A0A2K5UEY5_MACFA Loading...

MRG domain-containing protein

AlphaFold DB , UniProt , Accession A0A2K5UEY5, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene n/a, Length 362 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	45	Very low	67.3	Low	242 Å²	242	126.2 Å²	126.2	100%	1.192	65%	0.654	S	S	*	*				0	116.1	0	-83.9	157.4	64	0	0	107.7
2	A	49.4	Very low	69	Low	93 Å²	93	128 Å²	128	77%	0.769	66%	0.657	S	S	*	*			trans	-66.9	137.5	173	0	0	0	0	0	109.2	K4	A2-K4 PolarHBondContact O-N 3.33Å
3	P	52.6	Low	70.4	Confident	119 Å²	119	127.5 Å²	127.5	77%	0.773	65%	0.65	S	S	*	*			trans	-64.6	124.7	176.7	25.7	-30.9	0	0	0	109	Q5	P3-Q5 PolarHBondContact O-N 3.14Å; P3-Q5 VanDerWaalsContact O-N 3.14Å
4	K	58.8	Low	71.2	Confident	198 Å²	198	121.5 Å²	121.5	86%	0.861	64%	0.635	S	S	*	*			trans	-66.6	111	172.9	-73.4	-179.1	177.9	176.3	0	107.4	A2	A2-K4 PolarHBondContact O-N 3.33Å
5	Q	59.8	Low	72.4	Confident	187 Å²	187	117.5 Å²	117.5	87%	0.874	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-63.4	138.8	177.6	-71.3	178.2	-10.2	0	0	110.6	P3	P3-Q5 PolarHBondContact O-N 3.14Å; P3-Q5 VanDerWaalsContact O-N 3.14Å
6	D	66.7	Low	73.3	Confident	125 Å²	125	119.2 Å²	119.2	67%	0.668	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-64.6	148	173.6	-71.3	-49.2	0	0	0	111.3	K8	D6-K8 PolarHBondContact O-N 2.99Å
7	P	71.9	Confident	74.4	Confident	46 Å²	46	112.2 Å²	112.2	30%	0.299	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-64.3	122	-178	26.3	-34	0	0	0	110.7	I35 K38 V40	P7-I35 HydrophobicContact CG-CG2 4.27Å; P7-K38 WeakPolarHBondContact CG-O 3.38Å; P7-V40 HydrophobicContact CB-CG2 4.13Å; P7-V40 HydrophobicContact CG-CG2 4.31Å
8	K	79.3	Confident	75.1	Confident	186 Å²	186	105.9 Å²	105.9	81%	0.809	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-78.3	128	177.7	-171.7	175.8	-178.5	176.4	0	110.2	D6	D6-K8 PolarHBondContact O-N 2.99Å
9	P	83.6	Confident	75.8	Confident	52 Å²	52	100.4 Å²	100.4	34%	0.338	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-64.6	136.4	177.8	26.3	-33.7	0	0	0	111.4	V33 V40 Y42	P9-V33 HydrophobicContact CB-CG1 3.77Å; P9-V33 HydrophobicContact CG-CG1 4.34Å; P9-V40 HydrophobicContact CB-CG1 3.81Å; P9-Y42 WeakPolarHBondContact CA-OH 3.47Å; P9-Y42 HydrophobicContact CB-CE1 4.35Å
10	K	84.3	Confident	76	Confident	130 Å²	130	96.8 Å²	96.8	57%	0.565	49%	0.493	S	S	*	.	S	Bend	trans	-77.4	-23.3	176.8	-72.9	179.6	-172.6	136.7	0	114.8	Y42 E98	K10-Y42 PolarHBondContact N-OH 3.09Å; K10-E98 VanDerWaalsContact CB-OE1 3.25Å; K10-E98 WeakPolarHBondContact CB-OE1 3.33Å; K10-E98 VanDerWaalsContact CD-CD 3.44Å; K10-E98 HydrophobicContact CD-CG 4.02Å; K10-E98 WeakPolarHBondContact CD-OE1 3.4Å; K10-E98 VanDerWaalsContact CE-OE2 3.28Å; K10-E98 WeakPolarHBondContact CE-OE2 3.42Å; K10-E98 WeakPolarHBondContact CG-OE1 3.36Å; K10-E98 PolarHBondContact N-OE1 3.39Å; K10-E98 IonicContact NZ-OE2 3.27Å; K10-E98 PolarHBondContact NZ-OE2 3.01Å
11	F	89.4	Confident	75.9	Confident	10 Å²	10	95.4 Å²	95.4	4%	0.044	48%	0.484	C	S	.	.	S	Bend	trans	-125.8	151.6	-177	-52	-82.1	0	0	0	111.2	E15 V17 Y42 V101 K103	F11-E15 WeakPolarHBondContact CA-OE2 3.48Å; F11-V17 HydrophobicContact CB-CG1 4.49Å; F11-V17 HydrophobicContact CD1-CG1 3.58Å; F11-V17 HydrophobicContact CE1-CG1 3.99Å; F11-V17 HydrophobicContact CG-CG1 4.15Å; F11-Y42 HydrophobicContact CB-CD1 4.16Å; F11-Y42 HydrophobicContact CB-CE1 3.7Å; F11-Y42 HydrophobicContact CD2-CD2 4.39Å; F11-Y42 HydrophobicContact CD2-CE1 4.01Å; F11-Y42 AromaticContact CD2-CE2 3.85Å; F11-Y42 HydrophobicContact CD2-CE2 3.85Å; F11-Y42 AromaticContact CD2-CZ 3.62Å; F11-Y42 HydrophobicContact CE2-CE2 4.49Å; F11-Y42 HydrophobicContact CG-CE1 4.37Å; F11-Y42 PolarHBondContact N-OH 3.12Å; F11-V101 HydrophobicContact CD1-CG1 4.36Å; F11-V101 HydrophobicContact CD2-CB 4.13Å; F11-V101 HydrophobicContact CD2-CG1 3.82Å; F11-V101 HydrophobicContact CE1-CG1 4.14Å; F11-V101 HydrophobicContact CE2-CB 3.69Å; F11-V101 HydrophobicContact CE2-CG1 3.63Å; F11-V101 WeakPolarHBondContact CE2-O 3.42Å; F11-V101 HydrophobicContact CG-CG1 4.2Å; F11-V101 HydrophobicContact CZ-CB 4.14Å; F11-V101 HydrophobicContact CZ-CG1 3.8Å; F11-V101 VanDerWaalsContact CZ-O 3.26Å; F11-V101 WeakPolarHBondContact CZ-O 3.37Å; F11-K103 HydrophobicContact CD1-CG 4.23Å; F11-K103 HydrophobicContact CE1-CB 4.25Å; F11-K103 HydrophobicContact CE1-CG 3.44Å; F11-K103 VanDerWaalsContact CE1-CG 3.44Å; F11-K103 HydrophobicContact CZ-CG 4.22Å
12	Q	87.6	Confident	77.3	Confident	148 Å²	148	85.1 Å²	85.1	69%	0.692	44%	0.441	S	S	*	.			trans	-106.1	156.8	178.7	-62.3	-177	16.4	0	0	112.3	G14 E15 C30	Q12-G14 PolarHBondContact O-N 3Å; Q12-E15 PolarHBondContact N-OE2 2.93Å; Q12-E15 WeakPolarHBondContact O-CB 3.49Å; Q12-E15 PolarHBondContact O-N 3.28Å; Q12-E15 VanDerWaalsContact O-N 3.09Å; Q12-C30 WeakPolarHBondContact O-CB 3.35Å
13	E	87.6	Confident	78.6	Confident	122 Å²	122	83.8 Å²	83.8	57%	0.57	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	133.7	172.2	-58.3	-170.3	164.4	0	0	110.3	E15 K32 V33	E13-E15 VanDerWaalsContact C-N 3.33Å; E13-K32 WeakPolarHBondContact OE1-CA 3.17Å; E13-V33 HydrophobicContact CG-CB 4.46Å; E13-V33 HydrophobicContact CG-CG2 3.82Å; E13-V33 PolarHBondContact OE1-N 2.84Å
14	G	81.4	Confident	79.8	Confident	43 Å²	43	79.4 Å²	79.4	44%	0.443	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	-12.5	-174.2	0	0	0	0	0	115.1	Q12 K29 C30	Q12-G14 PolarHBondContact O-N 3Å; G14-K29 WeakPolarHBondContact O-CE 3.46Å; G14-C30 VanDerWaalsContact CA-O 3.32Å; G14-C30 WeakPolarHBondContact CA-O 3.25Å; G14-C30 PolarHBondContact N-O 3.14Å
15	E	88.3	Confident	81	Confident	62 Å²	62	70 Å²	70	29%	0.29	35%	0.353	S	S	.	.			trans	-69.5	139.2	-176	-167.2	175.8	165.8	0	0	112.1	F11 Q12 E13 V17 C30	F11-E15 WeakPolarHBondContact CA-OE2 3.48Å; Q12-E15 PolarHBondContact N-OE2 2.93Å; Q12-E15 WeakPolarHBondContact O-CB 3.49Å; Q12-E15 PolarHBondContact O-N 3.28Å; Q12-E15 VanDerWaalsContact O-N 3.09Å; E13-E15 VanDerWaalsContact C-N 3.33Å; E15-V17 HydrophobicContact CG-CG1 4.41Å; E15-C30 PolarHBondContact O-N 3.24Å
16	R	87.6	Confident	82	Confident	144 Å²	144	64.7 Å²	64.7	54%	0.543	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	128.5	173.5	-170.7	179.6	-67.3	-157.9	11.3	109.4	E27 Y104	R16-E27 VanDerWaalsContact CD-OE1 3.25Å; R16-E27 WeakPolarHBondContact CD-OE1 3.41Å; R16-E27 HydrophobicContact CG-CG 4.37Å; R16-E27 IonicContact CZ-OE1 3.91Å; R16-E27 IonicContact NE-OE1 2.75Å; R16-E27 PolarHBondContact NE-OE1 3.24Å; R16-E27 IonicContact NH1-OE1 3.34Å; R16-E27 PolarHBondContact NH1-OE1 3.42Å; R16-Y104 HydrophobicContact CG-CD2 3.9Å; R16-Y104 HydrophobicContact CG-CE2 4.35Å; R16-Y104 HydrophobicContact CG-CG 4.09Å; R16-Y104 WeakPolarHBondContact O-CB 3.34Å
17	V	91.3	Very high	83	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	165.3	-173.6	-63	0	0	0	0	110.4	F11 E15 A28 I44 V101 L102	F11-V17 HydrophobicContact CB-CG1 4.49Å; F11-V17 HydrophobicContact CD1-CG1 3.58Å; F11-V17 HydrophobicContact CE1-CG1 3.99Å; F11-V17 HydrophobicContact CG-CG1 4.15Å; E15-V17 HydrophobicContact CG-CG1 4.41Å; V17-A28 HydrophobicContact CG2-CB 4.26Å; V17-A28 PolarHBondContact N-O 2.93Å; V17-A28 PolarHBondContact O-N 3.4Å; V17-I44 HydrophobicContact CG2-CD1 4.02Å; V17-V101 HydrophobicContact CB-CG1 3.56Å; V17-V101 HydrophobicContact CG1-CG1 3.79Å; V17-V101 HydrophobicContact CG2-CG1 3.68Å; V17-L102 WeakPolarHBondContact CB-O 3.39Å
18	L	87.3	Confident	83.9	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.9	165.6	-67.4	168.2	0	0	0	107.5	L25 Y26 E27 L102 Y104 N108 L109	L18-L25 HydrophobicContact CB-CD2 4.06Å; L18-Y26 CarbonylContact C-O 3.58Å; L18-Y26 WeakPolarHBondContact CA-O 3.28Å; L18-E27 HydrophobicContact CD2-CB 4.5Å; L18-L102 HydrophobicContact CB-CB 4.23Å; L18-L102 PolarHBondContact N-O 3.13Å; L18-L102 PolarHBondContact O-N 3.15Å; L18-Y104 HydrophobicContact CD2-CD2 3.99Å; L18-Y104 HydrophobicContact CD2-CE2 4.13Å; L18-Y104 HydrophobicContact CG-CD2 3.96Å; L18-N108 HydrophobicContact CD1-CB 3.6Å; L18-L109 HydrophobicContact CD1-CG 4.31Å
19	C	88.1	Confident	84.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	133.5	-179.2	-171.7	0	0	0	0	110.3	Y26 A28 I44 Y46 R100	C19-Y26 PolarHBondContact N-O 2.9Å; C19-Y26 PolarHBondContact O-N 3.24Å; C19-A28 HydrophobicContact CB-CB 3.92Å; C19-I44 HydrophobicContact CB-CG2 3.8Å; C19-Y46 HydrophobicContact CB-CD1 4.47Å; C19-Y46 HydrophobicContact CB-CE1 3.68Å; C19-Y46 PolarHBondContact SG-OH 3.17Å; C19-R100 WeakPolarHBondContact CA-O 3.3Å
20	F	80.9	Confident	84.6	Confident	29 Å²	29	52.8 Å²	52.8	13%	0.127	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	129.7	173.7	-82	-75.7	0	0	0	110.2	L25 Y46 R100 L102 L115	F20-L25 HydrophobicContact CB-CD2 4.49Å; F20-L25 HydrophobicContact CD1-CD2 3.78Å; F20-L25 HydrophobicContact CD1-CG 3.83Å; F20-L25 HydrophobicContact CD2-CD2 3.64Å; F20-L25 HydrophobicContact CD2-CG 4.47Å; F20-L25 HydrophobicContact CE1-CD1 4.09Å; F20-L25 HydrophobicContact CE1-CD2 3.82Å; F20-L25 HydrophobicContact CE1-CG 3.57Å; F20-L25 HydrophobicContact CE2-CD2 3.68Å; F20-L25 HydrophobicContact CE2-CG 4.25Å; F20-L25 HydrophobicContact CG-CD2 3.69Å; F20-L25 HydrophobicContact CG-CG 4.28Å; F20-L25 HydrophobicContact CZ-CD1 3.93Å; F20-L25 HydrophobicContact CZ-CD2 3.76Å; F20-L25 HydrophobicContact CZ-CG 3.8Å; F20-Y46 PolarHBondContact O-OH 3.09Å; F20-R100 PolarHBondContact N-O 3.37Å; F20-R100 PolarHBondContact O-NE 3.13Å; F20-R100 VanDerWaalsContact O-NE 3.1Å; F20-R100 PolarHBondContact O-NH2 2.92Å; F20-L102 HydrophobicContact CE2-CD1 3.78Å; F20-L102 HydrophobicContact CE2-CG 4.16Å; F20-L102 HydrophobicContact CZ-CD1 4.22Å; F20-L115 HydrophobicContact CE1-CD1 3.85Å; F20-L115 HydrophobicContact CZ-CD1 4.46Å
21	H	74.1	Confident	84.7	Confident	67 Å²	67	49 Å²	49	31%	0.31	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	107.3	167.4	-171.4	85.9	0	0	0	107.7	L24 Y26 Y46 W92 E94	H21-L24 PolarHBondContact N-O 2.76Å; H21-L24 PolarHBondContact O-N 2.89Å; H21-Y26 HydrophobicContact CB-CD2 3.6Å; H21-Y26 HydrophobicContact CB-CE2 3.73Å; H21-Y26 WeakPolarHBondContact O-CE2 3.26Å; H21-Y46 HydrophobicContact CB-CE1 3.97Å; H21-W92 AromaticContact CE1-CZ3 3.94Å; H21-W92 AromaticContact NE2-CZ3 3.91Å; H21-E94 IonicContact ND1-OE1 2.72Å
22	G	74.4	Confident	84.6	Confident	27 Å²	27	54 Å²	54	28%	0.278	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	-138.6	-164.1	0	0	0	0	0	111.7	L24	G22-L24 VanDerWaalsContact C-N 3.27Å; G22-L24 PolarHBondContact O-N 3.36Å
23	P	74.9	Confident	84.7	Confident	65 Å²	65	48.7 Å²	48.7	42%	0.422	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-4.2	-176.5	32.8	-34.5	0	0	0	113.9
24	L	79.3	Confident	84.6	Confident	27 Å²	27	44.6 Å²	44.6	14%	0.141	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	150.1	-173.4	-62.3	-179.2	0	0	0	111.5	H21 G22 Y26 L115 Q116 N119	H21-L24 PolarHBondContact N-O 2.76Å; H21-L24 PolarHBondContact O-N 2.89Å; G22-L24 VanDerWaalsContact C-N 3.27Å; G22-L24 PolarHBondContact O-N 3.36Å; L24-Y26 HydrophobicContact CB-CD2 4.4Å; L24-Y26 HydrophobicContact CB-CE2 3.66Å; L24-L115 HydrophobicContact CD2-CB 4.1Å; L24-Q116 HydrophobicContact CD2-CG 4.11Å; L24-N119 HydrophobicContact CD2-CB 4.18Å
25	L	82.4	Confident	84.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	134.5	169.8	-79.3	163.5	0	0	0	109.5	L18 F20 L102 K111 Q112 L115	L18-L25 HydrophobicContact CB-CD2 4.06Å; F20-L25 HydrophobicContact CB-CD2 4.49Å; F20-L25 HydrophobicContact CD1-CD2 3.78Å; F20-L25 HydrophobicContact CD1-CG 3.83Å; F20-L25 HydrophobicContact CD2-CD2 3.64Å; F20-L25 HydrophobicContact CD2-CG 4.47Å; F20-L25 HydrophobicContact CE1-CD1 4.09Å; F20-L25 HydrophobicContact CE1-CD2 3.82Å; F20-L25 HydrophobicContact CE1-CG 3.57Å; F20-L25 HydrophobicContact CE2-CD2 3.68Å; F20-L25 HydrophobicContact CE2-CG 4.25Å; F20-L25 HydrophobicContact CG-CD2 3.69Å; F20-L25 HydrophobicContact CG-CG 4.28Å; F20-L25 HydrophobicContact CZ-CD1 3.93Å; F20-L25 HydrophobicContact CZ-CD2 3.76Å; F20-L25 HydrophobicContact CZ-CG 3.8Å; L25-L102 HydrophobicContact CD1-CD1 3.87Å; L25-L102 HydrophobicContact CD2-CD1 3.91Å; L25-L102 HydrophobicContact CD2-CG 4.44Å; L25-K111 HydrophobicContact CD1-CB 4.37Å; L25-K111 HydrophobicContact CD1-CD 4.33Å; L25-K111 HydrophobicContact CD1-CG 4.19Å; L25-Q112 HydrophobicContact CB-CB 3.89Å; L25-Q112 HydrophobicContact CB-CG 3.98Å; L25-Q112 HydrophobicContact CD1-CB 4.36Å; L25-Q112 WeakPolarHBondContact O-CG 3.17Å; L25-Q112 PolarHBondContact O-NE2 3.27Å; L25-L115 HydrophobicContact CD1-CD1 3.98Å; L25-L115 HydrophobicContact CG-CD1 4.21Å
26	Y	82.4	Confident	84.4	Confident	75 Å²	75	50.3 Å²	50.3	29%	0.294	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.7	175.2	-65.9	-92.3	0	0	0	109.9	L18 C19 H21 L24 A28 Y46	L18-Y26 CarbonylContact C-O 3.58Å; L18-Y26 WeakPolarHBondContact CA-O 3.28Å; C19-Y26 PolarHBondContact N-O 2.9Å; C19-Y26 PolarHBondContact O-N 3.24Å; H21-Y26 HydrophobicContact CB-CD2 3.6Å; H21-Y26 HydrophobicContact CB-CE2 3.73Å; H21-Y26 WeakPolarHBondContact O-CE2 3.26Å; L24-Y26 HydrophobicContact CB-CD2 4.4Å; L24-Y26 HydrophobicContact CB-CE2 3.66Å; Y26-A28 PolarHBondContact O-N 2.75Å; Y26-Y46 HydrophobicContact CG-CD1 4.48Å
27	E	88	Confident	83.9	Confident	53 Å²	53	50 Å²	50	25%	0.248	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	133.8	169.6	-175.2	174	173.3	0	0	109.1	R16 L18 S47 Y104	R16-E27 VanDerWaalsContact CD-OE1 3.25Å; R16-E27 WeakPolarHBondContact CD-OE1 3.41Å; R16-E27 HydrophobicContact CG-CG 4.37Å; R16-E27 IonicContact CZ-OE1 3.91Å; R16-E27 IonicContact NE-OE1 2.75Å; R16-E27 PolarHBondContact NE-OE1 3.24Å; R16-E27 IonicContact NH1-OE1 3.34Å; R16-E27 PolarHBondContact NH1-OE1 3.42Å; L18-E27 HydrophobicContact CD2-CB 4.5Å; E27-S47 WeakPolarHBondContact O-CB 2.93Å; E27-S47 PolarHBondContact O-N 2.83Å; E27-Y104 HydrophobicContact CB-CE2 4.49Å; E27-Y104 HydrophobicContact CG-CD2 4.39Å; E27-Y104 HydrophobicContact CG-CE2 3.84Å
28	A	89.6	Confident	83.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	170	-178.4	0	0	0	0	0	111.2	V17 C19 Y26 I44 H45 Y46	V17-A28 HydrophobicContact CG2-CB 4.26Å; V17-A28 PolarHBondContact N-O 2.93Å; V17-A28 PolarHBondContact O-N 3.4Å; C19-A28 HydrophobicContact CB-CB 3.92Å; Y26-A28 PolarHBondContact O-N 2.75Å; A28-I44 HydrophobicContact CB-CG2 3.35Å; A28-H45 CarbonylContact C-O 3.59Å; A28-H45 WeakPolarHBondContact CA-O 3.47Å; A28-H45 WeakPolarHBondContact CB-O 3.2Å; A28-Y46 HydrophobicContact CB-CD1 3.99Å; A28-Y46 HydrophobicContact CB-CE1 4.5Å; A28-Y46 HydrophobicContact CB-CG 4.4Å
29	K	88.1	Confident	82.7	Confident	106 Å²	106	63.1 Å²	63.1	46%	0.461	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130	177.2	-171.9	175	179	-179.1	0	109.1	G14 V31 I44 H45	G14-K29 WeakPolarHBondContact O-CE 3.46Å; K29-V31 PolarHBondContact O-N 2.95Å; K29-I44 WeakPolarHBondContact O-CA 3.4Å; K29-H45 PolarHBondContact N-O 2.84Å; K29-H45 PolarHBondContact O-N 2.97Å
30	C	88.9	Confident	82.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	119.5	167.4	-176.3	0	0	0	0	108.4	Q12 G14 E15 I44	Q12-C30 WeakPolarHBondContact O-CB 3.35Å; G14-C30 VanDerWaalsContact CA-O 3.32Å; G14-C30 WeakPolarHBondContact CA-O 3.25Å; G14-C30 PolarHBondContact N-O 3.14Å; E15-C30 PolarHBondContact O-N 3.24Å; C30-I44 HydrophobicContact CB-CD1 4.19Å
31	V	87.3	Confident	82.9	Confident	52 Å²	52	66 Å²	66	32%	0.315	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-41	-177.1	-178	0	0	0	0	110.8	K29 F43 H45	K29-V31 PolarHBondContact O-N 2.95Å; V31-F43 HydrophobicContact CB-CD1 3.87Å; V31-F43 HydrophobicContact CG1-CD1 4.02Å; V31-F43 PolarHBondContact N-O 2.97Å; V31-H45 HydrophobicContact CG2-CB 3.54Å
32	K	86.6	Confident	83.6	Confident	114 Å²	114	62.9 Å²	62.9	50%	0.496	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	152.1	177.4	-62	-176.5	177.1	176.6	0	112.1	E13 Y42 F43 W95	E13-K32 WeakPolarHBondContact OE1-CA 3.17Å; K32-Y42 CarbonylContact O-C 3.53Å; K32-Y42 WeakPolarHBondContact O-CA 3.43Å; K32-F43 HydrophobicContact CB-CB 3.78Å; K32-F43 HydrophobicContact CG-CB 4.46Å; K32-F43 PolarHBondContact N-O 3.46Å; K32-F43 PolarHBondContact O-N 2.85Å; K32-W95 HydrophobicContact CB-CH2 3.73Å; K32-W95 HydrophobicContact CB-CZ2 4.35Å; K32-W95 HydrophobicContact CB-CZ3 4.39Å
33	V	89.3	Confident	84.3	Confident	37 Å²	37	63.7 Å²	63.7	22%	0.224	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.6	172.1	-171.4	0	0	0	0	109.9	P9 E13 V40 Y42	P9-V33 HydrophobicContact CB-CG1 3.77Å; P9-V33 HydrophobicContact CG-CG1 4.34Å; E13-V33 HydrophobicContact CG-CB 4.46Å; E13-V33 HydrophobicContact CG-CG2 3.82Å; E13-V33 PolarHBondContact OE1-N 2.84Å; V33-V40 HydrophobicContact CG1-CG1 3.94Å; V33-Y42 HydrophobicContact CB-CD1 4.42Å; V33-Y42 HydrophobicContact CB-CE1 4.47Å; V33-Y42 HydrophobicContact CG1-CD1 4.13Å; V33-Y42 HydrophobicContact CG1-CE1 3.82Å; V33-Y42 HydrophobicContact CG2-CD1 3.83Å; V33-Y42 HydrophobicContact CG2-CE1 3.91Å
34	A	86.4	Confident	84.9	Confident	36 Å²	36	60.6 Å²	60.6	30%	0.298	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	137.9	175.2	0	0	0	0	0	110.9	K41 W95	A34-K41 PolarHBondContact N-O 2.97Å; A34-K41 PolarHBondContact O-N 3.37Å; A34-W95 HydrophobicContact CB-CE3 4.35Å; A34-W95 HydrophobicContact CB-CH2 3.59Å; A34-W95 HydrophobicContact CB-CZ3 3.47Å; A34-W95 VanDerWaalsContact CB-CZ3 3.47Å
35	I	86.7	Confident	85.2	Confident	87 Å²	87	61.8 Å²	61.8	45%	0.446	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	109.3	172.5	-52.8	177.8	0	0	0	107.1	P7 Q39 V40	P7-I35 HydrophobicContact CG-CG2 4.27Å; I35-Q39 WeakPolarHBondContact CA-O 3.36Å; I35-V40 HydrophobicContact CG1-CG2 4.33Å
36	K	78.5	Confident	85.1	Confident	138 Å²	138	63.2 Å²	63.2	60%	0.6	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.5	134.4	178	-164.6	-179.5	176.3	178.1	0	108.7	K38 Q39	K36-K38 PolarHBondContact O-N 2.91Å; K36-Q39 PolarHBondContact N-O 3.31Å; K36-Q39 PolarHBondContact O-N 3.33Å; K36-Q39 VanDerWaalsContact O-O 3.1Å
37	D	77.3	Confident	84.6	Confident	136 Å²	136	61.9 Å²	61.9	73%	0.727	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	35.4	178.4	-51.5	-44.9	0	0	0	114.2	Q39	D37-Q39 PolarHBondContact O-N 3.34Å
38	K	77.2	Confident	82.8	Confident	158 Å²	158	62.4 Å²	62.4	69%	0.687	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	24.6	-173.5	-54.5	175.3	177.7	172.1	0	114	P7 K36	P7-K38 WeakPolarHBondContact CG-O 3.38Å; K36-K38 PolarHBondContact O-N 2.91Å
39	Q	77	Confident	80.4	Confident	118 Å²	118	72.4 Å²	72.4	55%	0.551	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	135.2	170.6	-66.9	-175.9	-19.8	0	0	110.1	I35 K36 D37	I35-Q39 WeakPolarHBondContact CA-O 3.36Å; K36-Q39 PolarHBondContact N-O 3.31Å; K36-Q39 PolarHBondContact O-N 3.33Å; K36-Q39 VanDerWaalsContact O-O 3.1Å; D37-Q39 PolarHBondContact O-N 3.34Å
