 3.25Å; D376-A378 VanDerWaalsContact O-N 3.13Å; D376-A378 PolarHBondContact OD1-N 2.97Å; A378-A382 WeakPolarHBondContact O-CB 3.29Å; A378-A382 PolarHBondContact O-N 3.49Å; A378-A382 VanDerWaalsContact O-N 3.14Å
379	A	43.6	Very low	45.7	Very low	60 Å²	60	90.9 Å²	90.9	50%	0.496	54%	0.537	S	S	.	.	H	α-helix	trans	-73	-34.2	176.5	0	0	0	0	0	112.1	D376 A377 A383	D376-A379 WeakPolarHBondContact O-CB 3.43Å; D376-A379 PolarHBondContact O-N 2.73Å; A377-A379 VanDerWaalsContact C-N 3.25Å; A377-A379 PolarHBondContact O-N 3.24Å; A379-A383 WeakPolarHBondContact O-CB 3.46Å; A379-A383 PolarHBondContact O-N 2.84Å
380	V	55.2	Low	45.6	Very low	63 Å²	63	88 Å²	88	38%	0.382	53%	0.534	S	S	.	.	H	α-helix	trans	-70.1	-47.8	178.5	-178.9	0	0	0	0	110.9	A377 A382 A383 L384	A377-V380 PolarHBondContact O-N 3.39Å; V380-A382 VanDerWaalsContact C-N 3.32Å; V380-A382 PolarHBondContact O-N 2.91Å; V380-A383 PolarHBondContact O-N 3.46Å; V380-L384 HydrophobicContact CG1-CD1 3.86Å; V380-L384 VanDerWaalsContact O-CG 3.32Å; V380-L384 WeakPolarHBondContact O-CG 3.38Å; V380-L384 PolarHBondContact O-N 3.24Å
381	E	54.3	Low	45.4	Very low	52 Å²	52	85.7 Å²	85.7	24%	0.243	53%	0.526	C	S	.	.	H	α-helix	trans	-61.7	-39.6	174.9	-73.6	-70.2	126.9	0	0	111.8	I105 A377 A383 L384 S385	I105-E381 WeakPolarHBondContact CG1-OE1 3.46Å; A377-E381 PolarHBondContact O-N 3.3Å; E381-A383 PolarHBondContact O-N 2.89Å; E381-L384 PolarHBondContact O-N 2.97Å; E381-S385 PolarHBondContact O-N 2.83Å
382	A	50.1	Low	45.2	Very low	22 Å²	22	86 Å²	86	18%	0.182	53%	0.528	C	S	.	.	H	α-helix	trans	-66.1	-36.8	178.4	0	0	0	0	0	112.8	A378 V380 L711	A378-A382 WeakPolarHBondContact O-CB 3.29Å; A378-A382 PolarHBondContact O-N 3.49Å; A378-A382 VanDerWaalsContact O-N 3.14Å; V380-A382 VanDerWaalsContact C-N 3.32Å; V380-A382 PolarHBondContact O-N 2.91Å; A382-L711 HydrophobicContact CB-CD1 4.29Å; A382-L711 HydrophobicContact CB-CD2 3.93Å; A382-L711 HydrophobicContact CB-CG 4.15Å
383	A	42.4	Very low	44.6	Very low	54 Å²	54	88.9 Å²	88.9	45%	0.446	53%	0.534	S	S	.	.	H	α-helix	trans	-68.6	-40.5	172.7	0	0	0	0	0	112.3	A379 V380 E381 L386	A379-A383 WeakPolarHBondContact O-CB 3.46Å; A379-A383 PolarHBondContact O-N 2.84Å; V380-A383 PolarHBondContact O-N 3.46Å; E381-A383 PolarHBondContact O-N 2.89Å; A383-L386 PolarHBondContact O-N 2.88Å
384	L	45.2	Very low	43.9	Very low	34 Å²	34	82.5 Å²	82.5	18%	0.178	52%	0.521	C	S	.	.	H	α-helix	trans	-70.9	-31.6	-180	-68.3	166.7	0	0	0	112.7	L108 V380 E381 L386 C387 E388	L108-L384 HydrophobicContact CB-CD1 4.12Å; L108-L384 HydrophobicContact CD1-CB 4.02Å; L108-L384 HydrophobicContact CD1-CD1 3.76Å; L108-L384 HydrophobicContact CD1-CG 4.43Å; V380-L384 HydrophobicContact CG1-CD1 3.86Å; V380-L384 VanDerWaalsContact O-CG 3.32Å; V380-L384 WeakPolarHBondContact O-CG 3.38Å; V380-L384 PolarHBondContact O-N 3.24Å; E381-L384 PolarHBondContact O-N 2.97Å; L384-L386 VanDerWaalsContact C-N 3.29Å; L384-L386 PolarHBondContact O-N 3.48Å; L384-C387 WeakPolarHBondContact O-CB 3.48Å; L384-C387 PolarHBondContact O-N 2.82Å; L384-C387 VanDerWaalsContact O-N 3.13Å; L384-E388 PolarHBondContact O-N 3.1Å
385	S	53.8	Low	43	Very low	66 Å²	66	86.7 Å²	86.7	46%	0.462	52%	0.524	S	S	.	.	H	α-helix	trans	-62.4	-33.9	174.7	-169	0	0	0	0	113	E381 C387 E388 E389	E381-S385 PolarHBondContact O-N 2.83Å; S385-C387 VanDerWaalsContact C-N 3.27Å; S385-C387 PolarHBondContact O-N 3.37Å; S385-E388 PolarHBondContact O-N 3.41Å; S385-E389 PolarHBondContact O-N 3.39Å
386	L	43.5	Very low	42	Very low	96 Å²	96	85.2 Å²	85.2	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-67	-29.8	175.5	-74.9	164.1	0	0	0	112.1	A383 L384 A390 L711	A383-L386 PolarHBondContact O-N 2.88Å; L384-L386 VanDerWaalsContact C-N 3.29Å; L384-L386 PolarHBondContact O-N 3.48Å; L386-A390 PolarHBondContact O-N 3.47Å; L386-L711 HydrophobicContact CD1-CD2 3.99Å
387	C	40.6	Very low	41.2	Very low	81 Å²	81	87.4 Å²	87.4	55%	0.547	53%	0.533	S	S	.	.	H	α-helix	trans	-73.8	-33.9	175.6	-61.7	0	0	0	0	112.6	L384 S385 V391	L384-C387 WeakPolarHBondContact O-CB 3.48Å; L384-C387 PolarHBondContact O-N 2.82Å; L384-C387 VanDerWaalsContact O-N 3.13Å; S385-C387 VanDerWaalsContact C-N 3.27Å; S385-C387 PolarHBondContact O-N 3.37Å; C387-V391 WeakPolarHBondContact O-CG2 3.47Å
388	E	41.3	Very low	40.5	Very low	65 Å²	65	91.1 Å²	91.1	30%	0.304	55%	0.554	S	S	.	*	H	α-helix	trans	-74	-33.7	175.9	-68.8	-169.5	137.4	0	0	112.4	R104 L108 L384 S385 V391 S392	R104-E388 IonicContact CZ-OE1 2.76Å; R104-E388 IonicContact NH1-OE1 2.91Å; R104-E388 IonicContact NH2-OE1 3.95Å; R104-E388 PolarHBondContact NH2-OE1 3.24Å; R104-E388 IonicContact NH2-OE2 2.7Å; R104-E388 PolarHBondContact NH2-OE2 3.47Å; L108-E388 HydrophobicContact CD2-CG 4.42Å; L384-E388 PolarHBondContact O-N 3.1Å; S385-E388 PolarHBondContact O-N 3.41Å; E388-V391 PolarHBondContact O-N 3.22Å; E388-S392 PolarHBondContact O-N 2.96Å; E388-S392 PolarHBondContact O-OG 3.06Å
389	E	33.8	Very low	39.9	Very low	134 Å²	134	92.3 Å²	92.3	63%	0.626	57%	0.57	S	S	*	*	H	α-helix	trans	-68.3	-43.5	178.2	-166.3	163.6	-165.8	0	0	111.5	S385 V391 S392	S385-E389 PolarHBondContact O-N 3.39Å; E389-V391 PolarHBondContact O-N 3.11Å; E389-S392 WeakPolarHBondContact O-CB 3.39Å; E389-S392 PolarHBondContact O-N 3.45Å
390	A	38	Very low	39.6	Very low	85 Å²	85	95 Å²	95	70%	0.702	58%	0.582	S	S	*	*	H	α-helix	trans	-64.9	-20.8	176.7	0	0	0	0	0	114.7	L386	L386-A390 PolarHBondContact O-N 3.47Å
391	V	38.6	Very low	38.4	Very low	124 Å²	124	104.5 Å²	104.5	75%	0.752	61%	0.611	S	S	*	*	H	α-helix	trans	-89.5	-14.3	175	174	0	0	0	0	111.9	C387 E388 E389	C387-V391 WeakPolarHBondContact O-CG2 3.47Å; E388-V391 PolarHBondContact O-N 3.22Å; E389-V391 PolarHBondContact O-N 3.11Å
392	S	37.3	Very low	37.1	Very low	95 Å²	95	110 Å²	110	66%	0.664	64%	0.637	S	S	*	*	H	α-helix	trans	-89.1	-25.6	-174	-63.5	0	0	0	0	114.4	E388 E389 G394	E388-S392 PolarHBondContact O-N 2.96Å; E388-S392 PolarHBondContact O-OG 3.06Å; E389-S392 WeakPolarHBondContact O-CB 3.39Å; E389-S392 PolarHBondContact O-N 3.45Å; S392-G394 PolarHBondContact O-N 3.34Å
393	E	35.3	Very low	36.3	Very low	174 Å²	174	115.4 Å²	115.4	81%	0.813	67%	0.668	S	S	*	*			trans	-80.7	55.7	174.4	-69.1	-151.4	125.6	0	0	113	H395	E393-H395 PolarHBondContact O-N 2.92Å; E393-H395 VanDerWaalsContact O-N 3.14Å
394	G	31.2	Very low	35.6	Very low	63 Å²	63	120.6 Å²	120.6	65%	0.649	68%	0.683	S	S	*	*			trans	-67.1	107.4	170.4	0	0	0	0	0	111.7	S392 T396	S392-G394 PolarHBondContact O-N 3.34Å; G394-T396 PolarHBondContact O-N 3.16Å; G394-T396 VanDerWaalsContact O-N 3.17Å
395	H	28.6	Very low	34.6	Very low	180 Å²	180	126.6 Å²	126.6	83%	0.833	72%	0.716	S	S	*	*			trans	-57	117.1	177.3	-75	-57.8	0	0	0	112.5	E393 L397	E393-H395 PolarHBondContact O-N 2.92Å; E393-H395 VanDerWaalsContact O-N 3.14Å; H395-L397 PolarHBondContact O-N 3.48Å; H395-L397 VanDerWaalsContact O-N 3.11Å
396	T	26.3	Very low	33.3	Very low	140 Å²	140	132 Å²	132	86%	0.859	74%	0.738	S	S	*	*			trans	-72.4	100.2	168.4	30.3	0	0	0	0	110.7	G394	G394-T396 PolarHBondContact O-N 3.16Å; G394-T396 VanDerWaalsContact O-N 3.17Å
397	L	33.1	Very low	32.5	Very low	159 Å²	159	136.5 Å²	136.5	83%	0.832	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-60.5	134.9	170.9	-66	175.6	0	0	0	110.8	H395 G399	H395-L397 PolarHBondContact O-N 3.48Å; H395-L397 VanDerWaalsContact O-N 3.11Å; L397-G399 PolarHBondContact O-N 3.22Å
398	P	33.1	Very low	32	Very low	124 Å²	124	138.8 Å²	138.8	81%	0.805	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-77	117.9	174.7	30.3	-32.6	0	0	0	111
399	G	33.3	Very low	31.2	Very low	67 Å²	67	141.5 Å²	141.5	69%	0.691	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-71.3	173	156.2	0	0	0	0	0	111.6	L397	L397-G399 PolarHBondContact O-N 3.22Å
400	P	37.3	Very low	30.8	Very low	116 Å²	116	144.1 Å²	144.1	75%	0.753	81%	0.806	S	S	*	*			cis	-119.6	157.6	20.5	39	-28.2	0	0	0	114.8
401	W	29	Very low	30.5	Very low	263 Å²	263	145.5 Å²	145.5	100%	0.996	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-99.4	117.5	156.4	-77.2	20	0	0	0	108.1
402	E	27.1	Very low	30.2	Very low	167 Å²	167	145.7 Å²	145.7	78%	0.78	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-98.8	128.8	-180	-170.4	166.2	-136.8	0	0	109.6	Q404	E402-Q404 PolarHBondContact O-N 3.43Å
403	T	33.3	Very low	29.8	Very low	137 Å²	137	148 Å²	148	84%	0.84	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-66.6	120.2	-171.6	-36.2	0	0	0	0	111.3
404	Q	27.3	Very low	29.5	Very low	163 Å²	163	148.6 Å²	148.6	76%	0.762	82%	0.824	S	S	*	*			trans	-123.4	125.4	169.7	-63.4	-168.2	16.9	0	0	110.5	E402 L406	E402-Q404 PolarHBondContact O-N 3.43Å; Q404-L406 PolarHBondContact O-N 2.89Å
405	D	26	Very low	29.2	Very low	160 Å²	160	155.2 Å²	155.2	86%	0.856	84%	0.838	S	S	*	*			trans	-67.8	122.5	178.4	-68.8	-71.8	0	0	0	111.3
406	L	24.9	Very low	29.1	Very low	178 Å²	178	151.3 Å²	151.3	93%	0.932	84%	0.837	S	S	*	*			trans	-73	128.2	172.3	-66.5	176.3	0	0	0	110.6	Q404	Q404-L406 PolarHBondContact O-N 2.89Å
407	K	26.4	Very low	29.2	Very low	192 Å²	192	149 Å²	149	84%	0.835	83%	0.832	S	S	*	*			trans	-129.3	130.5	169.5	-164.4	171.3	-175.9	175.1	0	109.3
408	P	30.3	Very low	29	Very low	129 Å²	129	147.4 Å²	147.4	84%	0.838	83%	0.831	S	S	*	*			trans	-75.8	153.8	-167.7	30	-36.4	0	0	0	113.2
409	S	24.4	Very low	28.7	Very low	121 Å²	121	148.6 Å²	148.6	85%	0.846	84%	0.836	S	S	*	*			trans	-147.1	144.9	170.7	54.6	0	0	0	0	110.7
410	E	27	Very low	28.4	Very low	190 Å²	190	152.9 Å²	152.9	89%	0.888	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-92.3	171.7	-169.8	-100.1	179.9	150.7	0	0	113.4
411	P	31.3	Very low	27.9	Very low	113 Å²	113	154 Å²	154	73%	0.734	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-72.5	165.8	-161.6	27.1	-35.7	0	0	0	116.4
412	P	31.7	Very low	27.8	Very low	129 Å²	129	147.2 Å²	147.2	84%	0.838	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-86.1	155	-160.2	33.9	-37.6	0	0	0	115.7
413	V	28.1	Very low	27.9	Very low	142 Å²	142	147.3 Å²	147.3	86%	0.861	82%	0.816	S	S	*	*			trans	-126.9	152.1	167.8	-179.5	0	0	0	0	109.5
414	Q	29.1	Very low	27.6	Very low	187 Å²	187	147.6 Å²	147.6	87%	0.874	81%	0.813	S	S	*	*			trans	-79.5	157.6	-161.6	-63.5	162.2	-9.5	0	0	114.7
415	H	25.2	Very low	27.8	Very low	202 Å²	202	143.7 Å²	143.7	94%	0.935	81%	0.808	S	S	*	*			trans	-68.3	136.1	173.5	-89.5	-85.2	0	0	0	113
416	A	26.9	Very low	27.8	Very low	99 Å²	99	141.2 Å²	141.2	82%	0.818	80%	0.804	S	S	*	*			trans	-139.9	157.9	159.2	0	0	0	0	0	110.4
417	A	27.4	Very low	28	Very low	91 Å²	91	137.1 Å²	137.1	75%	0.752	80%	0.795	S	S	*	*			trans	-80.4	158.9	-170.2	0	0	0	0	0	113.8
418	P	29.5	Very low	28.1	Very low	125 Å²	125	132.4 Å²	132.4	81%	0.812	79%	0.793	S	S	*	*			trans	-82.6	152.5	-170.4	33.4	-36.7	0	0	0	114.3
419	V	27.2	Very low	28	Very low	150 Å²	150	134.5 Å²	134.5	91%	0.909	80%	0.796	S	S	*	*			trans	-128.5	149.4	162.5	179	0	0	0	0	108.2
420	Q	27.5	Very low	28.2	Very low	157 Å²	157	134.9 Å²	134.9	73%	0.734	79%	0.792	S	S	*	*			trans	-114.1	148.8	-158.5	177.3	176.5	-33.8	0	0	112.7
421	E	26	Very low	29.1	Very low	140 Å²	140	131.1 Å²	131.1	65%	0.654	79%	0.785	S	S	*	*			trans	54.8	122.7	166.6	-77.2	170.6	90.7	0	0	119
422	N	26.8	Very low	28.9	Very low	119 Å²	119	130.8 Å²	130.8	64%	0.636	79%	0.785	S	S	*	*				-176.8	150.1	93.2	-97.1	-71.4	0	0	0	113.1
423	Q	30.4	Very low	28.7	Very low	169 Å²	169	129.4 Å²	129.4	79%	0.79	78%	0.778	S	S	*	*			trans	41.7	144	136.3	-65.5	172.3	52.7	0	0	121.2
424	D	26.4	Very low	28.6	Very low	143 Å²	143	127.8 Å²	127.8	77%	0.765	77%	0.773	S	S	*	*			cis	-170.6	164.2	-9.7	-174.9	17.6	0	0	0	108.4
425	A	30.7	Very low	28.6	Very low	81 Å²	81	123.3 Å²	123.3	67%	0.669	77%	0.769	S	S	*	*			trans	59.9	165.9	158.1	0	0	0	0	0	119.6
426	S	27.4	Very low	28.7	Very low	109 Å²	109	121.3 Å²	121.3	76%	0.762	76%	0.764	S	S	*	*			cis	-166.6	166.8	-38.4	63.9	0	0	0	0	109.1
427	A	28.7	Very low	28.7	Very low	91 Å²	91	124.6 Å²	124.6	75%	0.752	76%	0.762	S	S	*	*			trans	60.4	119.8	173.1	0	0	0	0	0	116.4
428	A	27.7	Very low	28.6	Very low	94 Å²	94	129.3 Å²	129.3	78%	0.777	77%	0.771	S	S	*	*			cis	67.8	114.3	48.3	0	0	0	0	0	114.7
429	L	29.1	Very low	28.4	Very low	172 Å²	172	132 Å²	132	90%	0.901	77%	0.773	S	S	*	*			trans	-168.9	156.5	133.6	-102.6	166.2	0	0	0	111.7
430	V	29.1	Very low	28.3	Very low	129 Å²	129	130.7 Å²	130.7	78%	0.782	77%	0.771	S	S	*	*			trans	-133.5	177.2	180	-123.8	0	0	0	0	106.3
431	P	45.1	Very low	28.2	Very low	112 Å²	112	131.8 Å²	131.8	73%	0.727	78%	0.776	S	S	*	*			cis	-139.5	-172.8	-9.7	38.1	-17.6	0	0	0	115.3
432	S	27.3	Very low	29.2	Very low	106 Å²	106	130.4 Å²	130.4	74%	0.741	78%	0.779	S	S	*	*			trans	56.7	127.2	136.4	-177.6	0	0	0	0	122.1
433	S	26.6	Very low	29.1	Very low	99 Å²	99	130.4 Å²	130.4	69%	0.692	78%	0.779	S	S	*	*				173.8	143.9	96	-164.4	0	0	0	0	116.2
434	S	26.1	Very low	29	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	78%	0.782	S	S	*	*			trans	43.6	127.9	144.1	60.3	0	0	0	0	123.3
435	A	29.5	Very low	29.1	Very low	94 Å²	94	132.1 Å²	132.1	78%	0.777	78%	0.783	S	S	*	*			trans	-72.4	170.5	164.7	0	0	0	0	0	114.9
436	L	27.1	Very low	28.9	Very low	160 Å²	160	138.2 Å²	138.2	84%	0.838	79%	0.788	S	S	*	*				-164.7	170.4	128.4	-105.9	168.3	0	0	0	112
437	E	28.3	Very low	28.9	Very low	167 Å²	167	139.3 Å²	139.3	78%	0.78	78%	0.782	S	S	*	*			trans	-85.6	161.6	-170.6	-57.2	151.7	90.3	0	0	114.2
438	M	25	Very low	28.9	Very low	190 Å²	190	141 Å²	141	94%	0.936	77%	0.774	S	S	*	*				-172.5	158.3	123.9	-105	172.2	63.3	0	0	113.8
439	Q	25.5	Very low	28.8	Very low	181 Å²	181	144.5 Å²	144.5	85%	0.846	77%	0.774	S	S	*	*			trans	-91.1	152.2	179.2	-59.8	169.3	-13.7	0	0	112.2
440	S	24.4	Very low	28.7	Very low	124 Å²	124	143.7 Å²	143.7	87%	0.867	76%	0.764	S	S	*	*			trans	-170.4	138.8	141.7	19.2	0	0	0	0	114.8
441	Q	25.1	Very low	28.6	Very low	180 Å²	180	146.5 Å²	146.5	84%	0.841	77%	0.765	S	S	*	*			trans	-105.8	176.5	150.9	-97.3	-159.8	29.1	0	0	107.2
442	P	46.3	Very low	27.8	Very low	110 Å²	110	144.3 Å²	144.3	71%	0.714	76%	0.763	S	S	*	*			cis	-147	164.5	23.7	44.2	-24.6	0	0	0	119.7
443	N	25.8	Very low	27.6	Very low	119 Å²	119	145.8 Å²	145.8	64%	0.636	77%	0.774	S	S	*	*			trans	44	133.4	131.4	-171	33.5	0	0	0	123.2
444	I	27.3	Very low	27.6	Very low	167 Å²	167	144.1 Å²	144.1	86%	0.856	77%	0.772	S	S	*	*			trans	-155.8	151	132.7	-105.3	157	0	0	0	110.4
445	K	28.4	Very low	27.7	Very low	181 Å²	181	148.9 Å²	148.9	79%	0.787	78%	0.783	S	S	*	*			trans	-123.4	164.8	-179.4	-63.5	-178.7	176.7	-176.7	0	112.2
446	R	27.1	Very low	27.5	Very low	209 Å²	209	148.1 Å²	148.1	79%	0.789	78%	0.784	S	S	*	*			trans	-173.7	157.4	143.9	-99.2	-155	145.7	71.6	18.7	110.3
447	E	28.5	Very low	27.7	Very low	132 Å²	132	145.2 Å²	145.2	62%	0.617	78%	0.783	S	S	*	*			cis	-175.5	169	-28.9	-122.1	165.8	-132.7	0	0	106.7
448	E	27.8	Very low	27.7	Very low	127 Å²	127	146.1 Å²	146.1	59%	0.593	79%	0.787	S	S	*	*			cis	-126	-128.8	-2.9	-160	-147	152.7	0	0	107.6	F450	E448-F450 WeakPolarHBondContact OE1-CB 3.44Å
449	Q	26.6	Very low	28	Very low	168 Å²	168	141.5 Å²	141.5	79%	0.785	78%	0.779	S	S	*	*			cis	-154.9	164.2	-17.5	-172.2	165.9	102	0	0	105.8
450	F	26.2	Very low	28.4	Very low	155 Å²	155	138.1 Å²	138.1	68%	0.68	78%	0.782	S	S	*	*				-172.2	152	-55.9	177.2	-109.9	0	0	0	107.4	E448	E448-F450 WeakPolarHBondContact OE1-CB 3.44Å
451	K	27.3	Very low	28.6	Very low	187 Å²	187	136.1 Å²	136.1	81%	0.813	78%	0.781	S	S	*	*			trans	72.4	162.4	167.4	-111.4	179.5	-176.8	-177.3	0	120.4
452	G	26.7	Very low	29.1	Very low	66 Å²	66	133 Å²	133	68%	0.68	78%	0.779	S	S	*	*			trans	177.7	-167.9	177.4	0	0	0	0	0	112.6
453	S	24.9	Very low	28.5	Very low	138 Å²	138	135.2 Å²	135.2	97%	0.965	79%	0.785	S	S	*	*			trans	75.9	137	176.9	-160	0	0	0	0	118.6
454	G	25.4	Very low	28.8	Very low	64 Å²	64	137.6 Å²	137.6	66%	0.66	80%	0.796	S	S	*	*			trans	130.5	88.6	158.4	0	0	0	0	0	118.5
455	E	28.3	Very low	29	Very low	208 Å²	208	136.8 Å²	136.8	97%	0.972	79%	0.793	S	S	*	*			trans	33	138.4	145.3	-58.9	175.9	102.6	0	0	123.2
456	G	25.4	Very low	29.1	Very low	78 Å²	78	133.3 Å²	133.3	80%	0.804	79%	0.792	S	S	*	*			trans	166.3	87.3	161.4	0	0	0	0	0	120.3
457	A	30.9	Very low	29.5	Very low	98 Å²	98	128.5 Å²	128.5	81%	0.81	79%	0.79	S	S	*	*			trans	56.1	120.5	145.7	0	0	0	0	0	124.8
458	E	28.1	Very low	29.6	Very low	187 Å²	187	130.9 Å²	130.9	87%	0.874	81%	0.806	S	S	*	*				66.4	102.5	128.1	-60.4	-153	119.8	0	0	125.4
459	A	33	Very low	29.9	Very low	93 Å²	93	129 Å²	129	77%	0.769	81%	0.813	S	S	*	*				88.6	154.6	101.7	0	0	0	0	0	124.2
460	A	33.1	Very low	30.1	Very low	109 Å²	109	126.8 Å²	126.8	90%	0.901	82%	0.816	S	S	*	*			trans	85	130.1	174	0	0	0	0	0	117.5
461	G	28.4	Very low	30.5	Very low	83 Å²	83	127.3 Å²	127.3	86%	0.856	83%	0.825	S	S	*	*			cis	-141	173.2	1.8	0	0	0	0	0	113.4
462	S	35.3	Very low	30.5	Very low	114 Å²	114	126.1 Å²	126.1	80%	0.797	83%	0.828	S	S	*	*			trans	-121.6	175.8	-162.4	65.2	0	0	0	0	115.3
463	D	34.8	Very low	30.5	Very low	156 Å²	156	125.8 Å²	125.8	83%	0.834	82%	0.824	S	S	*	*			trans	-57.7	169.2	171.3	-47.9	-92.6	0	0	0	114.6
464	I	32.1	Very low	30.7	Very low	170 Å²	170	125.9 Å²	125.9	87%	0.872	82%	0.82	S	S	*	*			trans	-122	134.4	172.9	-45.1	174.5	0	0	0	108.7
465	N	31.5	Very low	30.9	Very low	149 Å²	149	127.9 Å²	127.9	80%	0.797	83%	0.83	S	S	*	*			trans	-140.6	150	171.9	-175.5	18.2	0	0	0	109.7
466	S	30.7	Very low	30.9	Very low	109 Å²	109	121.4 Å²	121.4	76%	0.762	82%	0.819	S	S	*	*			trans	-156.8	113	176.8	63.3	0	0	0	0	112.6
467	S	34.7	Very low	31.1	Very low	108 Å²	108	122.5 Å²	122.5	76%	0.755	81%	0.814	S	S	*	*			trans	-93.1	161.6	169.4	-47.3	0	0	0	0	111.1
468	L	30.8	Very low	31	Very low	181 Å²	181	125.7 Å²	125.7	95%	0.948	81%	0.812	S	S	*	*			trans	-162.4	168.4	146.2	-105.1	168.1	0	0	0	109.2