40	V	86.1	Confident	78	Confident	11 Å²	11	74 Å²	74	7%	0.067	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	127.8	175.4	-171.3	0	0	0	0	109	P7 P9 V33 I35 Y42 E98	P7-V40 HydrophobicContact CB-CG2 4.13Å; P7-V40 HydrophobicContact CG-CG2 4.31Å; P9-V40 HydrophobicContact CB-CG1 3.81Å; V33-V40 HydrophobicContact CG1-CG1 3.94Å; I35-V40 HydrophobicContact CG1-CG2 4.33Å; V40-Y42 HydrophobicContact CB-CE2 4.48Å; V40-Y42 HydrophobicContact CG1-CE1 3.99Å; V40-Y42 HydrophobicContact CG1-CE2 3.78Å; V40-Y42 VanDerWaalsContact CG1-CZ 3.45Å; V40-Y42 WeakPolarHBondContact CG1-OH 3.45Å; V40-E98 PolarHBondContact O-N 3.1Å
41	K	87.4	Confident	75.5	Confident	80 Å²	80	82.7 Å²	82.7	35%	0.348	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	146.9	173.9	-64.4	-173.1	179.7	-176.9	0	110.1	A34 W95 V96	A34-K41 PolarHBondContact N-O 2.97Å; A34-K41 PolarHBondContact O-N 3.37Å; K41-W95 HydrophobicContact CB-CE3 3.95Å; K41-W95 HydrophobicContact CB-CZ3 4.49Å; K41-V96 CarbonylContact C-O 3.6Å; K41-V96 WeakPolarHBondContact CA-O 3.47Å
42	Y	88.4	Confident	72.9	Confident	0 Å²	0	90.6 Å²	90.6	0%	0	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.5	179.9	-58.1	-80.7	0	0	0	109	P9 K10 F11 K32 V33 V40 W95 V96 E98 V101	P9-Y42 WeakPolarHBondContact CA-OH 3.47Å; P9-Y42 HydrophobicContact CB-CE1 4.35Å; K10-Y42 PolarHBondContact N-OH 3.09Å; F11-Y42 HydrophobicContact CB-CD1 4.16Å; F11-Y42 HydrophobicContact CB-CE1 3.7Å; F11-Y42 HydrophobicContact CD2-CD2 4.39Å; F11-Y42 HydrophobicContact CD2-CE1 4.01Å; F11-Y42 AromaticContact CD2-CE2 3.85Å; F11-Y42 HydrophobicContact CD2-CE2 3.85Å; F11-Y42 AromaticContact CD2-CZ 3.62Å; F11-Y42 HydrophobicContact CE2-CE2 4.49Å; F11-Y42 HydrophobicContact CG-CE1 4.37Å; F11-Y42 PolarHBondContact N-OH 3.12Å; K32-Y42 CarbonylContact O-C 3.53Å; K32-Y42 WeakPolarHBondContact O-CA 3.43Å; V33-Y42 HydrophobicContact CB-CD1 4.42Å; V33-Y42 HydrophobicContact CB-CE1 4.47Å; V33-Y42 HydrophobicContact CG1-CD1 4.13Å; V33-Y42 HydrophobicContact CG1-CE1 3.82Å; V33-Y42 HydrophobicContact CG2-CD1 3.83Å; V33-Y42 HydrophobicContact CG2-CE1 3.91Å; V40-Y42 HydrophobicContact CB-CE2 4.48Å; V40-Y42 HydrophobicContact CG1-CE1 3.99Å; V40-Y42 HydrophobicContact CG1-CE2 3.78Å; V40-Y42 VanDerWaalsContact CG1-CZ 3.45Å; V40-Y42 WeakPolarHBondContact CG1-OH 3.45Å; Y42-W95 CarbonylContact O-C 3.55Å; Y42-W95 WeakPolarHBondContact O-CA 3.25Å; Y42-V96 PolarHBondContact N-O 2.93Å; Y42-V96 PolarHBondContact O-N 3.41Å; Y42-E98 HydrophobicContact CD2-CB 4.44Å; Y42-E98 HydrophobicContact CE2-CB 3.71Å; Y42-E98 HydrophobicContact CE2-CG 3.79Å; Y42-E98 PolarHBondContact OH-OE1 2.8Å; Y42-V101 HydrophobicContact CD2-CG2 4.11Å; Y42-V101 HydrophobicContact CG-CG2 4.48Å
43	F	88.1	Confident	70.1	Confident	45 Å²	45	90.3 Å²	90.3	20%	0.197	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	116.9	167.7	-165.9	-116.8	0	0	0	107.6	V31 K32 D93 E94 W95	V31-F43 HydrophobicContact CB-CD1 3.87Å; V31-F43 HydrophobicContact CG1-CD1 4.02Å; V31-F43 PolarHBondContact N-O 2.97Å; K32-F43 HydrophobicContact CB-CB 3.78Å; K32-F43 HydrophobicContact CG-CB 4.46Å; K32-F43 PolarHBondContact N-O 3.46Å; K32-F43 PolarHBondContact O-N 2.85Å; F43-D93 HydrophobicContact CE1-CB 3.71Å; F43-D93 HydrophobicContact CE2-CB 4.04Å; F43-D93 HydrophobicContact CZ-CB 3.36Å; F43-E94 WeakPolarHBondContact CA-O 3.45Å; F43-W95 HydrophobicContact CB-CD2 3.98Å; F43-W95 HydrophobicContact CB-CE3 3.92Å; F43-W95 HydrophobicContact CB-CH2 3.98Å; F43-W95 HydrophobicContact CB-CZ2 4.03Å; F43-W95 HydrophobicContact CB-CZ3 3.91Å; F43-W95 AromaticContact CD2-CD1 3.68Å; F43-W95 AromaticContact CD2-CD2 3.9Å; F43-W95 HydrophobicContact CD2-CD2 3.9Å; F43-W95 AromaticContact CD2-CE2 3.75Å; F43-W95 AromaticContact CD2-CG 3.88Å; F43-W95 HydrophobicContact CD2-CG 3.88Å; F43-W95 HydrophobicContact CD2-CZ2 4.41Å; F43-W95 AromaticContact CD2-NE1 3.59Å; F43-W95 HydrophobicContact CG-CD2 4.39Å; F43-W95 HydrophobicContact CG-CZ2 4.41Å
44	I	88.9	Confident	67.4	Low	0 Å²	0	92.9 Å²	92.9	0%	0	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.8	-169.5	-63.3	-57.8	0	0	0	110.6	V17 C19 A28 K29 C30 Y46 D93 E94 V96 V101	V17-I44 HydrophobicContact CG2-CD1 4.02Å; C19-I44 HydrophobicContact CB-CG2 3.8Å; A28-I44 HydrophobicContact CB-CG2 3.35Å; K29-I44 WeakPolarHBondContact O-CA 3.4Å; C30-I44 HydrophobicContact CB-CD1 4.19Å; I44-Y46 HydrophobicContact CG2-CE2 4.37Å; I44-D93 VanDerWaalsContact O-CA 3.29Å; I44-D93 WeakPolarHBondContact O-CA 3.37Å; I44-E94 PolarHBondContact N-O 2.8Å; I44-E94 PolarHBondContact O-N 2.99Å; I44-V96 HydrophobicContact CB-CG2 4.41Å; I44-V96 HydrophobicContact CD1-CG2 4.41Å; I44-V96 HydrophobicContact CG1-CG1 4.47Å; I44-V96 HydrophobicContact CG1-CG2 3.41Å; I44-V96 VanDerWaalsContact CG1-CG2 3.41Å; I44-V101 HydrophobicContact CD1-CG1 4.4Å; I44-V101 HydrophobicContact CD1-CG2 4.01Å; I44-V101 HydrophobicContact CG1-CG2 4.14Å
45	H	83.8	Confident	64.7	Low	51 Å²	51	97.9 Å²	97.9	24%	0.236	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117.5	172.6	178.6	82.1	0	0	0	110.9	A28 K29 V31 D93	A28-H45 CarbonylContact C-O 3.59Å; A28-H45 WeakPolarHBondContact CA-O 3.47Å; A28-H45 WeakPolarHBondContact CB-O 3.2Å; K29-H45 PolarHBondContact N-O 2.84Å; K29-H45 PolarHBondContact O-N 2.97Å; V31-H45 HydrophobicContact CG2-CB 3.54Å; H45-D93 WeakPolarHBondContact CA-OD1 3.47Å; H45-D93 IonicContact CE1-OD1 2.86Å; H45-D93 IonicContact CG-OD1 3.33Å; H45-D93 IonicContact ND1-OD1 3.73Å; H45-D93 PolarHBondContact ND1-OD1 3.28Å; H45-D93 IonicContact ND1-OD2 3.39Å; H45-D93 PolarHBondContact ND1-OD2 2.87Å
46	Y	80.8	Confident	61.8	Low	31 Å²	31	103.2 Å²	103.2	12%	0.122	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	138	-177.2	-65.5	-88.7	0	0	0	112.9	C19 F20 H21 Y26 A28 I44 W92 E94 R100	C19-Y46 HydrophobicContact CB-CD1 4.47Å; C19-Y46 HydrophobicContact CB-CE1 3.68Å; C19-Y46 PolarHBondContact SG-OH 3.17Å; F20-Y46 PolarHBondContact O-OH 3.09Å; H21-Y46 HydrophobicContact CB-CE1 3.97Å; Y26-Y46 HydrophobicContact CG-CD1 4.48Å; A28-Y46 HydrophobicContact CB-CD1 3.99Å; A28-Y46 HydrophobicContact CB-CE1 4.5Å; A28-Y46 HydrophobicContact CB-CG 4.4Å; I44-Y46 HydrophobicContact CG2-CE2 4.37Å; Y46-W92 HydrophobicContact CD2-CB 4.11Å; Y46-W92 VanDerWaalsContact CD2-O 3.31Å; Y46-W92 WeakPolarHBondContact CD2-O 3.4Å; Y46-W92 WeakPolarHBondContact CE2-O 3.42Å; Y46-E94 HydrophobicContact CE2-CG 4.21Å; Y46-E94 PolarHBondContact OH-OE1 3.42Å; Y46-R100 PolarHBondContact OH-NH2 2.71Å
47	S	71.4	Confident	59.3	Low	47 Å²	47	102.7 Å²	102.7	33%	0.329	53%	0.531	S	S	.	.			trans	-98.7	140.2	-178.9	-49.2	0	0	0	0	110.9	E27	E27-S47 WeakPolarHBondContact O-CB 2.93Å; E27-S47 PolarHBondContact O-N 2.83Å
48	G	51.2	Low	56.9	Low	64 Å²	64	108.4 Å²	108.4	66%	0.66	54%	0.542	S	S	*	.			trans	101.6	5.9	162.3	0	0	0	0	0	118.2	N50	G48-N50 PolarHBondContact O-N 3.39Å
49	W	38.4	Very low	54.7	Low	210 Å²	210	108.1 Å²	108.1	80%	0.795	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-7.5	172	-160	-90.6	0	0	0	113.9
50	N	38.2	Very low	52.3	Low	138 Å²	138	107.8 Å²	107.8	74%	0.738	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	19	-175.3	-83.5	-2.8	0	0	0	115.8	G48	G48-N50 PolarHBondContact O-N 3.39Å
51	K	36.1	Very low	50.2	Low	184 Å²	184	116.1 Å²	116.1	80%	0.8	59%	0.586	S	S	*	*			trans	-140.2	95.9	-178.5	-70.1	-172.8	179.6	-177.9	0	113.7
52	K	32.7	Very low	47.5	Very low	218 Å²	218	121.9 Å²	121.9	95%	0.948	61%	0.61	S	S	*	*			trans	-154.4	109	138.3	-67	-160.2	-178.3	176.4	0	110.7
53	S	29.1	Very low	45	Very low	107 Å²	107	126.1 Å²	126.1	75%	0.748	64%	0.64	S	S	*	*			trans	-115.4	154.5	164.2	43.5	0	0	0	0	109.7
54	A	32.3	Very low	42.5	Very low	91 Å²	91	128.8 Å²	128.8	75%	0.752	66%	0.656	S	S	*	*			trans	74.9	108.4	167.3	0	0	0	0	0	118.5
55	V	28.5	Very low	40	Very low	142 Å²	142	137.1 Å²	137.1	86%	0.861	69%	0.692	S	S	*	*				-174	131.6	95.7	166.4	0	0	0	0	107.7
56	R	27.1	Very low	37.6	Very low	198 Å²	198	138.1 Å²	138.1	75%	0.747	70%	0.702	S	S	*	*			trans	-116	144.9	178.4	-67	-174.3	-173	-138.3	-1.2	111.5
57	P	25.4	Very low	35.3	Very low	128 Å²	128	147.2 Å²	147.2	83%	0.831	74%	0.736	S	S	*	*			trans	-105.2	155.8	149	9.6	10.9	0	0	0	112.3
58	R	26.3	Very low	33.6	Very low	256 Å²	256	152.6 Å²	152.6	97%	0.966	76%	0.756	S	S	*	*			trans	-71.4	136.1	-168.7	-152.8	174.5	-176.5	-159.2	0.9	112.7
59	R	30.8	Very low	33	Very low	152 Å²	152	151.2 Å²	151.2	57%	0.574	73%	0.734	S	S	*	*			trans	-95.9	135.9	-175.6	-157.4	179.2	-168.3	-179.9	4.4	111.1	D69	R59-D69 IonicContact NH2-OD1 3.67Å; R59-D69 PolarHBondContact NH2-OD1 3.31Å; R59-D69 VanDerWaalsContact NH2-OD1 3.08Å
60	S	28.3	Very low	32.9	Very low	111 Å²	111	146.2 Å²	146.2	78%	0.776	72%	0.721	S	S	*	*			trans	-105.3	140	159.6	59	0	0	0	0	109.7
61	E	41.8	Very low	32.8	Very low	186 Å²	186	145 Å²	145	87%	0.869	72%	0.718	S	S	*	*			trans	-54.1	135.4	-172.2	-74.7	162.4	125.2	0	0	115
62	K	30.9	Very low	32.7	Very low	200 Å²	200	139 Å²	139	87%	0.87	70%	0.703	S	S	*	*			trans	-166.5	144.2	149.4	-102.5	158.5	-166.7	-175.5	0	111.2
63	S	34.4	Very low	32.7	Very low	90 Å²	90	133.5 Å²	133.5	63%	0.629	68%	0.684	S	S	*	*			trans	-27.5	122.7	-177.2	-169.8	0	0	0	0	116.8	K65	S63-K65 PolarHBondContact O-N 2.86Å; S63-K65 WeakPolarHBondContact OG-CE 3.43Å
64	L	36.7	Very low	32.9	Very low	101 Å²	101	133.5 Å²	133.5	53%	0.529	67%	0.671	S	S	.	*			trans	-70.6	114.2	177.4	-56.6	163.1	0	0	0	109.6	D69	L64-D69 HydrophobicContact CB-CB 4.28Å; L64-D69 HydrophobicContact CD2-CB 3.69Å
65	K	35.7	Very low	32.8	Very low	174 Å²	174	133.2 Å²	133.2	76%	0.757	66%	0.661	S	S	*	*			trans	-136.7	2.7	-178.4	-69.4	-171.8	-179.9	-178.7	0	114.5	S63 D69	S63-K65 PolarHBondContact O-N 2.86Å; S63-K65 WeakPolarHBondContact OG-CE 3.43Å; K65-D69 PolarHBondContact N-OD2 3.11Å
66	T	33.9	Very low	33	Very low	72 Å²	72	132.8 Å²	132.8	44%	0.442	66%	0.659	S	S	.	*	S	Bend	trans	-132	155.5	-177.3	63.3	0	0	0	0	113.9	E68 D69	T66-E68 PolarHBondContact O-N 3.13Å; T66-E68 VanDerWaalsContact O-N 3.1Å; T66-D69 PolarHBondContact N-OD2 2.75Å; T66-D69 VanDerWaalsContact N-OD2 3.1Å; T66-D69 VanDerWaalsContact O-CB 3.29Å; T66-D69 WeakPolarHBondContact O-CB 3.32Å; T66-D69 PolarHBondContact O-N 3.3Å; T66-D69 PolarHBondContact OG1-OD2 2.87Å
67	R	32.3	Very low	33.2	Very low	222 Å²	222	129.1 Å²	129.1	84%	0.838	66%	0.661	S	S	*	*	H	α-helix	trans	-53.6	-27.4	175.5	-177.9	-179.1	176	-151	-1.1	113
68	E	35.7	Very low	33.5	Very low	160 Å²	160	132 Å²	132	75%	0.748	66%	0.663	S	S	*	*	H	α-helix	trans	-75.3	-27.7	178.3	-69.5	156.2	-174.5	0	0	111.9	T66	T66-E68 PolarHBondContact O-N 3.13Å; T66-E68 VanDerWaalsContact O-N 3.1Å
69	D	37.8	Very low	33.9	Very low	35 Å²	35	123.4 Å²	123.4	19%	0.187	65%	0.654	C	S	.	*	H	α-helix	trans	-71.8	-30	176.4	-70	-52.7	0	0	0	113.4	R59 L64 K65 T66	R59-D69 IonicContact NH2-OD1 3.67Å; R59-D69 PolarHBondContact NH2-OD1 3.31Å; R59-D69 VanDerWaalsContact NH2-OD1 3.08Å; L64-D69 HydrophobicContact CB-CB 4.28Å; L64-D69 HydrophobicContact CD2-CB 3.69Å; K65-D69 PolarHBondContact N-OD2 3.11Å; T66-D69 PolarHBondContact N-OD2 2.75Å; T66-D69 VanDerWaalsContact N-OD2 3.1Å; T66-D69 VanDerWaalsContact O-CB 3.29Å; T66-D69 WeakPolarHBondContact O-CB 3.32Å; T66-D69 PolarHBondContact O-N 3.3Å; T66-D69 PolarHBondContact OG1-OD2 2.87Å
70	I	36.7	Very low	33.7	Very low	105 Å²	105	120.9 Å²	120.9	54%	0.538	67%	0.666	S	S	.	*	H	α-helix	trans	-74.9	-36.4	-179.5	-62.7	174.6	0	0	0	110.9	A72 L73	I70-A72 PolarHBondContact O-N 2.87Å; I70-L73 PolarHBondContact O-N 2.84Å
71	V	35.6	Very low	33.6	Very low	112 Å²	112	121.2 Å²	121.2	68%	0.679	67%	0.666	S	S	*	*	H	α-helix	trans	-68.3	-25.1	178.4	178.8	0	0	0	0	111.5	L73	V71-L73 VanDerWaalsContact C-N 3.28Å; V71-L73 PolarHBondContact O-N 3.46Å
72	A	35.1	Very low	33.4	Very low	58 Å²	58	118.1 Å²	118.1	48%	0.479	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.2	-4.4	-180	0	0	0	0	0	114.9	I70	I70-A72 PolarHBondContact O-N 2.87Å
73	L	32.9	Very low	33.3	Very low	104 Å²	104	115 Å²	115	55%	0.545	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86	1	-176.3	-76.4	166.5	0	0	0	115.2	I70 V71 P75	I70-L73 PolarHBondContact O-N 2.84Å; V71-L73 VanDerWaalsContact C-N 3.28Å; V71-L73 PolarHBondContact O-N 3.46Å; L73-P75 WeakPolarHBondContact O-CD 3.14Å
74	F	33	Very low	33.1	Very low	106 Å²	106	119.3 Å²	119.3	47%	0.465	68%	0.677	S	S	.	*			trans	-116.3	91.8	-177.3	-64.1	-83.4	0	0	0	113.2	W211	F74-W211 HydrophobicContact CE1-CH2 4.25Å; F74-W211 HydrophobicContact CE2-CH2 4.49Å; F74-W211 AromaticContact CZ-CH2 3.95Å; F74-W211 HydrophobicContact CZ-CH2 3.95Å; F74-W211 AromaticContact CZ-CZ3 3.95Å; F74-W211 HydrophobicContact CZ-CZ3 3.95Å
75	P	30.3	Very low	32.6	Very low	86 Å²	86	121 Å²	121	56%	0.558	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-85.5	129.5	160	0.7	18.8	0	0	0	110.3	L73	L73-P75 WeakPolarHBondContact O-CD 3.14Å
76	V	33.5	Very low	32.3	Very low	133 Å²	133	118.1 Å²	118.1	81%	0.806	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-81.5	135.7	163.9	179.5	0	0	0	0	108.4
77	P	30.2	Very low	32.1	Very low	121 Å²	121	121.7 Å²	121.7	79%	0.786	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-72	137.2	179.5	-8.4	23.7	0	0	0	111.7
78	E	30.9	Very low	32.2	Very low	187 Å²	187	118 Å²	118	87%	0.874	69%	0.692	S	S	*	*	S	Bend	trans	-75.5	131.5	169.9	-75.6	-178.9	154.5	0	0	110.4
79	G	35.2	Very low	32	Very low	77 Å²	77	115.5 Å²	115.5	79%	0.794	69%	0.688	S	S	*	*			trans	133.6	8.5	159	0	0	0	0	0	119.9
80	A	27.3	Very low	32.2	Very low	99 Å²	99	116.5 Å²	116.5	82%	0.818	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-85.6	128.8	175.5	0	0	0	0	0	111.9
81	P	25.8	Very low	32.6	Very low	118 Å²	118	117 Å²	117	77%	0.766	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-75.6	147.6	-170.3	28.9	-31.8	0	0	0	113	V83	P81-V83 PolarHBondContact O-N 2.76Å
82	S	37.2	Very low	33.6	Very low	120 Å²	120	117.7 Å²	117.7	84%	0.839	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-63.4	118.2	173.2	-76.2	0	0	0	0	111.3
83	V	28.3	Very low	35.7	Very low	135 Å²	135	117 Å²	117	82%	0.818	69%	0.689	S	S	*	*			trans	-124.2	110.1	156.9	-86.6	0	0	0	0	107.8	P81 H85	P81-V83 PolarHBondContact O-N 2.76Å; V83-H85 PolarHBondContact O-N 2.86Å
84	L	30.5	Very low	38.1	Very low	180 Å²	180	114.7 Å²	114.7	94%	0.942	68%	0.676	S	S	*	*			trans	-58	116.3	171.4	-100.7	90	0	0	0	108.7
85	H	27.7	Very low	40.6	Very low	137 Å²	137	115.3 Å²	115.3	63%	0.634	68%	0.675	S	S	*	*			trans	-121.8	134.4	163.3	-160.1	-99.6	0	0	0	109.4	V83 L87	V83-H85 PolarHBondContact O-N 2.86Å; H85-L87 PolarHBondContact O-N 2.9Å
86	P	28.8	Very low	43.2	Very low	113 Å²	113	111.2 Å²	111.2	73%	0.734	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	17	-169.5	-18.8	32.8	0	0	0	117
87	L	29	Very low	45.8	Very low	147 Å²	147	106.5 Å²	106.5	77%	0.77	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	18.8	-175.1	-61.7	176.5	0	0	0	113.2	H85	H85-L87 PolarHBondContact O-N 2.9Å
88	L	34.1	Very low	48.3	Very low	144 Å²	144	102.8 Å²	102.8	75%	0.754	59%	0.593	S	S	*	*			trans	-114.4	60.2	175.6	-147.2	94	0	0	0	111.3
89	T	33.4	Very low	50.9	Low	109 Å²	109	96.9 Å²	96.9	67%	0.669	57%	0.572	S	S	*	*			trans	-104.1	107.1	163.9	55.6	0	0	0	0	109.4
90	S	40	Very low	53.3	Low	55 Å²	55	95 Å²	95	39%	0.385	54%	0.541	S	S	.	.			trans	-23.4	128.8	171.1	-57.3	0	0	0	0	115.6	W92	S90-W92 PolarHBondContact O-N 3.09Å
91	S	46.4	Very low	56.2	Low	115 Å²	115	90.5 Å²	90.5	80%	0.804	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	38.9	174.6	63.6	0	0	0	0	114.3
92	W	55.8	Low	59.2	Low	127 Å²	127	86.7 Å²	86.7	48%	0.481	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.6	7.5	175.2	-62.5	99.9	0	0	0	111.9	H21 Y46 S90 E94	H21-W92 AromaticContact CE1-CZ3 3.94Å; H21-W92 AromaticContact NE2-CZ3 3.91Å; Y46-W92 HydrophobicContact CD2-CB 4.11Å; Y46-W92 VanDerWaalsContact CD2-O 3.31Å; Y46-W92 WeakPolarHBondContact CD2-O 3.4Å; Y46-W92 WeakPolarHBondContact CE2-O 3.42Å; S90-W92 PolarHBondContact O-N 3.09Å; W92-E94 PolarHBondContact O-N 3.31Å
93	D	78.6	Confident	61.7	Low	43 Å²	43	86.3 Å²	86.3	23%	0.23	46%	0.46	C	S	.	.			trans	-79.8	118	179.1	-61.7	-1.9	0	0	0	109.4	F43 I44 H45	F43-D93 HydrophobicContact CE1-CB 3.71Å; F43-D93 HydrophobicContact CE2-CB 4.04Å; F43-D93 HydrophobicContact CZ-CB 3.36Å; I44-D93 VanDerWaalsContact O-CA 3.29Å; I44-D93 WeakPolarHBondContact O-CA 3.37Å; H45-D93 WeakPolarHBondContact CA-OD1 3.47Å; H45-D93 IonicContact CE1-OD1 2.86Å; H45-D93 IonicContact CG-OD1 3.33Å; H45-D93 IonicContact ND1-OD1 3.73Å; H45-D93 PolarHBondContact ND1-OD1 3.28Å; H45-D93 IonicContact ND1-OD2 3.39Å; H45-D93 PolarHBondContact ND1-OD2 2.87Å
94	E	83.6	Confident	64.5	Low	56 Å²	56	84 Å²	84	26%	0.262	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	152.4	-176.3	54.4	169.1	161.6	0	0	111	H21 F43 I44 Y46 W92 V96 R100	H21-E94 IonicContact ND1-OE1 2.72Å; F43-E94 WeakPolarHBondContact CA-O 3.45Å; I44-E94 PolarHBondContact N-O 2.8Å; I44-E94 PolarHBondContact O-N 2.99Å; Y46-E94 HydrophobicContact CE2-CG 4.21Å; Y46-E94 PolarHBondContact OH-OE1 3.42Å; W92-E94 PolarHBondContact O-N 3.31Å; E94-V96 HydrophobicContact CG-CG1 3.61Å; E94-R100 IonicContact OE1-CZ 3.76Å; E94-R100 IonicContact OE1-NH1 2.68Å; E94-R100 PolarHBondContact OE1-NH1 3.05Å; E94-R100 IonicContact OE1-NH2 3.44Å; E94-R100 PolarHBondContact OE1-NH2 3.27Å; E94-R100 IonicContact OE2-CZ 3.46Å; E94-R100 IonicContact OE2-NH1 3.62Å; E94-R100 PolarHBondContact OE2-NH1 3.4Å; E94-R100 IonicContact OE2-NH2 3.7Å
95	W	86.9	Confident	67.1	Low	120 Å²	120	78.5 Å²	78.5	46%	0.455	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	115.9	166.3	-75.2	100.1	0	0	0	109.3	K32 A34 K41 Y42 F43	K32-W95 HydrophobicContact CB-CH2 3.73Å; K32-W95 HydrophobicContact CB-CZ2 4.35Å; K32-W95 HydrophobicContact CB-CZ3 4.39Å; A34-W95 HydrophobicContact CB-CE3 4.35Å; A34-W95 HydrophobicContact CB-CH2 3.59Å; A34-W95 HydrophobicContact CB-CZ3 3.47Å; A34-W95 VanDerWaalsContact CB-CZ3 3.47Å; K41-W95 HydrophobicContact CB-CE3 3.95Å; K41-W95 HydrophobicContact CB-CZ3 4.49Å; Y42-W95 CarbonylContact O-C 3.55Å; Y42-W95 WeakPolarHBondContact O-CA 3.25Å; F43-W95 HydrophobicContact CB-CD2 3.98Å; F43-W95 HydrophobicContact CB-CE3 3.92Å; F43-W95 HydrophobicContact CB-CH2 3.98Å; F43-W95 HydrophobicContact CB-CZ2 4.03Å; F43-W95 HydrophobicContact CB-CZ3 3.91Å; F43-W95 AromaticContact CD2-CD1 3.68Å; F43-W95 AromaticContact CD2-CD2 3.9Å; F43-W95 HydrophobicContact CD2-CD2 3.9Å; F43-W95 AromaticContact CD2-CE2 3.75Å; F43-W95 AromaticContact CD2-CG 3.88Å; F43-W95 HydrophobicContact CD2-CG 3.88Å; F43-W95 HydrophobicContact CD2-CZ2 4.41Å; F43-W95 AromaticContact CD2-NE1 3.59Å; F43-W95 HydrophobicContact CG-CD2 4.39Å; F43-W95 HydrophobicContact CG-CZ2 4.41Å