469	A	34.1	Very low	31.1	Very low	89 Å²	89	122.5 Å²	122.5	74%	0.736	81%	0.805	S	S	*	*			trans	-140	164.3	-166.5	0	0	0	0	0	113.4
470	S	31	Very low	30.8	Very low	121 Å²	121	124.6 Å²	124.6	85%	0.846	81%	0.809	S	S	*	*			trans	176.9	113.8	141.9	-96.1	0	0	0	0	115
471	D	33.4	Very low	30.7	Very low	165 Å²	165	127.6 Å²	127.6	88%	0.882	80%	0.804	S	S	*	*				67.5	157.9	124.5	-140.3	11.3	0	0	0	125.8
472	D	27.9	Very low	30.7	Very low	162 Å²	162	132.2 Å²	132.2	87%	0.866	80%	0.804	S	S	*	*			trans	79.1	149.1	163.3	-155.2	25.5	0	0	0	122.2
473	G	27.4	Very low	30.4	Very low	59 Å²	59	130.2 Å²	130.2	61%	0.608	79%	0.794	S	S	*	*			trans	125.4	127.3	168.2	0	0	0	0	0	116.3
474	T	28.3	Very low	30.1	Very low	141 Å²	141	129.2 Å²	129.2	87%	0.865	79%	0.793	S	S	*	*			trans	-151.7	144.5	179.7	-72.9	0	0	0	0	113.8
475	A	30.2	Very low	29.8	Very low	105 Å²	105	126 Å²	126	87%	0.868	79%	0.791	S	S	*	*			trans	67.8	156.5	171.1	0	0	0	0	0	117.8
476	G	27.4	Very low	29.5	Very low	73 Å²	73	122 Å²	122	75%	0.753	79%	0.785	S	S	*	*			cis	170.6	177.7	-7.5	0	0	0	0	0	114.6
477	S	30.9	Very low	29.2	Very low	100 Å²	100	123.2 Å²	123.2	70%	0.699	79%	0.789	S	S	*	*			trans	63.8	118.5	162.6	-80.3	0	0	0	0	124.3
478	E	28.8	Very low	28.9	Very low	165 Å²	165	126 Å²	126	77%	0.771	79%	0.787	S	S	*	*				73.7	121.1	118.8	-65.6	170	100.8	0	0	125.4
479	V	29	Very low	28.7	Very low	120 Å²	120	124.9 Å²	124.9	73%	0.727	78%	0.777	S	S	*	*				47.5	119.5	124.4	-170.1	0	0	0	0	121
480	T	27	Very low	28.4	Very low	138 Å²	138	125.3 Å²	125.3	85%	0.847	78%	0.781	S	S	*	*				-171.6	179.2	121.4	16.5	0	0	0	0	113.4
481	E	30.9	Very low	28.5	Very low	171 Å²	171	124 Å²	124	80%	0.799	78%	0.778	S	S	*	*			trans	-103.5	176.7	-153	-52.3	172.4	112.9	0	0	116.2
482	E	29.1	Very low	28	Very low	181 Å²	181	125.5 Å²	125.5	85%	0.846	78%	0.779	S	S	*	*			trans	78.6	143.1	140.6	-83.9	-119.4	102.2	0	0	124.4
483	A	28.7	Very low	28.1	Very low	71 Å²	71	121.3 Å²	121.3	59%	0.587	77%	0.767	S	S	*	*			trans	74.9	107.4	138.5	0	0	0	0	0	123.8
484	V	27.7	Very low	28	Very low	136 Å²	136	124.3 Å²	124.3	82%	0.824	77%	0.774	S	S	*	*				54.4	106.3	117.6	-177.2	0	0	0	0	119.9
485	A	26.8	Very low	28	Very low	101 Å²	101	123.9 Å²	123.9	84%	0.835	77%	0.771	S	S	*	*			trans	37.8	132.3	135.4	0	0	0	0	0	122.5
486	G	24.6	Very low	28	Very low	65 Å²	65	127.3 Å²	127.3	67%	0.67	77%	0.766	S	S	*	*			trans	155.5	120	135.8	0	0	0	0	0	118.9
487	T	24.5	Very low	28	Very low	136 Å²	136	129.3 Å²	129.3	83%	0.834	76%	0.764	S	S	*	*				65.1	101.5	128	-46.5	0	0	0	0	120.8
488	K	28.1	Very low	28.3	Very low	167 Å²	167	133.3 Å²	133.3	73%	0.726	77%	0.772	S	S	*	*				43.6	137.7	128	-87.3	179.1	146.8	-130.5	0	123.3
489	E	26.1	Very low	28.2	Very low	156 Å²	156	129.2 Å²	129.2	73%	0.729	77%	0.773	S	S	*	*			trans	72	106	139.1	-69.4	177.6	96.8	0	0	121.9
490	A	28.7	Very low	28.5	Very low	98 Å²	98	133 Å²	133	81%	0.81	78%	0.783	S	S	*	*				-164.6	138.4	117.9	0	0	0	0	0	108.6
491	A	32.6	Very low	28.2	Very low	95 Å²	95	133.7 Å²	133.7	79%	0.785	78%	0.782	S	S	*	*			cis	96.9	110.3	16.3	0	0	0	0	0	116.2
492	E	24.2	Very low	28	Very low	195 Å²	195	136.3 Å²	136.3	91%	0.911	78%	0.784	S	S	*	*			trans	-155.8	146.5	155	-96.8	-158.4	113.2	0	0	108.1
493	A	28.8	Very low	27.9	Very low	75 Å²	75	132 Å²	132	62%	0.62	77%	0.774	S	S	*	*			cis	-148.9	137.4	-3.1	0	0	0	0	0	112.6
494	T	26.7	Very low	27.9	Very low	121 Å²	121	136.1 Å²	136.1	74%	0.742	78%	0.781	S	S	*	*				24.1	140	127.5	-1.7	0	0	0	0	119.3
495	V	26.6	Very low	28.5	Very low	133 Å²	133	135.2 Å²	135.2	81%	0.806	78%	0.779	S	S	*	*			cis	-152.2	150.7	41.5	-176.5	0	0	0	0	114.7
496	K	30.8	Very low	28.9	Very low	176 Å²	176	136.3 Å²	136.3	77%	0.765	77%	0.766	S	S	*	*			trans	-46.7	172.2	170.9	-52.8	176.4	175.3	-178.6	0	117.2
497	T	28.1	Very low	30.1	Very low	116 Å²	116	138.1 Å²	138.1	71%	0.712	77%	0.766	S	S	*	*			cis	-159.3	175.3	20.7	-19.4	0	0	0	0	113
498	E	37.3	Very low	30.1	Very low	184 Å²	184	138.3 Å²	138.3	86%	0.86	76%	0.762	S	S	*	*			trans	-69.6	168.3	-174.8	-50.2	100.3	-115.3	0	0	118.8
499	G	26.3	Very low	31.6	Very low	78 Å²	78	135.1 Å²	135.1	80%	0.804	76%	0.758	S	S	*	*			trans	170.9	128.8	158.7	0	0	0	0	0	115.3
500	E	34.3	Very low	32.7	Very low	200 Å²	200	133.3 Å²	133.3	94%	0.935	76%	0.76	S	S	*	*			trans	-114.1	124.7	172.5	-63	176.5	104	0	0	111
501	D	22.3	Very low	32.6	Very low	152 Å²	152	133.4 Å²	133.4	81%	0.813	75%	0.754	S	S	*	*			trans	-175.6	179.1	147.4	-153.2	-3.2	0	0	0	111.3
502	W	24.8	Very low	32.5	Very low	226 Å²	226	136 Å²	136	86%	0.856	75%	0.753	S	S	*	*			trans	-131	-172.8	-170.6	-48.3	73.3	0	0	0	112
503	S	27.8	Very low	32.6	Very low	91 Å²	91	133.2 Å²	133.2	64%	0.636	75%	0.745	S	S	*	*			cis	-161.2	155.7	-0.6	-153.5	0	0	0	0	112.3
504	Q	29.2	Very low	32.9	Very low	157 Å²	157	134.8 Å²	134.8	73%	0.734	75%	0.752	S	S	*	*			trans	63.3	168.7	151	-90.4	-149.2	4.1	0	0	120.2
505	P	40.2	Very low	33.2	Very low	118 Å²	118	137.8 Å²	137.8	77%	0.766	76%	0.757	S	S	*	*			cis	-130.9	172.7	16.3	42.5	-25.6	0	0	0	120.5
506	E	35	Very low	33.1	Very low	124 Å²	124	139.3 Å²	139.3	58%	0.579	76%	0.761	S	S	*	*			trans	-48.8	166.4	168.6	-96.9	-72.2	126.4	0	0	117.2	N508	E506-N508 PolarHBondContact OE2-N 2.65Å
507	P	48.7	Very low	33.2	Very low	102 Å²	102	135 Å²	135	66%	0.662	75%	0.753	S	S	*	*				-156.7	135.4	76.6	40.3	-17.9	0	0	0	120.6
508	N	24.4	Very low	33.5	Very low	141 Å²	141	134.8 Å²	134.8	75%	0.754	76%	0.756	S	S	*	*				163.8	111.8	102.9	-85.7	-60	0	0	0	115.6	E506	E506-N508 PolarHBondContact OE2-N 2.65Å
509	P	60.4	Low	32.9	Very low	99 Å²	99	132.9 Å²	132.9	64%	0.643	76%	0.757	S	S	*	*			trans	-100	-148.7	156	42.5	-34.9	0	0	0	109.8	C511	P509-C511 HydrophobicContact CB-CB 4.46Å
510	P	48.5	Very low	32.9	Very low	118 Å²	118	134.1 Å²	134.1	77%	0.766	75%	0.753	S	S	*	*			cis	-125.5	164.1	37.5	44.1	-30	0	0	0	114
511	C	27.1	Very low	32.4	Very low	100 Å²	100	127.8 Å²	127.8	68%	0.676	74%	0.741	S	S	*	*			cis	85.7	129.7	19.3	-157.4	0	0	0	0	116.7	P509	P509-C511 HydrophobicContact CB-CB 4.46Å
512	L	29.8	Very low	32.6	Very low	149 Å²	149	128.8 Å²	128.8	78%	0.78	74%	0.738	S	S	*	*			trans	172.8	144.7	149.5	-71.6	-154.5	0	0	0	106.2
513	D	27	Very low	32.6	Very low	138 Å²	138	124.9 Å²	124.9	74%	0.738	73%	0.729	S	S	*	*			cis	-161.4	178.4	-12.5	-106.6	-14.4	0	0	0	110
514	S	36.4	Very low	32.7	Very low	108 Å²	108	125.4 Å²	125.4	76%	0.755	73%	0.733	S	S	*	*			trans	-151.8	175.9	179.4	-149.1	0	0	0	0	108.9
515	E	31.9	Very low	32.5	Very low	183 Å²	183	126.7 Å²	126.7	86%	0.855	74%	0.736	S	S	*	*			cis	-142	-157.1	14.1	-54.9	-177.4	79.3	0	0	111.2
516	D	25.4	Very low	32	Very low	165 Å²	165	127.7 Å²	127.7	88%	0.882	74%	0.74	S	S	*	*			trans	117.3	161.4	141.5	-150.5	17.2	0	0	0	118.9
517	S	31.9	Very low	31.8	Very low	87 Å²	87	127.2 Å²	127.2	61%	0.608	74%	0.736	S	S	*	*			trans	-122.9	138.8	-151.2	-173.5	0	0	0	0	115.1
518	S	35.6	Very low	30.8	Very low	110 Å²	110	131.4 Å²	131.4	77%	0.769	75%	0.747	S	S	*	*			trans	42.4	89.5	144.5	-48.1	0	0	0	0	119.9
519	V	23.7	Very low	31.3	Very low	145 Å²	145	131.3 Å²	131.3	88%	0.879	74%	0.742	S	S	*	*			trans	-152.2	164.2	148.6	111.7	0	0	0	0	114.7
520	S	26.2	Very low	30	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	75%	0.751	S	S	*	*			trans	-49.3	133.9	-167.4	57.8	0	0	0	0	119.9
521	G	24.2	Very low	29.1	Very low	66 Å²	66	132.6 Å²	132.6	68%	0.68	75%	0.747	S	S	*	*				70.1	138.6	100.6	0	0	0	0	0	122.2
522	K	26.4	Very low	29.2	Very low	174 Å²	174	131.3 Å²	131.3	76%	0.757	75%	0.75	S	S	*	*			trans	72.9	144.9	165.7	-67.7	179.7	160.6	-75.4	0	116.9
523	E	24.5	Very low	29.5	Very low	143 Å²	143	130 Å²	130	67%	0.668	75%	0.753	S	S	*	*			cis	-169.4	166.5	-13.8	-119.3	163.3	172.7	0	0	111.5
524	S	29.2	Very low	29.7	Very low	103 Å²	103	132.7 Å²	132.7	72%	0.72	76%	0.762	S	S	*	*			trans	84.3	118.2	148.5	-68.8	0	0	0	0	124.9
525	K	26.3	Very low	29.5	Very low	183 Å²	183	131 Å²	131	80%	0.796	76%	0.761	S	S	*	*			trans	72.4	147.1	134.8	-116.8	153	-179.7	167.3	0	118.4	K527	K525-K527 HydrophobicContact CG-CB 4.47Å
526	V	28.2	Very low	29.9	Very low	139 Å²	139	129.5 Å²	129.5	84%	0.842	76%	0.759	S	S	*	*			cis	-152.5	166.2	40.2	-179.3	0	0	0	0	110
527	K	30.7	Very low	31	Very low	114 Å²	114	127.5 Å²	127.5	50%	0.496	76%	0.755	S	S	.	*				172.1	112.7	-50	175.2	-105.4	-170.3	-170.3	0	110.6	K525 E529	K525-K527 HydrophobicContact CG-CB 4.47Å; K527-E529 HydrophobicContact CD-CG 4.35Å; K527-E529 WeakPolarHBondContact CE-OE1 3.48Å; K527-E529 IonicContact NZ-OE1 3.72Å; K527-E529 PolarHBondContact NZ-OE1 2.81Å; K527-E529 IonicContact NZ-OE2 3.31Å; K527-E529 PolarHBondContact NZ-OE2 3.11Å
528	E	28.1	Very low	31.5	Very low	190 Å²	190	130.1 Å²	130.1	89%	0.888	76%	0.762	S	S	*	*			trans	-152.9	112.5	153.9	-63.5	-167.9	144.7	0	0	104.3
529	E	35.1	Very low	31.9	Very low	140 Å²	140	132.3 Å²	132.3	65%	0.654	77%	0.765	S	S	*	*				67.9	117.5	68.2	-69.1	-167.3	154.7	0	0	114.3	K527	K527-E529 HydrophobicContact CD-CG 4.35Å; K527-E529 WeakPolarHBondContact CE-OE1 3.48Å; K527-E529 IonicContact NZ-OE1 3.72Å; K527-E529 PolarHBondContact NZ-OE1 2.81Å; K527-E529 IonicContact NZ-OE2 3.31Å; K527-E529 PolarHBondContact NZ-OE2 3.11Å
530	E	34.1	Very low	32.2	Very low	178 Å²	178	128.3 Å²	128.3	83%	0.832	75%	0.753	S	S	*	*			cis	-145.3	174	2.6	-85.1	-119.1	68.6	0	0	109.4
531	G	29.1	Very low	32.5	Very low	66 Å²	66	132.7 Å²	132.7	68%	0.68	76%	0.764	S	S	*	*			cis	126	143	10.1	0	0	0	0	0	110.4
532	G	29.3	Very low	33.3	Very low	73 Å²	73	138.3 Å²	138.3	75%	0.753	77%	0.773	S	S	*	*			cis	-113.2	-146.3	-1.5	0	0	0	0	0	113.7
533	S	36.3	Very low	33.5	Very low	120 Å²	120	138.5 Å²	138.5	84%	0.839	78%	0.781	S	S	*	*			cis	93.8	132.6	31.4	-73.2	0	0	0	0	115.1
534	E	31.1	Very low	34	Very low	196 Å²	196	139.2 Å²	139.2	92%	0.916	78%	0.782	S	S	*	*			cis	-128.6	-171.9	3.5	-62.2	-177.2	117.9	0	0	111.4
535	G	32.3	Very low	34.2	Very low	72 Å²	72	141.8 Å²	141.8	74%	0.742	78%	0.783	S	S	*	*			trans	-156.1	169.4	179	0	0	0	0	0	115.7
536	D	39.9	Very low	34.3	Very low	152 Å²	152	139.8 Å²	139.8	81%	0.813	78%	0.781	S	S	*	*			trans	58.4	135.6	170.6	-143.9	65.3	0	0	0	119
537	P	48.1	Very low	34.3	Very low	122 Å²	122	138.7 Å²	138.7	79%	0.792	78%	0.778	S	S	*	*				-144.9	169.1	106.9	40.2	-26.5	0	0	0	116.4
538	D	42.5	Very low	34.2	Very low	142 Å²	142	136.3 Å²	136.3	76%	0.759	79%	0.786	S	S	*	*			trans	-89	160.8	-171.2	-165.7	17.3	0	0	0	116.2
539	D	43.4	Very low	34.4	Very low	157 Å²	157	137.4 Å²	137.4	84%	0.84	79%	0.791	S	S	*	*			trans	41	145.4	162.8	-137.7	-27.5	0	0	0	122.8
540	G	31.9	Very low	34.1	Very low	60 Å²	60	134.1 Å²	134.1	62%	0.619	80%	0.795	S	S	*	*			trans	149	104	158.4	0	0	0	0	0	121.3
541	M	31.5	Very low	33.9	Very low	196 Å²	196	135.3 Å²	135.3	97%	0.966	80%	0.801	S	S	*	*			trans	72.8	148.5	140.2	-63.1	-169.5	175.5	0	0	124
542	E	40.9	Very low	34	Very low	184 Å²	184	135.3 Å²	135.3	86%	0.86	80%	0.801	S	S	*	*			trans	-74.9	157.4	163.3	-55.2	171.5	98.5	0	0	112.4
543	L	31.1	Very low	34.8	Very low	179 Å²	179	137.7 Å²	137.7	94%	0.937	80%	0.803	S	S	*	*			trans	-156.8	-171	134.2	-138.2	86.4	0	0	0	113
544	K	33.8	Very low	34.5	Very low	158 Å²	158	142 Å²	142	69%	0.687	80%	0.802	S	S	*	*			trans	-148.7	171.5	-157.6	-175.4	-153.9	162.9	-153.6	0	108.9
545	E	34.9	Very low	34.4	Very low	157 Å²	157	138.7 Å²	138.7	73%	0.734	79%	0.79	S	S	*	*			trans	80.3	153.7	164.6	-54.7	-171.7	166.6	0	0	116
546	D	27.4	Very low	34.4	Very low	141 Å²	141	140 Å²	140	75%	0.754	79%	0.788	S	S	*	*			cis	-170.7	172.7	-23.6	178.5	42.7	0	0	0	109.5
547	C	27.9	Very low	34.1	Very low	116 Å²	116	141.6 Å²	141.6	78%	0.784	79%	0.791	S	S	*	*			trans	67.6	156.9	171.9	-72.4	0	0	0	0	117.8
548	G	30.1	Very low	33.5	Very low	64 Å²	64	142 Å²	142	66%	0.66	79%	0.791	S	S	*	*			cis	169.2	156.6	-7.9	0	0	0	0	0	113.3
549	E	32.2	Very low	32.9	Very low	212 Å²	212	143.5 Å²	143.5	99%	0.991	79%	0.793	S	S	*	*			trans	65.2	145.5	172.2	-50	-173.6	140.5	0	0	117.2
550	G	28.2	Very low	32.1	Very low	72 Å²	72	146.6 Å²	146.6	74%	0.742	79%	0.793	S	S	*	*			cis	-167.6	179.9	-4.9	0	0	0	0	0	107.9
551	E	30	Very low	32.4	Very low	203 Å²	203	147.9 Å²	147.9	95%	0.949	80%	0.797	S	S	*	*			cis	-150.3	-168.3	1.4	-74.7	-160.6	77.1	0	0	109.8
552	G	30.7	Very low	32.4	Very low	66 Å²	66	143 Å²	143	68%	0.68	79%	0.788	S	S	*	*			trans	-100.3	-164.3	169.6	0	0	0	0	0	113.8
553	P	45.8	Very low	32.3	Very low	122 Å²	122	138.8 Å²	138.8	79%	0.792	78%	0.779	S	S	*	*				-153.7	169.8	53.2	41.9	-22.1	0	0	0	119.6
554	Y	29.8	Very low	32.6	Very low	211 Å²	211	138.2 Å²	138.2	83%	0.827	77%	0.772	S	S	*	*			trans	63.3	138.5	150.9	-106.9	-151.6	0	0	0	119.2
555	L	30.6	Very low	32.9	Very low	127 Å²	127	136.3 Å²	136.3	67%	0.665	78%	0.778	S	S	*	*			cis	-152.8	163.7	5.3	-85.9	165.5	0	0	0	107.3
556	S	32.1	Very low	32.9	Very low	100 Å²	100	137 Å²	137	70%	0.699	78%	0.782	S	S	*	*			cis	-173.1	141.9	-25.9	52.9	0	0	0	0	108.9
557	E	33.8	Very low	33.2	Very low	185 Å²	185	137.5 Å²	137.5	86%	0.864	78%	0.784	S	S	*	*			trans	-89.6	-157.5	173	-63.7	-175.9	93.9	0	0	112.7
558	V	34.8	Very low	33.5	Very low	131 Å²	131	135.2 Å²	135.2	79%	0.794	78%	0.78	S	S	*	*			trans	81	126.7	162.1	179.2	0	0	0	0	114.1
559	E	30.7	Very low	33.6	Very low	172 Å²	172	144 Å²	144	80%	0.804	80%	0.795	S	S	*	*			cis	-160.8	168	2.7	-138.9	175.9	-150.2	0	0	110.6
560	R	26.2	Very low	33.4	Very low	223 Å²	223	136.9 Å²	136.9	84%	0.842	78%	0.779	S	S	*	*				-169.4	127.1	119.1	-165.2	159	-167.2	79.8	4.5	113.7
561	A	38.3	Very low	35	Very low	86 Å²	86	139.6 Å²	139.6	71%	0.711	78%	0.783	S	S	*	*			trans	-103	157.3	154.1	0	0	0	0	0	110.5
562	A	30.8	Very low	36.1	Very low	94 Å²	94	134.6 Å²	134.6	78%	0.777	77%	0.768	S	S	*	*			trans	-153.1	151.6	171.5	0	0	0	0	0	110.4
563	S	38.1	Very low	36.3	Very low	96 Å²	96	136.2 Å²	136.2	67%	0.671	77%	0.769	S	S	*	*			trans	-139	178	-168.3	-164.6	0	0	0	0	112.1
564	E	38.5	Very low	36	Very low	166 Å²	166	137.1 Å²	137.1	78%	0.776	76%	0.763	S	S	*	*			trans	61.4	123.2	159.8	-73.7	118.1	-125.3	0	0	121.8
565	S	39	Very low	36.4	Very low	118 Å²	118	135.6 Å²	135.6	83%	0.825	76%	0.756	S	S	*	*				157.1	164.8	127.6	49	0	0	0	0	111.5
566	E	35.5	Very low	36.8	Very low	173 Å²	173	138.9 Å²	138.9	81%	0.808	76%	0.76	S	S	*	*				-161.1	154	-52.6	-158.3	164.9	120.1	0	0	107.2
567	D	33.1	Very low	36.8	Very low	151 Å²	151	139.5 Å²	139.5	81%	0.807	76%	0.76	S	S	*	*			trans	31.7	100.9	165.9	-74.8	6.1	0	0	0	123.6
568	G	34.2	Very low	36.8	Very low	68 Å²	68	136.3 Å²	136.3	70%	0.701	75%	0.753	S	S	*	*				60.1	116.1	102	0	0	0	0	0	123.4
569	Y	32.9	Very low	36.5	Very low	249 Å²	249	136.3 Å²	136.3	98%	0.976	75%	0.749	S	S	*	*			trans	-161.3	159.8	142.6	-106.5	-76.1	0	0	0	110.6
570	G	28.7	Very low	36.9	Very low	62 Å²	62	132.2 Å²	132.2	64%	0.639	74%	0.739	S	S	*	*			trans	-159.6	-149.2	172.8	0	0	0	0	0	110
571	P	61.6	Low	37.4	Very low	128 Å²	128	129.3 Å²	129.3	83%	0.831	74%	0.739	S	S	*	*			cis	-112.9	-135.5	-46.9	39.2	-23	0	0	0	107.8
572	P	53.7	Low	37.1	Very low	98 Å²	98	129.5 Å²	129.5	64%	0.636	74%	0.741	S	S	*	*			cis	-133.9	174.3	-25.8	39.2	-22.4	0	0	0	115.7
573	S	32.9	Very low	37.2	Very low	101 Å²	101	130.9 Å²	130.9	71%	0.706	75%	0.745	S	S	*	*			trans	152	117.9	132.3	-73.8	0	0	0	0	112.3
574	Q	40.2	Very low	37.4	Very low	140 Å²	140	131.9 Å²	131.9	65%	0.654	75%	0.752	S	S	*	*				89.9	127	60.5	-85.6	-172.7	50.7	0	0	113
575	R	38.4	Very low	37.8	Very low	180 Å²	180	129.8 Å²	129.8	68%	0.679	75%	0.753	S	S	*	*			cis	-125.8	-149.7	-7.8	-73.1	158.4	-159.5	-174.4	4.1	107.4
576	Y	38.2	Very low	37.5	Very low	195 Å²	195	128.4 Å²	128.4	77%	0.765	75%	0.749	S	S	*	*			cis	-158.2	161.2	13.4	-65.3	-91.2	0	0	0	106.2
577	T	33.6	Very low	37.5	Very low	113 Å²	113	126.1 Å²	126.1	69%	0.693	75%	0.752	S	S	*	*			cis	-163.3	139.6	-7.9	20	0	0	0	0	105.9
578	V	33.1	Very low	37.8	Very low	118 Å²	118	124.8 Å²	124.8	72%	0.715	75%	0.754	S	S	*	*				59	127.6	77.9	176.3	0	0	0	0	112.8
579	D	29.7	Very low	37.8	Very low	132 Å²	132	127.3 Å²	127.3	71%	0.706	76%	0.761	S	S	*	*			cis	-176.8	164.3	-14.7	-103.8	-39.5	0	0	0	108.7
580	S	37.7	Very low	38.7	Very low	86 Å²	86	124.4 Å²	124.4	60%	0.601	76%	0.756	S	S	*	*			cis	-169.5	167.4	-22.6	-125.9	0	0	0	0	111.9
581	L	36.6	Very low	39.3	Very low	161 Å²	161	129.8 Å²	129.8	84%	0.843	77%	0.769	S	S	*	*			trans	57.9	135.3	150	-64.4	168.6	0	0	0	123.6
582	A	33.8	Very low	38.7	Very low	90 Å²	90	128 Å²	128	74%	0.744	76%	0.76	S	S	*	*			trans	64.8	104.1	141	0	0	0	0	0	122.3
583	S	32.7	Very low	38.2	Very low	124 Å²	124	129.6 Å²	129.6	87%	0.867	77%	0.768	S	S	*	*				-170.3	145.6	117.5	-81.4	0	0	0	0	112.7
584	S	40.7	Very low	38.9	Very low	117 Å²	117	128.9 Å²	128.9	82%	0.818	76%	0.762	S	S	*	*			trans	-132.5	154.6	165.5	-51.4	0	0	0	0	108
585	P	48.3	Very low	39.5	Very low	121 Å²	121	124.3 Å²	124.3	79%	0.786	75%	0.753	S	S	*	*				-150.4	174.1	89.5	39.7	-22.6	0	0	0	115.6
586	A	31.1	Very low	40.1	Very low	90 Å²	90	123.3 Å²	123.3	74%	0.744	76%	0.756	S	S	*	*			trans	53.2	107.8	160.3	0	0	0	0	0	118.1
587	S	36.1	Very low	41.4	Very low	125 Å²	125	119.9 Å²	119.9	87%	0.874	75%	0.751	S	S	*	*				92.9	145.8	59.3	-75.7	0	0	0	0	114.6
588	S	39	Very low	43.5	Very low	123 Å²	123	120.4 Å²	120.4	86%	0.86	75%	0.745	S	S	*	*			trans	95.8	76.4	166.6	-162.3	0	0	0	0	118.4
589	S	35.7	Very low	45.9	Very low	120 Å²	120	121.5 Å²	121.5	84%	0.839	74%	0.743	S	S	*	*			trans	-153.9	84.1	143.3	-161.5	0	0	0	0	111.1
590	Q	51	Low	48.4	Very low	189 Å²	189	118.1 Å²	118.1	88%	0.883	73%	0.733	S	S	*	*			trans	-142.5	88.9	169.1	-82.8	-158	-59.4	0	0	110.4
591	L	42.2	Very low	50.7	Low	174 Å²	174	117.7 Å²	117.7	91%	0.911	73%	0.727	S	S	*	*			trans	-173.3	136.3	162.5	-134.7	60.9	0	0	0	107.5
592	S	47.2	Very low	53.1	Low	92 Å²	92	115.3 Å²	115.3	64%	0.643	71%	0.711	S	S	*	*			cis	-158.8	116	-18.9	158.7	0	0	0	0	107.9
593	T	43.5	Very low	55.6	Low	130 Å²	130	113.7 Å²	113.7	80%	0.798	70%	0.698	S	S	*	*	S	Bend	trans	-128.9	66.2	-178.7	56.2	0	0	0	0	110.4
594	C	47.9	Very low	58.3	Low	86 Å²	86	111.2 Å²	111.2	58%	0.581	67%	0.673	S	S	*	*			trans	-151.3	8.1	-177.5	-86	0	0	0	0	114
595	G	52.8	Low	60.7	Low	45 Å²	45	111.8 Å²	111.8	46%	0.464	66%	0.661	S	S	.	*	S	Bend	trans	-87.3	-57.4	-176.5	0	0	0	0	0	113	D597 Q598 E599	G595-D597 VanDerWaalsContact C-N 3.31Å; G595-D597 PolarHBondContact O-N 3.09Å; G595-Q598 PolarHBondContact O-N 3.02Å; G595-E599 PolarHBondContact O-N 3.18Å
596	E	51.3	Low	62.7	Low	159 Å²	159	108.8 Å²	108.8	74%	0.743	64%	0.637	S	S	*	*	H	α-helix	trans	-57	-39.8	-172.9	-66.1	156.4	115.3	0	0	112.6	Q598 E599 A600	E596-Q598 VanDerWaalsContact C-N 3.32Å; E596-Q598 PolarHBondContact O-N 3.13Å; E596-E599 PolarHBondContact O-N 3.22Å; E596-A600 WeakPolarHBondContact O-CB 2.96Å; E596-A600 PolarHBondContact O-N 2.72Å
597	D	65.3	Low	65.7	Low	122 Å²	122	105.5 Å²	105.5	65%	0.652	61%	0.606	S	S	*	*	H	α-helix	trans	-61.8	-36.2	175.3	-68.3	-41.7	0	0	0	112.9	G595 V601	G595-D597 VanDerWaalsContact C-N 3.31Å; G595-D597 PolarHBondContact O-N 3.09Å; D597-V601 VanDerWaalsContact O-CB 3.29Å; D597-V601 WeakPolarHBondContact O-CB 3.45Å; D597-V601 WeakPolarHBondContact O-CG2 3.48Å; D597-V601 PolarHBondContact O-N 3.15Å
598	Q	79.1	Confident	68.6	Low	124 Å²	124	103 Å²	103	58%	0.579	58%	0.579	S	S	*	*	H	α-helix	trans	-74.8	-34.1	178.5	-67.9	-168.2	36.4	0	0	112.1	G595 E596 Q602	G595-Q598 PolarHBondContact O-N 3.02Å; E596-Q598 VanDerWaalsContact C-N 3.32Å; E596-Q598 PolarHBondContact O-N 3.13Å; Q598-Q602 WeakPolarHBondContact O-CB 3.24Å; Q598-Q602 VanDerWaalsContact O-CG 3.24Å; Q598-Q602 WeakPolarHBondContact O-CG 3.12Å; Q598-Q602 PolarHBondContact O-N 3.04Å; Q598-Q602 PolarHBondContact O-NE2 2.93Å
599	E	82.8	Confident	71.2	Confident	142 Å²	142	103.6 Å²	103.6	66%	0.664	57%	0.566	S	S	*	*	H	α-helix	trans	-67.7	-48.8	175.5	-172.2	168.7	-172.5	0	0	110.5	G595 E596 V601 Q602 A603	G595-E599 PolarHBondContact O-N 3.18Å; E596-E599 PolarHBondContact O-N 3.22Å; E599-V601 PolarHBondContact O-N 3.13Å; E599-Q602 PolarHBondContact O-N 3.06Å; E599-A603 PolarHBondContact O-N 3.04Å
600	A	81.7	Confident	73.9	Confident	61 Å²	61	98 Å²	98	50%	0.504	53%	0.527	S	S	.	.	H	α-helix	trans	-58.1	-43.8	174.2	0	0	0	0	0	112.4	E596 Q602 A603 Q604	E596-A600 WeakPolarHBondContact O-CB 2.96Å; E596-A600 PolarHBondContact O-N 2.72Å; A600-Q602 VanDerWaalsContact C-N 3.31Å; A600-Q602 PolarHBondContact O-N 3.44Å; A600-A603 PolarHBondContact O-N 3.49Å; A600-Q604 WeakPolarHBondContact O-CB 3.49Å; A600-Q604 PolarHBondContact O-N 3.32Å
601	V	86.3	Confident	76.1	Confident	77 Å²	77	89 Å²	89	47%	0.467	49%	0.485	S	S	.	.	H	α-helix	trans	-67.8	-28.1	176.3	166.9	0	0	0	0	112.6	D597 E599 K605	D597-V601 VanDerWaalsContact O-CB 3.29Å; D597-V601 WeakPolarHBondContact O-CB 3.45Å; D597-V601 WeakPolarHBondContact O-CG2 3.48Å; D597-V601 PolarHBondContact O-N 3.15Å; E599-V601 PolarHBondContact O-N 3.13Å; V601-K605 HydrophobicContact CG1-CD 4.38Å; V601-K605 WeakPolarHBondContact O-CD 3.41Å; V601-K605 VanDerWaalsContact O-CG 3.23Å; V601-K605 WeakPolarHBondContact O-CG 3.37Å; V601-K605 PolarHBondContact O-N 3.43Å
602	Q	86.8	Confident	78.7	Confident	111 Å²	111	81.6 Å²	81.6	52%	0.519	45%	0.446	S	S	.	.	H	α-helix	trans	-75.4	-47.3	172.8	-78.6	175.5	77.8	0	0	111.6	Q598 E599 A600 Q604 K605 I606	Q598-Q602 WeakPolarHBondContact O-CB 3.24Å; Q598-Q602 VanDerWaalsContact O-CG 3.24Å; Q598-Q602 WeakPolarHBondContact O-CG 3.12Å; Q598-Q602 PolarHBondContact O-N 3.04Å; Q598-Q602 PolarHBondContact O-NE2 2.93Å; E599-Q602 PolarHBondContact O-N 3.06Å; A600-Q602 VanDerWaalsContact C-N 3.31Å; A600-Q602 PolarHBondContact O-N 3.44Å; Q602-Q604 VanDerWaalsContact C-N 3.29Å; Q602-Q604 PolarHBondContact O-N 3.42Å; Q602-K605 WeakPolarHBondContact O-CB 3.33Å; Q602-K605 PolarHBondContact O-N 3.16Å; Q602-I606 WeakPolarHBondContact O-CG1 3.48Å; Q602-I606 PolarHBondContact O-N 3.39Å
603	A	86	Confident	81	Confident	56 Å²	56	78.3 Å²	78.3	46%	0.463	42%	0.421	S	S	.	.	H	α-helix	trans	-54.6	-45.4	173.6	0	0	0	0	0	111.3	E599 A600 K605 I606 W607	E599-A603 PolarHBondContact O-N 3.04Å; A600-A603 PolarHBondContact O-N 3.49Å; A603-K605 VanDerWaalsContact C-N 3.31Å; A603-K605 PolarHBondContact O-N 3.44Å; A603-I606 PolarHBondContact O-N 2.94Å; A603-I606 VanDerWaalsContact O-N 3.12Å; A603-W607 WeakPolarHBondContact O-CB 3.43Å; A603-W607 PolarHBondContact O-N 2.92Å
604	Q	89.3	Confident	83.6	Confident	72 Å²	72	72.1 Å²	72.1	34%	0.336	38%	0.383	S	S	.	.	H	α-helix	trans	-61.2	-36.8	176.3	-163.5	65.1	40.3	0	0	112.8	A600 Q602 K608 R662	A600-Q604 WeakPolarHBondContact O-CB 3.49Å; A600-Q604 PolarHBondContact O-N 3.32Å; Q602-Q604 VanDerWaalsContact C-N 3.29Å; Q602-Q604 PolarHBondContact O-N 3.42Å; Q604-K608 WeakPolarHBondContact O-CB 3.21Å; Q604-K608 PolarHBondContact O-N 3.14Å; Q604-R662 PolarHBondContact NE2-O 3.06Å
605	K	91.9	Very high	86	Confident	129 Å²	129	69.4 Å²	69.4	56%	0.561	36%	0.361	S	S	*	.	H	α-helix	trans	-70.3	-33.9	175.3	-73.5	165.2	-174.7	171.6	0	112.4	V601 Q602 A603 K609	V601-K605 HydrophobicContact CG1-CD 4.38Å; V601-K605 WeakPolarHBondContact O-CD 3.41Å; V601-K605 VanDerWaalsContact O-CG 3.23Å; V601-K605 WeakPolarHBondContact O-CG 3.37Å; V601-K605 PolarHBondContact O-N 3.43Å; Q602-K605 WeakPolarHBondContact O-CB 3.33Å; Q602-K605 PolarHBondContact O-N 3.16Å; A603-K605 VanDerWaalsContact C-N 3.31Å; A603-K605 PolarHBondContact O-N 3.44Å; K605-K609 WeakPolarHBondContact O-CG 3.39Å; K605-K609 PolarHBondContact O-N 2.81Å
606	I	90.6	Very high	88.1	Confident	57 Å²	57	73 Å²	73	29%	0.292	36%	0.361	S	S	.	.	H	α-helix	trans	-72	-53.3	176.9	-65	167.2	0	0	0	109.7	Q602 A603 K608 K609 A610 P748 L751	Q602-I606 WeakPolarHBondContact O-CG1 3.48Å; Q602-I606 PolarHBondContact O-N 3.39Å; A603-I606 PolarHBondContact O-N 2.94Å; A603-I606 VanDerWaalsContact O-N 3.12Å; I606-K608 VanDerWaalsContact C-N 3.29Å; I606-K608 PolarHBondContact O-N 3.3Å; I606-K609 WeakPolarHBondContact O-CB 3.26Å; I606-K609 PolarHBondContact O-N 3.44Å; I606-A610 PolarHBondContact O-N 3.01Å; I606-P748 HydrophobicContact CD1-CG 4.24Å; I606-P748 HydrophobicContact CG1-CG 4.07Å; I606-L751 HydrophobicContact CG2-CD1 4.26Å
607	W	94.3	Very high	90.3	Very high	22 Å²	22	66.9 Å²	66.9	8%	0.083	34%	0.337	C	S	.	.	H	α-helix	trans	-53.1	-46.1	174.1	170.8	87.4	0	0	0	111.4	A603 K609 A610 I611 I656 I661 R662 T663 T664	A603-W607 WeakPolarHBondContact O-CB 3.43Å; A603-W607 PolarHBondContact O-N 2.92Å; W607-K609 VanDerWaalsContact C-N 3.31Å; W607-K609 PolarHBondContact O-N 2.8Å; W607-A610 PolarHBondContact O-N 3.27Å; W607-I611 HydrophobicContact CD2-CG2 4.28Å; W607-I611 HydrophobicContact CE3-CG2 4.31Å; W607-I611 HydrophobicContact CH2-CG2 3.82Å; W607-I611 HydrophobicContact CZ2-CB 4.02Å; W607-I611 HydrophobicContact CZ2-CG1 3.94Å; W607-I611 HydrophobicContact CZ2-CG2 3.79Å; W607-I611 HydrophobicContact CZ3-CG2 4.1Å; W607-I611 WeakPolarHBondContact O-CG2 3.46Å; W607-I611 PolarHBondContact O-N 2.91Å; W607-I656 HydrophobicContact CZ3-CG2 4.48Å; W607-I661 HydrophobicContact CH2-CG2 3.85Å; W607-I661 HydrophobicContact CZ2-CG2 4.3Å; W607-R662 VanDerWaalsContact CH2-C 3.45Å; W607-T663 VanDerWaalsContact CZ2-C 3.41Å; W607-T663 WeakPolarHBondContact CZ2-O 3.47Å; W607-T664 PolarHBondContact NE1-OG1 3.49Å
608	K	95.8	Very high	91.8	Very high	73 Å²	73	61 Å²	61	32%	0.317	31%	0.305	S	S	.	.	H	α-helix	trans	-61.2	-36	178.4	176.6	170.3	173.2	178.6	0	113.1	Q604 I606 M612 I656 E657	Q604-K608 WeakPolarHBondContact O-CB 3.21Å; Q604-K608 PolarHBondContact O-N 3.14Å; I606-K608 VanDerWaalsContact C-N 3.29Å; I606-K608 PolarHBondContact O-N 3.3Å; K608-M612 WeakPolarHBondContact O-CB 3.3Å; K608-M612 WeakPolarHBondContact O-CG 3.32Å; K608-I656 WeakPolarHBondContact CE-O 3.32Å; K608-I656 HydrophobicContact CG-CG2 3.97Å; K608-E657 PolarHBondContact NZ-O 2.75Å
609	K	93.3	Very high	92.7	Very high	134 Å²	134	56 Å²	56	58%	0.583	29%	0.285	S	S	*	.	H	α-helix	trans	-68.7	-40.6	173.1	-77.2	178.3	176.8	-174.1	0	111.6	K605 I606 W607	K605-K609 WeakPolarHBondContact O-CG 3.39Å; K605-K609 PolarHBondContact O-N 2.81Å; I606-K609 WeakPolarHBondContact O-CB 3.26Å; I606-K609 PolarHBondContact O-N 3.44Å; W607-K609 VanDerWaalsContact C-N 3.31Å; W607-K609 PolarHBondContact O-N 2.8Å
610	A	93.9	Very high	93.4	Very high	4 Å²	4	55.7 Å²	55.7	3%	0.033	29%	0.288	C	S	.	.	H	α-helix	trans	-77	-44.5	-173.7	0	0	0	0	0	113.1	I606 W607 M612 L613 F706	I606-A610 PolarHBondContact O-N 3.01Å; W607-A610 PolarHBondContact O-N 3.27Å; A610-M612 PolarHBondContact O-N 2.92Å; A610-L613 VanDerWaalsContact O-CB 3.22Å; A610-L613 WeakPolarHBondContact O-CB 3.26Å; A610-L613 PolarHBondContact O-N 3.46Å; A610-F706 HydrophobicContact CB-CE2 3.67Å; A610-F706 HydrophobicContact CB-CZ 4.2Å
611	I	96.2	Very high	94.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.9	-29.4	175.2	-160.1	69.1	0	0	0	112	W607 L613 V614 W615 I656 T664 F667 F706	W607-I611 HydrophobicContact CD2-CG2 4.28Å; W607-I611 HydrophobicContact CE3-CG2 4.31Å; W607-I611 HydrophobicContact CH2-CG2 3.82Å; W607-I611 HydrophobicContact CZ2-CB 4.02Å; W607-I611 HydrophobicContact CZ2-CG1 3.94Å; W607-I611 HydrophobicContact CZ2-CG2 3.79Å; W607-I611 HydrophobicContact CZ3-CG2 4.1Å; W607-I611 WeakPolarHBondContact O-CG2 3.46Å; W607-I611 PolarHBondContact O-N 2.91Å; I611-L613 PolarHBondContact O-N 2.87Å; I611-V614 PolarHBondContact O-N 3.43Å; I611-V614 VanDerWaalsContact O-N 3.15Å; I611-W615 PolarHBondContact O-N 3.39Å; I611-I656 HydrophobicContact CG2-CD1 4.44Å; I611-I656 HydrophobicContact CG2-CG2 3.94Å; I611-T664 HydrophobicContact CD1-CG2 4.05Å; I611-F667 HydrophobicContact CD1-CB 4.19Å; I611-F667 HydrophobicContact CD1-CD1 3.6Å; I611-F667 HydrophobicContact CD1-CE1 4.1Å; I611-F667 HydrophobicContact CD1-CG 3.88Å; I611-F667 HydrophobicContact CG1-CB 4.05Å; I611-F667 HydrophobicContact CG1-CD1 3.9Å; I611-F667 HydrophobicContact CG1-CD2 4.03Å; I611-F667 HydrophobicContact CG1-CE1 4.34Å; I611-F667 HydrophobicContact CG1-CE2 4.46Å; I611-F667 HydrophobicContact CG1-CG 3.7Å; I611-F706 HydrophobicContact CD1-CD1 3.78Å; I611-F706 HydrophobicContact CD1-CE1 3.56Å; I611-F706 HydrophobicContact CD1-CZ 4.24Å
612	M	97.4	Very high	94.7	Very high	17 Å²	17	58.7 Å²	58.7	8%	0.084	28%	0.279	C	S	.	.	H	α-helix	trans	-67.9	-7.5	172.4	-78.4	-64.1	-60.8	0	0	113.7	K608 A610 W615 R616 K653 I656	K608-M612 WeakPolarHBondContact O-CB 3.3Å; K608-M612 WeakPolarHBondContact O-CG 3.32Å; A610-M612 PolarHBondContact O-N 2.92Å; M612-W615 HydrophobicContact CE-CD2 4.05Å; M612-W615 HydrophobicContact CE-CE3 3.59Å; M612-W615 HydrophobicContact CE-CZ3 4.19Å; M612-W615 HydrophobicContact SD-CB 4.2Å; M612-W615 HydrophobicContact SD-CD2 4.41Å; M612-W615 HydrophobicContact SD-CE3 4.47Å; M612-W615 HydrophobicContact SD-CG 4.27Å; M612-R616 VanDerWaalsContact O-CG 3.29Å; M612-R616 WeakPolarHBondContact O-CG 3.37Å; M612-R616 PolarHBondContact O-N 3.12Å; M612-R616 PolarHBondContact O-NH1 3.45Å; M612-K653 HydrophobicContact CE-CD 4.2Å; M612-K653 HydrophobicContact CE-CG 3.99Å; M612-K653 HydrophobicContact SD-CG 4.41Å; M612-I656 HydrophobicContact CG-CG2 3.98Å; M612-I656 HydrophobicContact SD-CB 4.33Å; M612-I656 HydrophobicContact SD-CD1 3.84Å; M612-I656 HydrophobicContact SD-CG2 4.02Å
613	L	95.8	Very high	95.2	Very high	23 Å²	23	55.4 Å²	55.4	12%	0.12	26%	0.262	C	S	.	.	H	α-helix	trans	-83.2	-42.5	169.7	-57.8	160.6	0	0	0	109.9	A610 I611 W615 R616 A617 L752 F755	A610-L613 VanDerWaalsContact O-CB 3.22Å; A610-L613 WeakPolarHBondContact O-CB 3.26Å; A610-L613 PolarHBondContact O-N 3.46Å; I611-L613 PolarHBondContact O-N 2.87Å; L613-W615 VanDerWaalsContact C-N 3.34Å; L613-W615 PolarHBondContact O-N 3.05Å; L613-R616 WeakPolarHBondContact O-CB 3.4Å; L613-R616 PolarHBondContact O-N 2.81Å; L613-R616 VanDerWaalsContact O-N 3.11Å; L613-A617 PolarHBondContact O-N 3.3Å; L613-L752 HydrophobicContact CD1-CD2 4.28Å; L613-L752 HydrophobicContact CD2-CD2 4.29Å; L613-F755 HydrophobicContact CB-CB 4.06Å; L613-F755 HydrophobicContact CB-CD1 3.97Å; L613-F755 HydrophobicContact CB-CG 4.02Å; L613-F755 HydrophobicContact CD1-CB 3.85Å; L613-F755 HydrophobicContact CD1-CD2 4.1Å; L613-F755 HydrophobicContact CD1-CG 4Å; L613-F755 HydrophobicContact CD2-CB 4.35Å; L613-F755 HydrophobicContact CG-CB 4.29Å
614	V	96.8	Very high	95.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.3	-42.9	170.9	-172.8	0	0	0	0	110.9	I611 R616 A617 A618 F667 H702 V703 F706 F755	I611-V614 PolarHBondContact O-N 3.43Å; I611-V614 VanDerWaalsContact O-N 3.15Å; V614-R616 VanDerWaalsContact C-N 3.31Å; V614-R616 PolarHBondContact O-N 2.71Å; V614-A617 WeakPolarHBondContact O-CB 3.42Å; V614-A617 PolarHBondContact O-N 3.49Å; V614-A618 PolarHBondContact O-N 3.48Å; V614-A618 VanDerWaalsContact O-N 3.1Å; V614-F667 HydrophobicContact CB-CE1 4.13Å; V614-F667 HydrophobicContact CB-CZ 4.33Å; V614-F667 HydrophobicContact CG1-CE1 3.66Å; V614-F667 HydrophobicContact CG1-CZ 4.08Å; V614-H702 HydrophobicContact CG1-CB 4.01Å; V614-V703 HydrophobicContact CG1-CG2 3.83Å; V614-F706 HydrophobicContact CG2-CB 3.71Å; V614-F706 HydrophobicContact CG2-CD2 4.2Å; V614-F706 HydrophobicContact CG2-CG 3.88Å; V614-F755 HydrophobicContact CG2-CE1 4.43Å
615	W	98.4	Very high	96.1	Very high	30 Å²	30	53.6 Å²	53.6	11%	0.114	25%	0.254	C	S	.	.	H	α-helix	trans	-60.1	-38.3	172.4	180	86.9	0	0	0	112.8	I611 M612 L613 A618 A619 L649 K653 I656 F667	I611-W615 PolarHBondContact O-N 3.39Å; M612-W615 HydrophobicContact CE-CD2 4.05Å; M612-W615 HydrophobicContact CE-CE3 3.59Å; M612-W615 HydrophobicContact CE-CZ3 4.19Å; M612-W615 HydrophobicContact SD-CB 4.2Å; M612-W615 HydrophobicContact SD-CD2 4.41Å; M612-W615 HydrophobicContact SD-CE3 4.47Å; M612-W615 HydrophobicContact SD-CG 4.27Å; L613-W615 VanDerWaalsContact C-N 3.34Å; L613-W615 PolarHBondContact O-N 3.05Å; W615-A618 PolarHBondContact O-N 3.16Å; W615-A619 HydrophobicContact CD2-CB 4.4Å; W615-A619 HydrophobicContact CE3-CB 4.27Å; W615-A619 HydrophobicContact CH2-CB 3.66Å; W615-A619 HydrophobicContact CZ2-CB 3.84Å; W615-A619 HydrophobicContact CZ3-CB 3.9Å; W615-A619 WeakPolarHBondContact O-CB 3.39Å; W615-A619 PolarHBondContact O-N 3.11Å; W615-L649 HydrophobicContact CZ2-CB 4.46Å; W615-L649 PolarHBondContact NE1-O 2.88Å; W615-K653 HydrophobicContact CD2-CB 4.35Å; W615-K653 HydrophobicContact CH2-CD 3.77Å; W615-K653 HydrophobicContact CZ2-CB 3.91Å; W615-K653 HydrophobicContact CZ2-CD 3.78Å; W615-K653 HydrophobicContact CZ2-CG 4.36Å; W615-K653 HydrophobicContact CZ3-CD 4.18Å; W615-I656 HydrophobicContact CB-CD1 4.47Å; W615-F667 HydrophobicContact CB-CE2 4.09Å; W615-F667 HydrophobicContact CB-CZ 4.25Å
616	R	97.8	Very high	96.3	Very high	121 Å²	121	50.3 Å²	50.3	46%	0.457	25%	0.245	S	C	.	.	H	α-helix	trans	-67.2	-38.3	175.4	-81	176.9	-172.5	94.1	-13.5	112.2	M612 L613 V614 A618 A619 N620	M612-R616 VanDerWaalsContact O-CG 3.29Å; M612-R616 WeakPolarHBondContact O-CG 3.37Å; M612-R616 PolarHBondContact O-N 3.12Å; M612-R616 PolarHBondContact O-NH1 3.45Å; L613-R616 WeakPolarHBondContact O-CB 3.4Å; L613-R616 PolarHBondContact O-N 2.81Å; L613-R616 VanDerWaalsContact O-N 3.11Å; V614-R616 VanDerWaalsContact C-N 3.31Å; V614-R616 PolarHBondContact O-N 2.71Å; R616-A618 VanDerWaalsContact C-N 3.32Å; R616-A618 PolarHBondContact O-N 2.85Å; R616-A619 PolarHBondContact O-N 3.13Å; R616-N620 VanDerWaalsContact O-CB 3.24Å; R616-N620 WeakPolarHBondContact O-CB 3.43Å; R616-N620 PolarHBondContact O-N 2.81Å; R616-N620 PolarHBondContact O-ND2 3.2Å
617	A	96.6	Very high	96.7	Very high	29 Å²	29	48 Å²	48	24%	0.24	23%	0.233	C	C	.	.	H	α-helix	trans	-59.6	-45.3	174.5	0	0	0	0	0	111	L613 V614 N620 H621 H702	L613-A617 PolarHBondContact O-N 3.3Å; V614-A617 WeakPolarHBondContact O-CB 3.42Å; V614-A617 PolarHBondContact O-N 3.49Å; A617-N620 PolarHBondContact O-N 2.54Å; A617-H621 PolarHBondContact O-N 3.28Å; A617-H702 VanDerWaalsContact CB-CD2 3.42Å; A617-H702 WeakPolarHBondContact CB-CD2 3.24Å
618	A	97.7	Very high	96.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.9	-47.9	172.9	0	0	0	0	0	112.6	V614 W615 R616 N620 H621 A624 L649 M695 V699	V614-A618 PolarHBondContact O-N 3.48Å; V614-A618 VanDerWaalsContact O-N 3.1Å; W615-A618 PolarHBondContact O-N 3.16Å; R616-A618 VanDerWaalsContact C-N 3.32Å; R616-A618 PolarHBondContact O-N 2.85Å; A618-N620 PolarHBondContact O-N 3.29Å; A618-H621 VanDerWaalsContact O-CB 3.29Å; A618-H621 WeakPolarHBondContact O-CB 3.04Å; A618-H621 PolarHBondContact O-N 3.26Å; A618-H621 VanDerWaalsContact O-N 3.14Å; A618-A624 VanDerWaalsContact O-CB 3.32Å; A618-A624 WeakPolarHBondContact O-CB 3.01Å; A618-L649 HydrophobicContact CB-CD2 4.03Å; A618-M695 HydrophobicContact CB-CE 4.23Å; A618-M695 WeakPolarHBondContact O-CE 3.5Å; A618-V699 HydrophobicContact CB-CG1 4Å; A618-V699 HydrophobicContact CB-CG2 3.64Å
619	A	98.1	Very high	96.9	Very high	17 Å²	17	52.6 Å²	52.6	14%	0.14	26%	0.258	C	S	.	.	H	α-helix	trans	-67.5	-21.3	-179.5	0	0	0	0	0	114.4	W615 R616 A624 L628 L649	W615-A619 HydrophobicContact CD2-CB 4.4Å; W615-A619 HydrophobicContact CE3-CB 4.27Å; W615-A619 HydrophobicContact CH2-CB 3.66Å; W615-A619 HydrophobicContact CZ2-CB 3.84Å; W615-A619 HydrophobicContact CZ3-CB 3.9Å; W615-A619 WeakPolarHBondContact O-CB 3.39Å; W615-A619 PolarHBondContact O-N 3.11Å; R616-A619 PolarHBondContact O-N 3.13Å; A619-A624 WeakPolarHBondContact O-CB 3.44Å; A619-L628 HydrophobicContact CB-CD2 4.2Å; A619-L649 HydrophobicContact CB-CD1 4.44Å
620	N	96.9	Very high	97.1	Very high	136 Å²	136	50 Å²	50	73%	0.727	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-0.3	175.2	-68.1	-9.1	0	0	0	113.1	R616 A617 A618	R616-N620 VanDerWaalsContact O-CB 3.24Å; R616-N620 WeakPolarHBondContact O-CB 3.43Å; R616-N620 PolarHBondContact O-N 2.81Å; R616-N620 PolarHBondContact O-ND2 3.2Å; A617-N620 PolarHBondContact O-N 2.54Å; A618-N620 PolarHBondContact O-N 3.29Å