96	V	84.7	Confident	69.6	Low	0 Å²	0	78.1 Å²	78.1	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	148.1	178.2	-50.8	0	0	0	0	111.4	K41 Y42 I44 E94 R100 V101	K41-V96 CarbonylContact C-O 3.6Å; K41-V96 WeakPolarHBondContact CA-O 3.47Å; Y42-V96 PolarHBondContact N-O 2.93Å; Y42-V96 PolarHBondContact O-N 3.41Å; I44-V96 HydrophobicContact CB-CG2 4.41Å; I44-V96 HydrophobicContact CD1-CG2 4.41Å; I44-V96 HydrophobicContact CG1-CG1 4.47Å; I44-V96 HydrophobicContact CG1-CG2 3.41Å; I44-V96 VanDerWaalsContact CG1-CG2 3.41Å; E94-V96 HydrophobicContact CG-CG1 3.61Å; V96-R100 HydrophobicContact CB-CB 4.1Å; V96-R100 HydrophobicContact CG2-CB 4.25Å; V96-V101 HydrophobicContact CG2-CG2 3.41Å; V96-V101 VanDerWaalsContact CG2-CG2 3.41Å
97	P	86.9	Confident	72.3	Confident	34 Å²	34	78 Å²	78	22%	0.221	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	160.9	169.9	29.9	-36.2	0	0	0	111.6	S99 R100	P97-S99 WeakPolarHBondContact CG-OG 3.41Å; P97-S99 PolarHBondContact O-N 3.46Å; P97-S99 VanDerWaalsContact O-N 3.13Å; P97-R100 HydrophobicContact CG-CG 4.25Å; P97-R100 PolarHBondContact O-N 3.4Å; P97-R100 VanDerWaalsContact O-N 3.11Å
98	E	83.1	Confident	75	Confident	43 Å²	43	72.5 Å²	72.5	20%	0.201	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-56.2	-28	177.3	-172.2	166	-105.7	0	0	114.2	K10 V40 Y42 R100 V101	K10-E98 VanDerWaalsContact CB-OE1 3.25Å; K10-E98 WeakPolarHBondContact CB-OE1 3.33Å; K10-E98 VanDerWaalsContact CD-CD 3.44Å; K10-E98 HydrophobicContact CD-CG 4.02Å; K10-E98 WeakPolarHBondContact CD-OE1 3.4Å; K10-E98 VanDerWaalsContact CE-OE2 3.28Å; K10-E98 WeakPolarHBondContact CE-OE2 3.42Å; K10-E98 WeakPolarHBondContact CG-OE1 3.36Å; K10-E98 PolarHBondContact N-OE1 3.39Å; K10-E98 IonicContact NZ-OE2 3.27Å; K10-E98 PolarHBondContact NZ-OE2 3.01Å; V40-E98 PolarHBondContact O-N 3.1Å; Y42-E98 HydrophobicContact CD2-CB 4.44Å; Y42-E98 HydrophobicContact CE2-CB 3.71Å; Y42-E98 HydrophobicContact CE2-CG 3.79Å; Y42-E98 PolarHBondContact OH-OE1 2.8Å; E98-R100 PolarHBondContact O-N 3.41Å; E98-V101 PolarHBondContact O-N 2.89Å
99	S	85.5	Confident	77.2	Confident	62 Å²	62	66.8 Å²	66.8	43%	0.434	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-62.5	-26.4	177.9	50.5	0	0	0	0	113.6	P97 E186	P97-S99 WeakPolarHBondContact CG-OG 3.41Å; P97-S99 PolarHBondContact O-N 3.46Å; P97-S99 VanDerWaalsContact O-N 3.13Å; S99-E186 PolarHBondContact OG-OE2 2.91Å
100	R	85.8	Confident	79.4	Confident	37 Å²	37	65.2 Å²	65.2	14%	0.14	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-87.3	-7.6	-178.5	-75.7	-175.5	62.4	-163.9	-3.7	114.1	C19 F20 Y46 E94 V96 P97 E98 M190	C19-R100 WeakPolarHBondContact CA-O 3.3Å; F20-R100 PolarHBondContact N-O 3.37Å; F20-R100 PolarHBondContact O-NE 3.13Å; F20-R100 VanDerWaalsContact O-NE 3.1Å; F20-R100 PolarHBondContact O-NH2 2.92Å; Y46-R100 PolarHBondContact OH-NH2 2.71Å; E94-R100 IonicContact OE1-CZ 3.76Å; E94-R100 IonicContact OE1-NH1 2.68Å; E94-R100 PolarHBondContact OE1-NH1 3.05Å; E94-R100 IonicContact OE1-NH2 3.44Å; E94-R100 PolarHBondContact OE1-NH2 3.27Å; E94-R100 IonicContact OE2-CZ 3.46Å; E94-R100 IonicContact OE2-NH1 3.62Å; E94-R100 PolarHBondContact OE2-NH1 3.4Å; E94-R100 IonicContact OE2-NH2 3.7Å; V96-R100 HydrophobicContact CB-CB 4.1Å; V96-R100 HydrophobicContact CG2-CB 4.25Å; P97-R100 HydrophobicContact CG-CG 4.25Å; P97-R100 PolarHBondContact O-N 3.4Å; P97-R100 VanDerWaalsContact O-N 3.11Å; E98-R100 PolarHBondContact O-N 3.41Å; R100-M190 HydrophobicContact CG-CE 4.48Å
101	V	88.8	Confident	81.3	Confident	6 Å²	6	66.4 Å²	66.4	4%	0.036	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	127.1	-172.6	-168.8	0	0	0	0	110.3	F11 V17 Y42 I44 V96 E98	F11-V101 HydrophobicContact CD1-CG1 4.36Å; F11-V101 HydrophobicContact CD2-CB 4.13Å; F11-V101 HydrophobicContact CD2-CG1 3.82Å; F11-V101 HydrophobicContact CE1-CG1 4.14Å; F11-V101 HydrophobicContact CE2-CB 3.69Å; F11-V101 HydrophobicContact CE2-CG1 3.63Å; F11-V101 WeakPolarHBondContact CE2-O 3.42Å; F11-V101 HydrophobicContact CG-CG1 4.2Å; F11-V101 HydrophobicContact CZ-CB 4.14Å; F11-V101 HydrophobicContact CZ-CG1 3.8Å; F11-V101 VanDerWaalsContact CZ-O 3.26Å; F11-V101 WeakPolarHBondContact CZ-O 3.37Å; V17-V101 HydrophobicContact CB-CG1 3.56Å; V17-V101 HydrophobicContact CG1-CG1 3.79Å; V17-V101 HydrophobicContact CG2-CG1 3.68Å; Y42-V101 HydrophobicContact CD2-CG2 4.11Å; Y42-V101 HydrophobicContact CG-CG2 4.48Å; I44-V101 HydrophobicContact CD1-CG1 4.4Å; I44-V101 HydrophobicContact CD1-CG2 4.01Å; I44-V101 HydrophobicContact CG1-CG2 4.14Å; V96-V101 HydrophobicContact CG2-CG2 3.41Å; V96-V101 VanDerWaalsContact CG2-CG2 3.41Å; E98-V101 PolarHBondContact O-N 2.89Å
102	L	88	Confident	83.1	Confident	38 Å²	38	62.3 Å²	62.3	20%	0.199	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	149.9	176.9	-65.8	-176.4	0	0	0	110.5	V17 L18 F20 L25 N108 K111	V17-L102 WeakPolarHBondContact CB-O 3.39Å; L18-L102 HydrophobicContact CB-CB 4.23Å; L18-L102 PolarHBondContact N-O 3.13Å; L18-L102 PolarHBondContact O-N 3.15Å; F20-L102 HydrophobicContact CE2-CD1 3.78Å; F20-L102 HydrophobicContact CE2-CG 4.16Å; F20-L102 HydrophobicContact CZ-CD1 4.22Å; L25-L102 HydrophobicContact CD1-CD1 3.87Å; L25-L102 HydrophobicContact CD2-CD1 3.91Å; L25-L102 HydrophobicContact CD2-CG 4.44Å; L102-N108 HydrophobicContact CB-CB 4.43Å; L102-N108 HydrophobicContact CD1-CB 4.39Å; L102-K111 HydrophobicContact CD1-CD 4.48Å
103	K	89.6	Confident	84.2	Confident	111 Å²	111	62.8 Å²	62.8	48%	0.483	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	142.9	172.9	-74.7	-172.9	174.7	-174.4	0	110.5	F11 V105 N108	F11-K103 HydrophobicContact CD1-CG 4.23Å; F11-K103 HydrophobicContact CE1-CB 4.25Å; F11-K103 HydrophobicContact CE1-CG 3.44Å; F11-K103 VanDerWaalsContact CE1-CG 3.44Å; F11-K103 HydrophobicContact CZ-CG 4.22Å; K103-V105 VanDerWaalsContact C-N 3.28Å; K103-V105 HydrophobicContact CB-CG1 4.05Å; K103-V105 HydrophobicContact CB-CG2 4.34Å; K103-V105 PolarHBondContact O-N 3.45Å; K103-N108 WeakPolarHBondContact O-CB 3.26Å; K103-N108 PolarHBondContact O-ND2 3.45Å
104	Y	87.6	Confident	84.4	Confident	87 Å²	87	66 Å²	66	34%	0.341	32%	0.319	S	S	.	.	S	Bend	trans	-75.5	82.8	171.2	-163.1	-86.8	0	0	0	109.6	R16 L18 E27 L109	R16-Y104 HydrophobicContact CG-CD2 3.9Å; R16-Y104 HydrophobicContact CG-CE2 4.35Å; R16-Y104 HydrophobicContact CG-CG 4.09Å; R16-Y104 WeakPolarHBondContact O-CB 3.34Å; L18-Y104 HydrophobicContact CD2-CD2 3.99Å; L18-Y104 HydrophobicContact CD2-CE2 4.13Å; L18-Y104 HydrophobicContact CG-CD2 3.96Å; E27-Y104 HydrophobicContact CB-CE2 4.49Å; E27-Y104 HydrophobicContact CG-CD2 4.39Å; E27-Y104 HydrophobicContact CG-CE2 3.84Å; Y104-L109 HydrophobicContact CD1-CD1 4.29Å; Y104-L109 HydrophobicContact CE1-CD1 3.92Å; Y104-L109 HydrophobicContact CE2-CD2 4.14Å
105	V	86.1	Confident	84.1	Confident	64 Å²	64	65.7 Å²	65.7	39%	0.388	32%	0.319	S	S	.	.	S	Bend	trans	-133	156.7	179.7	-65.3	0	0	0	0	110.1	K103 T107 N108 L109	K103-V105 VanDerWaalsContact C-N 3.28Å; K103-V105 HydrophobicContact CB-CG1 4.05Å; K103-V105 HydrophobicContact CB-CG2 4.34Å; K103-V105 PolarHBondContact O-N 3.45Å; V105-T107 PolarHBondContact O-N 3.41Å; V105-T107 VanDerWaalsContact O-N 3.15Å; V105-N108 HydrophobicContact CG2-CB 4.14Å; V105-N108 WeakPolarHBondContact CG2-ND2 3.45Å; V105-N108 PolarHBondContact O-N 3.04Å; V105-L109 PolarHBondContact O-N 2.86Å
106	D	78.9	Confident	83.6	Confident	129 Å²	129	64.2 Å²	64.2	69%	0.69	32%	0.317	S	S	*	.	H	α-helix	trans	-54.3	-38.2	-174.2	-65.8	-54.3	0	0	0	113.6	N108 L109 Q110	D106-N108 VanDerWaalsContact C-N 3.33Å; D106-N108 PolarHBondContact O-N 3.45Å; D106-L109 PolarHBondContact O-N 2.77Å; D106-Q110 WeakPolarHBondContact O-CB 3.49Å; D106-Q110 PolarHBondContact O-N 2.96Å
107	T	86.4	Confident	83.3	Confident	111 Å²	111	70.3 Å²	70.3	68%	0.681	34%	0.343	S	S	*	.	H	α-helix	trans	-60.7	-40.2	176.4	-44.6	0	0	0	0	112.4	V105 K111	V105-T107 PolarHBondContact O-N 3.41Å; V105-T107 VanDerWaalsContact O-N 3.15Å; T107-K111 PolarHBondContact O-N 3.09Å; T107-K111 VanDerWaalsContact O-N 3.13Å
108	N	85.1	Confident	82.7	Confident	31 Å²	31	71 Å²	71	17%	0.166	35%	0.352	C	S	.	.	H	α-helix	trans	-82.2	-29.4	-179.2	-65.8	-26.7	0	0	0	112	L18 L102 K103 V105 D106 Q110 K111 Q112	L18-N108 HydrophobicContact CD1-CB 3.6Å; L102-N108 HydrophobicContact CB-CB 4.43Å; L102-N108 HydrophobicContact CD1-CB 4.39Å; K103-N108 WeakPolarHBondContact O-CB 3.26Å; K103-N108 PolarHBondContact O-ND2 3.45Å; V105-N108 HydrophobicContact CG2-CB 4.14Å; V105-N108 WeakPolarHBondContact CG2-ND2 3.45Å; V105-N108 PolarHBondContact O-N 3.04Å; D106-N108 VanDerWaalsContact C-N 3.33Å; D106-N108 PolarHBondContact O-N 3.45Å; N108-Q110 VanDerWaalsContact C-N 3.32Å; N108-K111 WeakPolarHBondContact O-CB 3.49Å; N108-K111 PolarHBondContact O-N 3.02Å; N108-Q112 PolarHBondContact O-N 2.88Å
109	L	80.2	Confident	82.1	Confident	25 Å²	25	72.2 Å²	72.2	13%	0.131	36%	0.36	C	S	.	.	H	α-helix	trans	-64.1	-38.8	169	-80.6	153	0	0	0	111.3	L18 Y104 V105 D106 Q112 R113	L18-L109 HydrophobicContact CD1-CG 4.31Å; Y104-L109 HydrophobicContact CD1-CD1 4.29Å; Y104-L109 HydrophobicContact CE1-CD1 3.92Å; Y104-L109 HydrophobicContact CE2-CD2 4.14Å; V105-L109 PolarHBondContact O-N 2.86Å; D106-L109 PolarHBondContact O-N 2.77Å; L109-Q112 WeakPolarHBondContact O-CB 3.32Å; L109-Q112 PolarHBondContact O-N 2.81Å; L109-R113 WeakPolarHBondContact O-CG 3.39Å; L109-R113 PolarHBondContact O-N 2.81Å; L109-R113 VanDerWaalsContact O-N 3.09Å
110	Q	80.3	Confident	81.4	Confident	76 Å²	76	76.3 Å²	76.3	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-64.3	-44.5	172.8	-177	60.3	20.4	0	0	111	D106 N108 Q112 R113 E114	D106-Q110 WeakPolarHBondContact O-CB 3.49Å; D106-Q110 PolarHBondContact O-N 2.96Å; N108-Q110 VanDerWaalsContact C-N 3.32Å; Q110-Q112 VanDerWaalsContact C-N 3.28Å; Q110-Q112 PolarHBondContact O-N 3.49Å; Q110-R113 PolarHBondContact O-N 3.36Å; Q110-R113 VanDerWaalsContact O-N 3.1Å; Q110-E114 WeakPolarHBondContact CG-OE1 3.33Å; Q110-E114 PolarHBondContact NE2-OE1 2.76Å; Q110-E114 WeakPolarHBondContact O-CG 3.45Å; Q110-E114 PolarHBondContact O-N 2.86Å
111	K	78.8	Confident	80.7	Confident	80 Å²	80	79.4 Å²	79.4	35%	0.348	39%	0.388	S	S	.	.	H	α-helix	trans	-56.9	-40.2	172.8	-169.7	176.4	-177.8	-179.8	0	112.1	L25 L102 T107 N108 E114 L115	L25-K111 HydrophobicContact CD1-CB 4.37Å; L25-K111 HydrophobicContact CD1-CD 4.33Å; L25-K111 HydrophobicContact CD1-CG 4.19Å; L102-K111 HydrophobicContact CD1-CD 4.48Å; T107-K111 PolarHBondContact O-N 3.09Å; T107-K111 VanDerWaalsContact O-N 3.13Å; N108-K111 WeakPolarHBondContact O-CB 3.49Å; N108-K111 PolarHBondContact O-N 3.02Å; K111-E114 PolarHBondContact O-N 2.95Å; K111-L115 HydrophobicContact CG-CD1 4.13Å; K111-L115 HydrophobicContact CG-CG 4.49Å; K111-L115 WeakPolarHBondContact O-CB 3.49Å; K111-L115 WeakPolarHBondContact O-CG 3.4Å; K111-L115 PolarHBondContact O-N 2.89Å
112	Q	85	Confident	79.5	Confident	29 Å²	29	86 Å²	86	14%	0.136	42%	0.419	C	S	.	.	H	α-helix	trans	-60.1	-47.2	173.9	177.4	-175.9	47.7	0	0	112.1	L25 N108 L109 Q110 L115 Q116	L25-Q112 HydrophobicContact CB-CB 3.89Å; L25-Q112 HydrophobicContact CB-CG 3.98Å; L25-Q112 HydrophobicContact CD1-CB 4.36Å; L25-Q112 WeakPolarHBondContact O-CG 3.17Å; L25-Q112 PolarHBondContact O-NE2 3.27Å; N108-Q112 PolarHBondContact O-N 2.88Å; L109-Q112 WeakPolarHBondContact O-CB 3.32Å; L109-Q112 PolarHBondContact O-N 2.81Å; Q110-Q112 VanDerWaalsContact C-N 3.28Å; Q110-Q112 PolarHBondContact O-N 3.49Å; Q112-L115 PolarHBondContact O-N 2.75Å; Q112-Q116 VanDerWaalsContact O-CG 3.3Å; Q112-Q116 WeakPolarHBondContact O-CG 3.35Å; Q112-Q116 PolarHBondContact O-N 3.36Å
113	R	78.5	Confident	77.8	Confident	137 Å²	137	93.1 Å²	93.1	52%	0.517	44%	0.444	S	S	.	.	H	α-helix	trans	-64.1	-41.2	178.7	-66.1	177.8	-145.4	147.4	-2.3	112.2	L109 Q110 Q116 K117	L109-R113 WeakPolarHBondContact O-CG 3.39Å; L109-R113 PolarHBondContact O-N 2.81Å; L109-R113 VanDerWaalsContact O-N 3.09Å; Q110-R113 PolarHBondContact O-N 3.36Å; Q110-R113 VanDerWaalsContact O-N 3.1Å; R113-Q116 PolarHBondContact O-N 2.71Å; R113-K117 WeakPolarHBondContact O-CB 3.47Å; R113-K117 PolarHBondContact O-N 3.05Å
114	E	82.4	Confident	76.2	Confident	109 Å²	109	90.6 Å²	90.6	51%	0.509	44%	0.444	S	S	.	.	H	α-helix	trans	-64.4	-44.9	178	-74.2	170.5	-169.9	0	0	111.6	Q110 K111 Q116 K117 A118	Q110-E114 WeakPolarHBondContact CG-OE1 3.33Å; Q110-E114 PolarHBondContact NE2-OE1 2.76Å; Q110-E114 WeakPolarHBondContact O-CG 3.45Å; Q110-E114 PolarHBondContact O-N 2.86Å; K111-E114 PolarHBondContact O-N 2.95Å; E114-Q116 VanDerWaalsContact C-N 3.33Å; E114-Q116 PolarHBondContact O-N 3.1Å; E114-K117 PolarHBondContact O-N 2.86Å; E114-A118 WeakPolarHBondContact O-CB 2.85Å; E114-A118 PolarHBondContact O-N 2.72Å
115	L	77.8	Confident	74.5	Confident	51 Å²	51	93.3 Å²	93.3	27%	0.267	46%	0.46	S	S	.	.	H	α-helix	trans	-61.6	-40.7	175.3	-71.6	171	0	0	0	111.8	F20 L24 L25 K111 Q112 N119	F20-L115 HydrophobicContact CE1-CD1 3.85Å; F20-L115 HydrophobicContact CZ-CD1 4.46Å; L24-L115 HydrophobicContact CD2-CB 4.1Å; L25-L115 HydrophobicContact CD1-CD1 3.98Å; L25-L115 HydrophobicContact CG-CD1 4.21Å; K111-L115 HydrophobicContact CG-CD1 4.13Å; K111-L115 HydrophobicContact CG-CG 4.49Å; K111-L115 WeakPolarHBondContact O-CB 3.49Å; K111-L115 WeakPolarHBondContact O-CG 3.4Å; K111-L115 PolarHBondContact O-N 2.89Å; Q112-L115 PolarHBondContact O-N 2.75Å; L115-N119 VanDerWaalsContact O-CB 3.26Å; L115-N119 WeakPolarHBondContact O-CB 3.47Å; L115-N119 PolarHBondContact O-N 3.49Å
116	Q	76.1	Confident	72.7	Confident	88 Å²	88	93.1 Å²	93.1	41%	0.411	47%	0.471	S	S	.	.	H	α-helix	trans	-64.7	-43.6	175.4	-74.2	174.3	0.2	0	0	112	L24 Q112 R113 E114 Q120	L24-Q116 HydrophobicContact CD2-CG 4.11Å; Q112-Q116 VanDerWaalsContact O-CG 3.3Å; Q112-Q116 WeakPolarHBondContact O-CG 3.35Å; Q112-Q116 PolarHBondContact O-N 3.36Å; R113-Q116 PolarHBondContact O-N 2.71Å; E114-Q116 VanDerWaalsContact C-N 3.33Å; E114-Q116 PolarHBondContact O-N 3.1Å; Q116-Q120 PolarHBondContact O-N 2.68Å; Q116-Q120 VanDerWaalsContact O-N 3.13Å
117	K	78.9	Confident	71	Confident	128 Å²	128	95.7 Å²	95.7	56%	0.557	48%	0.476	S	S	*	.	H	α-helix	trans	-65.8	-47.6	178.8	-176.4	177.7	171.5	-176.4	0	111.9	R113 E114 N119 Q120 E121	R113-K117 WeakPolarHBondContact O-CB 3.47Å; R113-K117 PolarHBondContact O-N 3.05Å; E114-K117 PolarHBondContact O-N 2.86Å; K117-N119 VanDerWaalsContact C-N 3.31Å; K117-N119 PolarHBondContact O-N 3.39Å; K117-Q120 WeakPolarHBondContact O-CB 3.33Å; K117-Q120 PolarHBondContact O-N 3.39Å; K117-Q120 VanDerWaalsContact O-N 3.09Å; K117-E121 WeakPolarHBondContact CE-OE1 3.42Å; K117-E121 IonicContact NZ-OE1 2.75Å; K117-E121 WeakPolarHBondContact O-CG 3.43Å; K117-E121 PolarHBondContact O-N 3.21Å
118	A	74.2	Confident	68.7	Low	48 Å²	48	98.1 Å²	98.1	40%	0.397	48%	0.482	S	S	.	.	H	α-helix	trans	-62	-38.9	178.4	0	0	0	0	0	112	E114 Q120 E121 Q122	E114-A118 WeakPolarHBondContact O-CB 2.85Å; E114-A118 PolarHBondContact O-N 2.72Å; A118-Q120 VanDerWaalsContact C-N 3.3Å; A118-Q120 PolarHBondContact O-N 2.92Å; A118-E121 PolarHBondContact O-N 3.4Å; A118-Q122 WeakPolarHBondContact O-CG 3.29Å; A118-Q122 PolarHBondContact O-N 2.96Å
119	N	70.3	Confident	66.8	Low	70 Å²	70	108.1 Å²	108.1	37%	0.374	52%	0.517	S	S	.	.	H	α-helix	trans	-63.2	-37.5	174.8	-169.3	-96.7	0	0	0	111.9	L24 L115 K117 Y123	L24-N119 HydrophobicContact CD2-CB 4.18Å; L115-N119 VanDerWaalsContact O-CB 3.26Å; L115-N119 WeakPolarHBondContact O-CB 3.47Å; L115-N119 PolarHBondContact O-N 3.49Å; K117-N119 VanDerWaalsContact C-N 3.31Å; K117-N119 PolarHBondContact O-N 3.39Å; N119-Y123 PolarHBondContact O-N 3.02Å
120	Q	69.8	Low	64.6	Low	147 Å²	147	110.5 Å²	110.5	69%	0.687	55%	0.547	S	S	*	.	H	α-helix	trans	-71.6	-37.7	177.9	-159.9	169.2	19.7	0	0	112.8	Q116 K117 A118 Y123 A124	Q116-Q120 PolarHBondContact O-N 2.68Å; Q116-Q120 VanDerWaalsContact O-N 3.13Å; K117-Q120 WeakPolarHBondContact O-CB 3.33Å; K117-Q120 PolarHBondContact O-N 3.39Å; K117-Q120 VanDerWaalsContact O-N 3.09Å; A118-Q120 VanDerWaalsContact C-N 3.3Å; A118-Q120 PolarHBondContact O-N 2.92Å; Q120-Y123 PolarHBondContact O-N 3.18Å; Q120-A124 PolarHBondContact O-N 3.26Å
121	E	72.3	Confident	62.3	Low	102 Å²	102	111.1 Å²	111.1	48%	0.477	57%	0.566	S	S	.	*	H	α-helix	trans	-69.1	-43.3	177.1	-73.1	172.8	175	0	0	112.3	K117 A118 Y123 A124 E125	K117-E121 WeakPolarHBondContact CE-OE1 3.42Å; K117-E121 IonicContact NZ-OE1 2.75Å; K117-E121 WeakPolarHBondContact O-CG 3.43Å; K117-E121 PolarHBondContact O-N 3.21Å; A118-E121 PolarHBondContact O-N 3.4Å; E121-Y123 PolarHBondContact O-N 3.29Å; E121-A124 WeakPolarHBondContact O-CB 3.31Å; E121-A124 PolarHBondContact O-N 3.29Å; E121-E125 PolarHBondContact O-N 2.97Å
122	Q	63	Low	60	Low	146 Å²	146	112 Å²	112	68%	0.682	59%	0.588	S	S	*	*	H	α-helix	trans	-60.2	-34.7	173.5	-76.2	-165.8	-10.5	0	0	112.4	A118 A124 G126	A118-Q122 WeakPolarHBondContact O-CG 3.29Å; A118-Q122 PolarHBondContact O-N 2.96Å; Q122-A124 VanDerWaalsContact C-N 3.31Å; Q122-A124 PolarHBondContact O-N 3.46Å; Q122-G126 PolarHBondContact O-N 3.02Å
123	Y	53.4	Low	57.7	Low	186 Å²	186	116.7 Å²	116.7	73%	0.729	62%	0.621	S	S	*	*	H	α-helix	trans	-68.6	-30.3	175.8	-144.8	-91.5	0	0	0	112.5	N119 Q120 E121	N119-Y123 PolarHBondContact O-N 3.02Å; Q120-Y123 PolarHBondContact O-N 3.18Å; E121-Y123 PolarHBondContact O-N 3.29Å
124	A	56.2	Low	55.4	Low	59 Å²	59	114 Å²	114	49%	0.488	64%	0.636	S	S	.	*	H	α-helix	trans	-78.3	-42.5	176.8	0	0	0	0	0	112.7	Q120 E121 Q122 G126 K127	Q120-A124 PolarHBondContact O-N 3.26Å; E121-A124 WeakPolarHBondContact O-CB 3.31Å; E121-A124 PolarHBondContact O-N 3.29Å; Q122-A124 VanDerWaalsContact C-N 3.31Å; Q122-A124 PolarHBondContact O-N 3.46Å; A124-G126 VanDerWaalsContact C-N 3.35Å; A124-G126 PolarHBondContact O-N 3.14Å; A124-K127 WeakPolarHBondContact O-CB 3.44Å; A124-K127 PolarHBondContact O-N 3.22Å; A124-K127 VanDerWaalsContact O-N 3.13Å
125	E	50.6	Low	52.9	Low	143 Å²	143	119 Å²	119	67%	0.668	66%	0.656	S	S	*	*	H	α-helix	trans	-66	-35.2	178.7	-72.9	-171.9	158	0	0	112.8	E121 K127 M128	E121-E125 PolarHBondContact O-N 2.97Å; E125-K127 PolarHBondContact O-N 3.13Å; E125-K127 VanDerWaalsContact O-N 3.14Å; E125-M128 PolarHBondContact O-N 3.5Å; E125-M128 VanDerWaalsContact O-N 3.09Å
126	G	49.4	Very low	50.6	Low	61 Å²	61	126.5 Å²	126.5	63%	0.629	69%	0.686	S	S	*	*	H	α-helix	trans	-60.6	-20.7	173.8	0	0	0	0	0	113.9	Q122 A124	Q122-G126 PolarHBondContact O-N 3.02Å; A124-G126 VanDerWaalsContact C-N 3.35Å; A124-G126 PolarHBondContact O-N 3.14Å
127	K	41.9	Very low	48.3	Very low	182 Å²	182	128.7 Å²	128.7	79%	0.791	71%	0.706	S	S	*	*	H	α-helix	trans	-82.2	-21.4	177.7	-146.1	177.7	-177	-177.2	0	112.8	A124 E125	A124-K127 WeakPolarHBondContact O-CB 3.44Å; A124-K127 PolarHBondContact O-N 3.22Å; A124-K127 VanDerWaalsContact O-N 3.13Å; E125-K127 PolarHBondContact O-N 3.13Å; E125-K127 VanDerWaalsContact O-N 3.14Å