621	H	97.8	Very high	97.2	Very high	31 Å²	31	51.7 Å²	51.7	14%	0.144	26%	0.264	C	S	.	.	S	Bend	trans	-64.4	147.6	179.5	-170.6	-101.2	0	0	0	111.3	A617 A618 Y623 A624 M695 D698	A617-H621 PolarHBondContact O-N 3.28Å; A618-H621 VanDerWaalsContact O-CB 3.29Å; A618-H621 WeakPolarHBondContact O-CB 3.04Å; A618-H621 PolarHBondContact O-N 3.26Å; A618-H621 VanDerWaalsContact O-N 3.14Å; H621-Y623 AromaticContact CE1-CD2 3.73Å; H621-Y623 PolarHBondContact ND1-N 3.09Å; H621-Y623 PolarHBondContact O-N 2.71Å; H621-A624 HydrophobicContact CB-CB 4.32Å; H621-A624 VanDerWaalsContact O-CB 3.23Å; H621-A624 WeakPolarHBondContact O-CB 3.27Å; H621-A624 PolarHBondContact O-N 2.7Å; H621-M695 HydrophobicContact CB-CE 3.93Å; H621-M695 HydrophobicContact CB-CG 4.1Å; H621-M695 HydrophobicContact CB-SD 3.9Å; H621-M695 VanDerWaalsContact ND1-CG 3.29Å; H621-M695 WeakPolarHBondContact ND1-CG 3.32Å; H621-M695 PolarHBondContact ND1-SD 2.84Å; H621-D698 IonicContact NE2-OD2 2.69Å
622	R	97.5	Very high	97.1	Very high	171 Å²	171	53.4 Å²	53.4	65%	0.645	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-23.5	-178.2	59	-176.9	-69.7	-138.4	0.3	114.8	E694	R622-E694 WeakPolarHBondContact CD-OE1 3.05Å; R622-E694 IonicContact CZ-OE1 3.82Å; R622-E694 IonicContact NE-OE1 3.59Å; R622-E694 IonicContact NH1-OE1 3.91Å; R622-E694 PolarHBondContact NH1-OE1 3.47Å; R622-E694 IonicContact NH1-OE2 2.98Å; R622-E694 PolarHBondContact NH1-OE2 3.22Å
623	Y	97.8	Very high	96.8	Very high	41 Å²	41	56.7 Å²	56.7	16%	0.161	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	4.6	178.6	-57.4	-31.1	0	0	0	114.4	H621 S625 F627 M691 E694	H621-Y623 AromaticContact CE1-CD2 3.73Å; H621-Y623 PolarHBondContact ND1-N 3.09Å; H621-Y623 PolarHBondContact O-N 2.71Å; Y623-S625 PolarHBondContact O-N 2.94Å; Y623-F627 WeakPolarHBondContact O-CD2 3.49Å; Y623-M691 HydrophobicContact CD1-CE 3.91Å; Y623-M691 HydrophobicContact CD1-CG 3.94Å; Y623-M691 HydrophobicContact CD2-CB 3.69Å; Y623-M691 HydrophobicContact CD2-CG 3.8Å; Y623-M691 WeakPolarHBondContact CD2-O 3.38Å; Y623-M691 HydrophobicContact CE1-CG 4.16Å; Y623-M691 HydrophobicContact CE2-CB 4.19Å; Y623-M691 HydrophobicContact CE2-CG 4Å; Y623-M691 HydrophobicContact CG-CB 3.91Å; Y623-M691 HydrophobicContact CG-CE 3.92Å; Y623-M691 HydrophobicContact CG-CG 3.77Å; Y623-E694 HydrophobicContact CD2-CB 4.28Å; Y623-E694 HydrophobicContact CE2-CB 3.78Å; Y623-E694 HydrophobicContact CE2-CG 3.98Å; Y623-E694 WeakPolarHBondContact CE2-OE1 3.22Å; Y623-E694 WeakPolarHBondContact CE2-OE2 3.18Å; Y623-E694 PolarHBondContact OH-OE2 2.96Å
624	A	97.1	Very high	96.7	Very high	3 Å²	3	62.7 Å²	62.7	3%	0.025	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-58.8	-25.4	-173.4	0	0	0	0	0	113.7	A618 A619 H621 V626 F627 L628 L649 M695	A618-A624 VanDerWaalsContact O-CB 3.32Å; A618-A624 WeakPolarHBondContact O-CB 3.01Å; A619-A624 WeakPolarHBondContact O-CB 3.44Å; H621-A624 HydrophobicContact CB-CB 4.32Å; H621-A624 VanDerWaalsContact O-CB 3.23Å; H621-A624 WeakPolarHBondContact O-CB 3.27Å; H621-A624 PolarHBondContact O-N 2.7Å; A624-V626 VanDerWaalsContact C-N 3.3Å; A624-V626 PolarHBondContact O-N 3.43Å; A624-F627 CarbonylContact O-C 3.44Å; A624-F627 WeakPolarHBondContact O-CA 3.29Å; A624-F627 PolarHBondContact O-N 3.31Å; A624-L628 HydrophobicContact CB-CG 4.43Å; A624-L628 WeakPolarHBondContact O-CG 3.38Å; A624-L628 PolarHBondContact O-N 2.65Å; A624-L649 HydrophobicContact CB-CD1 4.36Å; A624-M695 HydrophobicContact CB-CE 4.07Å; A624-M695 HydrophobicContact CB-SD 4.44Å
625	S	96.9	Very high	96.5	Very high	87 Å²	87	69.1 Å²	69.1	61%	0.608	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-49.3	-43.3	-177.3	50.7	0	0	0	0	114.4	Y623 F627	Y623-S625 PolarHBondContact O-N 2.94Å; S625-F627 VanDerWaalsContact C-N 3.27Å; S625-F627 PolarHBondContact O-N 3.1Å
626	V	96.5	Very high	96.2	Very high	60 Å²	60	68.1 Å²	68.1	36%	0.364	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-77.9	-11.2	-179.9	-55	0	0	0	0	113.5	A624 V688 M691	A624-V626 VanDerWaalsContact C-N 3.3Å; A624-V626 PolarHBondContact O-N 3.43Å; V626-V688 HydrophobicContact CG2-CG1 4.41Å; V626-M691 HydrophobicContact CG1-CE 3.87Å; V626-M691 HydrophobicContact CG2-CE 3.8Å
627	F	98.2	Very high	96	Very high	10 Å²	10	67.2 Å²	67.2	4%	0.044	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-110.4	-3.7	179.7	-54.8	-71.9	0	0	0	113.2	Y623 A624 S625 Q629 L649 M674 F675 A678 A692 M695	Y623-F627 WeakPolarHBondContact O-CD2 3.49Å; A624-F627 CarbonylContact O-C 3.44Å; A624-F627 WeakPolarHBondContact O-CA 3.29Å; A624-F627 PolarHBondContact O-N 3.31Å; S625-F627 VanDerWaalsContact C-N 3.27Å; S625-F627 PolarHBondContact O-N 3.1Å; F627-Q629 PolarHBondContact O-N 2.93Å; F627-L649 HydrophobicContact CB-CD1 4.23Å; F627-L649 HydrophobicContact CB-CG 4.36Å; F627-L649 WeakPolarHBondContact O-CB 3.4Å; F627-L649 WeakPolarHBondContact O-CG 3.45Å; F627-L649 PolarHBondContact O-N 3.43Å; F627-M674 HydrophobicContact CB-CE 3.99Å; F627-M674 HydrophobicContact CB-SD 3.88Å; F627-M674 HydrophobicContact CD1-CE 4.28Å; F627-M674 HydrophobicContact CD1-CG 4.13Å; F627-M674 HydrophobicContact CD1-SD 4.45Å; F627-M674 HydrophobicContact CG-CE 4.19Å; F627-M674 HydrophobicContact CG-SD 4.5Å; F627-F675 HydrophobicContact CD2-CE1 4.45Å; F627-F675 HydrophobicContact CE1-CD1 4.16Å; F627-F675 HydrophobicContact CE1-CE1 4.47Å; F627-F675 HydrophobicContact CE2-CE1 4.34Å; F627-F675 HydrophobicContact CZ-CD1 4.25Å; F627-F675 HydrophobicContact CZ-CE1 4.37Å; F627-A678 HydrophobicContact CE1-CB 3.89Å; F627-A692 HydrophobicContact CE1-CB 4.31Å; F627-A692 HydrophobicContact CZ-CB 3.84Å; F627-M695 HydrophobicContact CD2-CE 4.28Å; F627-M695 HydrophobicContact CD2-SD 3.52Å; F627-M695 VanDerWaalsContact CD2-SD 3.52Å; F627-M695 HydrophobicContact CE2-SD 3.84Å
628	L	97.2	Very high	95.9	Very high	66 Å²	66	67.4 Å²	67.4	35%	0.346	37%	0.373	S	S	.	.	S	Bend	trans	-74.2	-22	-173.5	-90.2	178.1	0	0	0	114.3	A619 A624 L649 S650	A619-L628 HydrophobicContact CB-CD2 4.2Å; A624-L628 HydrophobicContact CB-CG 4.43Å; A624-L628 WeakPolarHBondContact O-CG 3.38Å; A624-L628 PolarHBondContact O-N 2.65Å; L628-L649 HydrophobicContact CD2-CB 4.37Å; L628-L649 HydrophobicContact CD2-CD1 4.1Å; L628-S650 WeakPolarHBondContact O-CB 3.46Å
629	Q	97.4	Very high	95.9	Very high	124 Å²	124	68 Å²	68	58%	0.579	38%	0.375	S	S	*	.	S	Bend	trans	-138.6	159.8	-174	-70.2	-65.4	-90.2	0	0	111.1	F627 V631 D648 S650	F627-Q629 PolarHBondContact O-N 2.93Å; Q629-V631 PolarHBondContact O-N 2.95Å; Q629-D648 WeakPolarHBondContact O-CB 3.38Å; Q629-S650 VanDerWaalsContact NE2-CB 3.31Å; Q629-S650 PolarHBondContact NE2-OG 3.03Å
630	P	97.1	Very high	95.8	Very high	81 Å²	81	71.6 Å²	71.6	53%	0.526	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-56.3	136.3	171.5	-21.8	31.3	0	0	0	111.8	D648	P630-D648 WeakPolarHBondContact CG-OD2 3.23Å
631	V	96.6	Very high	95.7	Very high	38 Å²	38	69.3 Å²	69.3	23%	0.23	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-67.6	130.2	176.7	-177.9	0	0	0	0	109.9	Q629 A636 Y639 H640	Q629-V631 PolarHBondContact O-N 2.95Å; V631-A636 HydrophobicContact CG1-CB 3.47Å; V631-A636 VanDerWaalsContact CG1-CB 3.47Å; V631-Y639 HydrophobicContact CB-CD1 3.96Å; V631-Y639 HydrophobicContact CB-CE1 3.82Å; V631-Y639 HydrophobicContact CB-CG 4.38Å; V631-Y639 HydrophobicContact CG1-CD1 3.97Å; V631-Y639 HydrophobicContact CG1-CD2 4.08Å; V631-Y639 HydrophobicContact CG1-CE1 4.22Å; V631-Y639 HydrophobicContact CG1-CE2 4.33Å; V631-Y639 HydrophobicContact CG1-CG 3.9Å; V631-Y639 HydrophobicContact CG2-CE1 4.06Å; V631-Y639 HydrophobicContact CG2-CE2 4.32Å; V631-H640 PolarHBondContact O-CE1 3.08Å; V631-H640 VanDerWaalsContact O-CE1 3.3Å
632	S	94.2	Very high	95.6	Very high	37 Å²	37	72 Å²	72	26%	0.259	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-96.9	156.1	170.7	78.5	0	0	0	0	111.7	D634 I635 A636	S632-D634 PolarHBondContact O-N 2.79Å; S632-D634 PolarHBondContact OG-OD2 3.17Å; S632-I635 PolarHBondContact O-N 3.42Å; S632-A636 PolarHBondContact O-N 2.89Å
633	D	91.3	Very high	95.6	Very high	86 Å²	86	64 Å²	64	46%	0.46	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.8	177.1	-69.9	-15	0	0	0	112.6	I635 A636 P637 H640	D633-I635 VanDerWaalsContact C-N 3.35Å; D633-A636 CarbonylContact O-C 3.42Å; D633-P637 VanDerWaalsContact O-CA 3.28Å; D633-P637 WeakPolarHBondContact O-CA 3.38Å; D633-H640 IonicContact OD1-CE1 2.71Å; D633-H640 IonicContact OD1-CG 2.7Å; D633-H640 IonicContact OD1-ND1 3.09Å; D633-H640 PolarHBondContact OD1-ND1 2.89Å
634	D	92.9	Very high	95.6	Very high	148 Å²	148	70 Å²	70	79%	0.791	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-30.8	173.2	-40.9	-80.3	0	0	0	112.6	S632	S632-D634 PolarHBondContact O-N 2.79Å; S632-D634 PolarHBondContact OG-OD2 3.17Å
635	I	92.2	Very high	95.6	Very high	136 Å²	136	76.6 Å²	76.6	70%	0.697	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-35.7	179.9	-61.4	170.5	0	0	0	110	S632 D633	S632-I635 PolarHBondContact O-N 3.42Å; D633-I635 VanDerWaalsContact C-N 3.35Å
636	A	92.3	Very high	95.6	Very high	9 Å²	9	75.3 Å²	75.3	7%	0.074	41%	0.411	C	S	.	.	S	Bend	trans	-137.5	88.1	-179	0	0	0	0	0	110.6	V631 S632 D633 G638 Y639 Y681	V631-A636 HydrophobicContact CG1-CB 3.47Å; V631-A636 VanDerWaalsContact CG1-CB 3.47Å; S632-A636 PolarHBondContact O-N 2.89Å; D633-A636 CarbonylContact O-C 3.42Å; A636-G638 PolarHBondContact O-N 3.06Å; A636-G638 VanDerWaalsContact O-N 3.15Å; A636-Y639 HydrophobicContact CB-CD2 3.95Å; A636-Y639 HydrophobicContact CB-CG 4.12Å; A636-Y639 WeakPolarHBondContact O-CB 3.38Å; A636-Y639 PolarHBondContact O-N 3.32Å; A636-Y681 VanDerWaalsContact C-OH 3.3Å; A636-Y681 HydrophobicContact CB-CE1 3.71Å
637	P	94.8	Very high	95.7	Very high	101 Å²	101	73.5 Å²	73.5	66%	0.656	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	117.8	-176.1	-29.7	37.4	0	0	0	113.5	D633 Y639 Y681	D633-P637 VanDerWaalsContact O-CA 3.28Å; D633-P637 WeakPolarHBondContact O-CA 3.38Å; P637-Y639 VanDerWaalsContact C-N 3.34Å; P637-Y681 PolarHBondContact O-OH 2.92Å; P637-Y681 VanDerWaalsContact O-OH 3.08Å
638	G	93.9	Very high	95.7	Very high	34 Å²	34	73.7 Å²	73.7	35%	0.351	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	9	179.3	0	0	0	0	0	115.1	A636 H640 S641	A636-G638 PolarHBondContact O-N 3.06Å; A636-G638 VanDerWaalsContact O-N 3.15Å; G638-H640 VanDerWaalsContact C-N 3.28Å; G638-H640 PolarHBondContact O-N 3.39Å; G638-S641 WeakPolarHBondContact O-CB 3.49Å; G638-S641 PolarHBondContact O-N 3.03Å; G638-S641 PolarHBondContact O-OG 3.42Å
639	Y	96.6	Very high	95.8	Very high	12 Å²	12	70.5 Å²	70.5	5%	0.047	38%	0.384	C	S	.	.	H	α-helix	trans	-46.5	-47.8	179.5	-176.1	-99.4	0	0	0	113.4	V631 A636 P637 S641 I642 V643 P646 Y681	V631-Y639 HydrophobicContact CB-CD1 3.96Å; V631-Y639 HydrophobicContact CB-CE1 3.82Å; V631-Y639 HydrophobicContact CB-CG 4.38Å; V631-Y639 HydrophobicContact CG1-CD1 3.97Å; V631-Y639 HydrophobicContact CG1-CD2 4.08Å; V631-Y639 HydrophobicContact CG1-CE1 4.22Å; V631-Y639 HydrophobicContact CG1-CE2 4.33Å; V631-Y639 HydrophobicContact CG1-CG 3.9Å; V631-Y639 HydrophobicContact CG2-CE1 4.06Å; V631-Y639 HydrophobicContact CG2-CE2 4.32Å; A636-Y639 HydrophobicContact CB-CD2 3.95Å; A636-Y639 HydrophobicContact CB-CG 4.12Å; A636-Y639 WeakPolarHBondContact O-CB 3.38Å; A636-Y639 PolarHBondContact O-N 3.32Å; P637-Y639 VanDerWaalsContact C-N 3.34Å; Y639-S641 PolarHBondContact O-N 3.16Å; Y639-S641 VanDerWaalsContact O-N 3.13Å; Y639-I642 PolarHBondContact O-N 3.2Å; Y639-V643 HydrophobicContact CD1-CB 4.14Å; Y639-V643 HydrophobicContact CD1-CG2 4.5Å; Y639-V643 HydrophobicContact CD2-CG2 4.02Å; Y639-V643 HydrophobicContact CE1-CB 3.81Å; Y639-V643 HydrophobicContact CE1-CG1 3.86Å; Y639-V643 HydrophobicContact CE1-CG2 4.15Å; Y639-V643 HydrophobicContact CE2-CB 4.23Å; Y639-V643 HydrophobicContact CE2-CG2 3.64Å; Y639-V643 HydrophobicContact CG-CB 4.49Å; Y639-V643 HydrophobicContact CG-CG2 4.43Å; Y639-V643 PolarHBondContact O-N 2.83Å; Y639-P646 HydrophobicContact CE1-CB 4.24Å; Y639-Y681 AromaticContact CD2-CD1 3.83Å; Y639-Y681 HydrophobicContact CD2-CD1 3.83Å; Y639-Y681 AromaticContact CD2-CD2 3.67Å; Y639-Y681 HydrophobicContact CD2-CD2 3.67Å; Y639-Y681 HydrophobicContact CD2-CE1 4.13Å; Y639-Y681 AromaticContact CD2-CE2 3.96Å; Y639-Y681 HydrophobicContact CD2-CE2 3.96Å; Y639-Y681 AromaticContact CD2-CG 3.6Å; Y639-Y681 HydrophobicContact CD2-CG 3.6Å; Y639-Y681 HydrophobicContact CE2-CD1 4.24Å; Y639-Y681 HydrophobicContact CE2-CD2 4.39Å; Y639-Y681 AromaticContact CE2-CG 3.97Å; Y639-Y681 HydrophobicContact CE2-CG 3.97Å; Y639-Y681 HydrophobicContact CG-CD2 4.46Å; Y639-Y681 HydrophobicContact CG-CE2 4.49Å
640	H	96.1	Very high	95.8	Very high	93 Å²	93	66.6 Å²	66.6	43%	0.431	37%	0.37	S	S	.	.	H	α-helix	trans	-65.6	-13.6	-179.8	-65.2	97.1	0	0	0	115	V631 D633 G638	V631-H640 PolarHBondContact O-CE1 3.08Å; V631-H640 VanDerWaalsContact O-CE1 3.3Å; D633-H640 IonicContact OD1-CE1 2.71Å; D633-H640 IonicContact OD1-CG 2.7Å; D633-H640 IonicContact OD1-ND1 3.09Å; D633-H640 PolarHBondContact OD1-ND1 2.89Å; G638-H640 VanDerWaalsContact C-N 3.28Å; G638-H640 PolarHBondContact O-N 3.39Å
641	S	96.1	Very high	95.9	Very high	88 Å²	88	63.9 Å²	63.9	62%	0.615	35%	0.354	S	S	*	.	H	α-helix	trans	-82.9	-22.9	173	73.3	0	0	0	0	113.3	G638 Y639 H644	G638-S641 WeakPolarHBondContact O-CB 3.49Å; G638-S641 PolarHBondContact O-N 3.03Å; G638-S641 PolarHBondContact O-OG 3.42Å; Y639-S641 PolarHBondContact O-N 3.16Å; Y639-S641 VanDerWaalsContact O-N 3.13Å; S641-H644 PolarHBondContact O-CE1 2.99Å
642	I	95.7	Very high	96	Very high	87 Å²	87	62.1 Å²	62.1	45%	0.446	34%	0.343	S	S	.	.	H	α-helix	trans	-104.3	-45.1	-178.2	-59.6	175.3	0	0	0	110.5	Y639 H644 M680 Y681	Y639-I642 PolarHBondContact O-N 3.2Å; I642-H644 PolarHBondContact O-N 3.14Å; I642-M680 HydrophobicContact CG2-CE 4.36Å; I642-Y681 HydrophobicContact CB-CD2 4.35Å; I642-Y681 HydrophobicContact CD1-CD2 4.08Å; I642-Y681 HydrophobicContact CD1-CE2 4.11Å
643	V	96.9	Very high	96.2	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.012	35%	0.346	C	S	.	.			trans	-93.3	93.7	-178.4	179.7	0	0	0	0	110.2	Y639 R645 N677 M680	Y639-V643 HydrophobicContact CD1-CB 4.14Å; Y639-V643 HydrophobicContact CD1-CG2 4.5Å; Y639-V643 HydrophobicContact CD2-CG2 4.02Å; Y639-V643 HydrophobicContact CE1-CB 3.81Å; Y639-V643 HydrophobicContact CE1-CG1 3.86Å; Y639-V643 HydrophobicContact CE1-CG2 4.15Å; Y639-V643 HydrophobicContact CE2-CB 4.23Å; Y639-V643 HydrophobicContact CE2-CG2 3.64Å; Y639-V643 HydrophobicContact CG-CB 4.49Å; Y639-V643 HydrophobicContact CG-CG2 4.43Å; Y639-V643 PolarHBondContact O-N 2.83Å; V643-R645 VanDerWaalsContact C-N 3.33Å; V643-R645 PolarHBondContact O-N 3.07Å; V643-N677 HydrophobicContact CG1-CB 3.89Å; V643-N677 VanDerWaalsContact CG1-CG 3.44Å; V643-N677 HydrophobicContact CG2-CB 4.41Å; V643-M680 HydrophobicContact CG2-CE 3.92Å
644	H	96.6	Very high	96.5	Very high	168 Å²	168	66.8 Å²	66.8	78%	0.778	36%	0.355	S	S	*	.	S	Bend	trans	-74	-16.8	-177.4	-58.2	-26.5	0	0	0	115	S641 I642	S641-H644 PolarHBondContact O-CE1 2.99Å; I642-H644 PolarHBondContact O-N 3.14Å
645	R	97.3	Very high	96.8	Very high	142 Å²	142	61.3 Å²	61.3	54%	0.536	33%	0.326	S	S	.	.	S	Bend	trans	-133.3	74.9	177.8	-169	-172.8	160.6	125	-7.5	110.2	V643 D670 L673 N677	V643-R645 VanDerWaalsContact C-N 3.33Å; V643-R645 PolarHBondContact O-N 3.07Å; R645-D670 IonicContact NH2-OD1 2.78Å; R645-D670 PolarHBondContact NH2-OD1 2.65Å; R645-L673 HydrophobicContact CG-CD2 3.85Å; R645-N677 PolarHBondContact O-ND2 3.35Å
646	P	97.5	Very high	97.1	Very high	60 Å²	60	54.8 Å²	54.8	39%	0.39	29%	0.293	S	S	.	.			trans	-59.4	149.7	176.5	26.3	-35.4	0	0	0	111.3	Y639	Y639-P646 HydrophobicContact CE1-CB 4.24Å
647	M	98.4	Very high	97.3	Very high	22 Å²	22	59 Å²	59	11%	0.108	31%	0.31	C	S	.	.			trans	-154.4	144.3	177.7	-170.1	56.3	62.9	0	0	109.5	A651 I652 D670 L673 M674	M647-A651 HydrophobicContact SD-CB 3.83Å; M647-I652 HydrophobicContact CG-CD1 3.93Å; M647-I652 HydrophobicContact CG-CG1 3.79Å; M647-I652 HydrophobicContact SD-CD1 4.45Å; M647-I652 HydrophobicContact SD-CG1 3.65Å; M647-D670 HydrophobicContact CE-CB 4.27Å; M647-D670 HydrophobicContact CG-CB 4.19Å; M647-D670 WeakPolarHBondContact CG-O 3.43Å; M647-D670 HydrophobicContact SD-CB 4.28Å; M647-L673 HydrophobicContact CB-CD2 4.01Å; M647-L673 HydrophobicContact CB-CG 4.15Å; M647-L673 HydrophobicContact CE-CD2 4.37Å; M647-L673 HydrophobicContact CG-CD2 4.5Å; M647-M674 HydrophobicContact CB-CB 4.27Å; M647-M674 HydrophobicContact CG-CB 4.3Å; M647-M674 WeakPolarHBondContact O-CG 3.36Å
648	D	98.6	Very high	97.4	Very high	13 Å²	13	57.9 Å²	57.9	7%	0.07	31%	0.305	C	S	.	.			trans	-148.2	163.5	-178.1	70.7	92.6	0	0	0	110.6	Q629 P630 S650 A651 I652	Q629-D648 WeakPolarHBondContact O-CB 3.38Å; P630-D648 WeakPolarHBondContact CG-OD2 3.23Å; D648-S650 VanDerWaalsContact C-N 3.26Å; D648-S650 PolarHBondContact O-N 3.15Å; D648-S650 VanDerWaalsContact OD1-CA 3.29Å; D648-S650 WeakPolarHBondContact OD1-CA 3.23Å; D648-S650 VanDerWaalsContact OD1-CB 3.25Å; D648-S650 WeakPolarHBondContact OD1-CB 3.15Å; D648-S650 PolarHBondContact OD1-N 2.95Å; D648-S650 PolarHBondContact OD1-OG 3.13Å; D648-A651 PolarHBondContact O-N 2.99Å; D648-A651 PolarHBondContact OD1-N 3.49Å; D648-A651 WeakPolarHBondContact OD2-CB 3.39Å; D648-I652 WeakPolarHBondContact O-CG1 3.4Å; D648-I652 PolarHBondContact O-N 3.46Å