128	M	39.5	Very low	45.9	Very low	163 Å²	163	128.8 Å²	128.8	80%	0.803	72%	0.723	S	S	*	*	H	α-helix	trans	-93.7	-11	-173.5	-67.8	-67.6	-82.6	0	0	114.6	E125 G130	E125-M128 PolarHBondContact O-N 3.5Å; E125-M128 VanDerWaalsContact O-N 3.09Å; M128-G130 VanDerWaalsContact C-N 3.34Å
129	R	43.9	Very low	43.5	Very low	241 Å²	241	129.6 Å²	129.6	91%	0.909	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	3.1	176.2	-84.7	-179	161.7	-176.3	-3.9	114.8
130	G	34.4	Very low	41.4	Very low	74 Å²	74	133.8 Å²	133.8	76%	0.763	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	0.3	-176.3	0	0	0	0	0	116.9	M128	M128-G130 VanDerWaalsContact C-N 3.34Å
131	A	33	Very low	39.3	Very low	90 Å²	90	134.3 Å²	134.3	74%	0.744	76%	0.76	S	S	*	*			trans	-107.6	97.1	179.5	0	0	0	0	0	111
132	A	30.5	Very low	37.1	Very low	97 Å²	97	137.6 Å²	137.6	80%	0.802	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-80.9	131.6	169.4	0	0	0	0	0	110.4
133	P	36.8	Very low	35.4	Very low	128 Å²	128	140.7 Å²	140.7	83%	0.831	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-76.8	134.2	169	29.8	-30.1	0	0	0	110.5
134	G	30	Very low	34	Very low	81 Å²	81	139.1 Å²	139.1	84%	0.835	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-65.1	139	-173.9	0	0	0	0	0	114.5
135	K	30.1	Very low	32.6	Very low	213 Å²	213	143.3 Å²	143.3	93%	0.926	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-90.9	117.1	171.1	-122.2	175.8	-179.1	177.5	0	109.1
136	K	28.1	Very low	31.4	Very low	210 Å²	210	143.8 Å²	143.8	91%	0.913	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-89.9	148.2	158.2	-81.3	-171.3	178.4	-179.1	0	110.1
137	T	28.3	Very low	30.2	Very low	133 Å²	133	145.9 Å²	145.9	82%	0.816	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-80.1	149.2	-174.7	48.4	0	0	0	0	114.1
138	S	28.2	Very low	29.5	Very low	130 Å²	130	145.2 Å²	145.2	91%	0.909	81%	0.809	S	S	*	*			trans	134.2	134.9	153.5	68.8	0	0	0	0	109.1
139	G	24.4	Very low	28.8	Very low	65 Å²	65	143.3 Å²	143.3	67%	0.67	81%	0.807	S	S	*	*			cis	171.4	155.4	2.6	0	0	0	0	0	107.1
140	L	25.1	Very low	28	Very low	158 Å²	158	141.5 Å²	141.5	83%	0.827	81%	0.806	S	S	*	*			trans	63.5	137.2	158	-77.8	96	0	0	0	123.5
141	Q	25.4	Very low	27.7	Very low	158 Å²	158	147.4 Å²	147.4	74%	0.738	81%	0.811	S	S	*	*			trans	91.4	99.6	139.4	-89.8	171	-6.3	0	0	121.5
142	Q	27.8	Very low	27.3	Very low	172 Å²	172	151 Å²	151	80%	0.804	82%	0.817	S	S	*	*				29.4	122.4	119.6	-68.9	176.9	-19.8	0	0	118.4
143	K	26.4	Very low	27.1	Very low	210 Å²	210	154.4 Å²	154.4	91%	0.913	81%	0.814	S	S	*	*				-167.3	131.4	112.6	-110.4	173.7	-179.3	177.9	0	113.2
144	N	23.6	Very low	26.7	Very low	154 Å²	154	156.7 Å²	156.7	82%	0.824	81%	0.814	S	S	*	*			trans	-52	137.3	158.6	-118.9	-1.9	0	0	0	111
145	V	28.2	Very low	26.7	Very low	146 Å²	146	161.3 Å²	161.3	89%	0.885	81%	0.811	S	S	*	*			trans	-141.5	127	140.2	-174	0	0	0	0	108.7
146	E	23.6	Very low	26.8	Very low	154 Å²	154	157.1 Å²	157.1	72%	0.72	80%	0.803	S	S	*	*			trans	-79.5	172.1	-178.7	-170.9	-172	154.1	0	0	111.7
147	V	25.7	Very low	27.2	Very low	105 Å²	105	153.4 Å²	153.4	64%	0.636	80%	0.8	S	S	*	*			trans	119	96.8	145.4	-174.8	0	0	0	0	118
148	K	25.7	Very low	27.1	Very low	167 Å²	167	150.9 Å²	150.9	73%	0.726	80%	0.8	S	S	*	*				72.1	111.1	124	-61.2	178	-166.4	169.5	0	122.8
149	T	25.5	Very low	27.1	Very low	123 Å²	123	153.3 Å²	153.3	76%	0.755	80%	0.803	S	S	*	*				43.3	124.8	111.4	-12.5	0	0	0	0	120
150	K	27.7	Very low	27.2	Very low	204 Å²	204	154 Å²	154	89%	0.887	81%	0.81	S	S	*	*				-172.8	126.3	110.8	-101.1	170.7	-177.2	-179.8	0	114
151	K	26.7	Very low	27.3	Very low	198 Å²	198	154.7 Å²	154.7	86%	0.861	82%	0.815	S	S	*	*			trans	-51.7	151.2	155	-91.6	172	165.9	171.7	0	111.4
152	N	24.6	Very low	27.4	Very low	165 Å²	165	150.5 Å²	150.5	88%	0.882	81%	0.814	S	S	*	*				-158.9	151.5	111.2	-144.1	6.2	0	0	0	114.3
153	K	28.3	Very low	27.2	Very low	168 Å²	168	146.1 Å²	146.1	73%	0.73	82%	0.815	S	S	*	*			trans	-132.2	138.8	-172.5	166.3	-173.4	-178.4	176.7	0	107.4
154	Q	28.4	Very low	27.3	Very low	177 Å²	177	141.2 Å²	141.2	83%	0.827	81%	0.807	S	S	*	*			trans	165.1	120.9	143.1	-97.7	171.3	-7.5	0	0	109.3
155	K	29.4	Very low	27.5	Very low	178 Å²	178	140.1 Å²	140.1	77%	0.774	81%	0.806	S	S	*	*				73.8	107.3	79.1	-83.6	-166.3	171.5	-170.9	0	115.3
156	T	30.8	Very low	27.7	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	80%	0.8	S	S	*	*			trans	5.6	157.1	132.3	55.8	0	0	0	0	119.1
157	P	38.4	Very low	27.9	Very low	131 Å²	131	139.7 Å²	139.7	85%	0.851	81%	0.807	S	S	*	*			cis	-156.1	-178.6	47.7	40	-16.8	0	0	0	118.3
158	G	25.5	Very low	28.2	Very low	80 Å²	80	141.5 Å²	141.5	83%	0.825	82%	0.818	S	S	*	*			trans	154.9	122.9	155.5	0	0	0	0	0	118
159	N	26.9	Very low	28.5	Very low	181 Å²	181	139.6 Å²	139.6	97%	0.968	82%	0.822	S	S	*	*			trans	-71.1	164.1	-179.4	-103.5	11.2	0	0	0	116
160	G	27.1	Very low	28.9	Very low	79 Å²	79	142.7 Å²	142.7	81%	0.814	83%	0.828	S	S	*	*			trans	169.9	127.1	155.9	0	0	0	0	0	116.5
161	D	27.3	Very low	29.3	Very low	174 Å²	174	138.5 Å²	138.5	93%	0.93	82%	0.822	S	S	*	*			trans	-79.7	166.2	-165	-155.7	4.5	0	0	0	117.7
162	G	27.1	Very low	29.8	Very low	69 Å²	69	135.1 Å²	135.1	71%	0.711	82%	0.82	S	S	*	*			trans	100.5	103	140.3	0	0	0	0	0	123.3
163	G	24.4	Very low	30.2	Very low	80 Å²	80	138.7 Å²	138.7	83%	0.825	82%	0.822	S	S	*	*				87	103.4	117.2	0	0	0	0	0	124.8
164	S	29.1	Very low	30.8	Very low	107 Å²	107	140.5 Å²	140.5	75%	0.748	83%	0.829	S	S	*	*				85.7	125.9	124.9	-138.7	0	0	0	0	126
165	T	28.2	Very low	31.1	Very low	131 Å²	131	142 Å²	142	80%	0.804	83%	0.833	S	S	*	*			trans	68.5	136.7	148.6	53.3	0	0	0	0	120.1
166	S	30.5	Very low	31.5	Very low	109 Å²	109	145 Å²	145	76%	0.762	84%	0.84	S	S	*	*			cis	-162.8	144	28.2	45.4	0	0	0	0	114
167	E	29	Very low	31.8	Very low	183 Å²	183	143 Å²	143	86%	0.855	84%	0.836	S	S	*	*			trans	40.8	120.3	141.2	-54.6	-165.1	132.2	0	0	125.5
168	T	31.2	Very low	31.8	Very low	143 Å²	143	148.4 Å²	148.4	88%	0.877	84%	0.839	S	S	*	*				-176	154.8	109.4	27.9	0	0	0	0	111.6
169	P	33.1	Very low	32.6	Very low	126 Å²	126	150.3 Å²	150.3	82%	0.818	84%	0.835	S	S	*	*			trans	-103.8	142.9	-152	32.2	-21.8	0	0	0	116.1
170	Q	33.2	Very low	33	Very low	188 Å²	188	146.7 Å²	146.7	88%	0.879	82%	0.815	S	S	*	*			trans	-124.7	145.5	167.5	-77	-166.9	0	0	0	112
171	P	36.3	Very low	33.7	Very low	117 Å²	117	148.5 Å²	148.5	76%	0.76	81%	0.813	S	S	*	*			trans	-73.9	155.9	-170.8	30.1	-34.5	0	0	0	113.6	R173	P171-R173 PolarHBondContact O-N 3.09Å
172	P	37	Very low	35	Very low	126 Å²	126	145.5 Å²	145.5	82%	0.818	80%	0.801	S	S	*	*			trans	-78.8	119.1	-160.8	29.9	-32.9	0	0	0	112.5	K174	P172-K174 PolarHBondContact O-N 3.33Å; P172-K174 VanDerWaalsContact O-N 3.14Å
173	R	33.8	Very low	35.9	Very low	241 Å²	241	148 Å²	148	91%	0.909	80%	0.802	S	S	*	*			trans	-57.7	112.5	161.2	-84.2	177.4	164.7	176.2	-4	109	P171 K175	P171-R173 PolarHBondContact O-N 3.09Å; R173-K175 PolarHBondContact O-N 2.7Å
174	K	39.9	Very low	36.6	Very low	206 Å²	206	150.4 Å²	150.4	90%	0.896	79%	0.792	S	S	*	*			trans	-54.9	109.3	166.7	-76.7	179.8	177.7	176.1	0	108.6	P172 R176	P172-K174 PolarHBondContact O-N 3.33Å; P172-K174 VanDerWaalsContact O-N 3.14Å; K174-R176 PolarHBondContact O-N 3.41Å
175	K	34	Very low	37.4	Very low	207 Å²	207	150 Å²	150	90%	0.9	78%	0.781	S	S	*	*			trans	-53	107.9	163.8	-78.6	178.7	175.5	176.2	0	107.3	R173 A177	R173-K175 PolarHBondContact O-N 2.7Å; K175-A177 PolarHBondContact O-N 3.39Å; K175-A177 VanDerWaalsContact O-N 3.12Å
176	R	39.7	Very low	38.4	Very low	243 Å²	243	148.7 Å²	148.7	92%	0.917	77%	0.766	S	S	*	*			trans	-58.2	116.8	161.4	-85.8	-179.6	166.8	-176.9	-4.4	105.9	K174 R178	K174-R176 PolarHBondContact O-N 3.41Å; R176-R178 PolarHBondContact O-N 3.31Å
177	A	35.3	Very low	39.1	Very low	83 Å²	83	148.8 Å²	148.8	69%	0.686	75%	0.754	S	S	*	*			trans	-50.1	127.1	169.6	0	0	0	0	0	107.7	K175 V179	K175-A177 PolarHBondContact O-N 3.39Å; K175-A177 VanDerWaalsContact O-N 3.12Å; A177-V179 PolarHBondContact O-N 3.21Å
178	R	40.2	Very low	40	Very low	243 Å²	243	144 Å²	144	92%	0.917	74%	0.738	S	S	*	*			trans	-58.9	102.1	171	-175.7	178.3	-176.3	174.8	-0.1	106.1	R176 D180	R176-R178 PolarHBondContact O-N 3.31Å; R178-D180 PolarHBondContact O-N 3.07Å
179	V	42.3	Very low	40.8	Very low	121 Å²	121	141 Å²	141	73%	0.733	71%	0.713	S	S	*	*			trans	-66.5	127.8	172.3	-174.9	0	0	0	0	106.3	A177	A177-V179 PolarHBondContact O-N 3.21Å
180	D	34.6	Very low	41.3	Very low	104 Å²	104	137.3 Å²	137.3	56%	0.556	69%	0.685	S	S	*	*			trans	-52	130.3	174.5	-144.1	-62.1	0	0	0	109.4	R178 T182	R178-D180 PolarHBondContact O-N 3.07Å; D180-T182 PolarHBondContact O-N 2.86Å; D180-T182 PolarHBondContact OD1-OG1 3.14Å
181	P	42.3	Very low	41.9	Very low	118 Å²	118	133.8 Å²	133.8	77%	0.766	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	3.1	-176.2	-14.5	28.7	0	0	0	114.4
182	T	53.9	Low	42.8	Very low	110 Å²	110	132.1 Å²	132.1	68%	0.675	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-5.6	-168.7	43.8	0	0	0	0	114.3	D180	D180-T182 PolarHBondContact O-N 2.86Å; D180-T182 PolarHBondContact OD1-OG1 3.14Å
183	V	45.4	Very low	43.8	Very low	122 Å²	122	132.3 Å²	132.3	74%	0.739	65%	0.649	S	S	*	*			trans	-111.5	90.1	176.6	-171.5	0	0	0	0	109.5
184	E	40.7	Very low	45.4	Very low	130 Å²	130	127 Å²	127	61%	0.607	64%	0.635	S	S	*	*			trans	-68	142.6	171.5	-64.8	-171.1	149	0	0	110.9	R192	E184-R192 IonicContact OE2-NH2 2.69Å
185	N	45.9	Very low	47.2	Very low	99 Å²	99	118 Å²	118	53%	0.529	60%	0.598	S	S	.	*			trans	-62	132.8	180	-173.4	37.9	0	0	0	111.4	E187 T188 F189	N185-E187 PolarHBondContact O-N 3.07Å; N185-E187 VanDerWaalsContact O-N 3.09Å; N185-T188 WeakPolarHBondContact O-CB 3.11Å; N185-T188 PolarHBondContact O-N 3.26Å; N185-T188 PolarHBondContact O-OG1 2.55Å; N185-F189 PolarHBondContact O-N 2.88Å
186	E	48	Very low	49.4	Very low	104 Å²	104	115.9 Å²	115.9	49%	0.486	59%	0.588	S	S	.	*	H	α-helix	trans	-57	-27.3	-174.3	-161.7	179.6	-158.3	0	0	113.4	S99 F189 M190	S99-E186 PolarHBondContact OG-OE2 2.91Å; E186-F189 WeakPolarHBondContact O-CB 3.14Å; E186-F189 PolarHBondContact O-N 3.15Å; E186-M190 PolarHBondContact O-N 3.14Å
187	E	44.4	Very low	51.8	Low	110 Å²	110	105.1 Å²	105.1	51%	0.514	55%	0.549	S	S	.	.	H	α-helix	trans	-71.2	-32.5	173.2	-79	-179.9	138.9	0	0	113.6	N185 F189 N191	N185-E187 PolarHBondContact O-N 3.07Å; N185-E187 VanDerWaalsContact O-N 3.09Å; E187-F189 VanDerWaalsContact C-N 3.26Å; E187-N191 PolarHBondContact O-N 2.97Å
188	T	48.8	Very low	54.4	Low	84 Å²	84	108.3 Å²	108.3	52%	0.515	55%	0.548	S	S	.	.	H	α-helix	trans	-72.3	-26.6	175.5	-36.5	0	0	0	0	110.8	N185	N185-T188 WeakPolarHBondContact O-CB 3.11Å; N185-T188 PolarHBondContact O-N 3.26Å; N185-T188 PolarHBondContact O-OG1 2.55Å
189	F	47.2	Very low	56.9	Low	80 Å²	80	98.1 Å²	98.1	35%	0.351	51%	0.511	S	S	.	.	H	α-helix	trans	-72.6	-37.1	177.1	-170.8	-101.4	0	0	0	112.7	N185 E186 E187 Y315	N185-F189 PolarHBondContact O-N 2.88Å; E186-F189 WeakPolarHBondContact O-CB 3.14Å; E186-F189 PolarHBondContact O-N 3.15Å; E187-F189 VanDerWaalsContact C-N 3.26Å; F189-Y315 HydrophobicContact CD1-CD1 4.12Å; F189-Y315 AromaticContact CE1-CD1 3.54Å; F189-Y315 HydrophobicContact CE1-CD1 3.54Å; F189-Y315 HydrophobicContact CE1-CE1 4.26Å; F189-Y315 HydrophobicContact CE1-CG 4.44Å; F189-Y315 AromaticContact CZ-CD1 3.94Å; F189-Y315 HydrophobicContact CZ-CD1 3.94Å
190	M	44.5	Very low	59.4	Low	48 Å²	48	93.3 Å²	93.3	24%	0.236	48%	0.482	C	S	.	.	H	α-helix	trans	-79.7	-19.7	179	-70.4	-90.4	-76.8	0	0	113.9	R100 E186 R192	R100-M190 HydrophobicContact CG-CE 4.48Å; E186-M190 PolarHBondContact O-N 3.14Å; M190-R192 VanDerWaalsContact C-N 3.33Å
191	N	45.3	Very low	62	Low	114 Å²	114	94.3 Å²	94.3	61%	0.61	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	9.9	178.9	-84.6	-23.1	0	0	0	113.9	E187 V193	E187-N191 PolarHBondContact O-N 2.97Å; N191-V193 PolarHBondContact O-N 2.81Å
192	R	56.3	Low	64.4	Low	81 Å²	81	94.4 Å²	94.4	31%	0.306	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-65.7	125	175.6	-72.5	-176.6	-179.1	179.6	3.7	109.4	E184 M190 E194 A314	E184-R192 IonicContact OE2-NH2 2.69Å; M190-R192 VanDerWaalsContact C-N 3.33Å; R192-E194 PolarHBondContact O-N 3.25Å; R192-A314 HydrophobicContact CB-CB 4.06Å; R192-A314 WeakPolarHBondContact CD-O 3.03Å; R192-A314 PolarHBondContact NH1-O 2.96Å
193	V	58.2	Low	66.3	Low	130 Å²	130	89.1 Å²	89.1	79%	0.788	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-52.9	121.4	178.1	177.3	0	0	0	0	108.5	N191 V195	N191-V193 PolarHBondContact O-N 2.81Å; V193-V195 PolarHBondContact O-N 2.94Å; V193-V195 VanDerWaalsContact O-N 3.14Å
194	E	66.8	Low	68.6	Low	131 Å²	131	87.4 Å²	87.4	61%	0.612	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-51.9	122	175.8	-176.7	-179.5	-172.1	0	0	109.3	R192 K196	R192-E194 PolarHBondContact O-N 3.25Å; E194-K196 PolarHBondContact O-N 3.46Å
195	V	78.3	Confident	71	Confident	17 Å²	17	84.5 Å²	84.5	10%	0.103	42%	0.417	C	S	.	.			trans	-74.5	106.3	-177.4	-179.1	0	0	0	0	108	V193 V197 G310 L313 L323 L327	V193-V195 PolarHBondContact O-N 2.94Å; V193-V195 VanDerWaalsContact O-N 3.14Å; V195-V197 PolarHBondContact O-N 3.1Å; V195-G310 PolarHBondContact N-O 3.29Å; V195-G310 CarbonylContact O-C 3.41Å; V195-G310 WeakPolarHBondContact O-CA 3.45Å; V195-L313 HydrophobicContact CB-CB 4.07Å; V195-L313 HydrophobicContact CG1-CB 4.46Å; V195-L313 HydrophobicContact CG1-CD1 4.31Å; V195-L313 HydrophobicContact CG2-CB 4.08Å; V195-L323 HydrophobicContact CG1-CD1 4.11Å; V195-L323 HydrophobicContact CG2-CD1 4.25Å; V195-L323 HydrophobicContact CG2-CD2 4.11Å; V195-L327 HydrophobicContact CG1-CD1 3.83Å; V195-L327 HydrophobicContact CG1-CD2 3.73Å; V195-L327 HydrophobicContact CG1-CG 4.17Å
196	K	79.9	Confident	73.3	Confident	161 Å²	161	83.4 Å²	83.4	70%	0.7	41%	0.405	S	S	*	.			trans	-77	99.1	-176.8	-168.4	170.9	-175	171	0	112.1	E194	E194-K196 PolarHBondContact O-N 3.46Å
197	V	89.1	Confident	75.4	Confident	17 Å²	17	80 Å²	80	10%	0.103	39%	0.39	C	S	.	.			trans	-70.5	126.9	166	-177.6	0	0	0	0	109	V195 F306 I309 L313 L327 L334	V195-V197 PolarHBondContact O-N 3.1Å; V197-F306 HydrophobicContact CG1-CD1 4.47Å; V197-I309 HydrophobicContact CG2-CG2 3.96Å; V197-L313 HydrophobicContact CG2-CD1 4.38Å; V197-L327 HydrophobicContact CG2-CD2 4.1Å; V197-L334 HydrophobicContact CG1-CD1 3.71Å
198	K	91.1	Very high	77.7	Confident	150 Å²	150	78.8 Å²	78.8	65%	0.652	39%	0.39	S	S	*	.			trans	-91.3	110.1	-178.8	-69.1	-177.5	-179.1	177.4	0	109.8	H331	K198-H331 PolarHBondContact N-NE2 2.99Å
199	I	92.5	Very high	79.8	Confident	29 Å²	29	78.6 Å²	78.6	15%	0.149	39%	0.386	C	S	.	.			trans	-73.7	127.6	171.8	-52.7	-57	0	0	0	109.5	L203 K204 L207 F306 V307 L334	I199-L203 HydrophobicContact CG2-CB 4.05Å; I199-K204 HydrophobicContact CG2-CG 4.24Å; I199-K204 WeakPolarHBondContact O-CE 3.49Å; I199-L207 HydrophobicContact CG2-CD1 4.13Å; I199-F306 HydrophobicContact CD1-CB 3.69Å; I199-V307 HydrophobicContact CD1-CG2 4.39Å; I199-V307 HydrophobicContact CG1-CG2 4.4Å; I199-L334 HydrophobicContact CD1-CD1 4.09Å; I199-L334 HydrophobicContact CD1-CD2 4.18Å
200	P	93.8	Very high	82	Confident	20 Å²	20	75.1 Å²	75.1	13%	0.13	37%	0.371	C	S	.	.			trans	-53.3	144.3	172.6	-24.9	32.8	0	0	0	112.2	E202 L203 L334 A338	P200-E202 WeakPolarHBondContact CB-OE2 3.45Å; P200-E202 PolarHBondContact O-N 3.23Å; P200-L203 HydrophobicContact CB-CD1 4.44Å; P200-L203 HydrophobicContact CB-CG 4.41Å; P200-L203 HydrophobicContact CG-CD1 4.11Å; P200-L203 PolarHBondContact O-N 3.3Å; P200-L203 VanDerWaalsContact O-N 3.14Å; P200-L334 HydrophobicContact CG-CB 3.85Å; P200-A338 HydrophobicContact CB-CB 4.25Å; P200-A338 HydrophobicContact CG-CB 4.47Å
201	E	90	Very high	84.4	Confident	126 Å²	126	77.5 Å²	77.5	59%	0.589	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-62.2	-32.8	-176.3	-165.1	64.5	-148	0	0	111.5	L203 K204 P205	E201-L203 PolarHBondContact O-N 2.83Å; E201-K204 PolarHBondContact O-N 3.34Å; E201-K204 IonicContact OE1-NZ 3.44Å; E201-K204 WeakPolarHBondContact OE2-CE 3.32Å; E201-K204 IonicContact OE2-NZ 2.7Å; E201-K204 PolarHBondContact OE2-NZ 3.05Å; E201-P205 WeakPolarHBondContact O-CD 3.48Å
202	E	93.3	Very high	86.7	Confident	119 Å²	119	72.8 Å²	72.8	56%	0.556	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-65.8	-24.7	-179.7	-53	81.4	-179.4	0	0	112.7	P200 A338	P200-E202 WeakPolarHBondContact CB-OE2 3.45Å; P200-E202 PolarHBondContact O-N 3.23Å; E202-A338 HydrophobicContact CB-CB 4.44Å
203	L	93.2	Very high	88.5	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-94.5	-11.5	-179.2	-65.8	-178.6	0	0	0	113.1	I199 P200 E201 W206 L207 L303 L334 L337 A338 F345	I199-L203 HydrophobicContact CG2-CB 4.05Å; P200-L203 HydrophobicContact CB-CD1 4.44Å; P200-L203 HydrophobicContact CB-CG 4.41Å; P200-L203 HydrophobicContact CG-CD1 4.11Å; P200-L203 PolarHBondContact O-N 3.3Å; P200-L203 VanDerWaalsContact O-N 3.14Å; E201-L203 PolarHBondContact O-N 2.83Å; L203-W206 PolarHBondContact O-N 2.9Å; L203-L207 PolarHBondContact O-N 2.95Å; L203-L303 HydrophobicContact CB-CD1 4.32Å; L203-L303 HydrophobicContact CB-CD2 4.13Å; L203-L303 HydrophobicContact CD1-CD1 3.79Å; L203-L303 HydrophobicContact CD2-CD2 4.46Å; L203-L334 HydrophobicContact CD1-CD2 4.32Å; L203-L337 HydrophobicContact CD1-CB 4.03Å; L203-A338 HydrophobicContact CD1-CB 4.11Å; L203-A338 HydrophobicContact CD2-CB 4.28Å; L203-A338 HydrophobicContact CG-CB 3.96Å; L203-F345 HydrophobicContact CD2-CD2 4.25Å; L203-F345 HydrophobicContact CD2-CE2 3.61Å; L203-F345 HydrophobicContact CD2-CZ 4.23Å
204	K	92.7	Very high	90.2	Very high	85 Å²	85	63.5 Å²	63.5	37%	0.37	30%	0.304	S	S	.	.	H	α-helix	trans	-68.8	-42.9	179.4	-65.8	177.3	-172.7	168.7	0	113.1	I199 E201 W206 L207 V208	I199-K204 HydrophobicContact CG2-CG 4.24Å; I199-K204 WeakPolarHBondContact O-CE 3.49Å; E201-K204 PolarHBondContact O-N 3.34Å; E201-K204 IonicContact OE1-NZ 3.44Å; E201-K204 WeakPolarHBondContact OE2-CE 3.32Å; E201-K204 IonicContact OE2-NZ 2.7Å; E201-K204 PolarHBondContact OE2-NZ 3.05Å; K204-W206 VanDerWaalsContact C-N 3.26Å; K204-W206 PolarHBondContact O-N 3.39Å; K204-L207 PolarHBondContact O-N 3.18Å; K204-V208 PolarHBondContact O-N 3.48Å; K204-V208 VanDerWaalsContact O-N 3.17Å
205	P	92.2	Very high	91.4	Very high	70 Å²	70	59 Å²	59	46%	0.455	29%	0.285	S	S	.	.	H	α-helix	trans	-55.9	-44	173.3	-26.4	35.2	0	0	0	111.6	E201 L207 V208 D209	E201-P205 WeakPolarHBondContact O-CD 3.48Å; P205-L207 VanDerWaalsContact C-N 3.32Å; P205-L207 PolarHBondContact O-N 3.04Å; P205-V208 WeakPolarHBondContact O-CA 3.47Å; P205-V208 WeakPolarHBondContact O-CB 2.97Å; P205-V208 PolarHBondContact O-N 3.4Å; P205-D209 PolarHBondContact O-N 2.87Å
206	W	92.9	Very high	91.9	Very high	75 Å²	75	65 Å²	65	28%	0.284	31%	0.306	S	S	.	.	H	α-helix	trans	-58.5	-38.6	176.6	-75.8	112.2	0	0	0	113.8	L203 K204 V208 D209 D210 F345	L203-W206 PolarHBondContact O-N 2.9Å; K204-W206 VanDerWaalsContact C-N 3.26Å; K204-W206 PolarHBondContact O-N 3.39Å; W206-V208 VanDerWaalsContact C-N 3.33Å; W206-D209 PolarHBondContact O-N 3.22Å; W206-D210 WeakPolarHBondContact O-CB 3.33Å; W206-D210 PolarHBondContact O-N 3.48Å; W206-F345 HydrophobicContact CD2-CB 3.52Å; W206-F345 HydrophobicContact CD2-CG 4.14Å; W206-F345 HydrophobicContact CE3-CB 3.54Å; W206-F345 HydrophobicContact CE3-CG 4.43Å; W206-F345 HydrophobicContact CG-CB 4.15Å; W206-F345 HydrophobicContact CG-CD2 4.42Å; W206-F345 HydrophobicContact CG-CG 4.25Å; W206-F345 HydrophobicContact CH2-CB 3.89Å; W206-F345 WeakPolarHBondContact CH2-O 3.45Å; W206-F345 HydrophobicContact CZ2-CB 3.88Å; W206-F345 WeakPolarHBondContact CZ2-O 3.26Å; W206-F345 HydrophobicContact CZ3-CB 3.72Å
207	L	93.1	Very high	92.5	Very high	33 Å²	33	61.6 Å²	61.6	17%	0.173	29%	0.293	C	S	.	.	H	α-helix	trans	-66.4	-35	174.4	-76.8	168.9	0	0	0	112.7	I199 L203 K204 P205 W211 L303 R304 V307	I199-L207 HydrophobicContact CG2-CD1 4.13Å; L203-L207 PolarHBondContact O-N 2.95Å; K204-L207 PolarHBondContact O-N 3.18Å; P205-L207 VanDerWaalsContact C-N 3.32Å; P205-L207 PolarHBondContact O-N 3.04Å; L207-W211 WeakPolarHBondContact O-CB 3.32Å; L207-W211 PolarHBondContact O-N 2.84Å; L207-W211 VanDerWaalsContact O-N 3.12Å; L207-L303 HydrophobicContact CD2-CD2 4.03Å; L207-L303 HydrophobicContact CD2-CG 3.92Å; L207-L303 HydrophobicContact CG-CD2 3.9Å; L207-L303 HydrophobicContact CG-CG 4.16Å; L207-R304 HydrophobicContact CD2-CG 4.39Å; L207-V307 HydrophobicContact CD1-CG2 3.7Å; L207-V307 HydrophobicContact CD2-CG2 4.12Å
208	V	93.5	Very high	92.8	Very high	84 Å²	84	64.5 Å²	64.5	51%	0.509	30%	0.304	S	S	.	.	H	α-helix	trans	-70.8	-44.1	176.5	177	0	0	0	0	110.1	K204 P205 W206 W211 D212	K204-V208 PolarHBondContact O-N 3.48Å; K204-V208 VanDerWaalsContact O-N 3.17Å; P205-V208 WeakPolarHBondContact O-CA 3.47Å; P205-V208 WeakPolarHBondContact O-CB 2.97Å; P205-V208 PolarHBondContact O-N 3.4Å; W206-V208 VanDerWaalsContact C-N 3.33Å; V208-W211 PolarHBondContact O-N 3.22Å; V208-D212 WeakPolarHBondContact O-CB 3.42Å; V208-D212 PolarHBondContact O-N 3.45Å
209	D	91.8	Very high	93.1	Very high	80 Å²	80	58.9 Å²	58.9	43%	0.428	28%	0.28	S	S	.	.	H	α-helix	trans	-65.8	-44.5	178.7	-66.1	-21.6	0	0	0	111.3	P205 W206 W211 D212 L213	P205-D209 PolarHBondContact O-N 2.87Å; W206-D209 PolarHBondContact O-N 3.22Å; D209-W211 PolarHBondContact O-N 3.43Å; D209-D212 WeakPolarHBondContact O-CB 3.44Å; D209-D212 PolarHBondContact O-N 3.17Å; D209-D212 VanDerWaalsContact O-N 3.11Å; D209-L213 WeakPolarHBondContact O-CB 3.43Å; D209-L213 VanDerWaalsContact O-CG 3.23Å; D209-L213 WeakPolarHBondContact O-CG 3.42Å; D209-L213 PolarHBondContact O-N 2.94Å
210	D	94.4	Very high	93.3	Very high	8 Å²	8	58.1 Å²	58.1	4%	0.043	28%	0.277	C	S	.	.	H	α-helix	trans	-56.4	-48.3	173.1	167.5	65.9	0	0	0	111.8	W206 D212 L213 I214 R304 Y350	W206-D210 WeakPolarHBondContact O-CB 3.33Å; W206-D210 PolarHBondContact O-N 3.48Å; D210-D212 VanDerWaalsContact C-N 3.29Å; D210-D212 PolarHBondContact O-N 3.33Å; D210-L213 PolarHBondContact O-N 3.48Å; D210-I214 WeakPolarHBondContact O-CG1 3.19Å; D210-I214 PolarHBondContact O-N 3.33Å; D210-I214 VanDerWaalsContact O-N 3.14Å; D210-R304 VanDerWaalsContact CG-NH2 3.31Å; D210-R304 IonicContact OD1-CZ 3.71Å; D210-R304 IonicContact OD1-NE 3.12Å; D210-R304 IonicContact OD1-NH2 3.02Å; D210-R304 PolarHBondContact OD1-NH2 3.29Å; D210-R304 IonicContact OD2-CZ 3.15Å; D210-R304 VanDerWaalsContact OD2-CZ 3.27Å; D210-R304 IonicContact OD2-NE 2.72Å; D210-R304 PolarHBondContact OD2-NE 3.11Å; D210-R304 IonicContact OD2-NH2 3.03Å; D210-R304 PolarHBondContact OD2-NH2 3.22Å; D210-R304 VanDerWaalsContact OD2-NH2 3.12Å; D210-Y350 PolarHBondContact OD1-OH 3.26Å
211	W	94.6	Very high	93.5	Very high	98 Å²	98	57.8 Å²	57.8	37%	0.371	27%	0.273	S	S	.	.	H	α-helix	trans	-59	-42.2	174.5	173.9	81.7	0	0	0	111.8	F74 L207 V208 D209 T215 Y274	F74-W211 HydrophobicContact CE1-CH2 4.25Å; F74-W211 HydrophobicContact CE2-CH2 4.49Å; F74-W211 AromaticContact CZ-CH2 3.95Å; F74-W211 HydrophobicContact CZ-CH2 3.95Å; F74-W211 AromaticContact CZ-CZ3 3.95Å; F74-W211 HydrophobicContact CZ-CZ3 3.95Å; L207-W211 WeakPolarHBondContact O-CB 3.32Å; L207-W211 PolarHBondContact O-N 2.84Å; L207-W211 VanDerWaalsContact O-N 3.12Å; V208-W211 PolarHBondContact O-N 3.22Å; D209-W211 PolarHBondContact O-N 3.43Å; W211-T215 VanDerWaalsContact CE2-OG1 3.3Å; W211-T215 HydrophobicContact CG-CG2 4.39Å; W211-T215 VanDerWaalsContact O-CB 3.3Å; W211-T215 WeakPolarHBondContact O-CB 3.44Å; W211-T215 WeakPolarHBondContact O-CG2 3.26Å; W211-T215 PolarHBondContact O-N 3.3Å; W211-T215 PolarHBondContact O-OG1 3.2Å; W211-Y274 AromaticContact CD1-CE1 3.67Å; W211-Y274 AromaticContact CD1-CZ 3.78Å
212	D	92.6	Very high	93.8	Very high	14 Å²	14	56.1 Å²	56.1	8%	0.075	26%	0.262	C	S	.	.	H	α-helix	trans	-66.6	-46.3	-179.3	-164.2	62.4	0	0	0	112.7	V208 D209 D210 I214 R216 Q217	V208-D212 WeakPolarHBondContact O-CB 3.42Å; V208-D212 PolarHBondContact O-N 3.45Å; D209-D212 WeakPolarHBondContact O-CB 3.44Å; D209-D212 PolarHBondContact O-N 3.17Å; D209-D212 VanDerWaalsContact O-N 3.11Å; D210-D212 VanDerWaalsContact C-N 3.29Å; D210-D212 PolarHBondContact O-N 3.33Å; D212-I214 VanDerWaalsContact C-N 3.34Å; D212-I214 PolarHBondContact O-N 3.4Å; D212-R216 VanDerWaalsContact CG-CZ 3.45Å; D212-R216 WeakPolarHBondContact O-CA 3.47Å; D212-R216 WeakPolarHBondContact O-CB 3.36Å; D212-R216 PolarHBondContact O-N 2.88Å; D212-R216 WeakPolarHBondContact OD1-CB 3.37Å; D212-R216 WeakPolarHBondContact OD1-CD 3.4Å; D212-R216 IonicContact OD1-CZ 3.51Å; D212-R216 IonicContact OD1-NE 2.96Å; D212-R216 PolarHBondContact OD1-NE 3.13Å; D212-R216 IonicContact OD1-NH1 3.67Å; D212-R216 PolarHBondContact OD1-NH1 3.38Å; D212-R216 IonicContact OD1-NH2 2.61Å; D212-R216 PolarHBondContact OD1-NH2 2.78Å; D212-R216 IonicContact OD2-CZ 2.84Å; D212-R216 IonicContact OD2-NE 3.6Å; D212-R216 IonicContact OD2-NH2 3.8Å; D212-R216 PolarHBondContact OD2-NH2 3.48Å; D212-Q217 PolarHBondContact O-N 2.88Å; D212-Q217 PolarHBondContact OD2-NE2 3.05Å
213	L	94.5	Very high	93.9	Very high	16 Å²	16	52.1 Å²	52.1	8%	0.084	24%	0.244	C	C	.	.	H	α-helix	trans	-55.8	-49.8	178.2	-74.8	166.8	0	0	0	110.6	D209 D210 Q217 K218 Q219 A347 Y350	D209-L213 WeakPolarHBondContact O-CB 3.43Å; D209-L213 VanDerWaalsContact O-CG 3.23Å; D209-L213 WeakPolarHBondContact O-CG 3.42Å; D209-L213 PolarHBondContact O-N 2.94Å; D210-L213 PolarHBondContact O-N 3.48Å; L213-Q217 CarbonylContact O-C 3.35Å; L213-Q217 WeakPolarHBondContact O-CB 3.24Å; L213-K218 PolarHBondContact O-N 3.13Å; L213-K218 VanDerWaalsContact O-N 3.14Å; L213-Q219 HydrophobicContact CD2-CG 4.49Å; L213-Q219 PolarHBondContact O-N 2.94Å; L213-A347 HydrophobicContact CD1-CB 4.49Å; L213-Y350 HydrophobicContact CB-CD1 4.24Å; L213-Y350 HydrophobicContact CB-CE1 4.45Å; L213-Y350 HydrophobicContact CD1-CD1 4.36Å; L213-Y350 HydrophobicContact CD1-CD2 3.88Å; L213-Y350 HydrophobicContact CD1-CE1 4.43Å; L213-Y350 HydrophobicContact CD1-CE2 3.96Å; L213-Y350 HydrophobicContact CD1-CG 4.09Å
214	I	94	Very high	94	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-74.1	-50.8	-178.3	-58.5	-58.5	0	0	0	112	D210 D212 Q219 Y274 F276 E277 Y350	D210-I214 WeakPolarHBondContact O-CG1 3.19Å; D210-I214 PolarHBondContact O-N 3.33Å; D210-I214 VanDerWaalsContact O-N 3.14Å; D212-I214 VanDerWaalsContact C-N 3.34Å; D212-I214 PolarHBondContact O-N 3.4Å; I214-Q219 WeakPolarHBondContact CA-O 3.47Å; I214-Q219 WeakPolarHBondContact CD1-O 3.26Å; I214-Y274 HydrophobicContact CB-CD2 3.85Å; I214-Y274 HydrophobicContact CB-CE2 4.38Å; I214-Y274 HydrophobicContact CG1-CD2 4.12Å; I214-Y274 HydrophobicContact CG1-CE2 4.44Å; I214-Y274 HydrophobicContact CG2-CD2 3.7Å; I214-Y274 HydrophobicContact CG2-CG 4.21Å; I214-F276 HydrophobicContact CG2-CB 4.15Å; I214-F276 HydrophobicContact CG2-CD1 4.32Å; I214-F276 WeakPolarHBondContact O-CD1 3.29Å; I214-E277 HydrophobicContact CD1-CG 4.34Å; I214-E277 HydrophobicContact CG2-CG 3.77Å; I214-Y350 HydrophobicContact CD1-CD1 3.84Å; I214-Y350 HydrophobicContact CD1-CE1 3.66Å; I214-Y350 HydrophobicContact CG1-CE1 4.22Å
215	T	91.6	Very high	94.2	Very high	36 Å²	36	52.6 Å²	52.6	22%	0.221	26%	0.257	C	S	.	.	H	α-helix	trans	-85.8	-36.8	-166.5	67.6	0	0	0	0	113.3	W211 K218 Y274	W211-T215 VanDerWaalsContact CE2-OG1 3.3Å; W211-T215 HydrophobicContact CG-CG2 4.39Å; W211-T215 VanDerWaalsContact O-CB 3.3Å; W211-T215 WeakPolarHBondContact O-CB 3.44Å; W211-T215 WeakPolarHBondContact O-CG2 3.26Å; W211-T215 PolarHBondContact O-N 3.3Å; W211-T215 PolarHBondContact O-OG1 3.2Å; T215-K218 WeakPolarHBondContact O-CE 3.41Å; T215-K218 PolarHBondContact O-NZ 3.35Å; T215-Y274 HydrophobicContact CG2-CD1 4.16Å; T215-Y274 HydrophobicContact CG2-CD2 4.38Å; T215-Y274 HydrophobicContact CG2-CG 4.04Å
216	R	90.4	Very high	94.3	Very high	143 Å²	143	56.9 Å²	56.9	54%	0.54	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-46.9	-175.5	-160.8	173.8	71.1	-166.7	-9	111.8	D212 K218	D212-R216 VanDerWaalsContact CG-CZ 3.45Å; D212-R216 WeakPolarHBondContact O-CA 3.47Å; D212-R216 WeakPolarHBondContact O-CB 3.36Å; D212-R216 PolarHBondContact O-N 2.88Å; D212-R216 WeakPolarHBondContact OD1-CB 3.37Å; D212-R216 WeakPolarHBondContact OD1-CD 3.4Å; D212-R216 IonicContact OD1-CZ 3.51Å; D212-R216 IonicContact OD1-NE 2.96Å; D212-R216 PolarHBondContact OD1-NE 3.13Å; D212-R216 IonicContact OD1-NH1 3.67Å; D212-R216 PolarHBondContact OD1-NH1 3.38Å; D212-R216 IonicContact OD1-NH2 2.61Å; D212-R216 PolarHBondContact OD1-NH2 2.78Å; D212-R216 IonicContact OD2-CZ 2.84Å; D212-R216 IonicContact OD2-NE 3.6Å; D212-R216 IonicContact OD2-NH2 3.8Å; D212-R216 PolarHBondContact OD2-NH2 3.48Å; R216-K218 VanDerWaalsContact C-N 3.32Å
217	Q	92.2	Very high	94.5	Very high	90 Å²	90	57.4 Å²	57.4	42%	0.421	27%	0.273	S	S	.	.	S	Bend	trans	-85.1	-6.5	-177.1	-52.9	-175.7	29.1	0	0	113.5	D212 L213 Q219	D212-Q217 PolarHBondContact O-N 2.88Å; D212-Q217 PolarHBondContact OD2-NE2 3.05Å; L213-Q217 CarbonylContact O-C 3.35Å; L213-Q217 WeakPolarHBondContact O-CB 3.24Å; Q217-Q219 HydrophobicContact CB-CG 4.06Å; Q217-Q219 PolarHBondContact O-N 3.1Å
218	K	95.3	Very high	94.7	Very high	79 Å²	79	57.4 Å²	57.4	34%	0.343	27%	0.273	S	S	.	.			trans	56.4	35.4	178.1	-52.1	-56.4	-174	-166.8	0	112.6	L213 T215 R216 F276 A353	L213-K218 PolarHBondContact O-N 3.13Å; L213-K218 VanDerWaalsContact O-N 3.14Å; T215-K218 WeakPolarHBondContact O-CE 3.41Å; T215-K218 PolarHBondContact O-NZ 3.35Å; R216-K218 VanDerWaalsContact C-N 3.32Å; K218-F276 HydrophobicContact CB-CE1 3.96Å; K218-F276 HydrophobicContact CB-CZ 3.8Å; K218-F276 HydrophobicContact CD-CD1 4.49Å; K218-F276 HydrophobicContact CD-CD2 4.16Å; K218-F276 HydrophobicContact CD-CE1 4.29Å; K218-F276 HydrophobicContact CD-CE2 3.95Å; K218-F276 HydrophobicContact CD-CG 4.43Å; K218-F276 HydrophobicContact CD-CZ 4.01Å; K218-F276 HydrophobicContact CG-CZ 4.41Å; K218-A353 VanDerWaalsContact O-CB 3.27Å; K218-A353 WeakPolarHBondContact O-CB 3.07Å; K218-A353 PolarHBondContact O-N 2.9Å
219	Q	96.5	Very high	94.9	Very high	32 Å²	32	53.4 Å²	53.4	15%	0.15	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	159.6	170.2	-54.8	-166.7	32.5	0	0	110.3	L213 I214 Q217 E351 V352	L213-Q219 HydrophobicContact CD2-CG 4.49Å; L213-Q219 PolarHBondContact O-N 2.94Å; I214-Q219 WeakPolarHBondContact CA-O 3.47Å; I214-Q219 WeakPolarHBondContact CD1-O 3.26Å; Q217-Q219 HydrophobicContact CB-CG 4.06Å; Q217-Q219 PolarHBondContact O-N 3.1Å; Q219-E351 CarbonylContact C-O 3.46Å; Q219-E351 WeakPolarHBondContact CA-O 3.34Å; Q219-E351 WeakPolarHBondContact CB-O 3.45Å; Q219-V352 HydrophobicContact CG-CG2 4.18Å
220	L	97.1	Very high	95.2	Very high	13 Å²	13	50.9 Å²	50.9	7%	0.068	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	146.8	174	-67.2	168	0	0	0	108.9	F276 E277 Y350 E351 A353 Y357	L220-F276 HydrophobicContact CD2-CD1 3.84Å; L220-F276 HydrophobicContact CD2-CE1 3.97Å; L220-F276 HydrophobicContact CG-CD1 4.47Å; L220-F276 HydrophobicContact CG-CE1 4.11Å; L220-E277 HydrophobicContact CD2-CG 4.11Å; L220-Y350 CarbonylContact O-C 3.53Å; L220-Y350 WeakPolarHBondContact O-CA 3.41Å; L220-E351 PolarHBondContact N-O 2.79Å; L220-E351 PolarHBondContact O-N 2.98Å; L220-A353 HydrophobicContact CD1-CB 3.74Å; L220-A353 HydrophobicContact CG-CB 4.04Å; L220-Y357 HydrophobicContact CD1-CD1 3.74Å; L220-Y357 HydrophobicContact CD1-CD2 3.82Å; L220-Y357 HydrophobicContact CD1-CE1 3.51Å; L220-Y357 HydrophobicContact CD1-CE2 3.58Å; L220-Y357 HydrophobicContact CD1-CG 3.9Å; L220-Y357 VanDerWaalsContact CD1-CZ 3.41Å; L220-Y357 HydrophobicContact CD2-CE1 3.95Å; L220-Y357 HydrophobicContact CG-CE1 4.19Å
221	F	97.6	Very high	95.4	Very high	12 Å²	12	52.2 Å²	52.2	5%	0.053	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	140.6	172.4	-171.8	-96.9	0	0	0	110.1	L223 A225 Q280 P300 H301 D349 Y350	F221-L223 HydrophobicContact CD1-CD2 3.73Å; F221-L223 HydrophobicContact CD1-CG 4.41Å; F221-L223 HydrophobicContact CE1-CD2 4.22Å; F221-L223 PolarHBondContact O-N 2.83Å; F221-A225 HydrophobicContact CE1-CB 3.77Å; F221-A225 HydrophobicContact CZ-CB 4.4Å; F221-Q280 PolarHBondContact O-NE2 2.89Å; F221-P300 HydrophobicContact CD2-CG 3.91Å; F221-P300 HydrophobicContact CE2-CG 3.63Å; F221-P300 HydrophobicContact CZ-CG 4.38Å; F221-H301 AromaticContact CG-CE1 3.91Å; F221-D349 WeakPolarHBondContact CA-O 3.26Å; F221-D349 HydrophobicContact CD2-CB 4.18Å; F221-D349 WeakPolarHBondContact CD2-O 3.11Å; F221-D349 HydrophobicContact CE2-CB 3.6Å; F221-D349 HydrophobicContact CZ-CB 4.22Å; F221-Y350 HydrophobicContact CB-CD1 4.19Å; F221-Y350 HydrophobicContact CB-CE1 3.96Å; F221-Y350 HydrophobicContact CD2-CD1 4.48Å; F221-Y350 HydrophobicContact CD2-CD2 4.32Å; F221-Y350 HydrophobicContact CD2-CE1 4.05Å; F221-Y350 AromaticContact CD2-CE2 3.88Å; F221-Y350 HydrophobicContact CD2-CE2 3.88Å; F221-Y350 AromaticContact CD2-CZ 3.72Å; F221-Y350 HydrophobicContact CE2-CE2 4.44Å
222	Y	95.8	Very high	95.5	Very high	91 Å²	91	47.6 Å²	47.6	36%	0.357	23%	0.228	S	C	.	.			trans	-64.8	119.6	175.9	-82.1	-67	0	0	0	111.3	D349 E351	Y222-D349 VanDerWaalsContact CD2-C 3.46Å; Y222-D349 WeakPolarHBondContact CD2-O 3.38Å; Y222-D349 PolarHBondContact N-O 2.71Å; Y222-E351 HydrophobicContact CE1-CB 3.95Å; Y222-E351 HydrophobicContact CE1-CG 4.5Å; Y222-E351 WeakPolarHBondContact CE1-OE2 3.34Å; Y222-E351 HydrophobicContact CE2-CB 4.03Å; Y222-E351 WeakPolarHBondContact OH-CB 3.48Å; Y222-E351 WeakPolarHBondContact OH-CG 2.97Å; Y222-E351 PolarHBondContact OH-OE2 2.88Å
223	L	95.8	Very high	95.8	Very high	35 Å²	35	47 Å²	47	18%	0.183	23%	0.225	C	C	.	.	S	Bend	trans	-120.8	140.4	174.2	-61	179.4	0	0	0	110.4	F221 Q280 I284 V296 Y297	F221-L223 HydrophobicContact CD1-CD2 3.73Å; F221-L223 HydrophobicContact CD1-CG 4.41Å; F221-L223 HydrophobicContact CE1-CD2 4.22Å; F221-L223 PolarHBondContact O-N 2.83Å; L223-Q280 VanDerWaalsContact CD1-CD 3.45Å; L223-Q280 HydrophobicContact CD1-CG 3.89Å; L223-I284 HydrophobicContact CB-CD1 4.09Å; L223-I284 HydrophobicContact CD1-CD1 4.41Å; L223-I284 HydrophobicContact CD1-CG1 4.01Å; L223-V296 HydrophobicContact CB-CG1 4.37Å; L223-V296 HydrophobicContact CD2-CG1 4.32Å; L223-V296 WeakPolarHBondContact CD2-O 3.15Å; L223-Y297 HydrophobicContact CD1-CD1 4.07Å; L223-Y297 HydrophobicContact CD1-CE1 3.47Å; L223-Y297 VanDerWaalsContact CD1-CE1 3.47Å; L223-Y297 HydrophobicContact CD1-CE2 4.2Å; L223-Y297 HydrophobicContact CD2-CD1 3.75Å; L223-Y297 HydrophobicContact CD2-CE1 4.04Å; L223-Y297 HydrophobicContact CD2-CG 4.1Å; L223-Y297 HydrophobicContact CG-CE1 4.39Å
224	P	95.6	Very high	95.9	Very high	85 Å²	85	51.9 Å²	51.9	55%	0.552	25%	0.247	S	C	*	.	S	Bend	cis	-64.7	146.6	-6	-21.2	34.1	0	0	0	113.5	K226	P224-K226 PolarHBondContact O-N 2.68Å
225	A	96.4	Very high	96	Very high	11 Å²	11	54.7 Å²	54.7	9%	0.091	26%	0.262	C	S	.	.			trans	-65.2	132.9	-175.3	0	0	0	0	0	111.9	F221 K227 N228 V296	F221-A225 HydrophobicContact CE1-CB 3.77Å; F221-A225 HydrophobicContact CZ-CB 4.4Å; A225-K227 PolarHBondContact O-N 2.82Å; A225-N228 HydrophobicContact CB-CB 4.42Å; A225-V296 VanDerWaalsContact CB-O 3.26Å; A225-V296 WeakPolarHBondContact CB-O 3.39Å; A225-V296 PolarHBondContact N-O 3.29Å
226	K	94.4	Very high	96.2	Very high	160 Å²	160	53 Å²	53	70%	0.696	25%	0.251	S	S	*	.	S	Bend	trans	-55.6	-40.5	174.2	-62.6	174.2	-169.1	153.7	0	112.3	P224 D349	P224-K226 PolarHBondContact O-N 2.68Å; K226-D349 IonicContact NZ-OD1 3.59Å; K226-D349 PolarHBondContact NZ-OD1 3.11Å
227	K	96.4	Very high	96.3	Very high	86 Å²	86	46.5 Å²	46.5	37%	0.374	23%	0.229	S	C	.	.	S	Bend	trans	-124.1	99.6	172.7	-170.5	72.6	175.3	-178.9	0	108.2	A225 I232 D235	A225-K227 PolarHBondContact O-N 2.82Å; K227-I232 HydrophobicContact CG-CD1 4.47Å; K227-I232 HydrophobicContact CG-CG1 3.91Å; K227-D235 WeakPolarHBondContact CE-OD2 3.42Å; K227-D235 IonicContact NZ-OD1 2.83Å; K227-D235 PolarHBondContact NZ-OD1 2.95Å; K227-D235 IonicContact NZ-OD2 3.5Å; K227-D235 PolarHBondContact NZ-OD2 3.24Å
228	N	97.8	Very high	96.4	Very high	32 Å²	32	45.9 Å²	45.9	17%	0.171	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-79.2	166.2	-176.9	64.9	19.3	0	0	0	113	A225 D230 S231 I232 Q295 Y297	A225-N228 HydrophobicContact CB-CB 4.42Å; N228-D230 VanDerWaalsContact C-N 3.29Å; N228-D230 PolarHBondContact O-N 3.42Å; N228-S231 PolarHBondContact O-N 3.17Å; N228-S231 VanDerWaalsContact OD1-CB 3.26Å; N228-S231 WeakPolarHBondContact OD1-CB 3.42Å; N228-S231 PolarHBondContact OD1-N 3.41Å; N228-S231 PolarHBondContact OD1-OG 2.91Å; N228-I232 WeakPolarHBondContact O-CG1 3.26Å; N228-I232 PolarHBondContact O-N 3.45Å; N228-I232 VanDerWaalsContact O-N 3.11Å; N228-Q295 VanDerWaalsContact CB-O 3.24Å; N228-Q295 WeakPolarHBondContact CB-O 3.4Å; N228-Q295 PolarHBondContact ND2-O 3.02Å; N228-Q295 VanDerWaalsContact ND2-O 3.07Å; N228-Y297 CarbonylContact C-O 3.48Å; N228-Y297 VanDerWaalsContact CA-O 3.23Å; N228-Y297 WeakPolarHBondContact CA-O 3.4Å