649	L	98.6	Very high	97.4	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.7	-29.4	-177	-69.5	173.4	0	0	0	113.3	W615 A618 A619 A624 F627 L628 K653 I671 M674 M695	W615-L649 HydrophobicContact CZ2-CB 4.46Å; W615-L649 PolarHBondContact NE1-O 2.88Å; A618-L649 HydrophobicContact CB-CD2 4.03Å; A619-L649 HydrophobicContact CB-CD1 4.44Å; A624-L649 HydrophobicContact CB-CD1 4.36Å; F627-L649 HydrophobicContact CB-CD1 4.23Å; F627-L649 HydrophobicContact CB-CG 4.36Å; F627-L649 WeakPolarHBondContact O-CB 3.4Å; F627-L649 WeakPolarHBondContact O-CG 3.45Å; F627-L649 PolarHBondContact O-N 3.43Å; L628-L649 HydrophobicContact CD2-CB 4.37Å; L628-L649 HydrophobicContact CD2-CD1 4.1Å; L649-K653 WeakPolarHBondContact O-CB 3.49Å; L649-K653 PolarHBondContact O-N 3.28Å; L649-I671 HydrophobicContact CD2-CD1 3.89Å; L649-M674 HydrophobicContact CD2-CE 3.92Å; L649-M674 HydrophobicContact CD2-SD 3.92Å; L649-M674 HydrophobicContact CG-CE 4.11Å; L649-M674 HydrophobicContact CG-SD 3.75Å; L649-M695 HydrophobicContact CD1-CE 4.12Å
650	S	98.6	Very high	97.4	Very high	42 Å²	42	60.5 Å²	60.5	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-75.9	-36.7	177	81.6	0	0	0	0	112.3	L628 Q629 D648 K653 K654	L628-S650 WeakPolarHBondContact O-CB 3.46Å; Q629-S650 VanDerWaalsContact NE2-CB 3.31Å; Q629-S650 PolarHBondContact NE2-OG 3.03Å; D648-S650 VanDerWaalsContact C-N 3.26Å; D648-S650 PolarHBondContact O-N 3.15Å; D648-S650 VanDerWaalsContact OD1-CA 3.29Å; D648-S650 WeakPolarHBondContact OD1-CA 3.23Å; D648-S650 VanDerWaalsContact OD1-CB 3.25Å; D648-S650 WeakPolarHBondContact OD1-CB 3.15Å; D648-S650 PolarHBondContact OD1-N 2.95Å; D648-S650 PolarHBondContact OD1-OG 3.13Å; S650-K653 PolarHBondContact O-N 3.1Å; S650-K654 VanDerWaalsContact O-CB 3.31Å; S650-K654 WeakPolarHBondContact O-CB 3.28Å; S650-K654 PolarHBondContact O-N 3.24Å
651	A	98.6	Very high	97.5	Very high	24 Å²	24	56.2 Å²	56.2	20%	0.198	30%	0.3	C	S	.	.	H	α-helix	trans	-62.9	-45.6	169	0	0	0	0	0	111.4	M647 D648 K653 K654 N655	M647-A651 HydrophobicContact SD-CB 3.83Å; D648-A651 PolarHBondContact O-N 2.99Å; D648-A651 PolarHBondContact OD1-N 3.49Å; D648-A651 WeakPolarHBondContact OD2-CB 3.39Å; A651-K653 PolarHBondContact O-N 2.86Å; A651-K654 PolarHBondContact O-N 2.98Å; A651-N655 WeakPolarHBondContact O-CB 3.1Å; A651-N655 PolarHBondContact O-N 2.99Å; A651-N655 PolarHBondContact O-OD1 2.84Å
652	I	98.7	Very high	97.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.9	-47.7	176.4	-66	170	0	0	0	110.6	M647 D648 K654 N655 I656 I661 F667 D670 I671 M674	M647-I652 HydrophobicContact CG-CD1 3.93Å; M647-I652 HydrophobicContact CG-CG1 3.79Å; M647-I652 HydrophobicContact SD-CD1 4.45Å; M647-I652 HydrophobicContact SD-CG1 3.65Å; D648-I652 WeakPolarHBondContact O-CG1 3.4Å; D648-I652 PolarHBondContact O-N 3.46Å; I652-K654 PolarHBondContact O-N 2.85Å; I652-N655 PolarHBondContact O-N 3.35Å; I652-I656 HydrophobicContact CG2-CD1 4.13Å; I652-I656 WeakPolarHBondContact O-CG1 3.27Å; I652-I656 PolarHBondContact O-N 3.47Å; I652-I661 HydrophobicContact CG2-CD1 4.2Å; I652-F667 HydrophobicContact CG2-CD2 3.82Å; I652-F667 HydrophobicContact CG2-CE2 3.71Å; I652-D670 HydrophobicContact CD1-CB 4.42Å; I652-D670 HydrophobicContact CG1-CB 4.09Å; I652-I671 HydrophobicContact CD1-CD1 3.64Å; I652-I671 HydrophobicContact CD1-CG1 3.99Å; I652-I671 HydrophobicContact CG2-CD1 4.37Å; I652-M674 HydrophobicContact CD1-CB 4.49Å; I652-M674 HydrophobicContact CD1-SD 4.16Å
653	K	98.6	Very high	97.5	Very high	72 Å²	72	57.7 Å²	57.7	31%	0.313	29%	0.294	S	S	.	.	H	α-helix	trans	-56	-50.2	174	176.7	175.4	172.6	-173.7	0	111.7	M612 W615 L649 S650 A651 N655 I656 E657	M612-K653 HydrophobicContact CE-CD 4.2Å; M612-K653 HydrophobicContact CE-CG 3.99Å; M612-K653 HydrophobicContact SD-CG 4.41Å; W615-K653 HydrophobicContact CD2-CB 4.35Å; W615-K653 HydrophobicContact CH2-CD 3.77Å; W615-K653 HydrophobicContact CZ2-CB 3.91Å; W615-K653 HydrophobicContact CZ2-CD 3.78Å; W615-K653 HydrophobicContact CZ2-CG 4.36Å; W615-K653 HydrophobicContact CZ3-CD 4.18Å; L649-K653 WeakPolarHBondContact O-CB 3.49Å; L649-K653 PolarHBondContact O-N 3.28Å; S650-K653 PolarHBondContact O-N 3.1Å; A651-K653 PolarHBondContact O-N 2.86Å; K653-N655 VanDerWaalsContact C-N 3.26Å; K653-N655 PolarHBondContact O-N 2.83Å; K653-I656 PolarHBondContact O-N 3.15Å; K653-E657 VanDerWaalsContact CE-CD 3.49Å; K653-E657 WeakPolarHBondContact CE-OE1 3.46Å; K653-E657 HydrophobicContact CG-CG 4.33Å; K653-E657 IonicContact NZ-OE1 3.66Å; K653-E657 WeakPolarHBondContact O-CB 3.23Å; K653-E657 WeakPolarHBondContact O-CG 3.46Å; K653-E657 PolarHBondContact O-N 3.18Å
654	K	98.5	Very high	97.5	Very high	149 Å²	149	58.4 Å²	58.4	65%	0.648	30%	0.298	S	S	*	.	H	α-helix	trans	-61	-34.7	178.8	-176.2	-179.4	176.5	-175.6	0	112	S650 A651 I652 E657 S658	S650-K654 VanDerWaalsContact O-CB 3.31Å; S650-K654 WeakPolarHBondContact O-CB 3.28Å; S650-K654 PolarHBondContact O-N 3.24Å; A651-K654 PolarHBondContact O-N 2.98Å; I652-K654 PolarHBondContact O-N 2.85Å; K654-E657 PolarHBondContact O-N 2.98Å; K654-S658 WeakPolarHBondContact O-CB 3.44Å; K654-S658 PolarHBondContact O-N 3.34Å; K654-S658 PolarHBondContact O-OG 3.13Å
655	N	98.3	Very high	97.5	Very high	33 Å²	33	53.3 Å²	53.3	18%	0.176	29%	0.285	C	S	.	.	H	α-helix	trans	-72.5	-36.2	177.7	-68.6	-10.1	0	0	0	112.1	A651 I652 K653 S658 G659 V660 I661	A651-N655 WeakPolarHBondContact O-CB 3.1Å; A651-N655 PolarHBondContact O-N 2.99Å; A651-N655 PolarHBondContact O-OD1 2.84Å; I652-N655 PolarHBondContact O-N 3.35Å; K653-N655 VanDerWaalsContact C-N 3.26Å; K653-N655 PolarHBondContact O-N 2.83Å; N655-S658 PolarHBondContact O-OG 3.19Å; N655-G659 PolarHBondContact O-N 3.09Å; N655-V660 HydrophobicContact CB-CB 4.09Å; N655-V660 HydrophobicContact CB-CG1 4.37Å; N655-V660 PolarHBondContact O-N 3.38Å; N655-I661 HydrophobicContact CB-CD1 3.6Å; N655-I661 HydrophobicContact CB-CG1 3.78Å; N655-I661 PolarHBondContact O-N 3.16Å
656	I	98	Very high	97.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.7	-41.2	167.7	-60.3	160.1	0	0	0	110.6	W607 K608 I611 M612 W615 I652 K653 G659 I661 F667	W607-I656 HydrophobicContact CZ3-CG2 4.48Å; K608-I656 WeakPolarHBondContact CE-O 3.32Å; K608-I656 HydrophobicContact CG-CG2 3.97Å; I611-I656 HydrophobicContact CG2-CD1 4.44Å; I611-I656 HydrophobicContact CG2-CG2 3.94Å; M612-I656 HydrophobicContact CG-CG2 3.98Å; M612-I656 HydrophobicContact SD-CB 4.33Å; M612-I656 HydrophobicContact SD-CD1 3.84Å; M612-I656 HydrophobicContact SD-CG2 4.02Å; W615-I656 HydrophobicContact CB-CD1 4.47Å; I652-I656 HydrophobicContact CG2-CD1 4.13Å; I652-I656 WeakPolarHBondContact O-CG1 3.27Å; I652-I656 PolarHBondContact O-N 3.47Å; K653-I656 PolarHBondContact O-N 3.15Å; I656-G659 PolarHBondContact O-N 3.04Å; I656-I661 HydrophobicContact CG1-CB 4.26Å; I656-I661 HydrophobicContact CG1-CD1 4.21Å; I656-I661 HydrophobicContact CG1-CG2 4.28Å; I656-F667 HydrophobicContact CD1-CD2 3.74Å; I656-F667 HydrophobicContact CD1-CE2 3.86Å; I656-F667 HydrophobicContact CG1-CD2 4.37Å
657	E	97	Very high	97.5	Very high	96 Å²	96	45.8 Å²	45.8	45%	0.449	25%	0.251	S	S	.	.	H	α-helix	trans	-70.4	-39.6	-175.5	-78.1	179	170.7	0	0	113	K608 K653 K654 G659	K608-E657 PolarHBondContact NZ-O 2.75Å; K653-E657 VanDerWaalsContact CE-CD 3.49Å; K653-E657 WeakPolarHBondContact CE-OE1 3.46Å; K653-E657 HydrophobicContact CG-CG 4.33Å; K653-E657 IonicContact NZ-OE1 3.66Å; K653-E657 WeakPolarHBondContact O-CB 3.23Å; K653-E657 WeakPolarHBondContact O-CG 3.46Å; K653-E657 PolarHBondContact O-N 3.18Å; K654-E657 PolarHBondContact O-N 2.98Å; E657-G659 VanDerWaalsContact C-N 3.34Å
658	S	96.4	Very high	97.5	Very high	78 Å²	78	47.6 Å²	47.6	55%	0.545	26%	0.259	S	S	.	.	H	α-helix	trans	-79	-11.7	172.8	56.3	0	0	0	0	114.3	K654 N655	K654-S658 WeakPolarHBondContact O-CB 3.44Å; K654-S658 PolarHBondContact O-N 3.34Å; K654-S658 PolarHBondContact O-OG 3.13Å; N655-S658 PolarHBondContact O-OG 3.19Å
659	G	94.6	Very high	97.5	Very high	22 Å²	22	53.4 Å²	53.4	23%	0.227	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	34.8	-175.9	0	0	0	0	0	113.1	N655 I656 E657 R662	N655-G659 PolarHBondContact O-N 3.09Å; I656-G659 PolarHBondContact O-N 3.04Å; E657-G659 VanDerWaalsContact C-N 3.34Å; G659-R662 PolarHBondContact O-NE 2.92Å; G659-R662 PolarHBondContact O-NH2 3.29Å
660	V	97.1	Very high	97.5	Very high	79 Å²	79	53.7 Å²	53.7	48%	0.479	28%	0.282	S	S	.	.	S	Bend	trans	-76.6	-49.1	162.9	171	0	0	0	0	109.3	N655	N655-V660 HydrophobicContact CB-CB 4.09Å; N655-V660 HydrophobicContact CB-CG1 4.37Å; N655-V660 PolarHBondContact O-N 3.38Å
661	I	97.9	Very high	97.5	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.015	27%	0.268	C	S	.	.			trans	-83.1	124	165.8	-63.7	167.4	0	0	0	107.1	W607 I652 N655 I656 E666 F667 D670	W607-I661 HydrophobicContact CH2-CG2 3.85Å; W607-I661 HydrophobicContact CZ2-CG2 4.3Å; I652-I661 HydrophobicContact CG2-CD1 4.2Å; N655-I661 HydrophobicContact CB-CD1 3.6Å; N655-I661 HydrophobicContact CB-CG1 3.78Å; N655-I661 PolarHBondContact O-N 3.16Å; I656-I661 HydrophobicContact CG1-CB 4.26Å; I656-I661 HydrophobicContact CG1-CD1 4.21Å; I656-I661 HydrophobicContact CG1-CG2 4.28Å; I661-E666 HydrophobicContact CB-CB 4.35Å; I661-E666 HydrophobicContact CG1-CB 4.36Å; I661-E666 HydrophobicContact CG2-CB 3.77Å; I661-F667 HydrophobicContact CG2-CB 3.93Å; I661-D670 HydrophobicContact CD1-CB 4.36Å
662	R	95.6	Very high	97.5	Very high	140 Å²	140	54.2 Å²	54.2	53%	0.528	28%	0.277	S	S	.	.			trans	-122.1	-17.9	179.8	-57.8	-174.3	-168.1	101.4	16.6	113.5	Q604 W607 G659 E666	Q604-R662 PolarHBondContact NE2-O 3.06Å; W607-R662 VanDerWaalsContact CH2-C 3.45Å; G659-R662 PolarHBondContact O-NE 2.92Å; G659-R662 PolarHBondContact O-NH2 3.29Å; R662-E666 WeakPolarHBondContact CA-OE2 3.48Å; R662-E666 PolarHBondContact N-OE2 3.47Å
663	T	95.9	Very high	97.5	Very high	66 Å²	66	56 Å²	56	41%	0.405	29%	0.286	S	S	.	.	S	Bend	trans	-125.7	157.9	-174.3	63.8	0	0	0	0	111.7	W607 A665 E666 F667	W607-T663 VanDerWaalsContact CZ2-C 3.41Å; W607-T663 WeakPolarHBondContact CZ2-O 3.47Å; T663-A665 VanDerWaalsContact C-N 3.3Å; T663-A665 PolarHBondContact O-N 2.75Å; T663-E666 WeakPolarHBondContact CB-OE2 3.35Å; T663-E666 PolarHBondContact N-OE2 2.93Å; T663-E666 PolarHBondContact O-N 3.28Å; T663-E666 WeakPolarHBondContact OG1-CG 3.26Å; T663-E666 PolarHBondContact OG1-N 3.46Å; T663-E666 PolarHBondContact OG1-OE2 3.48Å; T663-F667 PolarHBondContact O-N 3.25Å
664	T	95.9	Very high	97.5	Very high	17 Å²	17	52.8 Å²	52.8	10%	0.104	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-36.6	177.4	-43.7	0	0	0	0	112.2	W607 I611 E666 F667 Q668 F706 L707	W607-T664 PolarHBondContact NE1-OG1 3.49Å; I611-T664 HydrophobicContact CD1-CG2 4.05Å; T664-E666 VanDerWaalsContact C-N 3.35Å; T664-E666 PolarHBondContact O-N 2.91Å; T664-F667 WeakPolarHBondContact O-CB 3.45Å; T664-F667 PolarHBondContact O-N 3.29Å; T664-Q668 WeakPolarHBondContact O-CB 3.38Å; T664-Q668 PolarHBondContact O-N 2.94Å; T664-F706 HydrophobicContact CG2-CD1 3.73Å; T664-F706 HydrophobicContact CG2-CE1 3.85Å; T664-L707 HydrophobicContact CG2-CD2 3.65Å; T664-L707 HydrophobicContact CG2-CG 4.07Å
665	A	96.6	Very high	97.5	Very high	61 Å²	61	45.7 Å²	45.7	50%	0.504	24%	0.241	S	C	.	.	H	α-helix	trans	-63.9	-37.1	176.2	0	0	0	0	0	112.6	T663 R669	T663-A665 VanDerWaalsContact C-N 3.3Å; T663-A665 PolarHBondContact O-N 2.75Å; A665-R669 WeakPolarHBondContact O-CB 3.48Å; A665-R669 PolarHBondContact O-N 3.21Å
666	E	97.9	Very high	97.5	Very high	44 Å²	44	49.1 Å²	49.1	21%	0.206	26%	0.256	C	S	.	.	H	α-helix	trans	-68	-38.2	173.5	-70.1	162.7	136.5	0	0	112.3	I661 R662 T663 T664 R669 D670	I661-E666 HydrophobicContact CB-CB 4.35Å; I661-E666 HydrophobicContact CG1-CB 4.36Å; I661-E666 HydrophobicContact CG2-CB 3.77Å; R662-E666 WeakPolarHBondContact CA-OE2 3.48Å; R662-E666 PolarHBondContact N-OE2 3.47Å; T663-E666 WeakPolarHBondContact CB-OE2 3.35Å; T663-E666 PolarHBondContact N-OE2 2.93Å; T663-E666 PolarHBondContact O-N 3.28Å; T663-E666 WeakPolarHBondContact OG1-CG 3.26Å; T663-E666 PolarHBondContact OG1-N 3.46Å; T663-E666 PolarHBondContact OG1-OE2 3.48Å; T664-E666 VanDerWaalsContact C-N 3.35Å; T664-E666 PolarHBondContact O-N 2.91Å; E666-R669 PolarHBondContact O-N 3.07Å; E666-D670 PolarHBondContact O-N 3.2Å
667	F	98.4	Very high	97.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.1	-50.2	175.5	173.5	-101.7	0	0	0	111.3	I611 V614 W615 I652 I656 I661 T663 T664 R669 D670 I671 V703	I611-F667 HydrophobicContact CD1-CB 4.19Å; I611-F667 HydrophobicContact CD1-CD1 3.6Å; I611-F667 HydrophobicContact CD1-CE1 4.1Å; I611-F667 HydrophobicContact CD1-CG 3.88Å; I611-F667 HydrophobicContact CG1-CB 4.05Å; I611-F667 HydrophobicContact CG1-CD1 3.9Å; I611-F667 HydrophobicContact CG1-CD2 4.03Å; I611-F667 HydrophobicContact CG1-CE1 4.34Å; I611-F667 HydrophobicContact CG1-CE2 4.46Å; I611-F667 HydrophobicContact CG1-CG 3.7Å; V614-F667 HydrophobicContact CB-CE1 4.13Å; V614-F667 HydrophobicContact CB-CZ 4.33Å; V614-F667 HydrophobicContact CG1-CE1 3.66Å; V614-F667 HydrophobicContact CG1-CZ 4.08Å; W615-F667 HydrophobicContact CB-CE2 4.09Å; W615-F667 HydrophobicContact CB-CZ 4.25Å; I652-F667 HydrophobicContact CG2-CD2 3.82Å; I652-F667 HydrophobicContact CG2-CE2 3.71Å; I656-F667 HydrophobicContact CD1-CD2 3.74Å; I656-F667 HydrophobicContact CD1-CE2 3.86Å; I656-F667 HydrophobicContact CG1-CD2 4.37Å; I661-F667 HydrophobicContact CG2-CB 3.93Å; T663-F667 PolarHBondContact O-N 3.25Å; T664-F667 WeakPolarHBondContact O-CB 3.45Å; T664-F667 PolarHBondContact O-N 3.29Å; F667-R669 VanDerWaalsContact C-N 3.3Å; F667-R669 PolarHBondContact O-N 2.95Å; F667-D670 PolarHBondContact O-N 3.05Å; F667-I671 HydrophobicContact CD1-CG1 4.25Å; F667-I671 HydrophobicContact CD2-CG1 4.19Å; F667-I671 HydrophobicContact CE1-CD1 4.48Å; F667-I671 HydrophobicContact CE1-CG1 3.88Å; F667-I671 HydrophobicContact CE2-CD1 4.03Å; F667-I671 HydrophobicContact CE2-CG1 3.81Å; F667-I671 HydrophobicContact CG-CG1 4.42Å; F667-I671 HydrophobicContact CZ-CD1 3.85Å; F667-I671 HydrophobicContact CZ-CG1 3.65Å; F667-I671 WeakPolarHBondContact O-CB 3.4Å; F667-I671 VanDerWaalsContact O-CG1 3.27Å; F667-I671 WeakPolarHBondContact O-CG1 3.47Å; F667-I671 PolarHBondContact O-N 2.92Å; F667-V703 HydrophobicContact CD1-CG2 4.37Å; F667-V703 HydrophobicContact CE1-CG2 3.98Å
668	Q	98.3	Very high	97.5	Very high	61 Å²	61	45.4 Å²	45.4	29%	0.285	24%	0.24	S	C	.	.	H	α-helix	trans	-58.6	-41.5	177.3	-178.8	177.6	-20.9	0	0	111.4	T664 I671 M672 L700 V703	T664-Q668 WeakPolarHBondContact O-CB 3.38Å; T664-Q668 PolarHBondContact O-N 2.94Å; Q668-I671 PolarHBondContact O-N 3.28Å; Q668-M672 HydrophobicContact CG-CG 4.33Å; Q668-M672 HydrophobicContact CG-SD 3.86Å; Q668-M672 WeakPolarHBondContact O-CB 3.4Å; Q668-M672 VanDerWaalsContact O-CG 3.31Å; Q668-M672 WeakPolarHBondContact O-CG 3.44Å; Q668-M672 PolarHBondContact O-N 2.75Å; Q668-L700 HydrophobicContact CG-CD2 4.43Å; Q668-V703 HydrophobicContact CB-CG1 4.25Å; Q668-V703 HydrophobicContact CG-CG1 4.23Å
669	R	98.4	Very high	97.6	Very high	134 Å²	134	43.1 Å²	43.1	51%	0.506	22%	0.222	S	C	.	.	H	α-helix	trans	-61.6	-49.2	178.3	-166.8	-162.1	-48.3	109	0.9	112.8	A665 E666 F667 M672 L673	A665-R669 WeakPolarHBondContact O-CB 3.48Å; A665-R669 PolarHBondContact O-N 3.21Å; E666-R669 PolarHBondContact O-N 3.07Å; F667-R669 VanDerWaalsContact C-N 3.3Å; F667-R669 PolarHBondContact O-N 2.95Å; R669-M672 PolarHBondContact O-N 3.1Å; R669-L673 VanDerWaalsContact O-CB 3.29Å; R669-L673 WeakPolarHBondContact O-CB 3.43Å; R669-L673 PolarHBondContact O-N 3.37Å
670	D	98.6	Very high	97.7	Very high	7 Å²	7	46.9 Å²	46.9	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-71.9	-30.5	-179.2	-79.2	-4.4	0	0	0	111.4	R645 M647 I652 I661 E666 F667 M674	R645-D670 IonicContact NH2-OD1 2.78Å; R645-D670 PolarHBondContact NH2-OD1 2.65Å; M647-D670 HydrophobicContact CE-CB 4.27Å; M647-D670 HydrophobicContact CG-CB 4.19Å; M647-D670 WeakPolarHBondContact CG-O 3.43Å; M647-D670 HydrophobicContact SD-CB 4.28Å; I652-D670 HydrophobicContact CD1-CB 4.42Å; I652-D670 HydrophobicContact CG1-CB 4.09Å; I661-D670 HydrophobicContact CD1-CB 4.36Å; E666-D670 PolarHBondContact O-N 3.2Å; F667-D670 PolarHBondContact O-N 3.05Å; D670-M674 PolarHBondContact O-N 3.28Å; D670-M674 VanDerWaalsContact O-N 3.14Å
671	I	98.4	Very high	97.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-48.4	169.4	-72.6	-76.5	0	0	0	111.7	L649 I652 F667 Q668 L673 M674 F675 V699	L649-I671 HydrophobicContact CD2-CD1 3.89Å; I652-I671 HydrophobicContact CD1-CD1 3.64Å; I652-I671 HydrophobicContact CD1-CG1 3.99Å; I652-I671 HydrophobicContact CG2-CD1 4.37Å; F667-I671 HydrophobicContact CD1-CG1 4.25Å; F667-I671 HydrophobicContact CD2-CG1 4.19Å; F667-I671 HydrophobicContact CE1-CD1 4.48Å; F667-I671 HydrophobicContact CE1-CG1 3.88Å; F667-I671 HydrophobicContact CE2-CD1 4.03Å; F667-I671 HydrophobicContact CE2-CG1 3.81Å; F667-I671 HydrophobicContact CG-CG1 4.42Å; F667-I671 HydrophobicContact CZ-CD1 3.85Å; F667-I671 HydrophobicContact CZ-CG1 3.65Å; F667-I671 WeakPolarHBondContact O-CB 3.4Å; F667-I671 VanDerWaalsContact O-CG1 3.27Å; F667-I671 WeakPolarHBondContact O-CG1 3.47Å; F667-I671 PolarHBondContact O-N 2.92Å; Q668-I671 PolarHBondContact O-N 3.28Å; I671-L673 VanDerWaalsContact C-N 3.33Å; I671-L673 PolarHBondContact O-N 3.34Å; I671-M674 WeakPolarHBondContact O-CB 3.35Å; I671-M674 PolarHBondContact O-N 2.75Å; I671-F675 HydrophobicContact CG2-CD2 4.11Å; I671-F675 HydrophobicContact CG2-CE2 3.64Å; I671-F675 VanDerWaalsContact O-CD2 3.26Å; I671-F675 WeakPolarHBondContact O-CD2 3.4Å; I671-F675 PolarHBondContact O-N 2.69Å; I671-V699 HydrophobicContact CG2-CG1 3.88Å