229	V	98.2	Very high	96.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-57.9	-41.7	179.9	172.6	0	0	0	0	111.7	S231 I232 L233 F264 S294 Y297 L302	V229-S231 VanDerWaalsContact C-N 3.31Å; V229-S231 PolarHBondContact O-N 3.36Å; V229-I232 PolarHBondContact O-N 3.39Å; V229-I232 VanDerWaalsContact O-N 3.15Å; V229-L233 HydrophobicContact CG1-CD1 3.7Å; V229-L233 HydrophobicContact CG1-CG 4.02Å; V229-L233 WeakPolarHBondContact O-CB 3.2Å; V229-L233 VanDerWaalsContact O-CG 3.29Å; V229-L233 WeakPolarHBondContact O-CG 3.24Å; V229-L233 PolarHBondContact O-N 3.35Å; V229-F264 HydrophobicContact CB-CD1 4.45Å; V229-F264 HydrophobicContact CB-CE1 4.3Å; V229-F264 HydrophobicContact CG1-CD1 4.3Å; V229-F264 HydrophobicContact CG1-CG 4.46Å; V229-F264 HydrophobicContact CG2-CD1 4.16Å; V229-F264 HydrophobicContact CG2-CE1 3.66Å; V229-F264 HydrophobicContact CG2-CE2 4.2Å; V229-F264 HydrophobicContact CG2-CZ 3.67Å; V229-S294 WeakPolarHBondContact CB-O 3.29Å; V229-S294 PolarHBondContact N-O 3.46Å; V229-S294 VanDerWaalsContact N-O 3.12Å; V229-Y297 WeakPolarHBondContact CG2-O 3.5Å; V229-Y297 PolarHBondContact N-O 3.49Å; V229-L302 HydrophobicContact CG1-CD1 3.85Å; V229-L302 HydrophobicContact CG1-CD2 4Å; V229-L302 HydrophobicContact CG1-CG 4.38Å; V229-L302 HydrophobicContact CG2-CB 3.87Å; V229-L302 HydrophobicContact CG2-CD1 4.47Å; V229-L302 HydrophobicContact CG2-CD2 4.33Å; V229-L302 HydrophobicContact CG2-CG 4.45Å
230	D	97.9	Very high	95.9	Very high	27 Å²	27	45.7 Å²	45.7	14%	0.144	23%	0.226	C	C	.	.	H	α-helix	trans	-54.7	-47.7	177.4	-88	18.8	0	0	0	111.9	N228 I232 L233 E234 K261 S294 Q295	N228-D230 VanDerWaalsContact C-N 3.29Å; N228-D230 PolarHBondContact O-N 3.42Å; D230-I232 PolarHBondContact O-N 3.04Å; D230-L233 PolarHBondContact O-N 3.24Å; D230-E234 WeakPolarHBondContact O-CB 3.48Å; D230-E234 PolarHBondContact O-N 2.88Å; D230-K261 WeakPolarHBondContact OD1-CD 3.42Å; D230-K261 WeakPolarHBondContact OD1-CE 3.42Å; D230-K261 IonicContact OD1-NZ 2.64Å; D230-K261 PolarHBondContact OD1-NZ 2.67Å; D230-K261 IonicContact OD2-NZ 3.84Å; D230-K261 PolarHBondContact OD2-NZ 3.15Å; D230-S294 PolarHBondContact N-O 3.25Å; D230-S294 WeakPolarHBondContact OD1-CB 3.46Å; D230-S294 PolarHBondContact OD1-OG 3.29Å; D230-Q295 HydrophobicContact CB-CG 4.48Å; D230-Q295 WeakPolarHBondContact OD2-CG 3.48Å
231	S	97.9	Very high	95.4	Very high	37 Å²	37	49.1 Å²	49.1	26%	0.259	24%	0.24	S	C	.	.	H	α-helix	trans	-65.5	-38	178.2	-59.2	0	0	0	0	112.5	N228 V229 D235	N228-S231 PolarHBondContact O-N 3.17Å; N228-S231 VanDerWaalsContact OD1-CB 3.26Å; N228-S231 WeakPolarHBondContact OD1-CB 3.42Å; N228-S231 PolarHBondContact OD1-N 3.41Å; N228-S231 PolarHBondContact OD1-OG 2.91Å; V229-S231 VanDerWaalsContact C-N 3.31Å; V229-S231 PolarHBondContact O-N 3.36Å; S231-D235 WeakPolarHBondContact O-CB 3.36Å; S231-D235 PolarHBondContact O-N 2.88Å
232	I	98.1	Very high	94.8	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-66.7	-42	178.8	-64.5	164.6	0	0	0	110.7	K227 N228 V229 D230 D235 Y236 A299 L302 F333 L337 L344	K227-I232 HydrophobicContact CG-CD1 4.47Å; K227-I232 HydrophobicContact CG-CG1 3.91Å; N228-I232 WeakPolarHBondContact O-CG1 3.26Å; N228-I232 PolarHBondContact O-N 3.45Å; N228-I232 VanDerWaalsContact O-N 3.11Å; V229-I232 PolarHBondContact O-N 3.39Å; V229-I232 VanDerWaalsContact O-N 3.15Å; D230-I232 PolarHBondContact O-N 3.04Å; I232-D235 PolarHBondContact O-N 3.26Å; I232-Y236 PolarHBondContact O-N 2.95Å; I232-A299 HydrophobicContact CD1-CB 3.68Å; I232-L302 HydrophobicContact CG2-CD2 4.1Å; I232-F333 HydrophobicContact CG2-CZ 4.22Å; I232-L337 HydrophobicContact CG2-CD2 3.91Å; I232-L344 HydrophobicContact CD1-CD2 4.04Å; I232-L344 HydrophobicContact CG1-CD2 3.88Å
233	L	97.5	Very high	94	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-67.2	-39.6	178.7	-71.9	177.7	0	0	0	111.7	V229 D230 Y236 A237 V257 I260 K261 F333	V229-L233 HydrophobicContact CG1-CD1 3.7Å; V229-L233 HydrophobicContact CG1-CG 4.02Å; V229-L233 WeakPolarHBondContact O-CB 3.2Å; V229-L233 VanDerWaalsContact O-CG 3.29Å; V229-L233 WeakPolarHBondContact O-CG 3.24Å; V229-L233 PolarHBondContact O-N 3.35Å; D230-L233 PolarHBondContact O-N 3.24Å; L233-Y236 PolarHBondContact O-N 3.28Å; L233-A237 PolarHBondContact O-N 2.87Å; L233-V257 HydrophobicContact CB-CG1 3.79Å; L233-V257 HydrophobicContact CD1-CG1 4.4Å; L233-V257 HydrophobicContact CG-CG1 4.47Å; L233-I260 HydrophobicContact CD1-CG2 4.46Å; L233-I260 HydrophobicContact CD2-CB 4.21Å; L233-I260 HydrophobicContact CD2-CD1 4.45Å; L233-I260 HydrophobicContact CD2-CG2 3.86Å; L233-K261 HydrophobicContact CD1-CB 3.79Å; L233-K261 HydrophobicContact CD1-CG 4.43Å; L233-F333 HydrophobicContact CD2-CE2 3.88Å; L233-F333 HydrophobicContact CD2-CZ 3.73Å
234	E	96.6	Very high	92.5	Very high	118 Å²	118	57 Å²	57	55%	0.551	29%	0.291	S	S	*	.	H	α-helix	trans	-64	-46.3	173.9	-176.3	172.4	-163.2	0	0	111.8	D230 Y236 A237 N238	D230-E234 WeakPolarHBondContact O-CB 3.48Å; D230-E234 PolarHBondContact O-N 2.88Å; E234-Y236 VanDerWaalsContact C-N 3.25Å; E234-Y236 PolarHBondContact O-N 2.96Å; E234-A237 PolarHBondContact O-N 3.38Å; E234-A237 VanDerWaalsContact O-N 3.13Å; E234-N238 WeakPolarHBondContact O-CB 3.28Å; E234-N238 PolarHBondContact O-N 3.43Å; E234-N238 PolarHBondContact O-ND2 2.93Å
235	D	96.7	Very high	90.5	Very high	59 Å²	59	61 Å²	61	32%	0.316	31%	0.307	S	S	.	.	H	α-helix	trans	-58	-40.1	175.9	-71.3	-15.4	0	0	0	111.5	K227 S231 I232 Y239 Y336	K227-D235 WeakPolarHBondContact CE-OD2 3.42Å; K227-D235 IonicContact NZ-OD1 2.83Å; K227-D235 PolarHBondContact NZ-OD1 2.95Å; K227-D235 IonicContact NZ-OD2 3.5Å; K227-D235 PolarHBondContact NZ-OD2 3.24Å; S231-D235 WeakPolarHBondContact O-CB 3.36Å; S231-D235 PolarHBondContact O-N 2.88Å; I232-D235 PolarHBondContact O-N 3.26Å; D235-Y239 VanDerWaalsContact O-CB 3.27Å; D235-Y239 WeakPolarHBondContact O-CB 3.4Å; D235-Y239 PolarHBondContact O-N 3.37Å; D235-Y336 WeakPolarHBondContact CB-OH 3.31Å
236	Y	95.4	Very high	89.1	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-65.7	-45.7	175.1	172.9	-106.2	0	0	0	112.3	I232 L233 E234 N238 Y239 K240 V253 V257 D332 F333 Y336	I232-Y236 PolarHBondContact O-N 2.95Å; L233-Y236 PolarHBondContact O-N 3.28Å; E234-Y236 VanDerWaalsContact C-N 3.25Å; E234-Y236 PolarHBondContact O-N 2.96Å; Y236-N238 VanDerWaalsContact C-N 3.29Å; Y236-N238 PolarHBondContact O-N 2.87Å; Y236-Y239 HydrophobicContact CD2-CD1 4.43Å; Y236-Y239 WeakPolarHBondContact O-CB 3.24Å; Y236-Y239 PolarHBondContact O-N 3.36Å; Y236-K240 HydrophobicContact CD1-CG 4.4Å; Y236-K240 HydrophobicContact CD2-CG 4.21Å; Y236-K240 HydrophobicContact CE1-CG 3.96Å; Y236-K240 HydrophobicContact CE2-CD 3.78Å; Y236-K240 HydrophobicContact CE2-CG 3.74Å; Y236-K240 WeakPolarHBondContact O-CG 3.29Å; Y236-K240 PolarHBondContact O-N 3Å; Y236-V253 HydrophobicContact CD1-CG1 4.43Å; Y236-V253 HydrophobicContact CE1-CG1 4.12Å; Y236-V257 HydrophobicContact CD1-CG2 3.89Å; Y236-V257 HydrophobicContact CE1-CG2 4.4Å; Y236-D332 WeakPolarHBondContact CE2-OD2 3.19Å; Y236-D332 PolarHBondContact OH-OD2 2.97Å; Y236-F333 AromaticContact CD1-CD2 3.53Å; Y236-F333 HydrophobicContact CD1-CD2 3.53Å; Y236-F333 HydrophobicContact CD1-CE2 4.03Å; Y236-F333 AromaticContact CD2-CD2 3.66Å; Y236-F333 HydrophobicContact CD2-CD2 3.66Å; Y236-F333 HydrophobicContact CD2-CE2 4.27Å; Y236-F333 HydrophobicContact CE1-CB 4.4Å; Y236-F333 AromaticContact CE1-CD2 3.86Å; Y236-F333 HydrophobicContact CE1-CD2 3.86Å; Y236-F333 HydrophobicContact CE2-CB 4.28Å; Y236-F333 AromaticContact CE2-CD2 3.99Å; Y236-F333 HydrophobicContact CE2-CD2 3.99Å; Y236-F333 AromaticContact CG-CD2 3.4Å; Y236-F333 HydrophobicContact CG-CD2 3.4Å; Y236-F333 VanDerWaalsContact CG-CD2 3.4Å; Y236-F333 AromaticContact CG-CE2 3.74Å; Y236-F333 HydrophobicContact CG-CE2 3.74Å; Y236-Y336 AromaticContact CD2-CD1 3.89Å; Y236-Y336 HydrophobicContact CD2-CD1 3.89Å; Y236-Y336 HydrophobicContact CD2-CD2 4.08Å; Y236-Y336 AromaticContact CD2-CG 3.65Å; Y236-Y336 HydrophobicContact CD2-CG 3.65Å; Y236-Y336 HydrophobicContact CE2-CG 4.38Å; Y236-Y336 HydrophobicContact CG-CD1 4.44Å
237	A	93.3	Very high	87.7	Confident	8 Å²	8	62.2 Å²	62.2	7%	0.066	32%	0.323	C	S	.	.	H	α-helix	trans	-57.1	-46.7	177.1	0	0	0	0	0	110.6	L233 E234 Y239 K240 K241 V253 V257	L233-A237 PolarHBondContact O-N 2.87Å; E234-A237 PolarHBondContact O-N 3.38Å; E234-A237 VanDerWaalsContact O-N 3.13Å; A237-Y239 PolarHBondContact O-N 3.28Å; A237-K240 PolarHBondContact O-N 3.5Å; A237-K240 VanDerWaalsContact O-N 3.14Å; A237-K241 WeakPolarHBondContact O-CG 3.37Å; A237-K241 PolarHBondContact O-N 2.88Å; A237-V253 HydrophobicContact CB-CG1 4.25Å; A237-V257 HydrophobicContact CB-CG2 4.44Å
238	N	93.5	Very high	86.6	Confident	76 Å²	76	65 Å²	65	41%	0.406	34%	0.342	S	S	.	.	H	α-helix	trans	-64.9	-38.5	177.3	-68.5	-25.8	0	0	0	112.6	E234 Y236 K240 K241 S242	E234-N238 WeakPolarHBondContact O-CB 3.28Å; E234-N238 PolarHBondContact O-N 3.43Å; E234-N238 PolarHBondContact O-ND2 2.93Å; Y236-N238 VanDerWaalsContact C-N 3.29Å; Y236-N238 PolarHBondContact O-N 2.87Å; N238-K240 VanDerWaalsContact C-N 3.28Å; N238-K240 PolarHBondContact O-N 3.34Å; N238-K241 PolarHBondContact O-N 2.99Å; N238-S242 PolarHBondContact O-N 3.21Å; N238-S242 PolarHBondContact O-OG 2.97Å
239	Y	91.4	Very high	85.5	Confident	54 Å²	54	69.4 Å²	69.4	21%	0.212	36%	0.359	C	S	.	.	H	α-helix	trans	-60.2	-37.2	172.4	171.6	-102.5	0	0	0	112.4	D235 Y236 A237 S242 R243 Y336	D235-Y239 VanDerWaalsContact O-CB 3.27Å; D235-Y239 WeakPolarHBondContact O-CB 3.4Å; D235-Y239 PolarHBondContact O-N 3.37Å; Y236-Y239 HydrophobicContact CD2-CD1 4.43Å; Y236-Y239 WeakPolarHBondContact O-CB 3.24Å; Y236-Y239 PolarHBondContact O-N 3.36Å; A237-Y239 PolarHBondContact O-N 3.28Å; Y239-S242 PolarHBondContact O-OG 3.36Å; Y239-S242 VanDerWaalsContact O-OG 3.04Å; Y239-R243 PolarHBondContact O-N 3.18Å; Y239-R243 PolarHBondContact OH-NE 3.35Å; Y239-R243 PolarHBondContact OH-NH1 3.15Å; Y239-Y336 AromaticContact CD1-CD2 3.68Å; Y239-Y336 HydrophobicContact CD1-CD2 3.68Å; Y239-Y336 HydrophobicContact CD1-CE2 4.1Å; Y239-Y336 HydrophobicContact CD2-CD2 4.49Å; Y239-Y336 HydrophobicContact CD2-CE2 4.34Å; Y239-Y336 HydrophobicContact CE1-CD2 4Å; Y239-Y336 AromaticContact CG-CD2 3.94Å; Y239-Y336 HydrophobicContact CG-CD2 3.94Å; Y239-Y336 AromaticContact CG-CE2 3.88Å; Y239-Y336 HydrophobicContact CG-CE2 3.88Å
240	K	89.9	Confident	84.7	Confident	53 Å²	53	72.9 Å²	72.9	23%	0.23	38%	0.376	C	S	.	.	H	α-helix	trans	-74.4	-39.7	177.4	-65.3	-63.8	-69.2	-165.7	0	112.4	Y236 A237 N238 R243 G244 V253 D332	Y236-K240 HydrophobicContact CD1-CG 4.4Å; Y236-K240 HydrophobicContact CD2-CG 4.21Å; Y236-K240 HydrophobicContact CE1-CG 3.96Å; Y236-K240 HydrophobicContact CE2-CD 3.78Å; Y236-K240 HydrophobicContact CE2-CG 3.74Å; Y236-K240 WeakPolarHBondContact O-CG 3.29Å; Y236-K240 PolarHBondContact O-N 3Å; A237-K240 PolarHBondContact O-N 3.5Å; A237-K240 VanDerWaalsContact O-N 3.14Å; N238-K240 VanDerWaalsContact C-N 3.28Å; N238-K240 PolarHBondContact O-N 3.34Å; K240-R243 PolarHBondContact O-N 2.9Å; K240-G244 PolarHBondContact O-N 3.31Å; K240-V253 HydrophobicContact CB-CG1 4.08Å; K240-V253 HydrophobicContact CB-CG2 3.96Å; K240-V253 HydrophobicContact CG-CG1 4.16Å; K240-V253 HydrophobicContact CG-CG2 4.1Å; K240-D332 WeakPolarHBondContact CD-OD2 3.33Å; K240-D332 WeakPolarHBondContact CE-OD2 3.41Å; K240-D332 VanDerWaalsContact NZ-CG 3.31Å; K240-D332 IonicContact NZ-OD1 2.75Å; K240-D332 PolarHBondContact NZ-OD1 3.07Å; K240-D332 IonicContact NZ-OD2 2.65Å; K240-D332 PolarHBondContact NZ-OD2 3.26Å
241	K	86.9	Confident	83.9	Confident	85 Å²	85	78.9 Å²	78.9	37%	0.37	40%	0.397	S	S	.	.	H	α-helix	trans	-59.6	-44.9	175.5	-67.7	178.3	-163.4	-152.9	0	111.6	A237 N238 R243 G244 E250	A237-K241 WeakPolarHBondContact O-CG 3.37Å; A237-K241 PolarHBondContact O-N 2.88Å; N238-K241 PolarHBondContact O-N 2.99Å; K241-R243 VanDerWaalsContact C-N 3.27Å; K241-R243 PolarHBondContact O-N 3.13Å; K241-G244 PolarHBondContact O-N 3.3Å; K241-E250 HydrophobicContact CD-CG 4.31Å; K241-E250 WeakPolarHBondContact CD-OE1 3.49Å; K241-E250 WeakPolarHBondContact CE-OE1 3.48Å; K241-E250 HydrophobicContact CG-CG 4.07Å; K241-E250 IonicContact NZ-OE1 2.76Å; K241-E250 PolarHBondContact NZ-OE1 3.26Å
242	S	85.6	Confident	83.4	Confident	97 Å²	97	78.2 Å²	78.2	68%	0.678	39%	0.394	S	S	*	.	H	α-helix	trans	-69.1	-20.6	179.2	59.5	0	0	0	0	114.4	N238 Y239	N238-S242 PolarHBondContact O-N 3.21Å; N238-S242 PolarHBondContact O-OG 2.97Å; Y239-S242 PolarHBondContact O-OG 3.36Å; Y239-S242 VanDerWaalsContact O-OG 3.04Å
243	R	78.3	Confident	82.9	Confident	178 Å²	178	78.4 Å²	78.4	67%	0.672	40%	0.395	S	S	*	.	H	α-helix	trans	-97.4	-7	180	-90.7	-165.3	171.7	-154.3	-2.8	115.3	Y239 K240 K241	Y239-R243 PolarHBondContact O-N 3.18Å; Y239-R243 PolarHBondContact OH-NE 3.35Å; Y239-R243 PolarHBondContact OH-NH1 3.15Å; K240-R243 PolarHBondContact O-N 2.9Å; K241-R243 VanDerWaalsContact C-N 3.27Å; K241-R243 PolarHBondContact O-N 3.13Å
244	G	64.4	Low	82.4	Confident	30 Å²	30	81.2 Å²	81.2	31%	0.309	41%	0.41	S	S	.	.			trans	-155.9	121.1	-175.3	0	0	0	0	0	113.8	K240 K241 T246	K240-G244 PolarHBondContact O-N 3.31Å; K241-G244 PolarHBondContact O-N 3.3Å; G244-T246 PolarHBondContact O-N 3.22Å
245	N	54.3	Low	82	Confident	167 Å²	167	80.6 Å²	80.6	89%	0.893	41%	0.407	S	S	*	.			trans	-94.5	56.5	-174.1	-161.1	35.9	0	0	0	112.8
246	T	66.1	Low	81.7	Confident	70 Å²	70	78.5 Å²	78.5	43%	0.429	40%	0.397	S	S	.	.			trans	-138.5	114	176.8	16.1	0	0	0	0	110.9	G244 N248 K249 E250	G244-T246 PolarHBondContact O-N 3.22Å; T246-N248 PolarHBondContact O-N 3.17Å; T246-N248 VanDerWaalsContact O-N 3.12Å; T246-K249 WeakPolarHBondContact O-CB 3.23Å; T246-K249 PolarHBondContact O-N 3.4Å; T246-K249 WeakPolarHBondContact OG1-CD 3.38Å; T246-E250 PolarHBondContact O-N 3.08Å
247	D	65.8	Low	81.6	Confident	128 Å²	128	79.4 Å²	79.4	68%	0.684	40%	0.402	S	S	*	.	H	α-helix	trans	-51.4	-38.5	-176.3	-56.2	-16	0	0	0	113	K249 E250 Y251	D247-K249 VanDerWaalsContact C-N 3.26Å; D247-K249 PolarHBondContact O-N 3.42Å; D247-E250 WeakPolarHBondContact O-CB 3.38Å; D247-E250 PolarHBondContact O-N 3Å; D247-E250 VanDerWaalsContact O-N 3.1Å; D247-Y251 PolarHBondContact O-N 2.86Å; D247-Y251 VanDerWaalsContact O-N 3.08Å
248	N	72.8	Confident	81.3	Confident	145 Å²	145	81.6 Å²	81.6	78%	0.775	42%	0.42	S	S	*	.	H	α-helix	trans	-62.5	-30.1	177.5	-69.5	0.2	0	0	0	113.4	T246 A252	T246-N248 PolarHBondContact O-N 3.17Å; T246-N248 VanDerWaalsContact O-N 3.12Å; N248-A252 PolarHBondContact O-N 3.43Å
249	K	75.6	Confident	81.1	Confident	124 Å²	124	79.3 Å²	79.3	54%	0.539	41%	0.414	S	S	.	.	H	α-helix	trans	-78.3	-32.2	175.9	-68.4	-177	-172.3	161.6	0	111.4	T246 D247 V253	T246-K249 WeakPolarHBondContact O-CB 3.23Å; T246-K249 PolarHBondContact O-N 3.4Å; T246-K249 WeakPolarHBondContact OG1-CD 3.38Å; D247-K249 VanDerWaalsContact C-N 3.26Å; D247-K249 PolarHBondContact O-N 3.42Å; K249-V253 VanDerWaalsContact O-CG2 3.23Å; K249-V253 WeakPolarHBondContact O-CG2 3.46Å; K249-V253 PolarHBondContact O-N 3.26Å
250	E	80.1	Confident	81.3	Confident	73 Å²	73	76.9 Å²	76.9	34%	0.341	41%	0.405	S	S	.	.	H	α-helix	trans	-65.5	-46.7	176.5	-177.6	173.5	178.6	0	0	110.9	K241 T246 D247 A252 V253 N254	K241-E250 HydrophobicContact CD-CG 4.31Å; K241-E250 WeakPolarHBondContact CD-OE1 3.49Å; K241-E250 WeakPolarHBondContact CE-OE1 3.48Å; K241-E250 HydrophobicContact CG-CG 4.07Å; K241-E250 IonicContact NZ-OE1 2.76Å; K241-E250 PolarHBondContact NZ-OE1 3.26Å; T246-E250 PolarHBondContact O-N 3.08Å; D247-E250 WeakPolarHBondContact O-CB 3.38Å; D247-E250 PolarHBondContact O-N 3Å; D247-E250 VanDerWaalsContact O-N 3.1Å; E250-A252 VanDerWaalsContact C-N 3.34Å; E250-A252 PolarHBondContact O-N 2.87Å; E250-V253 PolarHBondContact O-N 2.92Å; E250-N254 VanDerWaalsContact O-CG 3.29Å; E250-N254 PolarHBondContact O-N 3.46Å; E250-N254 PolarHBondContact O-ND2 3.37Å
251	Y	82.3	Confident	81.4	Confident	152 Å²	152	77.5 Å²	77.5	60%	0.596	41%	0.408	S	S	*	.	H	α-helix	trans	-55.9	-48.9	175	-179.3	-102.8	0	0	0	111.6	D247 V253 N254 E255	D247-Y251 PolarHBondContact O-N 2.86Å; D247-Y251 VanDerWaalsContact O-N 3.08Å; Y251-V253 VanDerWaalsContact C-N 3.33Å; Y251-V253 PolarHBondContact O-N 3.12Å; Y251-N254 PolarHBondContact O-N 2.93Å; Y251-E255 HydrophobicContact CD1-CG 4.2Å; Y251-E255 HydrophobicContact CE1-CG 3.73Å; Y251-E255 HydrophobicContact CE2-CG 4.13Å; Y251-E255 WeakPolarHBondContact O-CG 3.42Å; Y251-E255 PolarHBondContact O-N 3.34Å; Y251-E255 PolarHBondContact OH-OE1 3.1Å
252	A	85.9	Confident	81.5	Confident	23 Å²	23	79 Å²	79	19%	0.19	42%	0.416	C	S	.	.	H	α-helix	trans	-62.1	-37	178.3	0	0	0	0	0	113.4	N248 E250 V256 Y329	N248-A252 PolarHBondContact O-N 3.43Å; E250-A252 VanDerWaalsContact C-N 3.34Å; E250-A252 PolarHBondContact O-N 2.87Å; A252-V256 VanDerWaalsContact O-CG2 3.29Å; A252-V256 WeakPolarHBondContact O-CG2 3.44Å; A252-V256 PolarHBondContact O-N 3.14Å; A252-Y329 HydrophobicContact CB-CE2 4.08Å; A252-Y329 WeakPolarHBondContact CB-OH 3.28Å
253	V	88.4	Confident	81.7	Confident	5 Å²	5	77.4 Å²	77.4	3%	0.03	40%	0.396	C	S	.	.	H	α-helix	trans	-66	-43.5	175.9	168.6	0	0	0	0	110.9	Y236 A237 K240 K249 E250 Y251 V256 V257 Y329	Y236-V253 HydrophobicContact CD1-CG1 4.43Å; Y236-V253 HydrophobicContact CE1-CG1 4.12Å; A237-V253 HydrophobicContact CB-CG1 4.25Å; K240-V253 HydrophobicContact CB-CG1 4.08Å; K240-V253 HydrophobicContact CB-CG2 3.96Å; K240-V253 HydrophobicContact CG-CG1 4.16Å; K240-V253 HydrophobicContact CG-CG2 4.1Å; K249-V253 VanDerWaalsContact O-CG2 3.23Å; K249-V253 WeakPolarHBondContact O-CG2 3.46Å; K249-V253 PolarHBondContact O-N 3.26Å; E250-V253 PolarHBondContact O-N 2.92Å; Y251-V253 VanDerWaalsContact C-N 3.33Å; Y251-V253 PolarHBondContact O-N 3.12Å; V253-V256 PolarHBondContact O-N 3.26Å; V253-V257 HydrophobicContact CG1-CG2 4.39Å; V253-V257 WeakPolarHBondContact O-CB 3.47Å; V253-V257 WeakPolarHBondContact O-CG2 3.4Å; V253-V257 PolarHBondContact O-N 2.97Å; V253-Y329 HydrophobicContact CG2-CD1 4.27Å; V253-Y329 HydrophobicContact CG2-CE1 3.71Å
254	N	87.4	Confident	82.5	Confident	60 Å²	60	68.9 Å²	68.9	32%	0.321	36%	0.364	S	S	.	.	H	α-helix	trans	-63.7	-42	179	-65.7	-25.6	0	0	0	111.5	E250 Y251 V257 A258	E250-N254 VanDerWaalsContact O-CG 3.29Å; E250-N254 PolarHBondContact O-N 3.46Å; E250-N254 PolarHBondContact O-ND2 3.37Å; Y251-N254 PolarHBondContact O-N 2.93Å; N254-V257 PolarHBondContact O-N 2.64Å; N254-A258 WeakPolarHBondContact O-CB 3.28Å; N254-A258 PolarHBondContact O-N 3.08Å
255	E	88.5	Confident	83.8	Confident	105 Å²	105	69.4 Å²	69.4	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-61	-44.2	174.9	-71.9	-69.4	128.2	0	0	111.9	Y251 A258 G259	Y251-E255 HydrophobicContact CD1-CG 4.2Å; Y251-E255 HydrophobicContact CE1-CG 3.73Å; Y251-E255 HydrophobicContact CE2-CG 4.13Å; Y251-E255 WeakPolarHBondContact O-CG 3.42Å; Y251-E255 PolarHBondContact O-N 3.34Å; Y251-E255 PolarHBondContact OH-OE1 3.1Å; E255-A258 PolarHBondContact O-N 3.1Å; E255-G259 PolarHBondContact O-N 3.4Å