672	M	98.3	Very high	97.6	Very high	77 Å²	77	46.9 Å²	46.9	38%	0.379	23%	0.228	S	C	.	.	H	α-helix	trans	-65.4	-37.2	178.1	-74	179.4	68.5	0	0	111.7	Q668 R669 M674 F675 Q676 L700	Q668-M672 HydrophobicContact CG-CG 4.33Å; Q668-M672 HydrophobicContact CG-SD 3.86Å; Q668-M672 WeakPolarHBondContact O-CB 3.4Å; Q668-M672 VanDerWaalsContact O-CG 3.31Å; Q668-M672 WeakPolarHBondContact O-CG 3.44Å; Q668-M672 PolarHBondContact O-N 2.75Å; R669-M672 PolarHBondContact O-N 3.1Å; M672-M674 VanDerWaalsContact C-N 3.34Å; M672-M674 PolarHBondContact O-N 3.03Å; M672-F675 PolarHBondContact O-N 3.49Å; M672-Q676 VanDerWaalsContact O-CB 3.23Å; M672-Q676 WeakPolarHBondContact O-CB 3.46Å; M672-Q676 PolarHBondContact O-N 3.34Å; M672-L700 HydrophobicContact CG-CD2 4.2Å; M672-L700 HydrophobicContact SD-CD2 4.3Å
673	L	98.6	Very high	97.6	Very high	38 Å²	38	43.5 Å²	43.5	20%	0.199	23%	0.226	C	C	.	.	H	α-helix	trans	-59.1	-43.4	173.7	173.7	65.2	0	0	0	112.1	R645 M647 R669 I671 Q676 N677	R645-L673 HydrophobicContact CG-CD2 3.85Å; M647-L673 HydrophobicContact CB-CD2 4.01Å; M647-L673 HydrophobicContact CB-CG 4.15Å; M647-L673 HydrophobicContact CE-CD2 4.37Å; M647-L673 HydrophobicContact CG-CD2 4.5Å; R669-L673 VanDerWaalsContact O-CB 3.29Å; R669-L673 WeakPolarHBondContact O-CB 3.43Å; R669-L673 PolarHBondContact O-N 3.37Å; I671-L673 VanDerWaalsContact C-N 3.33Å; I671-L673 PolarHBondContact O-N 3.34Å; L673-Q676 PolarHBondContact O-N 3.18Å; L673-N677 VanDerWaalsContact O-CB 3.3Å; L673-N677 WeakPolarHBondContact O-CB 3.43Å; L673-N677 PolarHBondContact O-N 3.03Å; L673-N677 PolarHBondContact O-ND2 3.45Å
674	M	98.6	Very high	97.6	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.02	23%	0.226	C	C	.	.	H	α-helix	trans	-58.3	-47.9	177.4	178.7	-172.7	80.8	0	0	111.8	F627 M647 L649 I652 D670 I671 M672 A678	F627-M674 HydrophobicContact CB-CE 3.99Å; F627-M674 HydrophobicContact CB-SD 3.88Å; F627-M674 HydrophobicContact CD1-CE 4.28Å; F627-M674 HydrophobicContact CD1-CG 4.13Å; F627-M674 HydrophobicContact CD1-SD 4.45Å; F627-M674 HydrophobicContact CG-CE 4.19Å; F627-M674 HydrophobicContact CG-SD 4.5Å; M647-M674 HydrophobicContact CB-CB 4.27Å; M647-M674 HydrophobicContact CG-CB 4.3Å; M647-M674 WeakPolarHBondContact O-CG 3.36Å; L649-M674 HydrophobicContact CD2-CE 3.92Å; L649-M674 HydrophobicContact CD2-SD 3.92Å; L649-M674 HydrophobicContact CG-CE 4.11Å; L649-M674 HydrophobicContact CG-SD 3.75Å; I652-M674 HydrophobicContact CD1-CB 4.49Å; I652-M674 HydrophobicContact CD1-SD 4.16Å; D670-M674 PolarHBondContact O-N 3.28Å; D670-M674 VanDerWaalsContact O-N 3.14Å; I671-M674 WeakPolarHBondContact O-CB 3.35Å; I671-M674 PolarHBondContact O-N 2.75Å; M672-M674 VanDerWaalsContact C-N 3.34Å; M672-M674 PolarHBondContact O-N 3.03Å; M674-A678 PolarHBondContact O-N 3.48Å
675	F	98.6	Very high	97.6	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-69.4	-43	176.4	-61.7	-58	0	0	0	112.3	F627 I671 M672 N677 A678 I679 A692 M695 Q696 V699	F627-F675 HydrophobicContact CD2-CE1 4.45Å; F627-F675 HydrophobicContact CE1-CD1 4.16Å; F627-F675 HydrophobicContact CE1-CE1 4.47Å; F627-F675 HydrophobicContact CE2-CE1 4.34Å; F627-F675 HydrophobicContact CZ-CD1 4.25Å; F627-F675 HydrophobicContact CZ-CE1 4.37Å; I671-F675 HydrophobicContact CG2-CD2 4.11Å; I671-F675 HydrophobicContact CG2-CE2 3.64Å; I671-F675 VanDerWaalsContact O-CD2 3.26Å; I671-F675 WeakPolarHBondContact O-CD2 3.4Å; I671-F675 PolarHBondContact O-N 2.69Å; M672-F675 PolarHBondContact O-N 3.49Å; F675-N677 VanDerWaalsContact C-N 3.31Å; F675-N677 PolarHBondContact O-N 3.01Å; F675-A678 WeakPolarHBondContact O-CB 3.46Å; F675-A678 PolarHBondContact O-N 2.86Å; F675-I679 HydrophobicContact CB-CD1 4.41Å; F675-I679 WeakPolarHBondContact O-CG1 3.24Å; F675-I679 PolarHBondContact O-N 3.04Å; F675-A692 HydrophobicContact CD1-CB 4.39Å; F675-M695 HydrophobicContact CE1-CB 3.88Å; F675-M695 HydrophobicContact CE1-CE 4.29Å; F675-M695 HydrophobicContact CE1-CG 3.69Å; F675-M695 HydrophobicContact CE1-SD 4.1Å; F675-M695 HydrophobicContact CZ-CB 4.26Å; F675-M695 HydrophobicContact CZ-CE 4.14Å; F675-M695 HydrophobicContact CZ-CG 3.74Å; F675-M695 HydrophobicContact CZ-SD 4.41Å; F675-Q696 HydrophobicContact CB-CB 4.12Å; F675-Q696 HydrophobicContact CB-CG 4.35Å; F675-Q696 VanDerWaalsContact CB-OE1 3.26Å; F675-Q696 HydrophobicContact CD1-CB 4.26Å; F675-Q696 HydrophobicContact CD2-CB 3.72Å; F675-Q696 HydrophobicContact CD2-CG 3.93Å; F675-Q696 HydrophobicContact CE2-CB 4.15Å; F675-Q696 HydrophobicContact CG-CB 3.78Å; F675-Q696 HydrophobicContact CG-CG 4.28Å; F675-V699 HydrophobicContact CE2-CB 4.26Å; F675-V699 HydrophobicContact CE2-CG1 4.37Å; F675-V699 HydrophobicContact CZ-CB 4.32Å; F675-V699 HydrophobicContact CZ-CG2 4.26Å
676	Q	98.4	Very high	97.6	Very high	105 Å²	105	50.3 Å²	50.3	49%	0.491	25%	0.252	S	S	.	.	H	α-helix	trans	-63.6	-35.6	-179.4	-173.4	59.1	83.1	0	0	112.4	M672 L673 A678 I679 M680	M672-Q676 VanDerWaalsContact O-CB 3.23Å; M672-Q676 WeakPolarHBondContact O-CB 3.46Å; M672-Q676 PolarHBondContact O-N 3.34Å; L673-Q676 PolarHBondContact O-N 3.18Å; Q676-A678 VanDerWaalsContact C-N 3.34Å; Q676-I679 PolarHBondContact O-N 3.08Å; Q676-M680 WeakPolarHBondContact O-CB 3.2Å; Q676-M680 PolarHBondContact O-N 2.99Å
677	N	98.2	Very high	97.6	Very high	10 Å²	10	54 Å²	54	5%	0.053	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-41.6	171.8	-74.5	-20.9	0	0	0	111.7	V643 R645 L673 F675 Y681	V643-N677 HydrophobicContact CG1-CB 3.89Å; V643-N677 VanDerWaalsContact CG1-CG 3.44Å; V643-N677 HydrophobicContact CG2-CB 4.41Å; R645-N677 PolarHBondContact O-ND2 3.35Å; L673-N677 VanDerWaalsContact O-CB 3.3Å; L673-N677 WeakPolarHBondContact O-CB 3.43Å; L673-N677 PolarHBondContact O-N 3.03Å; L673-N677 PolarHBondContact O-ND2 3.45Å; F675-N677 VanDerWaalsContact C-N 3.31Å; F675-N677 PolarHBondContact O-N 3.01Å; N677-Y681 WeakPolarHBondContact O-CB 3.15Å; N677-Y681 PolarHBondContact O-N 3.13Å; N677-Y681 VanDerWaalsContact O-N 3.1Å
678	A	97.8	Very high	97.5	Very high	8 Å²	8	55.4 Å²	55.4	7%	0.066	28%	0.282	C	S	.	.	H	α-helix	trans	-69.1	-45.9	177.1	0	0	0	0	0	111.7	F627 M674 F675 Q676 M680 Y681 N682 V688 A692	F627-A678 HydrophobicContact CE1-CB 3.89Å; M674-A678 PolarHBondContact O-N 3.48Å; F675-A678 WeakPolarHBondContact O-CB 3.46Å; F675-A678 PolarHBondContact O-N 2.86Å; Q676-A678 VanDerWaalsContact C-N 3.34Å; A678-M680 VanDerWaalsContact C-N 3.26Å; A678-M680 PolarHBondContact O-N 3.31Å; A678-Y681 PolarHBondContact O-N 3.01Å; A678-N682 WeakPolarHBondContact O-CB 3.32Å; A678-N682 PolarHBondContact O-N 3.14Å; A678-N682 PolarHBondContact O-ND2 3.18Å; A678-V688 HydrophobicContact CB-CG1 4.5Å; A678-A692 HydrophobicContact CB-CB 4.03Å
679	I	97.6	Very high	97.5	Very high	29 Å²	29	55.4 Å²	55.4	15%	0.149	28%	0.28	C	S	.	.	H	α-helix	trans	-62.9	-31.2	177.5	-68.2	163.8	0	0	0	111.9	F675 Q676 Y689 A692 L693	F675-I679 HydrophobicContact CB-CD1 4.41Å; F675-I679 WeakPolarHBondContact O-CG1 3.24Å; F675-I679 PolarHBondContact O-N 3.04Å; Q676-I679 PolarHBondContact O-N 3.08Å; I679-Y689 HydrophobicContact CB-CE2 4.48Å; I679-Y689 HydrophobicContact CG2-CD2 4.29Å; I679-Y689 HydrophobicContact CG2-CE2 3.77Å; I679-A692 HydrophobicContact CD1-CB 4.31Å; I679-A692 HydrophobicContact CG1-CB 3.82Å; I679-L693 HydrophobicContact CD1-CD2 3.7Å; I679-L693 HydrophobicContact CD1-CG 4.28Å; I679-L693 HydrophobicContact CG1-CD2 4.3Å; I679-L693 HydrophobicContact CG1-CG 4.46Å
680	M	96.8	Very high	97.5	Very high	102 Å²	102	54 Å²	54	50%	0.502	28%	0.279	S	S	.	.	H	α-helix	trans	-81	-34.4	178.2	-177.9	-176.7	70	0	0	113.5	I642 V643 Q676 A678	I642-M680 HydrophobicContact CG2-CE 4.36Å; V643-M680 HydrophobicContact CG2-CE 3.92Å; Q676-M680 WeakPolarHBondContact O-CB 3.2Å; Q676-M680 PolarHBondContact O-N 2.99Å; A678-M680 VanDerWaalsContact C-N 3.26Å; A678-M680 PolarHBondContact O-N 3.31Å
681	Y	97.2	Very high	97.4	Very high	57 Å²	57	55.2 Å²	55.2	22%	0.224	29%	0.285	C	S	.	.	H	α-helix	trans	-85.9	-35.3	-177.1	175.6	-91.6	0	0	0	113.1	A636 P637 Y639 I642 N677 A678	A636-Y681 VanDerWaalsContact C-OH 3.3Å; A636-Y681 HydrophobicContact CB-CE1 3.71Å; P637-Y681 PolarHBondContact O-OH 2.92Å; P637-Y681 VanDerWaalsContact O-OH 3.08Å; Y639-Y681 AromaticContact CD2-CD1 3.83Å; Y639-Y681 HydrophobicContact CD2-CD1 3.83Å; Y639-Y681 AromaticContact CD2-CD2 3.67Å; Y639-Y681 HydrophobicContact CD2-CD2 3.67Å; Y639-Y681 HydrophobicContact CD2-CE1 4.13Å; Y639-Y681 AromaticContact CD2-CE2 3.96Å; Y639-Y681 HydrophobicContact CD2-CE2 3.96Å; Y639-Y681 AromaticContact CD2-CG 3.6Å; Y639-Y681 HydrophobicContact CD2-CG 3.6Å; Y639-Y681 HydrophobicContact CE2-CD1 4.24Å; Y639-Y681 HydrophobicContact CE2-CD2 4.39Å; Y639-Y681 AromaticContact CE2-CG 3.97Å; Y639-Y681 HydrophobicContact CE2-CG 3.97Å; Y639-Y681 HydrophobicContact CG-CD2 4.46Å; Y639-Y681 HydrophobicContact CG-CE2 4.49Å; I642-Y681 HydrophobicContact CB-CD2 4.35Å; I642-Y681 HydrophobicContact CD1-CD2 4.08Å; I642-Y681 HydrophobicContact CD1-CE2 4.11Å; N677-Y681 WeakPolarHBondContact O-CB 3.15Å; N677-Y681 PolarHBondContact O-N 3.13Å; N677-Y681 VanDerWaalsContact O-N 3.1Å; A678-Y681 PolarHBondContact O-N 3.01Å
682	N	96.5	Very high	97.4	Very high	25 Å²	25	55.2 Å²	55.2	13%	0.134	29%	0.285	C	S	.	.	S	Bend	trans	-90.1	141.4	-179	-62.8	-91.6	0	0	0	110.4	A678 H686	A678-N682 WeakPolarHBondContact O-CB 3.32Å; A678-N682 PolarHBondContact O-N 3.14Å; A678-N682 PolarHBondContact O-ND2 3.18Å; N682-H686 HydrophobicContact CB-CB 4.36Å; N682-H686 PolarHBondContact OD1-CE1 3.15Å; N682-H686 VanDerWaalsContact OD1-CE1 3.29Å; N682-H686 PolarHBondContact OD1-ND1 2.98Å
683	S	95.2	Very high	97.4	Very high	68 Å²	68	55 Å²	55	48%	0.476	28%	0.284	S	S	.	.			trans	-68.1	161.4	169.9	53.9	0	0	0	0	111.5	D685 H686 Y689	S683-D685 PolarHBondContact O-N 3.03Å; S683-D685 VanDerWaalsContact O-N 3.08Å; S683-H686 PolarHBondContact O-N 2.9Å; S683-Y689 WeakPolarHBondContact O-CB 3.34Å
684	S	96	Very high	97.4	Very high	60 Å²	60	55.8 Å²	55.8	42%	0.42	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-30.5	174.9	43.1	0	0	0	0	113.9	H690	S684-H690 PolarHBondContact O-CE1 2.79Å; S684-H690 VanDerWaalsContact O-CE1 3.3Å; S684-H690 PolarHBondContact O-NE2 3.14Å
685	D	95.8	Very high	97.3	Very high	139 Å²	139	55.6 Å²	55.6	74%	0.743	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	5.8	-168.5	-31.5	-37.4	0	0	0	112.4	S683	S683-D685 PolarHBondContact O-N 3.03Å; S683-D685 VanDerWaalsContact O-N 3.08Å
686	H	96.9	Very high	97.3	Very high	89 Å²	89	57.7 Å²	57.7	41%	0.412	30%	0.296	S	S	.	.	S	Bend	trans	-106	131.9	-176.9	-171.8	-113.2	0	0	0	111.1	N682 S683 V688 Y689	N682-H686 HydrophobicContact CB-CB 4.36Å; N682-H686 PolarHBondContact OD1-CE1 3.15Å; N682-H686 VanDerWaalsContact OD1-CE1 3.29Å; N682-H686 PolarHBondContact OD1-ND1 2.98Å; S683-H686 PolarHBondContact O-N 2.9Å; H686-V688 PolarHBondContact O-N 2.84Å; H686-Y689 VanDerWaalsContact O-CB 3.25Å; H686-Y689 WeakPolarHBondContact O-CB 3.48Å; H686-Y689 PolarHBondContact O-N 3.39Å
687	D	96.9	Very high	97.3	Very high	120 Å²	120	60.5 Å²	60.5	64%	0.642	30%	0.302	S	S	*	.	H	α-helix	trans	-48.6	-40.1	-173.6	-68.7	-38.6	0	0	0	113.8	Y689 H690 M691	D687-Y689 PolarHBondContact O-N 3.02Å; D687-H690 PolarHBondContact O-N 3.11Å; D687-H690 VanDerWaalsContact O-N 3.17Å; D687-M691 HydrophobicContact CB-SD 4.38Å; D687-M691 WeakPolarHBondContact O-CB 3.43Å; D687-M691 VanDerWaalsContact O-CG 3.24Å; D687-M691 WeakPolarHBondContact O-CG 3.46Å; D687-M691 PolarHBondContact O-N 2.86Å
688	V	96.8	Very high	97.2	Very high	31 Å²	31	61.7 Å²	61.7	19%	0.188	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-28.1	-178.8	-179.8	0	0	0	0	112.7	V626 A678 H686 A692	V626-V688 HydrophobicContact CG2-CG1 4.41Å; A678-V688 HydrophobicContact CB-CG1 4.5Å; H686-V688 PolarHBondContact O-N 2.84Å; V688-A692 VanDerWaalsContact O-CB 3.29Å; V688-A692 WeakPolarHBondContact O-CB 3.46Å; V688-A692 PolarHBondContact O-N 2.9Å
689	Y	98.1	Very high	97.2	Very high	61 Å²	61	61.5 Å²	61.5	24%	0.239	31%	0.307	C	S	.	.	H	α-helix	trans	-66.5	-49.2	173.6	177.5	-88.1	0	0	0	110.9	I679 S683 H686 D687 A692 L693	I679-Y689 HydrophobicContact CB-CE2 4.48Å; I679-Y689 HydrophobicContact CG2-CD2 4.29Å; I679-Y689 HydrophobicContact CG2-CE2 3.77Å; S683-Y689 WeakPolarHBondContact O-CB 3.34Å; H686-Y689 VanDerWaalsContact O-CB 3.25Å; H686-Y689 WeakPolarHBondContact O-CB 3.48Å; H686-Y689 PolarHBondContact O-N 3.39Å; D687-Y689 PolarHBondContact O-N 3.02Å; Y689-A692 PolarHBondContact O-N 3.23Å; Y689-L693 HydrophobicContact CD1-CD1 3.92Å; Y689-L693 HydrophobicContact CE1-CD1 3.43Å; Y689-L693 VanDerWaalsContact CE1-CD1 3.43Å; Y689-L693 HydrophobicContact CE1-CG 4.49Å; Y689-L693 PolarHBondContact O-N 3.05Å; Y689-L693 VanDerWaalsContact O-N 3.11Å
690	H	97.8	Very high	97.1	Very high	104 Å²	104	61.6 Å²	61.6	48%	0.481	31%	0.307	S	S	.	.	H	α-helix	trans	-66	-40.4	175.8	-63.3	-50.1	0	0	0	112.3	S684 D687 A692 L693 E694	S684-H690 PolarHBondContact O-CE1 2.79Å; S684-H690 VanDerWaalsContact O-CE1 3.3Å; S684-H690 PolarHBondContact O-NE2 3.14Å; D687-H690 PolarHBondContact O-N 3.11Å; D687-H690 VanDerWaalsContact O-N 3.17Å; H690-A692 VanDerWaalsContact C-N 3.3Å; H690-A692 PolarHBondContact O-N 3.47Å; H690-L693 PolarHBondContact O-N 2.97Å; H690-E694 PolarHBondContact O-N 3.29Å
691	M	98	Very high	97	Very high	33 Å²	33	62.9 Å²	62.9	16%	0.163	31%	0.312	C	S	.	.	H	α-helix	trans	-60.1	-39.3	174.6	-70.2	169.1	67.9	0	0	112.1	Y623 V626 D687 M695	Y623-M691 HydrophobicContact CD1-CE 3.91Å; Y623-M691 HydrophobicContact CD1-CG 3.94Å; Y623-M691 HydrophobicContact CD2-CB 3.69Å; Y623-M691 HydrophobicContact CD2-CG 3.8Å; Y623-M691 WeakPolarHBondContact CD2-O 3.38Å; Y623-M691 HydrophobicContact CE1-CG 4.16Å; Y623-M691 HydrophobicContact CE2-CB 4.19Å; Y623-M691 HydrophobicContact CE2-CG 4Å; Y623-M691 HydrophobicContact CG-CB 3.91Å; Y623-M691 HydrophobicContact CG-CE 3.92Å; Y623-M691 HydrophobicContact CG-CG 3.77Å; V626-M691 HydrophobicContact CG1-CE 3.87Å; V626-M691 HydrophobicContact CG2-CE 3.8Å; D687-M691 HydrophobicContact CB-SD 4.38Å; D687-M691 WeakPolarHBondContact O-CB 3.43Å; D687-M691 VanDerWaalsContact O-CG 3.24Å; D687-M691 WeakPolarHBondContact O-CG 3.46Å; D687-M691 PolarHBondContact O-N 2.86Å; M691-M695 WeakPolarHBondContact O-CB 3.35Å; M691-M695 PolarHBondContact O-N 3.1Å; M691-M695 VanDerWaalsContact O-N 3.1Å
692	A	98.2	Very high	96.8	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-65	-43.3	175	0	0	0	0	0	111.7	F627 F675 A678 I679 V688 Y689 H690 Q696	F627-A692 HydrophobicContact CE1-CB 4.31Å; F627-A692 HydrophobicContact CZ-CB 3.84Å; F675-A692 HydrophobicContact CD1-CB 4.39Å; A678-A692 HydrophobicContact CB-CB 4.03Å; I679-A692 HydrophobicContact CD1-CB 4.31Å; I679-A692 HydrophobicContact CG1-CB 3.82Å; V688-A692 VanDerWaalsContact O-CB 3.29Å; V688-A692 WeakPolarHBondContact O-CB 3.46Å; V688-A692 PolarHBondContact O-N 2.9Å; Y689-A692 PolarHBondContact O-N 3.23Å; H690-A692 VanDerWaalsContact C-N 3.3Å; H690-A692 PolarHBondContact O-N 3.47Å; A692-Q696 WeakPolarHBondContact O-CA 3.5Å; A692-Q696 WeakPolarHBondContact O-CB 3.32Å; A692-Q696 PolarHBondContact O-N 3.29Å
693	L	97.7	Very high	96.6	Very high	71 Å²	71	62.6 Å²	62.6	37%	0.372	31%	0.312	S	S	.	.	H	α-helix	trans	-66.8	-46.9	179.7	-71	172.4	0	0	0	113.2	I679 Y689 H690 Q696 R697	I679-L693 HydrophobicContact CD1-CD2 3.7Å; I679-L693 HydrophobicContact CD1-CG 4.28Å; I679-L693 HydrophobicContact CG1-CD2 4.3Å; I679-L693 HydrophobicContact CG1-CG 4.46Å; Y689-L693 HydrophobicContact CD1-CD1 3.92Å; Y689-L693 HydrophobicContact CE1-CD1 3.43Å; Y689-L693 VanDerWaalsContact CE1-CD1 3.43Å; Y689-L693 HydrophobicContact CE1-CG 4.49Å; Y689-L693 PolarHBondContact O-N 3.05Å; Y689-L693 VanDerWaalsContact O-N 3.11Å; H690-L693 PolarHBondContact O-N 2.97Å; L693-Q696 PolarHBondContact O-N 2.91Å; L693-R697 PolarHBondContact O-N 3.34Å; L693-R697 VanDerWaalsContact O-N 3.14Å
694	E	97.8	Very high	96.5	Very high	56 Å²	56	65.5 Å²	65.5	26%	0.262	32%	0.318	S	S	.	.	H	α-helix	trans	-60.9	-49.6	176.9	-169.6	-175.5	132.5	0	0	110.3	R622 Y623 H690 Q696 R697 D698	R622-E694 WeakPolarHBondContact CD-OE1 3.05Å; R622-E694 IonicContact CZ-OE1 3.82Å; R622-E694 IonicContact NE-OE1 3.59Å; R622-E694 IonicContact NH1-OE1 3.91Å; R622-E694 PolarHBondContact NH1-OE1 3.47Å; R622-E694 IonicContact NH1-OE2 2.98Å; R622-E694 PolarHBondContact NH1-OE2 3.22Å; Y623-E694 HydrophobicContact CD2-CB 4.28Å; Y623-E694 HydrophobicContact CE2-CB 3.78Å; Y623-E694 HydrophobicContact CE2-CG 3.98Å; Y623-E694 WeakPolarHBondContact CE2-OE1 3.22Å; Y623-E694 WeakPolarHBondContact CE2-OE2 3.18Å; Y623-E694 PolarHBondContact OH-OE2 2.96Å; H690-E694 PolarHBondContact O-N 3.29Å; E694-Q696 PolarHBondContact O-N 3.07Å; E694-R697 PolarHBondContact O-N 3.09Å; E694-D698 PolarHBondContact O-N 2.7Å
695	M	98.2	Very high	96.3	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-68.8	-33	-179.1	-171.6	169.1	163.7	0	0	112.9	A618 H621 A624 F627 L649 F675 M691 V699	A618-M695 HydrophobicContact CB-CE 4.23Å; A618-M695 WeakPolarHBondContact O-CE 3.5Å; H621-M695 HydrophobicContact CB-CE 3.93Å; H621-M695 HydrophobicContact CB-CG 4.1Å; H621-M695 HydrophobicContact CB-SD 3.9Å; H621-M695 VanDerWaalsContact ND1-CG 3.29Å; H621-M695 WeakPolarHBondContact ND1-CG 3.32Å; H621-M695 PolarHBondContact ND1-SD 2.84Å; A624-M695 HydrophobicContact CB-CE 4.07Å; A624-M695 HydrophobicContact CB-SD 4.44Å; F627-M695 HydrophobicContact CD2-CE 4.28Å; F627-M695 HydrophobicContact CD2-SD 3.52Å; F627-M695 VanDerWaalsContact CD2-SD 3.52Å; F627-M695 HydrophobicContact CE2-SD 3.84Å; L649-M695 HydrophobicContact CD1-CE 4.12Å; F675-M695 HydrophobicContact CE1-CB 3.88Å; F675-M695 HydrophobicContact CE1-CE 4.29Å; F675-M695 HydrophobicContact CE1-CG 3.69Å; F675-M695 HydrophobicContact CE1-SD 4.1Å; F675-M695 HydrophobicContact CZ-CB 4.26Å; F675-M695 HydrophobicContact CZ-CE 4.14Å; F675-M695 HydrophobicContact CZ-CG 3.74Å; F675-M695 HydrophobicContact CZ-SD 4.41Å; M691-M695 WeakPolarHBondContact O-CB 3.35Å; M691-M695 PolarHBondContact O-N 3.1Å; M691-M695 VanDerWaalsContact O-N 3.1Å; M695-V699 HydrophobicContact CE-CG2 4.27Å; M695-V699 HydrophobicContact CG-CG2 4.03Å; M695-V699 VanDerWaalsContact O-CB 3.25Å; M695-V699 WeakPolarHBondContact O-CB 3.49Å; M695-V699 WeakPolarHBondContact O-CG2 3.45Å; M695-V699 PolarHBondContact O-N 3.35Å