256	V	90.1	Very high	85.4	Confident	16 Å²	16	65.9 Å²	65.9	10%	0.097	34%	0.343	C	S	.	.	H	α-helix	trans	-65.6	-42.6	177.4	172	0	0	0	0	111.2	A252 V253 G259 I260 L326 Y329 L330	A252-V256 VanDerWaalsContact O-CG2 3.29Å; A252-V256 WeakPolarHBondContact O-CG2 3.44Å; A252-V256 PolarHBondContact O-N 3.14Å; V253-V256 PolarHBondContact O-N 3.26Å; V256-G259 PolarHBondContact O-N 3.06Å; V256-I260 HydrophobicContact CG1-CD1 3.79Å; V256-I260 HydrophobicContact CG1-CG1 4.35Å; V256-I260 VanDerWaalsContact O-CG1 3.31Å; V256-I260 WeakPolarHBondContact O-CG1 3.36Å; V256-I260 PolarHBondContact O-N 3.13Å; V256-L326 HydrophobicContact CG2-CD1 4.1Å; V256-Y329 HydrophobicContact CG2-CD2 4.12Å; V256-Y329 HydrophobicContact CG2-CG 4.01Å; V256-L330 HydrophobicContact CG1-CD2 4.3Å
257	V	92.4	Very high	86.5	Confident	18 Å²	18	62.7 Å²	62.7	11%	0.109	32%	0.324	C	S	.	.	H	α-helix	trans	-61.3	-45.6	176.9	158.5	0	0	0	0	111.1	L233 Y236 A237 V253 N254 G259 I260 K261	L233-V257 HydrophobicContact CB-CG1 3.79Å; L233-V257 HydrophobicContact CD1-CG1 4.4Å; L233-V257 HydrophobicContact CG-CG1 4.47Å; Y236-V257 HydrophobicContact CD1-CG2 3.89Å; Y236-V257 HydrophobicContact CE1-CG2 4.4Å; A237-V257 HydrophobicContact CB-CG2 4.44Å; V253-V257 HydrophobicContact CG1-CG2 4.39Å; V253-V257 WeakPolarHBondContact O-CB 3.47Å; V253-V257 WeakPolarHBondContact O-CG2 3.4Å; V253-V257 PolarHBondContact O-N 2.97Å; N254-V257 PolarHBondContact O-N 2.64Å; V257-G259 VanDerWaalsContact C-N 3.34Å; V257-G259 PolarHBondContact O-N 3.48Å; V257-I260 PolarHBondContact O-N 3.39Å; V257-K261 PolarHBondContact O-N 3.35Å
258	A	87.8	Confident	87.8	Confident	54 Å²	54	56.6 Å²	56.6	45%	0.446	29%	0.291	S	S	.	.	H	α-helix	trans	-61.1	-43.9	175.4	0	0	0	0	0	111.3	N254 E255 K261 E262	N254-A258 WeakPolarHBondContact O-CB 3.28Å; N254-A258 PolarHBondContact O-N 3.08Å; E255-A258 PolarHBondContact O-N 3.1Å; A258-K261 WeakPolarHBondContact O-CB 3.29Å; A258-K261 PolarHBondContact O-N 3.22Å; A258-E262 PolarHBondContact O-N 3.34Å
259	G	89.5	Confident	88.5	Confident	28 Å²	28	50.2 Å²	50.2	29%	0.289	26%	0.26	S	S	.	.	H	α-helix	trans	-58.8	-49.9	175.2	0	0	0	0	0	112.5	E255 V256 V257 K261 E262 Y263	E255-G259 PolarHBondContact O-N 3.4Å; V256-G259 PolarHBondContact O-N 3.06Å; V257-G259 VanDerWaalsContact C-N 3.34Å; V257-G259 PolarHBondContact O-N 3.48Å; G259-K261 VanDerWaalsContact C-N 3.29Å; G259-K261 PolarHBondContact O-N 3.19Å; G259-E262 PolarHBondContact O-N 3.41Å; G259-Y263 WeakPolarHBondContact O-CB 3.28Å; G259-Y263 VanDerWaalsContact O-CD2 3.26Å; G259-Y263 WeakPolarHBondContact O-CD2 3.28Å; G259-Y263 PolarHBondContact O-N 3.06Å
260	I	94.3	Very high	89	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-58.3	-43.5	177.7	-67.5	163	0	0	0	110.7	L233 V256 V257 F264 L302 L305 F306 L330 F333	L233-I260 HydrophobicContact CD1-CG2 4.46Å; L233-I260 HydrophobicContact CD2-CB 4.21Å; L233-I260 HydrophobicContact CD2-CD1 4.45Å; L233-I260 HydrophobicContact CD2-CG2 3.86Å; V256-I260 HydrophobicContact CG1-CD1 3.79Å; V256-I260 HydrophobicContact CG1-CG1 4.35Å; V256-I260 VanDerWaalsContact O-CG1 3.31Å; V256-I260 WeakPolarHBondContact O-CG1 3.36Å; V256-I260 PolarHBondContact O-N 3.13Å; V257-I260 PolarHBondContact O-N 3.39Å; I260-F264 VanDerWaalsContact O-CB 3.28Å; I260-F264 WeakPolarHBondContact O-CB 3.48Å; I260-F264 PolarHBondContact O-N 2.65Å; I260-L302 HydrophobicContact CG2-CD1 3.81Å; I260-L305 HydrophobicContact CG2-CD2 4.04Å; I260-F306 HydrophobicContact CD1-CE1 4.47Å; I260-F306 HydrophobicContact CD1-CZ 4.07Å; I260-F306 HydrophobicContact CG1-CZ 4.33Å; I260-F306 HydrophobicContact CG2-CZ 4.19Å; I260-L330 HydrophobicContact CD1-CD2 4.02Å; I260-L330 HydrophobicContact CG1-CD2 4.01Å; I260-F333 HydrophobicContact CD1-CD1 4.33Å; I260-F333 HydrophobicContact CD1-CG 4.35Å
261	K	93.9	Very high	89.3	Confident	66 Å²	66	49 Å²	49	29%	0.287	26%	0.262	S	S	.	.	H	α-helix	trans	-59.7	-47.9	177.6	-173.8	-177.9	-63.4	-154.8	0	111.8	D230 L233 V257 A258 G259 F264 N265	D230-K261 WeakPolarHBondContact OD1-CD 3.42Å; D230-K261 WeakPolarHBondContact OD1-CE 3.42Å; D230-K261 IonicContact OD1-NZ 2.64Å; D230-K261 PolarHBondContact OD1-NZ 2.67Å; D230-K261 IonicContact OD2-NZ 3.84Å; D230-K261 PolarHBondContact OD2-NZ 3.15Å; L233-K261 HydrophobicContact CD1-CB 3.79Å; L233-K261 HydrophobicContact CD1-CG 4.43Å; V257-K261 PolarHBondContact O-N 3.35Å; A258-K261 WeakPolarHBondContact O-CB 3.29Å; A258-K261 PolarHBondContact O-N 3.22Å; G259-K261 VanDerWaalsContact C-N 3.29Å; G259-K261 PolarHBondContact O-N 3.19Å; K261-F264 WeakPolarHBondContact O-CB 3.4Å; K261-F264 PolarHBondContact O-N 2.83Å; K261-N265 PolarHBondContact O-N 2.78Å; K261-N265 PolarHBondContact O-ND2 3.35Å
262	E	89.1	Confident	89.9	Confident	116 Å²	116	42 Å²	42	54%	0.542	24%	0.235	S	C	.	.	H	α-helix	trans	-65	-46.5	-178.8	-169.4	59.9	-157.5	0	0	111.5	A258 G259 F264 N265 V266	A258-E262 PolarHBondContact O-N 3.34Å; G259-E262 PolarHBondContact O-N 3.41Å; E262-F264 VanDerWaalsContact C-N 3.27Å; E262-F264 PolarHBondContact O-N 3.02Å; E262-N265 PolarHBondContact O-N 3.15Å; E262-V266 WeakPolarHBondContact O-CG2 3.35Å; E262-V266 PolarHBondContact O-N 2.72Å
263	Y	89.6	Confident	90.4	Very high	64 Å²	64	41.6 Å²	41.6	25%	0.251	23%	0.23	S	C	.	.	H	α-helix	trans	-57.8	-42.1	173.6	-90.2	-77.7	0	0	0	111.6	G259 M267 I309 M312 T316	G259-Y263 WeakPolarHBondContact O-CB 3.28Å; G259-Y263 VanDerWaalsContact O-CD2 3.26Å; G259-Y263 WeakPolarHBondContact O-CD2 3.28Å; G259-Y263 PolarHBondContact O-N 3.06Å; Y263-M267 HydrophobicContact CD1-SD 3.84Å; Y263-M267 WeakPolarHBondContact O-CB 3.1Å; Y263-M267 WeakPolarHBondContact O-CG 3.04Å; Y263-M267 PolarHBondContact O-N 3.12Å; Y263-I309 HydrophobicContact CD1-CD1 4.36Å; Y263-I309 HydrophobicContact CD1-CG1 4.25Å; Y263-I309 HydrophobicContact CD2-CD1 4.29Å; Y263-I309 HydrophobicContact CG-CD1 4.03Å; Y263-I309 HydrophobicContact CG-CG1 4.42Å; Y263-M312 HydrophobicContact CD1-CB 4.47Å; Y263-M312 HydrophobicContact CE1-CB 3.81Å; Y263-M312 HydrophobicContact CE1-CG 4.46Å; Y263-T316 PolarHBondContact OH-OG1 3.41Å; Y263-T316 VanDerWaalsContact OH-OG1 3.1Å
264	F	94.9	Very high	90.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.8	-49	177.7	-173.4	-101	0	0	0	111.8	V229 I260 K261 E262 V266 M267 L268 L272 M293 H301 L302 L305	V229-F264 HydrophobicContact CB-CD1 4.45Å; V229-F264 HydrophobicContact CB-CE1 4.3Å; V229-F264 HydrophobicContact CG1-CD1 4.3Å; V229-F264 HydrophobicContact CG1-CG 4.46Å; V229-F264 HydrophobicContact CG2-CD1 4.16Å; V229-F264 HydrophobicContact CG2-CE1 3.66Å; V229-F264 HydrophobicContact CG2-CE2 4.2Å; V229-F264 HydrophobicContact CG2-CZ 3.67Å; I260-F264 VanDerWaalsContact O-CB 3.28Å; I260-F264 WeakPolarHBondContact O-CB 3.48Å; I260-F264 PolarHBondContact O-N 2.65Å; K261-F264 WeakPolarHBondContact O-CB 3.4Å; K261-F264 PolarHBondContact O-N 2.83Å; E262-F264 VanDerWaalsContact C-N 3.27Å; E262-F264 PolarHBondContact O-N 3.02Å; F264-V266 VanDerWaalsContact C-N 3.33Å; F264-V266 PolarHBondContact O-N 3.03Å; F264-M267 PolarHBondContact O-N 2.82Å; F264-L268 HydrophobicContact CE1-CD1 3.64Å; F264-L268 HydrophobicContact CE2-CD1 3.86Å; F264-L268 HydrophobicContact CZ-CD1 3.23Å; F264-L268 VanDerWaalsContact O-CB 3.26Å; F264-L268 WeakPolarHBondContact O-CB 3.24Å; F264-L268 PolarHBondContact O-N 2.84Å; F264-L272 HydrophobicContact CD2-CD1 3.85Å; F264-L272 HydrophobicContact CE2-CD1 3.95Å; F264-M293 HydrophobicContact CE1-CB 4.33Å; F264-H301 HydrophobicContact CE2-CB 3.9Å; F264-H301 HydrophobicContact CZ-CB 3.87Å; F264-L302 HydrophobicContact CD2-CD1 4.08Å; F264-L302 HydrophobicContact CE2-CB 4.33Å; F264-L305 HydrophobicContact CB-CD2 4.02Å; F264-L305 HydrophobicContact CD2-CB 4.39Å; F264-L305 HydrophobicContact CD2-CD2 4.32Å
265	N	90.9	Very high	90.9	Very high	41 Å²	41	47.8 Å²	47.8	22%	0.219	25%	0.252	C	S	.	.	H	α-helix	trans	-60.1	-41.9	-179.6	-74.8	-28.7	0	0	0	112.4	K261 E262 M293 S294	K261-N265 PolarHBondContact O-N 2.78Å; K261-N265 PolarHBondContact O-ND2 3.35Å; E262-N265 PolarHBondContact O-N 3.15Å; N265-M293 PolarHBondContact OD1-N 3.26Å; N265-S294 WeakPolarHBondContact OD1-CB 3.48Å; N265-S294 PolarHBondContact OD1-N 3.39Å; N265-S294 PolarHBondContact OD1-OG 2.94Å
266	V	88.4	Confident	91.3	Very high	92 Å²	92	43.6 Å²	43.6	56%	0.558	23%	0.232	S	C	*	.	H	α-helix	trans	-74.5	-40.3	179.1	174.7	0	0	0	0	112.1	E262 F264 T270	E262-V266 WeakPolarHBondContact O-CG2 3.35Å; E262-V266 PolarHBondContact O-N 2.72Å; F264-V266 VanDerWaalsContact C-N 3.33Å; F264-V266 PolarHBondContact O-N 3.03Å; V266-T270 PolarHBondContact O-OG1 3.45Å
267	M	89	Confident	91.5	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.015	23%	0.228	C	C	.	.	H	α-helix	trans	-85.9	-21.6	-172.3	-66.4	-177.3	73.3	0	0	113.8	Y263 F264 G269 T270 Q271 L272 L305 R308 M312	Y263-M267 HydrophobicContact CD1-SD 3.84Å; Y263-M267 WeakPolarHBondContact O-CB 3.1Å; Y263-M267 WeakPolarHBondContact O-CG 3.04Å; Y263-M267 PolarHBondContact O-N 3.12Å; F264-M267 PolarHBondContact O-N 2.82Å; M267-G269 PolarHBondContact O-N 3.43Å; M267-T270 PolarHBondContact O-N 3.27Å; M267-T270 VanDerWaalsContact O-N 3.17Å; M267-T270 PolarHBondContact O-OG1 3.24Å; M267-Q271 HydrophobicContact CE-CB 4.3Å; M267-Q271 HydrophobicContact CE-CG 4.5Å; M267-Q271 PolarHBondContact O-N 3.49Å; M267-L272 HydrophobicContact CB-CD1 4.21Å; M267-L272 HydrophobicContact CB-CD2 4.47Å; M267-L272 HydrophobicContact CB-CG 4.15Å; M267-L272 PolarHBondContact O-N 2.75Å; M267-L305 HydrophobicContact CB-CD1 4.24Å; M267-L305 HydrophobicContact CE-CD1 4.28Å; M267-L305 HydrophobicContact CG-CD1 4.39Å; M267-L305 HydrophobicContact SD-CD1 3.44Å; M267-L305 WeakPolarHBondContact SD-CD1 3.46Å; M267-R308 HydrophobicContact CE-CB 3.81Å; M267-M312 HydrophobicContact CE-CG 3.57Å; M267-M312 HydrophobicContact CE-SD 4.42Å; M267-M312 HydrophobicContact SD-CG 3.76Å
268	L	92.6	Very high	91.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.24	C	C	.	.	I	π-helix	trans	-55.9	-57.6	-173.2	-177.5	124.9	0	0	0	111.9	F264 T270 L272 L273 Y281 M293 Y297 H301	F264-L268 HydrophobicContact CE1-CD1 3.64Å; F264-L268 HydrophobicContact CE2-CD1 3.86Å; F264-L268 HydrophobicContact CZ-CD1 3.23Å; F264-L268 VanDerWaalsContact O-CB 3.26Å; F264-L268 WeakPolarHBondContact O-CB 3.24Å; F264-L268 PolarHBondContact O-N 2.84Å; L268-T270 PolarHBondContact O-N 3.44Å; L268-T270 VanDerWaalsContact O-N 3.11Å; L268-L272 HydrophobicContact CB-CD1 4.42Å; L268-L272 PolarHBondContact O-N 3.11Å; L268-L273 HydrophobicContact CD2-CD1 4.15Å; L268-L273 HydrophobicContact CD2-CD2 4.43Å; L268-L273 HydrophobicContact CD2-CG 4.43Å; L268-L273 HydrophobicContact CG-CD2 4.37Å; L268-L273 HydrophobicContact CG-CG 4.39Å; L268-L273 WeakPolarHBondContact O-CG 3.34Å; L268-Y281 HydrophobicContact CD2-CD2 3.83Å; L268-Y281 HydrophobicContact CD2-CE2 3.68Å; L268-M293 HydrophobicContact CB-CB 4.14Å; L268-M293 HydrophobicContact CB-CG 4.3Å; L268-M293 HydrophobicContact CD1-CB 4.31Å; L268-M293 HydrophobicContact CD2-CB 3.88Å; L268-M293 HydrophobicContact CD2-CG 3.62Å; L268-M293 HydrophobicContact CD2-SD 3.65Å; L268-M293 HydrophobicContact CG-CB 4.31Å; L268-M293 HydrophobicContact CG-CG 4.45Å; L268-Y297 HydrophobicContact CD1-CD1 3.85Å; L268-Y297 HydrophobicContact CD1-CD2 3.58Å; L268-Y297 HydrophobicContact CD1-CE1 4.23Å; L268-Y297 HydrophobicContact CD1-CE2 4.01Å; L268-Y297 HydrophobicContact CD1-CG 3.5Å; L268-Y297 VanDerWaalsContact CD1-CG 3.5Å; L268-Y297 HydrophobicContact CD2-CD2 3.76Å; L268-Y297 HydrophobicContact CD2-CE1 4.4Å; L268-Y297 HydrophobicContact CD2-CE2 3.37Å; L268-Y297 HydrophobicContact CD2-CG 4.43Å; L268-Y297 HydrophobicContact CG-CD2 4.33Å; L268-Y297 HydrophobicContact CG-CE2 4.32Å; L268-H301 HydrophobicContact CD1-CB 4.21Å
269	G	88.1	Confident	92	Very high	12 Å²	12	44.7 Å²	44.7	12%	0.124	22%	0.223	C	C	.	.	I	π-helix	trans	-66.4	-13.3	-177.8	0	0	0	0	0	114.7	M267 R278 Y281	M267-G269 PolarHBondContact O-N 3.43Å; G269-R278 PolarHBondContact O-NH1 3.21Å; G269-Y281 VanDerWaalsContact CA-CZ 3.49Å; G269-Y281 WeakPolarHBondContact CA-OH 3.38Å
270	T	86.3	Confident	92.3	Very high	89 Å²	89	44.4 Å²	44.4	55%	0.546	22%	0.215	S	C	.	.	I	π-helix	trans	-110	-42	-173.9	53.9	0	0	0	0	112.8	V266 M267 L268 R278	V266-T270 PolarHBondContact O-OG1 3.45Å; M267-T270 PolarHBondContact O-N 3.27Å; M267-T270 VanDerWaalsContact O-N 3.17Å; M267-T270 PolarHBondContact O-OG1 3.24Å; L268-T270 PolarHBondContact O-N 3.44Å; L268-T270 VanDerWaalsContact O-N 3.11Å; T270-R278 PolarHBondContact O-NH2 3.21Å
271	Q	86.9	Confident	92.4	Very high	82 Å²	82	46.5 Å²	46.5	38%	0.383	22%	0.223	S	C	.	.	I	π-helix	trans	-128.8	-15.3	-165.3	-60.4	-174.3	37.1	0	0	115.4	M267	M267-Q271 HydrophobicContact CE-CB 4.3Å; M267-Q271 HydrophobicContact CE-CG 4.5Å; M267-Q271 PolarHBondContact O-N 3.49Å
272	L	94.4	Very high	92.4	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.026	23%	0.232	C	C	.	.	I	π-helix	trans	-103.2	-10.1	-170.8	-50	-175.3	0	0	0	114.5	F264 M267 L268 R304 L305 R308	F264-L272 HydrophobicContact CD2-CD1 3.85Å; F264-L272 HydrophobicContact CE2-CD1 3.95Å; M267-L272 HydrophobicContact CB-CD1 4.21Å; M267-L272 HydrophobicContact CB-CD2 4.47Å; M267-L272 HydrophobicContact CB-CG 4.15Å; M267-L272 PolarHBondContact O-N 2.75Å; L268-L272 HydrophobicContact CB-CD1 4.42Å; L268-L272 PolarHBondContact O-N 3.11Å; L272-R304 WeakPolarHBondContact O-CD 3.5Å; L272-R304 PolarHBondContact O-NH1 3.31Å; L272-L305 HydrophobicContact CD1-CB 3.92Å; L272-L305 HydrophobicContact CD1-CD1 4.19Å; L272-L305 HydrophobicContact CD2-CB 4.41Å; L272-L305 HydrophobicContact CD2-CD1 4.47Å; L272-R308 HydrophobicContact CD2-CB 4.25Å; L272-R308 HydrophobicContact CD2-CG 4.15Å
273	L	95.6	Very high	92.7	Very high	14 Å²	14	43.8 Å²	43.8	7%	0.073	22%	0.221	C	C	.	.			trans	-99.4	136	-178.9	-60.9	174.2	0	0	0	111.8	L268 E277 Y281 Y297	L268-L273 HydrophobicContact CD2-CD1 4.15Å; L268-L273 HydrophobicContact CD2-CD2 4.43Å; L268-L273 HydrophobicContact CD2-CG 4.43Å; L268-L273 HydrophobicContact CG-CD2 4.37Å; L268-L273 HydrophobicContact CG-CG 4.39Å; L268-L273 WeakPolarHBondContact O-CG 3.34Å; L273-E277 HydrophobicContact CB-CB 4.37Å; L273-E277 HydrophobicContact CD2-CB 4.24Å; L273-Y281 HydrophobicContact CD1-CD1 3.98Å; L273-Y281 HydrophobicContact CD1-CD2 3.73Å; L273-Y281 HydrophobicContact CD1-CE2 4.43Å; L273-Y281 HydrophobicContact CD1-CG 3.46Å; L273-Y281 VanDerWaalsContact CD1-CG 3.46Å; L273-Y297 HydrophobicContact CD2-CE1 3.93Å
274	Y	95.4	Very high	92.9	Very high	60 Å²	60	41.3 Å²	41.3	24%	0.235	21%	0.212	C	C	.	.			trans	-72.6	161.6	168.6	-62.6	-61.4	0	0	0	110.9	W211 I214 T215 F276 E277	W211-Y274 AromaticContact CD1-CE1 3.67Å; W211-Y274 AromaticContact CD1-CZ 3.78Å; I214-Y274 HydrophobicContact CB-CD2 3.85Å; I214-Y274 HydrophobicContact CB-CE2 4.38Å; I214-Y274 HydrophobicContact CG1-CD2 4.12Å; I214-Y274 HydrophobicContact CG1-CE2 4.44Å; I214-Y274 HydrophobicContact CG2-CD2 3.7Å; I214-Y274 HydrophobicContact CG2-CG 4.21Å; T215-Y274 HydrophobicContact CG2-CD1 4.16Å; T215-Y274 HydrophobicContact CG2-CD2 4.38Å; T215-Y274 HydrophobicContact CG2-CG 4.04Å; Y274-F276 PolarHBondContact O-N 2.89Å; Y274-F276 VanDerWaalsContact O-N 3.15Å; Y274-E277 WeakPolarHBondContact CB-OE2 3.44Å; Y274-E277 WeakPolarHBondContact CD2-OE2 3.41Å; Y274-E277 PolarHBondContact N-OE2 3.48Å; Y274-E277 PolarHBondContact O-N 3.39Å
275	K	92.2	Very high	92.8	Very high	136 Å²	136	44.8 Å²	44.8	59%	0.591	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-54.2	-37.9	179	-168.8	-170.7	172.3	-156.5	0	111.9	E277 R278 V362	K275-E277 VanDerWaalsContact C-N 3.31Å; K275-E277 PolarHBondContact O-N 2.69Å; K275-R278 WeakPolarHBondContact O-CB 2.99Å; K275-R278 VanDerWaalsContact O-CG 3.26Å; K275-R278 WeakPolarHBondContact O-CG 3.34Å; K275-R278 PolarHBondContact O-N 2.91Å; K275-V362 PolarHBondContact NZ-OXT 2.65Å
276	F	95.2	Very high	92.9	Very high	17 Å²	17	46.3 Å²	46.3	8%	0.075	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-70.5	-22.5	-177.9	-167	-113.2	0	0	0	113.9	I214 K218 L220 Y274 R278 A353 Y357 H358 A361	I214-F276 HydrophobicContact CG2-CB 4.15Å; I214-F276 HydrophobicContact CG2-CD1 4.32Å; I214-F276 WeakPolarHBondContact O-CD1 3.29Å; K218-F276 HydrophobicContact CB-CE1 3.96Å; K218-F276 HydrophobicContact CB-CZ 3.8Å; K218-F276 HydrophobicContact CD-CD1 4.49Å; K218-F276 HydrophobicContact CD-CD2 4.16Å; K218-F276 HydrophobicContact CD-CE1 4.29Å; K218-F276 HydrophobicContact CD-CE2 3.95Å; K218-F276 HydrophobicContact CD-CG 4.43Å; K218-F276 HydrophobicContact CD-CZ 4.01Å; K218-F276 HydrophobicContact CG-CZ 4.41Å; L220-F276 HydrophobicContact CD2-CD1 3.84Å; L220-F276 HydrophobicContact CD2-CE1 3.97Å; L220-F276 HydrophobicContact CG-CD1 4.47Å; L220-F276 HydrophobicContact CG-CE1 4.11Å; Y274-F276 PolarHBondContact O-N 2.89Å; Y274-F276 VanDerWaalsContact O-N 3.15Å; F276-R278 VanDerWaalsContact C-N 3.34Å; F276-A353 HydrophobicContact CE1-CB 3.82Å; F276-A353 HydrophobicContact CZ-CB 3.7Å; F276-Y357 HydrophobicContact CD1-CE1 4.37Å; F276-Y357 HydrophobicContact CD2-CE1 4.47Å; F276-Y357 HydrophobicContact CE1-CD1 4.31Å; F276-Y357 HydrophobicContact CE1-CE1 4.03Å; F276-Y357 HydrophobicContact CE2-CD1 4.23Å; F276-Y357 HydrophobicContact CE2-CE1 4.15Å; F276-Y357 AromaticContact CZ-CD1 3.86Å; F276-Y357 HydrophobicContact CZ-CD1 3.86Å; F276-Y357 AromaticContact CZ-CE1 3.91Å; F276-Y357 HydrophobicContact CZ-CE1 3.91Å; F276-Y357 VanDerWaalsContact O-CE1 3.24Å; F276-Y357 WeakPolarHBondContact O-CE1 3.41Å; F276-Y357 PolarHBondContact O-OH 3.47Å; F276-H358 AromaticContact CZ-NE2 3.85Å; F276-A361 HydrophobicContact CD2-CB 3.55Å; F276-A361 HydrophobicContact CE2-CB 3.6Å
277	E	95.8	Very high	93.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-86.4	-5.5	178.7	-67.2	166.8	119.7	0	0	112.6	I214 L220 L273 Y274 K275 Q280 Y281 H301 R304	I214-E277 HydrophobicContact CD1-CG 4.34Å; I214-E277 HydrophobicContact CG2-CG 3.77Å; L220-E277 HydrophobicContact CD2-CG 4.11Å; L273-E277 HydrophobicContact CB-CB 4.37Å; L273-E277 HydrophobicContact CD2-CB 4.24Å; Y274-E277 WeakPolarHBondContact CB-OE2 3.44Å; Y274-E277 WeakPolarHBondContact CD2-OE2 3.41Å; Y274-E277 PolarHBondContact N-OE2 3.48Å; Y274-E277 PolarHBondContact O-N 3.39Å; K275-E277 VanDerWaalsContact C-N 3.31Å; K275-E277 PolarHBondContact O-N 2.69Å; E277-Q280 PolarHBondContact O-N 2.88Å; E277-Y281 PolarHBondContact O-N 2.76Å; E277-H301 IonicContact OE1-CD2 3.42Å; E277-H301 IonicContact OE1-CE1 2.76Å; E277-H301 IonicContact OE1-NE2 2.89Å; E277-H301 PolarHBondContact OE1-NE2 3.12Å; E277-R304 VanDerWaalsContact CD-NH1 3.34Å; E277-R304 IonicContact OE1-CZ 2.72Å; E277-R304 IonicContact OE1-NH1 3.4Å; E277-R304 PolarHBondContact OE1-NH1 2.72Å; E277-R304 VanDerWaalsContact OE1-NH1 3.11Å; E277-R304 IonicContact OE1-NH2 3.08Å; E277-R304 PolarHBondContact OE1-NH2 3.42Å; E277-R304 VanDerWaalsContact OE1-NH2 3.15Å; E277-R304 IonicContact OE2-CZ 3.41Å; E277-R304 IonicContact OE2-NH1 2.74Å; E277-R304 PolarHBondContact OE2-NH1 3.13Å; E277-R304 IonicContact OE2-NH2 3.88Å