696	Q	98.2	Very high	96.1	Very high	43 Å²	43	61.8 Å²	61.8	20%	0.201	29%	0.289	C	S	.	.	H	α-helix	trans	-62.2	-46.7	174.5	175.8	175.8	-46.8	0	0	111.1	F675 A692 L693 E694 L700	F675-Q696 HydrophobicContact CB-CB 4.12Å; F675-Q696 HydrophobicContact CB-CG 4.35Å; F675-Q696 VanDerWaalsContact CB-OE1 3.26Å; F675-Q696 HydrophobicContact CD1-CB 4.26Å; F675-Q696 HydrophobicContact CD2-CB 3.72Å; F675-Q696 HydrophobicContact CD2-CG 3.93Å; F675-Q696 HydrophobicContact CE2-CB 4.15Å; F675-Q696 HydrophobicContact CG-CB 3.78Å; F675-Q696 HydrophobicContact CG-CG 4.28Å; A692-Q696 WeakPolarHBondContact O-CA 3.5Å; A692-Q696 WeakPolarHBondContact O-CB 3.32Å; A692-Q696 PolarHBondContact O-N 3.29Å; L693-Q696 PolarHBondContact O-N 2.91Å; E694-Q696 PolarHBondContact O-N 3.07Å; Q696-L700 HydrophobicContact CG-CD1 3.75Å; Q696-L700 HydrophobicContact CG-CG 4.38Å; Q696-L700 VanDerWaalsContact O-CB 3.29Å; Q696-L700 WeakPolarHBondContact O-CB 3.41Å; Q696-L700 WeakPolarHBondContact O-CG 3.39Å; Q696-L700 PolarHBondContact O-N 3.05Å
697	R	97.4	Very high	95.8	Very high	165 Å²	165	60.8 Å²	60.8	62%	0.623	29%	0.287	S	S	*	.	H	α-helix	trans	-58.1	-53.8	177.9	-176	-164.7	67.1	-173.6	-4	110.7	L693 E694 V699 L700 E701	L693-R697 PolarHBondContact O-N 3.34Å; L693-R697 VanDerWaalsContact O-N 3.14Å; E694-R697 PolarHBondContact O-N 3.09Å; R697-V699 PolarHBondContact O-N 2.98Å; R697-L700 PolarHBondContact O-N 3.42Å; R697-E701 PolarHBondContact O-N 2.89Å; R697-E701 VanDerWaalsContact O-N 3.09Å
698	D	96.8	Very high	95.3	Very high	35 Å²	35	57.1 Å²	57.1	19%	0.187	27%	0.273	C	S	.	.	H	α-helix	trans	-68.2	-35.3	-173	-65.7	11.7	0	0	0	111.7	H621 E694 H702	H621-D698 IonicContact NE2-OD2 2.69Å; E694-D698 PolarHBondContact O-N 2.7Å; D698-H702 PolarHBondContact O-N 2.82Å; D698-H702 PolarHBondContact O-ND1 3.08Å
699	V	96.7	Very high	94.7	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.024	27%	0.27	C	S	.	.	H	α-helix	trans	-73.5	-34.6	174.8	173	0	0	0	0	112	A618 I671 F675 M695 R697 E701 H702 V703	A618-V699 HydrophobicContact CB-CG1 4Å; A618-V699 HydrophobicContact CB-CG2 3.64Å; I671-V699 HydrophobicContact CG2-CG1 3.88Å; F675-V699 HydrophobicContact CE2-CB 4.26Å; F675-V699 HydrophobicContact CE2-CG1 4.37Å; F675-V699 HydrophobicContact CZ-CB 4.32Å; F675-V699 HydrophobicContact CZ-CG2 4.26Å; M695-V699 HydrophobicContact CE-CG2 4.27Å; M695-V699 HydrophobicContact CG-CG2 4.03Å; M695-V699 VanDerWaalsContact O-CB 3.25Å; M695-V699 WeakPolarHBondContact O-CB 3.49Å; M695-V699 WeakPolarHBondContact O-CG2 3.45Å; M695-V699 PolarHBondContact O-N 3.35Å; R697-V699 PolarHBondContact O-N 2.98Å; V699-E701 VanDerWaalsContact C-N 3.34Å; V699-H702 PolarHBondContact O-N 3.04Å; V699-V703 WeakPolarHBondContact O-CG2 3.47Å; V699-V703 PolarHBondContact O-N 3.23Å; V699-V703 VanDerWaalsContact O-N 3.09Å
700	L	95.8	Very high	94	Very high	31 Å²	31	55.2 Å²	55.2	16%	0.162	27%	0.266	C	S	.	.	H	α-helix	trans	-66.8	-34.1	175	-76.4	172.5	0	0	0	112.3	Q668 M672 Q696 R697 H702 V703 Q704	Q668-L700 HydrophobicContact CG-CD2 4.43Å; M672-L700 HydrophobicContact CG-CD2 4.2Å; M672-L700 HydrophobicContact SD-CD2 4.3Å; Q696-L700 HydrophobicContact CG-CD1 3.75Å; Q696-L700 HydrophobicContact CG-CG 4.38Å; Q696-L700 VanDerWaalsContact O-CB 3.29Å; Q696-L700 WeakPolarHBondContact O-CB 3.41Å; Q696-L700 WeakPolarHBondContact O-CG 3.39Å; Q696-L700 PolarHBondContact O-N 3.05Å; R697-L700 PolarHBondContact O-N 3.42Å; L700-H702 VanDerWaalsContact C-N 3.33Å; L700-H702 PolarHBondContact O-N 3.3Å; L700-V703 PolarHBondContact O-N 2.92Å; L700-Q704 WeakPolarHBondContact O-CG 3.25Å; L700-Q704 PolarHBondContact O-N 3.04Å
701	E	94.3	Very high	93.2	Very high	128 Å²	128	52.8 Å²	52.8	60%	0.598	26%	0.256	S	S	*	.	H	α-helix	trans	-57.6	-46.1	170.8	-171.8	-175.8	-179	0	0	111.1	R697 V699 V703 Q704 Q705	R697-E701 PolarHBondContact O-N 2.89Å; R697-E701 VanDerWaalsContact O-N 3.09Å; V699-E701 VanDerWaalsContact C-N 3.34Å; E701-V703 VanDerWaalsContact C-N 3.31Å; E701-V703 PolarHBondContact O-N 2.9Å; E701-Q704 PolarHBondContact O-N 2.96Å; E701-Q705 WeakPolarHBondContact O-CB 3.32Å; E701-Q705 PolarHBondContact O-N 3.27Å
702	H	93	Very high	92.2	Very high	75 Å²	75	56.7 Å²	56.7	35%	0.347	28%	0.276	S	S	.	.	H	α-helix	trans	-64.5	-32.2	176.7	-70.3	78.1	0	0	0	113	V614 A617 D698 V699 L700 F706	V614-H702 HydrophobicContact CG1-CB 4.01Å; A617-H702 VanDerWaalsContact CB-CD2 3.42Å; A617-H702 WeakPolarHBondContact CB-CD2 3.24Å; D698-H702 PolarHBondContact O-N 2.82Å; D698-H702 PolarHBondContact O-ND1 3.08Å; V699-H702 PolarHBondContact O-N 3.04Å; L700-H702 VanDerWaalsContact C-N 3.33Å; L700-H702 PolarHBondContact O-N 3.3Å; H702-F706 WeakPolarHBondContact O-CB 3.44Å; H702-F706 PolarHBondContact O-N 3.35Å; H702-F706 VanDerWaalsContact O-N 3.14Å
703	V	93.6	Very high	90.9	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.006	29%	0.285	C	S	.	.	H	α-helix	trans	-69.1	-43.9	173	173.6	0	0	0	0	111.1	V614 F667 Q668 V699 L700 E701 F706 L707	V614-V703 HydrophobicContact CG1-CG2 3.83Å; F667-V703 HydrophobicContact CD1-CG2 4.37Å; F667-V703 HydrophobicContact CE1-CG2 3.98Å; Q668-V703 HydrophobicContact CB-CG1 4.25Å; Q668-V703 HydrophobicContact CG-CG1 4.23Å; V699-V703 WeakPolarHBondContact O-CG2 3.47Å; V699-V703 PolarHBondContact O-N 3.23Å; V699-V703 VanDerWaalsContact O-N 3.09Å; L700-V703 PolarHBondContact O-N 2.92Å; E701-V703 VanDerWaalsContact C-N 3.31Å; E701-V703 PolarHBondContact O-N 2.9Å; V703-F706 PolarHBondContact O-N 3.49Å; V703-L707 HydrophobicContact CG1-CD1 4.1Å; V703-L707 WeakPolarHBondContact O-CG 3.46Å; V703-L707 PolarHBondContact O-N 3.29Å
704	Q	93.7	Very high	89.7	Confident	130 Å²	130	60.5 Å²	60.5	61%	0.607	29%	0.292	S	S	*	.	H	α-helix	trans	-64.3	-45.1	177.6	-70	174.5	36.5	0	0	111.6	L700 E701 F706 L707 A708	L700-Q704 WeakPolarHBondContact O-CG 3.25Å; L700-Q704 PolarHBondContact O-N 3.04Å; E701-Q704 PolarHBondContact O-N 2.96Å; Q704-F706 VanDerWaalsContact C-N 3.26Å; Q704-F706 PolarHBondContact O-N 2.89Å; Q704-L707 PolarHBondContact O-N 3.21Å; Q704-L707 VanDerWaalsContact O-N 3.16Å; Q704-A708 PolarHBondContact O-N 2.93Å
705	Q	90	Very high	88.1	Confident	119 Å²	119	60.6 Å²	60.6	56%	0.556	30%	0.297	S	S	*	.	H	α-helix	trans	-59.1	-38.1	175	-172.2	64.5	17	0	0	111.8	E701 T709	E701-Q705 WeakPolarHBondContact O-CB 3.32Å; E701-Q705 PolarHBondContact O-N 3.27Å; Q705-T709 WeakPolarHBondContact O-CB 3.47Å; Q705-T709 PolarHBondContact O-N 2.98Å; Q705-T709 PolarHBondContact O-OG1 3.09Å
706	F	91.9	Very high	85.9	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.009	31%	0.311	C	S	.	.	H	α-helix	trans	-68.4	-42.7	174.6	179.1	-105.2	0	0	0	112.6	A610 I611 V614 T664 H702 V703 Q704 T709 Q710 F755	A610-F706 HydrophobicContact CB-CE2 3.67Å; A610-F706 HydrophobicContact CB-CZ 4.2Å; I611-F706 HydrophobicContact CD1-CD1 3.78Å; I611-F706 HydrophobicContact CD1-CE1 3.56Å; I611-F706 HydrophobicContact CD1-CZ 4.24Å; V614-F706 HydrophobicContact CG2-CB 3.71Å; V614-F706 HydrophobicContact CG2-CD2 4.2Å; V614-F706 HydrophobicContact CG2-CG 3.88Å; T664-F706 HydrophobicContact CG2-CD1 3.73Å; T664-F706 HydrophobicContact CG2-CE1 3.85Å; H702-F706 WeakPolarHBondContact O-CB 3.44Å; H702-F706 PolarHBondContact O-N 3.35Å; H702-F706 VanDerWaalsContact O-N 3.14Å; V703-F706 PolarHBondContact O-N 3.49Å; Q704-F706 VanDerWaalsContact C-N 3.26Å; Q704-F706 PolarHBondContact O-N 2.89Å; F706-T709 PolarHBondContact O-N 3.46Å; F706-Q710 HydrophobicContact CD1-CG 4.33Å; F706-Q710 HydrophobicContact CE1-CG 3.89Å; F706-Q710 HydrophobicContact CE2-CG 4.11Å; F706-Q710 HydrophobicContact CZ-CG 3.77Å; F706-Q710 VanDerWaalsContact O-CG 3.3Å; F706-Q710 WeakPolarHBondContact O-CG 3.47Å; F706-Q710 PolarHBondContact O-N 3.25Å; F706-F755 HydrophobicContact CB-CZ 4.44Å; F706-F755 HydrophobicContact CD2-CZ 4.2Å
707	L	91.1	Very high	83.8	Confident	68 Å²	68	65.2 Å²	65.2	36%	0.356	32%	0.323	S	S	.	.	H	α-helix	trans	-61.4	-45.8	175.1	-74.2	167.9	0	0	0	111.9	T664 V703 Q704 T709 Q710 L711	T664-L707 HydrophobicContact CG2-CD2 3.65Å; T664-L707 HydrophobicContact CG2-CG 4.07Å; V703-L707 HydrophobicContact CG1-CD1 4.1Å; V703-L707 WeakPolarHBondContact O-CG 3.46Å; V703-L707 PolarHBondContact O-N 3.29Å; Q704-L707 PolarHBondContact O-N 3.21Å; Q704-L707 VanDerWaalsContact O-N 3.16Å; L707-T709 VanDerWaalsContact C-N 3.33Å; L707-T709 PolarHBondContact O-N 2.78Å; L707-Q710 PolarHBondContact O-N 3.4Å; L707-L711 WeakPolarHBondContact O-CB 3.39Å; L707-L711 PolarHBondContact O-N 2.94Å
708	A	85.9	Confident	81.5	Confident	43 Å²	43	61.3 Å²	61.3	36%	0.355	32%	0.321	S	S	.	.	H	α-helix	trans	-60.1	-41.8	174.8	0	0	0	0	0	112	Q704 Q710 L711 I712	Q704-A708 PolarHBondContact O-N 2.93Å; A708-Q710 PolarHBondContact O-N 2.93Å; A708-L711 PolarHBondContact O-N 2.94Å; A708-I712 WeakPolarHBondContact O-CG1 3.41Å; A708-I712 PolarHBondContact O-N 2.8Å
709	T	85.1	Confident	78.9	Confident	18 Å²	18	61.9 Å²	61.9	11%	0.11	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-42.7	176.2	-56.7	0	0	0	0	111.9	Q705 F706 L707 L711 I712 M713 L751 L754	Q705-T709 WeakPolarHBondContact O-CB 3.47Å; Q705-T709 PolarHBondContact O-N 2.98Å; Q705-T709 PolarHBondContact O-OG1 3.09Å; F706-T709 PolarHBondContact O-N 3.46Å; L707-T709 VanDerWaalsContact C-N 3.33Å; L707-T709 PolarHBondContact O-N 2.78Å; T709-L711 VanDerWaalsContact C-N 3.33Å; T709-L711 PolarHBondContact O-N 2.94Å; T709-I712 PolarHBondContact O-N 2.92Å; T709-M713 PolarHBondContact O-N 3.22Å; T709-M713 VanDerWaalsContact O-N 3.1Å; T709-L751 HydrophobicContact CG2-CD2 3.9Å; T709-L754 HydrophobicContact CG2-CD2 4.37Å
710	Q	83.4	Confident	76.6	Confident	34 Å²	34	67.1 Å²	67.1	16%	0.159	36%	0.357	C	S	.	.	H	α-helix	trans	-63	-38.6	176.3	-71.6	-80.4	107.2	0	0	112.1	F706 L707 A708 M713 Q714	F706-Q710 HydrophobicContact CD1-CG 4.33Å; F706-Q710 HydrophobicContact CE1-CG 3.89Å; F706-Q710 HydrophobicContact CE2-CG 4.11Å; F706-Q710 HydrophobicContact CZ-CG 3.77Å; F706-Q710 VanDerWaalsContact O-CG 3.3Å; F706-Q710 WeakPolarHBondContact O-CG 3.47Å; F706-Q710 PolarHBondContact O-N 3.25Å; L707-Q710 PolarHBondContact O-N 3.4Å; A708-Q710 PolarHBondContact O-N 2.93Å; Q710-M713 PolarHBondContact O-N 3.32Å; Q710-Q714 WeakPolarHBondContact O-CG 3.31Å; Q710-Q714 PolarHBondContact O-N 3.46Å
711	L	79.9	Confident	74.1	Confident	52 Å²	52	69.7 Å²	69.7	27%	0.272	38%	0.378	S	S	.	.	H	α-helix	trans	-66.6	-44.5	178.8	-170.7	57.7	0	0	0	111.9	A382 L386 L707 A708 T709 M713 Q714 T715	A382-L711 HydrophobicContact CB-CD1 4.29Å; A382-L711 HydrophobicContact CB-CD2 3.93Å; A382-L711 HydrophobicContact CB-CG 4.15Å; L386-L711 HydrophobicContact CD1-CD2 3.99Å; L707-L711 WeakPolarHBondContact O-CB 3.39Å; L707-L711 PolarHBondContact O-N 2.94Å; A708-L711 PolarHBondContact O-N 2.94Å; T709-L711 VanDerWaalsContact C-N 3.33Å; T709-L711 PolarHBondContact O-N 2.94Å; L711-M713 VanDerWaalsContact C-N 3.28Å; L711-M713 PolarHBondContact O-N 2.73Å; L711-Q714 PolarHBondContact O-N 3.48Å; L711-T715 PolarHBondContact O-N 3.09Å; L711-T715 PolarHBondContact O-OG1 3.1Å
712	I	77.5	Confident	71.7	Confident	115 Å²	115	67.3 Å²	67.3	59%	0.59	38%	0.38	S	S	*	.	H	α-helix	trans	-61.7	-35.9	174.2	-66.6	163.6	0	0	0	111.5	A708 T709 T715 S716	A708-I712 WeakPolarHBondContact O-CG1 3.41Å; A708-I712 PolarHBondContact O-N 2.8Å; T709-I712 PolarHBondContact O-N 2.92Å; I712-T715 PolarHBondContact O-OG1 3Å; I712-S716 WeakPolarHBondContact O-CB 3.42Å; I712-S716 PolarHBondContact O-N 3.32Å; I712-S716 VanDerWaalsContact O-N 3.13Å
713	M	71.4	Confident	69.5	Low	38 Å²	38	71 Å²	71	19%	0.187	40%	0.395	C	S	.	.	H	α-helix	trans	-64.9	-47.5	177	-166.5	168.9	67.8	0	0	111.3	T709 Q710 L711 T715 S716 E717 L751	T709-M713 PolarHBondContact O-N 3.22Å; T709-M713 VanDerWaalsContact O-N 3.1Å; Q710-M713 PolarHBondContact O-N 3.32Å; L711-M713 VanDerWaalsContact C-N 3.28Å; L711-M713 PolarHBondContact O-N 2.73Å; M713-T715 PolarHBondContact O-N 3.18Å; M713-S716 PolarHBondContact O-N 2.98Å; M713-S716 VanDerWaalsContact O-N 3.15Å; M713-S716 PolarHBondContact O-OG 3.07Å; M713-E717 PolarHBondContact O-N 3.14Å; M713-E717 VanDerWaalsContact O-N 3.13Å; M713-L751 HydrophobicContact SD-CD1 4.32Å
714	Q	72.9	Confident	66.8	Low	113 Å²	113	75.8 Å²	75.8	53%	0.528	43%	0.428	S	S	.	.	H	α-helix	trans	-63.4	-37.3	-179.7	-70.4	176.7	0.5	0	0	113.7	Q710 L711 S718	Q710-Q714 WeakPolarHBondContact O-CG 3.31Å; Q710-Q714 PolarHBondContact O-N 3.46Å; L711-Q714 PolarHBondContact O-N 3.48Å; Q714-S718 PolarHBondContact O-N 3.03Å; Q714-S718 PolarHBondContact O-OG 3.46Å
715	T	62.6	Low	64.5	Low	59 Å²	59	77.5 Å²	77.5	36%	0.362	44%	0.441	S	S	.	.	H	α-helix	trans	-69.4	-37.3	174	57.7	0	0	0	0	111.5	L711 I712 M713 S718 A719	L711-T715 PolarHBondContact O-N 3.09Å; L711-T715 PolarHBondContact O-OG1 3.1Å; I712-T715 PolarHBondContact O-OG1 3Å; M713-T715 PolarHBondContact O-N 3.18Å; T715-S718 WeakPolarHBondContact O-CB 3.43Å; T715-S718 PolarHBondContact O-N 3.13Å; T715-A719 WeakPolarHBondContact O-CB 3.11Å; T715-A719 PolarHBondContact O-N 2.86Å
716	S	52.4	Low	62.5	Low	41 Å²	41	82.9 Å²	82.9	29%	0.287	46%	0.456	S	S	.	.	H	α-helix	trans	-64.9	-41.7	179.3	80.2	0	0	0	0	113.5	I712 M713 A719 I720	I712-S716 WeakPolarHBondContact O-CB 3.42Å; I712-S716 PolarHBondContact O-N 3.32Å; I712-S716 VanDerWaalsContact O-N 3.13Å; M713-S716 PolarHBondContact O-N 2.98Å; M713-S716 VanDerWaalsContact O-N 3.15Å; M713-S716 PolarHBondContact O-OG 3.07Å; S716-A719 PolarHBondContact O-N 3.13Å; S716-I720 WeakPolarHBondContact O-CG1 3.35Å; S716-I720 PolarHBondContact O-N 3.46Å
717	E	53.4	Low	59.8	Low	99 Å²	99	86.1 Å²	86.1	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-64.2	-43.2	177.9	-69.5	175.8	164.6	0	0	111.2	M713 A719 I720 S721	M713-E717 PolarHBondContact O-N 3.14Å; M713-E717 VanDerWaalsContact O-N 3.13Å; E717-A719 VanDerWaalsContact C-N 3.3Å; E717-A719 PolarHBondContact O-N 3Å; E717-I720 PolarHBondContact O-N 2.98Å; E717-I720 VanDerWaalsContact O-N 3.16Å; E717-S721 PolarHBondContact O-N 2.86Å; E717-S721 VanDerWaalsContact O-N 3.16Å
718	S	49.2	Very low	57.5	Low	83 Å²	83	94 Å²	94	58%	0.58	52%	0.515	S	S	*	.	H	α-helix	trans	-57.5	-42.5	173.5	-58.8	0	0	0	0	111.9	Q714 T715 I720 A722	Q714-S718 PolarHBondContact O-N 3.03Å; Q714-S718 PolarHBondContact O-OG 3.46Å; T715-S718 WeakPolarHBondContact O-CB 3.43Å; T715-S718 PolarHBondContact O-N 3.13Å; S718-I720 VanDerWaalsContact C-N 3.29Å; S718-I720 PolarHBondContact O-N 3.39Å; S718-A722 PolarHBondContact O-N 2.94Å
719	A	43.7	Very low	55.4	Low	46 Å²	46	101.2 Å²	101.2	38%	0.38	54%	0.541	S	S	.	.	H	α-helix	trans	-72.9	-13.8	179.5	0	0	0	0	0	114.5	T715 S716 E717 K723	T715-A719 WeakPolarHBondContact O-CB 3.11Å; T715-A719 PolarHBondContact O-N 2.86Å; S716-A719 PolarHBondContact O-N 3.13Å; E717-A719 VanDerWaalsContact C-N 3.3Å; E717-A719 PolarHBondContact O-N 3Å; A719-K723 VanDerWaalsContact O-CD 3.23Å; A719-K723 WeakPolarHBondContact O-CD 3.32Å; A719-K723 WeakPolarHBondContact O-CE 3.45Å; A719-K723 PolarHBondContact O-NZ 3.5Å
720	I	48.3	Very low	53.2	Low	115 Å²	115	103.3 Å²	103.3	59%	0.59	57%	0.567	S	S	*	*	H	α-helix	trans	-90.2	-44.6	174.5	-64.5	161.7	0	0	0	110.2	S716 E717 S718 A722 K723	S716-I720 WeakPolarHBondContact O-CG1 3.35Å; S716-I720 PolarHBondContact O-N 3.46Å; E717-I720 PolarHBondContact O-N 2.98Å; E717-I720 VanDerWaalsContact O-N 3.16Å; S718-I720 VanDerWaalsContact C-N 3.29Å; S718-I720 PolarHBondContact O-N 3.39Å; I720-A722 VanDerWaalsContact C-N 3.3Å; I720-A722 PolarHBondContact O-N 2.99Å; I720-K723 WeakPolarHBondContact O-CB 3.29Å; I720-K723 PolarHBondContact O-N 3.12Å
721	S	42.3	Very low	51.2	Low	84 Å²	84	108.8 Å²	108.8	59%	0.587	60%	0.597	S	S	*	*	H	α-helix	trans	-55.6	-43.2	-179.9	-174.1	0	0	0	0	112.6	E717 K723 S724	E717-S721 PolarHBondContact O-N 2.86Å; E717-S721 VanDerWaalsContact O-N 3.16Å; S721-K723 PolarHBondContact O-N 3.41Å; S721-K723 VanDerWaalsContact O-N 3.09Å; S721-S724 PolarHBondContact O-N 3.2Å
722	A	43.5	Very low	49.2	Very low	79 Å²	79	117.9 Å²	117.9	65%	0.653	63%	0.628	S	S	*	*	H	α-helix	trans	-58.1	-24.6	177.8	0	0	0	0	0	114.6	S718 I720	S718-A722 PolarHBondContact O-N 2.94Å; I720-A722 VanDerWaalsContact C-N 3.3Å; I720-A722 PolarHBondContact O-N 2.99Å
723	K	47.7	Very low	47.4	Very low	153 Å²	153	121.8 Å²	121.8	67%	0.665	64%	0.641	S	S	*	*	H	α-helix	trans	-85.2	-26.2	-177	-65.1	164.7	-177.6	144.7	0	112.5	A719 I720 S721 L725	A719-K723 VanDerWaalsContact O-CD 3.23Å; A719-K723 WeakPolarHBondContact O-CD 3.32Å; A719-K723 WeakPolarHBondContact O-CE 3.45Å; A719-K723 PolarHBondContact O-NZ 3.5Å; I720-K723 WeakPolarHBondContact O-CB 3.29Å; I720-K723 PolarHBondContact O-N 3.12Å; S721-K723 PolarHBondContact O-N 3.41Å; S721-K723 VanDerWaalsContact O-N 3.09Å; K723-L725 VanDerWaalsContact C-N 3.32Å; K723-L725 PolarHBondContact O-N 3.26Å
724	S	36.1	Very low	45.9	Very low	100 Å²	100	126.3 Å²	126.3	70%	0.699	67%	0.673	S	S	*	*	H	α-helix	trans	-69.1	-26.2	-174.1	-165.4	0	0	0	0	113.9	S721 R726	S721-S724 PolarHBondContact O-N 3.2Å; S724-R726 VanDerWaalsContact C-N 3.27Å; S724-R726 PolarHBondContact O-N 3.48Å
725	L	45.1	Very low	44.4	Very low	166 Å²	166	124.4 Å²	124.4	87%	0.869	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	0.1	-175.8	-71.8	173.1	0	0	0	114.9	K723	K723-L725 VanDerWaalsContact C-N 3.32Å; K723-L725 PolarHBondContact O-N 3.26Å
726	R	48	Very low	42.8	Very low	233 Å²	233	130.5 Å²	130.5	88%	0.879	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	21.2	175.6	-151.3	169.8	-73.9	-125.8	3.7	113.6	S724 R728	S724-R726 VanDerWaalsContact C-N 3.27Å; S724-R726 PolarHBondContact O-N 3.48Å; R726-R728 PolarHBondContact O-N 3.2Å
727	G	36.5	Very low	42.4	Very low	70 Å²	70	134 Å²	134	72%	0.722	73%	0.73	S	S	*	*			trans	-75.1	94.5	175.3	0	0	0	0	0	113.6
728	R	42.3	Very low	41.8	Very low	234 Å²	234	132.8 Å²	132.8	88%	0.883	74%	0.737	S	S	*	*			trans	-82	121.2	174.4	173.2	178.2	173.8	176.9	-0.6	111.2	R726 G730	R726-R728 PolarHBondContact O-N 3.2Å; R728-G730 PolarHBondContact O-N 3.5Å
729	E	41.5	Very low	41.2	Very low	193 Å²	193	138.2 Å²	138.2	90%	0.902	75%	0.753	S	S	*	*			trans	-57.8	131.4	169.4	-65.3	-167	145.4	0	0	111.1
730	G	39	Very low	41.4	Very low	63 Å²	63	144.1 Å²	144.1	65%	0.649	77%	0.77	S	S	*	*			trans	-172.1	28.2	-162.1	0	0	0	0	0	118.9	R728	R728-G730 PolarHBondContact O-N 3.5Å
731	N	42.1	Very low	41	Very low	149 Å²	149	146.2 Å²	146.2	80%	0.797	78%	0.783	S	S	*	*			trans	44.5	97.3	158.7	-176	16.7	0	0	0	118
732	R	38.2	Very low	41	Very low	242 Å²	242	147.6 Å²	147.6	91%	0.913	79%	0.792	S	S	*	*			trans	-133.3	152.6	156.9	-69	-170.3	178.3	-179.3	0	110.7
733	K	38.2	Very low	40.8	Very low	197 Å²	197	148.3 Å²	148.3	86%	0.857	79%	0.788	S	S	*	*			trans	-81.1	153.4	-172.5	-66.3	-178.7	179.3	-179.8	0	112.2
734	P	40.4	Very low	40.7	Very low	134 Å²	134	145.3 Å²	145.3	87%	0.87	79%	0.785	S	S	*	*			trans	-82.9	148.3	179.7	33.8	-35.2	0	0	0	113
735	G	41	Very low	41.2	Very low	73 Å²	73	146.4 Å²	146.4	75%	0.753	78%	0.78	S	S	*	*			trans	136.5	89.2	166.4	0	0	0	0	0	114.3
736	E	30.9	Very low	41.3	Very low	186 Å²	186	140.7 Å²	140.7	87%	0.869	76%	0.756	S	S	*	*			trans	-172.2	154.2	152.6	-94.9	-75.2	74.5	0	0	106.3
737	P	43.8	Very low	40.9	Very low	115 Å²	115	130.9 Å²	130.9	75%	0.747	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-79.9	155.6	-173.6	32.5	-34.7	0	0	0	113.1
738	A	39.1	Very low	41.5	Very low	74 Å²	74	129.9 Å²	129.9	61%	0.612	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-97.8	124.3	178.2	0	0	0	0	0	111.8	K740	A738-K740 HydrophobicContact CB-CG 4.17Å
739	E	38.2	Very low	41.7	Very low	197 Å²	197	121.4 Å²	121.4	92%	0.921	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-67.9	140.1	157.2	-64.3	-172.7	131.8	0	0	109.6
740	K	46.8	Very low	42.5	Very low	169 Å²	169	115.6 Å²	115.6	74%	0.735	66%	0.656	S	S	*	*			trans	-143.6	46.1	-168	-63.8	-175.7	-174.5	177.8	0	114.2	A738	A738-K740 HydrophobicContact CB-CG 4.17Å
741	D	40.9	Very low	43.2	Very low	160 Å²	160	113.1 Å²	113.1	86%	0.856	63%	0.628	S	S	*	*			trans	-120.6	13.4	177.9	-78.5	-62	0	0	0	114.5	V743	D741-V743 PolarHBondContact O-N 3.37Å
742	S	40.6	Very low	43.8	Very low	113 Å²	113	109.8 Å²	109.8	79%	0.79	61%	0.61	S	S	*	*			trans	-85	83.7	168.1	44.1	0	0	0	0	111.4
743	V	39.6	Very low	44.6	Very low	94 Å²	94	101.3 Å²	101.3	57%	0.57	59%	0.588	S	S	*	*			trans	-59.4	126.4	169.2	-179.7	0	0	0	0	108.9	D741	D741-V743 PolarHBondContact O-N 3.37Å
744	P	45.8	Very low	45.3	Very low	90 Å²	90	95.8 Å²	95.8	58%	0.584	57%	0.567	S	S	*	*			trans	-67.1	144.8	-177.9	26.3	-33.9	0	0	0	111.4	A746 S747	P744-A746 PolarHBondContact O-N 3.3Å; P744-A746 VanDerWaalsContact O-N 3.17Å; P744-S747 WeakPolarHBondContact O-CB 3.33Å; P744-S747 PolarHBondContact O-N 2.95Å
745	M	47.6	Very low	45.7	Very low	123 Å²	123	92.4 Å²	92.4	61%	0.606	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.4	-177.8	-60.7	-70.3	-77.3	0	0	113.4	S747 F750	M745-S747 PolarHBondContact O-N 3.32Å; M745-F750 HydrophobicContact CE-CD2 4.48Å; M745-F750 HydrophobicContact CE-CE1 3.76Å; M745-F750 HydrophobicContact CE-CE2 3.7Å; M745-F750 HydrophobicContact CE-CZ 3.29Å; M745-F750 WeakPolarHBondContact O-CB 3.39Å; M745-F750 VanDerWaalsContact O-CD1 3.26Å; M745-F750 WeakPolarHBondContact O-CD1 3.45Å; M745-F750 HydrophobicContact SD-CD2 4.08Å; M745-F750 HydrophobicContact SD-CE1 4.43Å; M745-F750 HydrophobicContact SD-CE2 3.75Å; M745-F750 HydrophobicContact SD-CZ 3.96Å
746	A	45.9	Very low	46.2	Very low	45 Å²	45	95.6 Å²	95.6	37%	0.372	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	1.9	173.8	0	0	0	0	0	114	P744	P744-A746 PolarHBondContact O-N 3.3Å; P744-A746 VanDerWaalsContact O-N 3.17Å
747	S	41.2	Very low	46.7	Very low	28 Å²	28	87.8 Å²	87.8	20%	0.196	51%	0.508	C	S	.	.	S	Bend	trans	-68.7	136	176.3	-179.4	0	0	0	0	111	P744 M745 A749 F750	P744-S747 WeakPolarHBondContact O-CB 3.33Å; P744-S747 PolarHBondContact O-N 2.95Å; M745-S747 PolarHBondContact O-N 3.32Å; S747-A749 PolarHBondContact O-N 3.25Å; S747-A749 PolarHBondContact OG-N 3.14Å; S747-F750 WeakPolarHBondContact O-CB 3.25Å; S747-F750 PolarHBondContact O-N 3.01Å
748	P	47.9	Very low	46.9	Very low	49 Å²	49	85.3 Å²	85.3	32%	0.318	50%	0.504	S	S	.	.	H	α-helix	trans	-55.2	-21.4	169.9	-27.5	36.4	0	0	0	114	I606 L752	I606-P748 HydrophobicContact CD1-CG 4.24Å; I606-P748 HydrophobicContact CG1-CG 4.07Å; P748-L752 WeakPolarHBondContact O-CB 3.43Å; P748-L752 WeakPolarHBondContact O-CD1 3.48Å; P748-L752 VanDerWaalsContact O-CG 3.25Å; P748-L752 WeakPolarHBondContact O-CG 3.42Å; P748-L752 PolarHBondContact O-N 3.1Å; P748-L752 VanDerWaalsContact O-N 3.08Å
749	A	46.5	Very low	47.1	Very low	56 Å²	56	86.3 Å²	86.3	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-68.3	-32.6	173	0	0	0	0	0	113.1	S747 S753	S747-A749 PolarHBondContact O-N 3.25Å; S747-A749 PolarHBondContact OG-N 3.14Å; A749-S753 WeakPolarHBondContact O-CB 3.3Å; A749-S753 PolarHBondContact O-N 3.43Å
750	F	58.3	Low	47.4	Very low	70 Å²	70	86 Å²	86	31%	0.307	49%	0.493	S	S	.	.	H	α-helix	trans	-70.1	-46.4	176.6	-178.4	-102.7	0	0	0	111	M745 S747 L752 S753 L754	M745-F750 HydrophobicContact CE-CD2 4.48Å; M745-F750 HydrophobicContact CE-CE1 3.76Å; M745-F750 HydrophobicContact CE-CE2 3.7Å; M745-F750 HydrophobicContact CE-CZ 3.29Å; M745-F750 WeakPolarHBondContact O-CB 3.39Å; M745-F750 VanDerWaalsContact O-CD1 3.26Å; M745-F750 WeakPolarHBondContact O-CD1 3.45Å; M745-F750 HydrophobicContact SD-CD2 4.08Å; M745-F750 HydrophobicContact SD-CE1 4.43Å; M745-F750 HydrophobicContact SD-CE2 3.75Å; M745-F750 HydrophobicContact SD-CZ 3.96Å; S747-F750 WeakPolarHBondContact O-CB 3.25Å; S747-F750 PolarHBondContact O-N 3.01Å; F750-L752 VanDerWaalsContact C-N 3.32Å; F750-L752 PolarHBondContact O-N 2.95Å; F750-S753 PolarHBondContact O-N 2.8Å; F750-S753 VanDerWaalsContact O-N 3.14Å; F750-L754 HydrophobicContact CD1-CD1 4.42Å; F750-L754 HydrophobicContact CE1-CD1 3.8Å; F750-L754 HydrophobicContact CE1-CD2 4.4Å; F750-L754 HydrophobicContact CE2-CD1 3.92Å; F750-L754 HydrophobicContact CZ-CD1 3.51Å; F750-L754 PolarHBondContact O-N 2.77Å
751	L	53.4	Low	47.5	Very low	12 Å²	12	78.9 Å²	78.9	6%	0.063	47%	0.467	C	S	.	.	H	α-helix	trans	-60.4	-39.8	174.2	-66.6	177.1	0	0	0	112.2	I606 T709 M713 L754 F755	I606-L751 HydrophobicContact CG2-CD1 4.26Å; T709-L751 HydrophobicContact CG2-CD2 3.9Å; M713-L751 HydrophobicContact SD-CD1 4.32Å; L751-L754 PolarHBondContact O-N 3.48Å; L751-F755 WeakPolarHBondContact O-CD2 3.1Å
752	L	55	Low	48	Very low	79 Å²	79	79.9 Å²	79.9	41%	0.414	46%	0.459	S	S	.	.	H	α-helix	trans	-63.9	-46	172.6	-72.6	166.8	0	0	0	111.3	L613 P748 F750 L754 F755 D756	L613-L752 HydrophobicContact CD1-CD2 4.28Å; L613-L752 HydrophobicContact CD2-CD2 4.29Å; P748-L752 WeakPolarHBondContact O-CB 3.43Å; P748-L752 WeakPolarHBondContact O-CD1 3.48Å; P748-L752 VanDerWaalsContact O-CG 3.25Å; P748-L752 WeakPolarHBondContact O-CG 3.42Å; P748-L752 PolarHBondContact O-N 3.1Å; P748-L752 VanDerWaalsContact O-N 3.08Å; F750-L752 VanDerWaalsContact C-N 3.32Å; F750-L752 PolarHBondContact O-N 2.95Å; L752-L754 PolarHBondContact O-N 3.26Å; L752-F755 PolarHBondContact O-N 2.74Å; L752-D756 WeakPolarHBondContact O-CB 3.45Å; L752-D756 PolarHBondContact O-N 3.01Å
753	S	54.9	Low	48.3	Very low	64 Å²	64	81.7 Å²	81.7	45%	0.448	45%	0.448	S	S	.	.	H	α-helix	trans	-61.5	-28.2	178.9	-171.1	0	0	0	0	114.1	A749 F750	A749-S753 WeakPolarHBondContact O-CB 3.3Å; A749-S753 PolarHBondContact O-N 3.43Å; F750-S753 PolarHBondContact O-N 2.8Å; F750-S753 VanDerWaalsContact O-N 3.14Å
754	L	53.7	Low	48.7	Very low	81 Å²	81	80.4 Å²	80.4	42%	0.424	44%	0.444	S	S	.	.	H	α-helix	trans	-70.2	-41.3	177	-118.2	69.2	0	0	0	112.5	T709 F750 L751 L752	T709-L754 HydrophobicContact CG2-CD2 4.37Å; F750-L754 HydrophobicContact CD1-CD1 4.42Å; F750-L754 HydrophobicContact CE1-CD1 3.8Å; F750-L754 HydrophobicContact CE1-CD2 4.4Å; F750-L754 HydrophobicContact CE2-CD1 3.92Å; F750-L754 HydrophobicContact CZ-CD1 3.51Å; F750-L754 PolarHBondContact O-N 2.77Å; L751-L754 PolarHBondContact O-N 3.48Å; L752-L754 PolarHBondContact O-N 3.26Å
755	F	49.5	Very low	48.9	Very low	62 Å²	62	79.3 Å²	79.3	27%	0.272	44%	0.442	S	S	.	.	H	α-helix	trans	-96.3	-28.7	-173.1	-78	-94.7	0	0	0	114	L613 V614 F706 L751 L752 G757	L613-F755 HydrophobicContact CB-CB 4.06Å; L613-F755 HydrophobicContact CB-CD1 3.97Å; L613-F755 HydrophobicContact CB-CG 4.02Å; L613-F755 HydrophobicContact CD1-CB 3.85Å; L613-F755 HydrophobicContact CD1-CD2 4.1Å; L613-F755 HydrophobicContact CD1-CG 4Å; L613-F755 HydrophobicContact CD2-CB 4.35Å; L613-F755 HydrophobicContact CG-CB 4.29Å; V614-F755 HydrophobicContact CG2-CE1 4.43Å; F706-F755 HydrophobicContact CB-CZ 4.44Å; F706-F755 HydrophobicContact CD2-CZ 4.2Å; L751-F755 WeakPolarHBondContact O-CD2 3.1Å; L752-F755 PolarHBondContact O-N 2.74Å; F755-G757 PolarHBondContact O-N 3.47Å
756	D	50.3	Low	49	Very low	141 Å²	141	79 Å²	79	75%	0.754	44%	0.441	S	S	*	.	S	Bend	trans	-77.9	-11.6	176	-156	47.2	0	0	0	111.9	L752 G758	L752-D756 WeakPolarHBondContact O-CB 3.45Å; L752-D756 PolarHBondContact O-N 3.01Å; D756-G758 VanDerWaalsContact C-N 3.33Å; D756-G758 PolarHBondContact O-N 2.91Å
757	G	41.5	Very low	48.8	Very low	21 Å²	21	81.9 Å²	81.9	22%	0.216	45%	0.447	C	S	.	.			trans	-80.1	44.3	-167.2	0	0	0	0	0	117.1	F755 T759 R760 G761	F755-G757 PolarHBondContact O-N 3.47Å; G757-T759 PolarHBondContact O-N 3.44Å; G757-R760 PolarHBondContact O-N 3.45Å; G757-R760 VanDerWaalsContact O-N 3.07Å; G757-G761 PolarHBondContact O-N 2.92Å
758	G	48.2	Very low	49.3	Very low	64 Å²	64	83.1 Å²	83.1	66%	0.66	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	109.4	178	0	0	0	0	0	113.2	D756 R760	D756-G758 VanDerWaalsContact C-N 3.33Å; D756-G758 PolarHBondContact O-N 2.91Å; G758-R760 PolarHBondContact O-N 3.2Å
759	T	44.4	Very low	49.3	Very low	95 Å²	95	84.4 Å²	84.4	58%	0.583	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	-27.9	-166.6	76.6	0	0	0	0	117.1	G757	G757-T759 PolarHBondContact O-N 3.44Å
760	R	44.1	Very low	49.5	Very low	190 Å²	190	87.5 Å²	87.5	72%	0.717	47%	0.471	S	S	*	.	H	α-helix	trans	-82.9	-36.3	-173.5	-166.2	172.9	-174.2	159.2	0.9	113.4	G757 G758 R762 R763 S764	G757-R760 PolarHBondContact O-N 3.45Å; G757-R760 VanDerWaalsContact O-N 3.07Å; G758-R760 PolarHBondContact O-N 3.2Å; R760-R762 VanDerWaalsContact C-N 3.29Å; R760-R762 PolarHBondContact O-N 2.72Å; R760-R763 PolarHBondContact O-N 2.9Å; R760-R763 VanDerWaalsContact O-N 3.11Å; R760-S764 PolarHBondContact O-N 3.36Å
761	G	48.1	Very low	49.4	Very low	19 Å²	19	90.8 Å²	90.8	20%	0.196	49%	0.485	C	S	.	.	H	α-helix	trans	-61.6	-37.8	178.4	0	0	0	0	0	112.3	G757 R763 S764 A765	G757-G761 PolarHBondContact O-N 2.92Å; G761-R763 VanDerWaalsContact C-N 3.34Å; G761-R763 PolarHBondContact O-N 3.17Å; G761-S764 PolarHBondContact O-N 2.59Å; G761-A765 PolarHBondContact O-N 2.83Å
762	R	51.6	Low	49.1	Very low	182 Å²	182	98.1 Å²	98.1	69%	0.687	52%	0.521	S	S	*	.	H	α-helix	trans	-53.6	-47.8	171.8	-75.8	-161.7	-83.9	-122.2	5.1	111.7	R760 S764 A765 M766	R760-R762 VanDerWaalsContact C-N 3.29Å; R760-R762 PolarHBondContact O-N 2.72Å; R762-S764 VanDerWaalsContact C-N 3.34Å; R762-S764 PolarHBondContact O-N 3.42Å; R762-A765 PolarHBondContact O-N 3.49Å; R762-A765 VanDerWaalsContact O-N 3.16Å; R762-M766 WeakPolarHBondContact O-CG 3.15Å; R762-M766 PolarHBondContact O-N 3.14Å
763	R	48	Very low	49.2	Very low	150 Å²	150	101.4 Å²	101.4	57%	0.566	53%	0.532	S	S	*	.	H	α-helix	trans	-59.3	-39.7	-179.9	-83.8	-174	-72.3	-104.1	-5.4	113.4	R760 G761 A765 M766 E767	R760-R763 PolarHBondContact O-N 2.9Å; R760-R763 VanDerWaalsContact O-N 3.11Å; G761-R763 VanDerWaalsContact C-N 3.34Å; G761-R763 PolarHBondContact O-N 3.17Å; R763-A765 VanDerWaalsContact C-N 3.35Å; R763-A765 PolarHBondContact O-N 2.67Å; R763-M766 PolarHBondContact O-N 3.49Å; R763-E767 WeakPolarHBondContact O-CB 3.22Å; R763-E767 PolarHBondContact O-N 3.23Å
764	S	47.5	Very low	48.4	Very low	68 Å²	68	109.8 Å²	109.8	48%	0.476	56%	0.56	S	S	.	*	H	α-helix	trans	-69.7	-29.6	178.6	-65.2	0	0	0	0	113.4	R760 G761 R762 A768	R760-S764 PolarHBondContact O-N 3.36Å; G761-S764 PolarHBondContact O-N 2.59Å; R762-S764 VanDerWaalsContact C-N 3.34Å; R762-S764 PolarHBondContact O-N 3.42Å; S764-A768 WeakPolarHBondContact O-CB 3.48Å; S764-A768 PolarHBondContact O-N 3.38Å; S764-A768 VanDerWaalsContact O-N 3.11Å
765	A	50.2	Low	48.1	Very low	67 Å²	67	111.2 Å²	111.2	55%	0.554	57%	0.567	S	S	*	*	H	α-helix	trans	-69	-44.8	173.2	0	0	0	0	0	112.3	G761 R762 R763 A768 D769	G761-A765 PolarHBondContact O-N 2.83Å; R762-A765 PolarHBondContact O-N 3.49Å; R762-A765 VanDerWaalsContact O-N 3.16Å; R763-A765 VanDerWaalsContact C-N 3.35Å; R763-A765 PolarHBondContact O-N 2.67Å; A765-A768 PolarHBondContact O-N 3.19Å; A765-D769 PolarHBondContact O-N 3.05Å
766	M	48.7	Very low	48.1	Very low	116 Å²	116	113.8 Å²	113.8	57%	0.571	58%	0.582	S	S	*	*	H	α-helix	trans	-70.1	-30.6	175.8	18.2	173.6	90	0	0	112.5	R762 R763 A768 L770	R762-M766 WeakPolarHBondContact O-CG 3.15Å; R762-M766 PolarHBondContact O-N 3.14Å; R763-M766 PolarHBondContact O-N 3.49Å; M766-A768 VanDerWaalsContact C-N 3.34Å; M766-L770 VanDerWaalsContact O-CB 3.23Å; M766-L770 WeakPolarHBondContact O-CB 3.3Å; M766-L770 PolarHBondContact O-N 2.82Å
767	E	42.9	Very low	47.9	Very low	106 Å²	106	112.3 Å²	112.3	50%	0.495	57%	0.573	S	S	.	*	H	α-helix	trans	-68.7	-32.6	171.8	-159.8	-165.1	137.4	0	0	112.2	R763 K771	R763-E767 WeakPolarHBondContact O-CB 3.22Å; R763-E767 PolarHBondContact O-N 3.23Å; E767-K771 WeakPolarHBondContact O-CB 3.46Å; E767-K771 WeakPolarHBondContact O-CG 3.28Å; E767-K771 PolarHBondContact O-N 3.45Å; E767-K771 VanDerWaalsContact O-N 3.15Å; E767-K771 IonicContact OE1-NZ 3.71Å; E767-K771 PolarHBondContact OE1-NZ 2.67Å
768	A	50.4	Low	48.3	Very low	53 Å²	53	117.6 Å²	117.6	44%	0.438	59%	0.594	S	S	.	*	H	α-helix	trans	-69.2	-46.5	173.1	0	0	0	0	0	111.9	S764 A765 M766 L770 K771 M772	S764-A768 WeakPolarHBondContact O-CB 3.48Å; S764-A768 PolarHBondContact O-N 3.38Å; S764-A768 VanDerWaalsContact O-N 3.11Å; A765-A768 PolarHBondContact O-N 3.19Å; M766-A768 VanDerWaalsContact C-N 3.34Å; A768-L770 PolarHBondContact O-N 2.79Å; A768-K771 CarbonylContact O-C 3.58Å; A768-K771 WeakPolarHBondContact O-CB 3.22Å; A768-K771 PolarHBondContact O-N 2.94Å; A768-K771 VanDerWaalsContact O-N 3.1Å; A768-M772 PolarHBondContact O-N 2.96Å; A768-M772 VanDerWaalsContact O-N 3.1Å
769	D	48.2	Very low	48.3	Very low	77 Å²	77	121 Å²	121	41%	0.412	59%	0.59	S	S	.	*	H	α-helix	trans	-59.5	-44.3	174.8	178.6	71.1	0	0	0	111.9	A765 K771 M772 K773	A765-D769 PolarHBondContact O-N 3.05Å; D769-K771 PolarHBondContact O-N 2.67Å; D769-M772 PolarHBondContact O-N 2.95Å; D769-K773 PolarHBondContact O-N 3.32Å; D769-K773 IonicContact OD1-NZ 3.83Å; D769-K773 PolarHBondContact OD1-NZ 3.4Å; D769-K773 IonicContact OD2-NZ 3.15Å; D769-K773 PolarHBondContact OD2-NZ 3.42Å
770	L	50.1	Low	48.6	Very low	121 Å²	121	122.7 Å²	122.7	63%	0.634	59%	0.59	S	S	*	*	H	α-helix	trans	-67.6	-18.1	176.7	-162.8	68.4	0	0	0	113.4	M766 A768	M766-L770 VanDerWaalsContact O-CB 3.23Å; M766-L770 WeakPolarHBondContact O-CB 3.3Å; M766-L770 PolarHBondContact O-N 2.82Å; A768-L770 PolarHBondContact O-N 2.79Å
771	K	56.9	Low	48.9	Very low	139 Å²	139	117.9 Å²	117.9	60%	0.604	58%	0.581	S	S	*	*	H	α-helix	trans	-90.3	-10	170.2	-84.5	169.9	171.6	162.1	0	113.9	E767 A768 D769	E767-K771 WeakPolarHBondContact O-CB 3.46Å; E767-K771 WeakPolarHBondContact O-CG 3.28Å; E767-K771 PolarHBondContact O-N 3.45Å; E767-K771 VanDerWaalsContact O-N 3.15Å; E767-K771 IonicContact OE1-NZ 3.71Å; E767-K771 PolarHBondContact OE1-NZ 2.67Å; A768-K771 CarbonylContact O-C 3.58Å; A768-K771 WeakPolarHBondContact O-CB 3.22Å; A768-K771 PolarHBondContact O-N 2.94Å; A768-K771 VanDerWaalsContact O-N 3.1Å; D769-K771 PolarHBondContact O-N 2.67Å
772	M	47.4	Very low	49	Very low	166 Å²	166	125.5 Å²	125.5	82%	0.818	61%	0.611	S	S	*	*	H	α-helix	trans	-97.1	-20.6	171.2	-68	-169.1	69.9	0	0	112.7	A768 D769 K774	A768-M772 PolarHBondContact O-N 2.96Å; A768-M772 VanDerWaalsContact O-N 3.1Å; D769-M772 PolarHBondContact O-N 2.95Å; M772-K774 VanDerWaalsContact C-N 3.29Å; M772-K774 PolarHBondContact O-N 3.36Å
773	K	56.5	Low	48.8	Very low	147 Å²	147	120.8 Å²	120.8	64%	0.639	60%	0.604	S	S	*	*			trans	-87	19.1	174	-74.6	168.5	175.2	147.9	0	114	D769	D769-K773 PolarHBondContact O-N 3.32Å; D769-K773 IonicContact OD1-NZ 3.83Å; D769-K773 PolarHBondContact OD1-NZ 3.4Å; D769-K773 IonicContact OD2-NZ 3.15Å; D769-K773 PolarHBondContact OD2-NZ 3.42Å
774	K	38.3	Very low	48.8	Very low	240 Å²	240	118.2 Å²	118.2	100%	1.043	61%	0.608	S	S	*	*			trans	-151.8	0	-171.1	-166.6	174.5	-175.5	176.3	0	113.7	M772	M772-K774 VanDerWaalsContact C-N 3.29Å; M772-K774 PolarHBondContact O-N 3.36Å

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