278	R	94.8	Very high	93.3	Very high	95 Å²	95	51.1 Å²	51.1	36%	0.358	27%	0.268	S	S	.	.	H	α-helix	trans	-62	-43	-174.9	-63.4	-61	-166.3	165.5	0.7	113.7	G269 T270 K275 F276 Y281 A282	G269-R278 PolarHBondContact O-NH1 3.21Å; T270-R278 PolarHBondContact O-NH2 3.21Å; K275-R278 WeakPolarHBondContact O-CB 2.99Å; K275-R278 VanDerWaalsContact O-CG 3.26Å; K275-R278 WeakPolarHBondContact O-CG 3.34Å; K275-R278 PolarHBondContact O-N 2.91Å; F276-R278 VanDerWaalsContact C-N 3.34Å; R278-Y281 PolarHBondContact O-N 3.17Å; R278-A282 PolarHBondContact O-N 2.85Å
279	P	95.8	Very high	93	Very high	16 Å²	16	55.5 Å²	55.5	10%	0.104	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-43.7	174.9	-22.8	33.7	0	0	0	112.8	Y281 A282 E283 Y357 K360 A361	P279-Y281 VanDerWaalsContact C-N 3.3Å; P279-Y281 PolarHBondContact O-N 3.11Å; P279-A282 PolarHBondContact O-N 3.48Å; P279-A282 VanDerWaalsContact O-N 3.13Å; P279-E283 WeakPolarHBondContact O-CG 3.3Å; P279-E283 PolarHBondContact O-N 3.2Å; P279-Y357 HydrophobicContact CB-CE2 3.79Å; P279-Y357 WeakPolarHBondContact CD-OH 3.35Å; P279-Y357 HydrophobicContact CG-CE1 4.43Å; P279-K360 HydrophobicContact CB-CB 3.84Å; P279-K360 HydrophobicContact CG-CB 3.98Å; P279-K360 WeakPolarHBondContact CG-O 3.39Å; P279-A361 HydrophobicContact CG-CB 3.84Å
280	Q	95.9	Very high	93.2	Very high	22 Å²	22	62.4 Å²	62.4	10%	0.103	33%	0.331	C	S	.	.	H	α-helix	trans	-58.8	-43.6	177.2	-174.2	-174.6	50.8	0	0	111	F221 L223 E277 A282 E283 I284 Y357	F221-Q280 PolarHBondContact O-NE2 2.89Å; L223-Q280 VanDerWaalsContact CD1-CD 3.45Å; L223-Q280 HydrophobicContact CD1-CG 3.89Å; E277-Q280 PolarHBondContact O-N 2.88Å; Q280-A282 PolarHBondContact O-N 2.99Å; Q280-E283 PolarHBondContact O-N 3.3Å; Q280-I284 WeakPolarHBondContact O-CG1 3.38Å; Q280-I284 PolarHBondContact O-N 3.41Å; Q280-Y357 HydrophobicContact CB-CE2 3.76Å; Q280-Y357 VanDerWaalsContact CB-OH 3.28Å; Q280-Y357 WeakPolarHBondContact CB-OH 2.95Å; Q280-Y357 PolarHBondContact N-OH 3.38Å
281	Y	95.8	Very high	93.4	Very high	47 Å²	47	59.5 Å²	59.5	18%	0.184	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-40.9	176	174.8	-112.5	0	0	0	113	L268 G269 L273 E277 R278 P279 E283 I284 L285 M293 Y297	L268-Y281 HydrophobicContact CD2-CD2 3.83Å; L268-Y281 HydrophobicContact CD2-CE2 3.68Å; G269-Y281 VanDerWaalsContact CA-CZ 3.49Å; G269-Y281 WeakPolarHBondContact CA-OH 3.38Å; L273-Y281 HydrophobicContact CD1-CD1 3.98Å; L273-Y281 HydrophobicContact CD1-CD2 3.73Å; L273-Y281 HydrophobicContact CD1-CE2 4.43Å; L273-Y281 HydrophobicContact CD1-CG 3.46Å; L273-Y281 VanDerWaalsContact CD1-CG 3.46Å; E277-Y281 PolarHBondContact O-N 2.76Å; R278-Y281 PolarHBondContact O-N 3.17Å; P279-Y281 VanDerWaalsContact C-N 3.3Å; P279-Y281 PolarHBondContact O-N 3.11Å; Y281-E283 VanDerWaalsContact C-N 3.32Å; Y281-E283 PolarHBondContact O-N 2.86Å; Y281-I284 PolarHBondContact O-N 2.93Å; Y281-L285 HydrophobicContact CD1-CD1 4.19Å; Y281-L285 HydrophobicContact CD2-CG 4.5Å; Y281-L285 HydrophobicContact CE1-CD1 3.54Å; Y281-L285 HydrophobicContact CE1-CG 4.26Å; Y281-L285 HydrophobicContact CE2-CD1 4.17Å; Y281-L285 HydrophobicContact CE2-CD2 4.2Å; Y281-L285 HydrophobicContact CE2-CG 4.04Å; Y281-L285 WeakPolarHBondContact O-CG 3.47Å; Y281-L285 PolarHBondContact O-N 2.9Å; Y281-M293 HydrophobicContact CD2-SD 4.16Å; Y281-M293 HydrophobicContact CE2-CG 4.42Å; Y281-M293 HydrophobicContact CE2-SD 3.6Å; Y281-M293 VanDerWaalsContact CE2-SD 3.6Å; Y281-Y297 HydrophobicContact CD2-CE2 4.46Å
282	A	94.8	Very high	93.8	Very high	58 Å²	58	57.7 Å²	57.7	48%	0.479	31%	0.311	S	S	.	.	H	α-helix	trans	-64.4	-37.9	176.5	0	0	0	0	0	112.1	R278 P279 Q280 L285 A286	R278-A282 PolarHBondContact O-N 2.85Å; P279-A282 PolarHBondContact O-N 3.48Å; P279-A282 VanDerWaalsContact O-N 3.13Å; Q280-A282 PolarHBondContact O-N 2.99Å; A282-L285 PolarHBondContact O-N 3.17Å; A282-A286 PolarHBondContact O-N 3.17Å; A282-A286 VanDerWaalsContact O-N 3.15Å
283	E	94.1	Very high	93.7	Very high	67 Å²	67	58.1 Å²	58.1	31%	0.313	31%	0.313	S	S	.	.	H	α-helix	trans	-63.9	-46.3	173.8	-71.2	172.8	-174.5	0	0	111.2	P279 Q280 Y281 L285 A286 D287 K360	P279-E283 WeakPolarHBondContact O-CG 3.3Å; P279-E283 PolarHBondContact O-N 3.2Å; Q280-E283 PolarHBondContact O-N 3.3Å; Y281-E283 VanDerWaalsContact C-N 3.32Å; Y281-E283 PolarHBondContact O-N 2.86Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 2.98Å; E283-A286 WeakPolarHBondContact O-CB 3.5Å; E283-A286 PolarHBondContact O-N 3.33Å; E283-D287 PolarHBondContact O-N 3.29Å; E283-K360 IonicContact OE1-NZ 3.11Å; E283-K360 PolarHBondContact OE1-NZ 2.75Å
284	I	94.6	Very high	93.8	Very high	12 Å²	12	57.5 Å²	57.5	6%	0.062	31%	0.31	C	S	.	.	H	α-helix	trans	-58.3	-42.2	175.9	-70.3	-60.5	0	0	0	112.3	L223 Q280 Y281 A286 H288 M293 V296	L223-I284 HydrophobicContact CB-CD1 4.09Å; L223-I284 HydrophobicContact CD1-CD1 4.41Å; L223-I284 HydrophobicContact CD1-CG1 4.01Å; Q280-I284 WeakPolarHBondContact O-CG1 3.38Å; Q280-I284 PolarHBondContact O-N 3.41Å; Y281-I284 PolarHBondContact O-N 2.93Å; I284-A286 VanDerWaalsContact C-N 3.27Å; I284-A286 PolarHBondContact O-N 2.94Å; I284-H288 CarbonylContact O-C 3.42Å; I284-H288 WeakPolarHBondContact O-CA 3.38Å; I284-H288 WeakPolarHBondContact O-CB 3.17Å; I284-H288 PolarHBondContact O-N 3.35Å; I284-M293 HydrophobicContact CG2-CE 4.2Å; I284-M293 HydrophobicContact CG2-SD 4.47Å; I284-V296 HydrophobicContact CD1-CG1 3.95Å; I284-V296 HydrophobicContact CG1-CG1 4.28Å; I284-V296 HydrophobicContact CG2-CB 4.46Å; I284-V296 HydrophobicContact CG2-CG1 3.83Å; I284-V296 HydrophobicContact CG2-CG2 4.29Å
285	L	92.3	Very high	93.9	Very high	72 Å²	72	59.2 Å²	59.2	38%	0.377	32%	0.32	S	S	.	.	H	α-helix	trans	-66.5	-29.9	176.8	-72.3	-179.8	0	0	0	113	Y281 A282 E283 P289 M293	Y281-L285 HydrophobicContact CD1-CD1 4.19Å; Y281-L285 HydrophobicContact CD2-CG 4.5Å; Y281-L285 HydrophobicContact CE1-CD1 3.54Å; Y281-L285 HydrophobicContact CE1-CG 4.26Å; Y281-L285 HydrophobicContact CE2-CD1 4.17Å; Y281-L285 HydrophobicContact CE2-CD2 4.2Å; Y281-L285 HydrophobicContact CE2-CG 4.04Å; Y281-L285 WeakPolarHBondContact O-CG 3.47Å; Y281-L285 PolarHBondContact O-N 2.9Å; A282-L285 PolarHBondContact O-N 3.17Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 2.98Å; L285-P289 WeakPolarHBondContact O-CA 3.44Å; L285-M293 HydrophobicContact CD2-CE 3.83Å
286	A	94.1	Very high	94.1	Very high	74 Å²	74	53 Å²	53	61%	0.612	29%	0.294	S	S	*	.	H	α-helix	trans	-77.4	-43	177.4	0	0	0	0	0	111.9	A282 E283 I284	A282-A286 PolarHBondContact O-N 3.17Å; A282-A286 VanDerWaalsContact O-N 3.15Å; E283-A286 WeakPolarHBondContact O-CB 3.5Å; E283-A286 PolarHBondContact O-N 3.33Å; I284-A286 VanDerWaalsContact C-N 3.27Å; I284-A286 PolarHBondContact O-N 2.94Å
287	D	93.7	Very high	94.3	Very high	114 Å²	114	52.2 Å²	52.2	61%	0.61	29%	0.29	S	S	*	.	H	α-helix	trans	-78.6	-29.3	-177.2	-67	-15.8	0	0	0	112.2	E283	E283-D287 PolarHBondContact O-N 3.29Å
288	H	90.4	Very high	94.4	Very high	81 Å²	81	52.2 Å²	52.2	38%	0.375	29%	0.29	S	S	.	.			trans	-136.9	67.2	-175.5	-54.2	-52.7	0	0	0	112	I284 D290 A291	I284-H288 CarbonylContact O-C 3.42Å; I284-H288 WeakPolarHBondContact O-CA 3.38Å; I284-H288 WeakPolarHBondContact O-CB 3.17Å; I284-H288 PolarHBondContact O-N 3.35Å; H288-D290 VanDerWaalsContact C-N 3.3Å; H288-D290 PolarHBondContact O-N 2.65Å; H288-A291 HydrophobicContact CB-CB 3.77Å; H288-A291 PolarHBondContact O-N 2.72Å
289	P	87.4	Confident	94.5	Very high	92 Å²	92	47.9 Å²	47.9	60%	0.597	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.8	-172.2	25.1	-35.1	0	0	0	114.2	L285	L285-P289 WeakPolarHBondContact O-CA 3.44Å
290	D	91.1	Very high	94.6	Very high	158 Å²	158	47.4 Å²	47.4	85%	0.845	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-5.4	-177.2	-59.9	-43.5	0	0	0	113.3	H288	H288-D290 VanDerWaalsContact C-N 3.3Å; H288-D290 PolarHBondContact O-N 2.65Å
291	A	91.1	Very high	94.7	Very high	27 Å²	27	46.3 Å²	46.3	22%	0.223	27%	0.267	C	S	.	.			trans	-78.5	125.4	-176.4	0	0	0	0	0	110.7	H288 M293 V296	H288-A291 HydrophobicContact CB-CB 3.77Å; H288-A291 PolarHBondContact O-N 2.72Å; A291-M293 VanDerWaalsContact O-CE 3.28Å; A291-M293 WeakPolarHBondContact O-CE 3.41Å; A291-V296 HydrophobicContact CB-CG2 4.04Å
292	P	94.6	Very high	94.8	Very high	45 Å²	45	44.1 Å²	44.1	29%	0.292	26%	0.258	S	S	.	.			trans	-67.1	144	172.6	28.9	-34.2	0	0	0	110.1	S294 Q295	P292-S294 PolarHBondContact O-N 3.4Å; P292-S294 VanDerWaalsContact O-N 3.11Å; P292-Q295 HydrophobicContact CG-CB 4.18Å; P292-Q295 HydrophobicContact CG-CG 3.77Å; P292-Q295 PolarHBondContact O-N 3.24Å
293	M	94.1	Very high	94.9	Very high	13 Å²	13	41.5 Å²	41.5	6%	0.064	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-27.3	-176.5	-65.2	-59.6	110.9	0	0	112.9	F264 N265 L268 Y281 I284 L285 A291 Q295 V296 Y297	F264-M293 HydrophobicContact CE1-CB 4.33Å; N265-M293 PolarHBondContact OD1-N 3.26Å; L268-M293 HydrophobicContact CB-CB 4.14Å; L268-M293 HydrophobicContact CB-CG 4.3Å; L268-M293 HydrophobicContact CD1-CB 4.31Å; L268-M293 HydrophobicContact CD2-CB 3.88Å; L268-M293 HydrophobicContact CD2-CG 3.62Å; L268-M293 HydrophobicContact CD2-SD 3.65Å; L268-M293 HydrophobicContact CG-CB 4.31Å; L268-M293 HydrophobicContact CG-CG 4.45Å; Y281-M293 HydrophobicContact CD2-SD 4.16Å; Y281-M293 HydrophobicContact CE2-CG 4.42Å; Y281-M293 HydrophobicContact CE2-SD 3.6Å; Y281-M293 VanDerWaalsContact CE2-SD 3.6Å; I284-M293 HydrophobicContact CG2-CE 4.2Å; I284-M293 HydrophobicContact CG2-SD 4.47Å; L285-M293 HydrophobicContact CD2-CE 3.83Å; A291-M293 VanDerWaalsContact O-CE 3.28Å; A291-M293 WeakPolarHBondContact O-CE 3.41Å; M293-Q295 PolarHBondContact O-N 3.27Å; M293-V296 PolarHBondContact O-N 3.46Å; M293-Y297 HydrophobicContact CB-CD2 4.25Å; M293-Y297 PolarHBondContact O-N 2.97Å; M293-Y297 HydrophobicContact SD-CD2 4.1Å; M293-Y297 HydrophobicContact SD-CE2 3.69Å
294	S	97	Very high	95.1	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-20.2	174.9	68.5	0	0	0	0	114.3	V229 D230 N265 P292	V229-S294 WeakPolarHBondContact CB-O 3.29Å; V229-S294 PolarHBondContact N-O 3.46Å; V229-S294 VanDerWaalsContact N-O 3.12Å; D230-S294 PolarHBondContact N-O 3.25Å; D230-S294 WeakPolarHBondContact OD1-CB 3.46Å; D230-S294 PolarHBondContact OD1-OG 3.29Å; N265-S294 WeakPolarHBondContact OD1-CB 3.48Å; N265-S294 PolarHBondContact OD1-N 3.39Å; N265-S294 PolarHBondContact OD1-OG 2.94Å; P292-S294 PolarHBondContact O-N 3.4Å; P292-S294 VanDerWaalsContact O-N 3.11Å
295	Q	97.2	Very high	95.1	Very high	96 Å²	96	38.2 Å²	38.2	45%	0.449	22%	0.22	S	C	.	.	H	α-helix	trans	-89.2	-22.8	174.3	-72.6	178.7	0	0	0	113	N228 D230 P292 M293	N228-Q295 VanDerWaalsContact CB-O 3.24Å; N228-Q295 WeakPolarHBondContact CB-O 3.4Å; N228-Q295 PolarHBondContact ND2-O 3.02Å; N228-Q295 VanDerWaalsContact ND2-O 3.07Å; D230-Q295 HydrophobicContact CB-CG 4.48Å; D230-Q295 WeakPolarHBondContact OD2-CG 3.48Å; P292-Q295 HydrophobicContact CG-CB 4.18Å; P292-Q295 HydrophobicContact CG-CG 3.77Å; P292-Q295 PolarHBondContact O-N 3.24Å; M293-Q295 PolarHBondContact O-N 3.27Å
296	V	97.6	Very high	95.3	Very high	6 Å²	6	35 Å²	35	4%	0.036	20%	0.202	C	C	.	.	H	α-helix	trans	-93.9	-42.2	-176.5	-176.2	0	0	0	0	111.9	L223 A225 I284 A291 M293	L223-V296 HydrophobicContact CB-CG1 4.37Å; L223-V296 HydrophobicContact CD2-CG1 4.32Å; L223-V296 WeakPolarHBondContact CD2-O 3.15Å; A225-V296 VanDerWaalsContact CB-O 3.26Å; A225-V296 WeakPolarHBondContact CB-O 3.39Å; A225-V296 PolarHBondContact N-O 3.29Å; I284-V296 HydrophobicContact CD1-CG1 3.95Å; I284-V296 HydrophobicContact CG1-CG1 4.28Å; I284-V296 HydrophobicContact CG2-CB 4.46Å; I284-V296 HydrophobicContact CG2-CG1 3.83Å; I284-V296 HydrophobicContact CG2-CG2 4.29Å; A291-V296 HydrophobicContact CB-CG2 4.04Å; M293-V296 PolarHBondContact O-N 3.46Å
297	Y	98.3	Very high	95.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.194	C	C	.	.			trans	-94.3	164.2	-174.3	-73.5	-94.7	0	0	0	112.9	L223 N228 V229 L268 L273 Y281 M293 H301	L223-Y297 HydrophobicContact CD1-CD1 4.07Å; L223-Y297 HydrophobicContact CD1-CE1 3.47Å; L223-Y297 VanDerWaalsContact CD1-CE1 3.47Å; L223-Y297 HydrophobicContact CD1-CE2 4.2Å; L223-Y297 HydrophobicContact CD2-CD1 3.75Å; L223-Y297 HydrophobicContact CD2-CE1 4.04Å; L223-Y297 HydrophobicContact CD2-CG 4.1Å; L223-Y297 HydrophobicContact CG-CE1 4.39Å; N228-Y297 CarbonylContact C-O 3.48Å; N228-Y297 VanDerWaalsContact CA-O 3.23Å; N228-Y297 WeakPolarHBondContact CA-O 3.4Å; V229-Y297 WeakPolarHBondContact CG2-O 3.5Å; V229-Y297 PolarHBondContact N-O 3.49Å; L268-Y297 HydrophobicContact CD1-CD1 3.85Å; L268-Y297 HydrophobicContact CD1-CD2 3.58Å; L268-Y297 HydrophobicContact CD1-CE1 4.23Å; L268-Y297 HydrophobicContact CD1-CE2 4.01Å; L268-Y297 HydrophobicContact CD1-CG 3.5Å; L268-Y297 VanDerWaalsContact CD1-CG 3.5Å; L268-Y297 HydrophobicContact CD2-CD2 3.76Å; L268-Y297 HydrophobicContact CD2-CE1 4.4Å; L268-Y297 HydrophobicContact CD2-CE2 3.37Å; L268-Y297 HydrophobicContact CD2-CG 4.43Å; L268-Y297 HydrophobicContact CG-CD2 4.33Å; L268-Y297 HydrophobicContact CG-CE2 4.32Å; L273-Y297 HydrophobicContact CD2-CE1 3.93Å; Y281-Y297 HydrophobicContact CD2-CE2 4.46Å; M293-Y297 HydrophobicContact CB-CD2 4.25Å; M293-Y297 PolarHBondContact O-N 2.97Å; M293-Y297 HydrophobicContact SD-CD2 4.1Å; M293-Y297 HydrophobicContact SD-CE2 3.69Å; Y297-H301 HydrophobicContact CD1-CB 4.27Å; Y297-H301 AromaticContact CD1-CD2 3.71Å; Y297-H301 AromaticContact CD1-CE1 3.67Å; Y297-H301 AromaticContact CD1-CG 3.55Å; Y297-H301 AromaticContact CD1-ND1 3.55Å; Y297-H301 AromaticContact CD1-NE2 3.77Å; Y297-H301 AromaticContact CE1-CD2 3.96Å; Y297-H301 AromaticContact CE1-NE2 3.85Å
298	G	97.6	Very high	94.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-118.1	-162.4	-173.1	0	0	0	0	0	115.3	P300 L302	G298-P300 VanDerWaalsContact C-CD 3.48Å; G298-L302 PolarHBondContact O-N 3.03Å
299	A	97.7	Very high	94.6	Very high	4 Å²	4	32.5 Å²	32.5	3%	0.033	17%	0.173	C	C	.	.	H	α-helix	trans	-58.2	-39.2	-175.3	0	0	0	0	0	115.4	I232 H301 L302 L303 L344 F345	I232-A299 HydrophobicContact CD1-CB 3.68Å; A299-H301 PolarHBondContact O-N 3.15Å; A299-L302 WeakPolarHBondContact O-CB 3.49Å; A299-L302 PolarHBondContact O-N 3.34Å; A299-L303 PolarHBondContact O-N 2.87Å; A299-L344 HydrophobicContact CB-CB 3.92Å; A299-L344 HydrophobicContact CB-CD2 4.45Å; A299-L344 WeakPolarHBondContact CB-O 3.44Å; A299-F345 HydrophobicContact CB-CD1 4.23Å; A299-F345 HydrophobicContact CB-CE1 3.82Å; A299-F345 HydrophobicContact CB-CZ 4.23Å
300	P	97.4	Very high	94.4	Very high	6 Å²	6	28.3 Å²	28.3	4%	0.039	15%	0.147	C	C	.	.	H	α-helix	trans	-60.1	-49	-178.9	-26.2	36.5	0	0	0	112.5	F221 G298 L302 L303 R304 F345 Y350	F221-P300 HydrophobicContact CD2-CG 3.91Å; F221-P300 HydrophobicContact CE2-CG 3.63Å; F221-P300 HydrophobicContact CZ-CG 4.38Å; G298-P300 VanDerWaalsContact C-CD 3.48Å; P300-L302 VanDerWaalsContact C-N 3.32Å; P300-L302 PolarHBondContact O-N 3.03Å; P300-L303 WeakPolarHBondContact O-CB 3.15Å; P300-L303 PolarHBondContact O-N 3.26Å; P300-R304 WeakPolarHBondContact O-CG 3.29Å; P300-R304 PolarHBondContact O-N 3.25Å; P300-R304 VanDerWaalsContact O-N 3.13Å; P300-F345 HydrophobicContact CG-CD1 4.36Å; P300-Y350 WeakPolarHBondContact CB-OH 3.21Å; P300-Y350 VanDerWaalsContact CG-OH 3.26Å; P300-Y350 WeakPolarHBondContact CG-OH 3.43Å
301	H	98.4	Very high	94	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.9	-38	177.5	-55.7	82.8	0	0	0	111.7	F221 F264 L268 E277 Y297 A299 L303 R304 L305	F221-H301 AromaticContact CG-CE1 3.91Å; F264-H301 HydrophobicContact CE2-CB 3.9Å; F264-H301 HydrophobicContact CZ-CB 3.87Å; L268-H301 HydrophobicContact CD1-CB 4.21Å; E277-H301 IonicContact OE1-CD2 3.42Å; E277-H301 IonicContact OE1-CE1 2.76Å; E277-H301 IonicContact OE1-NE2 2.89Å; E277-H301 PolarHBondContact OE1-NE2 3.12Å; Y297-H301 HydrophobicContact CD1-CB 4.27Å; Y297-H301 AromaticContact CD1-CD2 3.71Å; Y297-H301 AromaticContact CD1-CE1 3.67Å; Y297-H301 AromaticContact CD1-CG 3.55Å; Y297-H301 AromaticContact CD1-ND1 3.55Å; Y297-H301 AromaticContact CD1-NE2 3.77Å; Y297-H301 AromaticContact CE1-CD2 3.96Å; Y297-H301 AromaticContact CE1-NE2 3.85Å; A299-H301 PolarHBondContact O-N 3.15Å; H301-L303 VanDerWaalsContact C-N 3.3Å; H301-L303 PolarHBondContact O-N 3.46Å; H301-R304 PolarHBondContact CD2-NH1 2.98Å; H301-R304 WeakPolarHBondContact O-CB 3.12Å; H301-R304 PolarHBondContact O-N 2.87Å; H301-L305 PolarHBondContact O-N 3.43Å
302	L	98.1	Very high	93.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.6	-39.6	174.5	-178.4	60.2	0	0	0	111.7	V229 I232 I260 F264 G298 A299 P300 R304 L305 F306 F333	V229-L302 HydrophobicContact CG1-CD1 3.85Å; V229-L302 HydrophobicContact CG1-CD2 4Å; V229-L302 HydrophobicContact CG1-CG 4.38Å; V229-L302 HydrophobicContact CG2-CB 3.87Å; V229-L302 HydrophobicContact CG2-CD1 4.47Å; V229-L302 HydrophobicContact CG2-CD2 4.33Å; V229-L302 HydrophobicContact CG2-CG 4.45Å; I232-L302 HydrophobicContact CG2-CD2 4.1Å; I260-L302 HydrophobicContact CG2-CD1 3.81Å; F264-L302 HydrophobicContact CD2-CD1 4.08Å; F264-L302 HydrophobicContact CE2-CB 4.33Å; G298-L302 PolarHBondContact O-N 3.03Å; A299-L302 WeakPolarHBondContact O-CB 3.49Å; A299-L302 PolarHBondContact O-N 3.34Å; P300-L302 VanDerWaalsContact C-N 3.32Å; P300-L302 PolarHBondContact O-N 3.03Å; L302-R304 VanDerWaalsContact C-N 3.33Å; L302-R304 PolarHBondContact O-N 3.13Å; L302-L305 HydrophobicContact CD1-CD2 4.32Å; L302-L305 VanDerWaalsContact O-CB 3.24Å; L302-L305 WeakPolarHBondContact O-CB 3.41Å; L302-L305 PolarHBondContact O-N 3.44Å; L302-F306 HydrophobicContact CD1-CE2 4.2Å; L302-F306 HydrophobicContact CG-CE2 4.23Å; L302-F306 VanDerWaalsContact O-CD2 3.24Å; L302-F306 WeakPolarHBondContact O-CD2 3.46Å; L302-F333 HydrophobicContact CD2-CE1 4.06Å; L302-F333 HydrophobicContact CD2-CZ 3.89Å; L302-F333 HydrophobicContact CG-CE1 4.47Å
303	L	97.4	Very high	92.6	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-64.8	-38.1	176.3	-176.9	58.7	0	0	0	111.6	L203 L207 A299 P300 H301 L305 F306 L334 L337 F345	L203-L303 HydrophobicContact CB-CD1 4.32Å; L203-L303 HydrophobicContact CB-CD2 4.13Å; L203-L303 HydrophobicContact CD1-CD1 3.79Å; L203-L303 HydrophobicContact CD2-CD2 4.46Å; L207-L303 HydrophobicContact CD2-CD2 4.03Å; L207-L303 HydrophobicContact CD2-CG 3.92Å; L207-L303 HydrophobicContact CG-CD2 3.9Å; L207-L303 HydrophobicContact CG-CG 4.16Å; A299-L303 PolarHBondContact O-N 2.87Å; P300-L303 WeakPolarHBondContact O-CB 3.15Å; P300-L303 PolarHBondContact O-N 3.26Å; H301-L303 VanDerWaalsContact C-N 3.3Å; H301-L303 PolarHBondContact O-N 3.46Å; L303-L305 PolarHBondContact O-N 3.38Å; L303-F306 PolarHBondContact O-N 3Å; L303-F306 VanDerWaalsContact O-N 3.15Å; L303-L334 HydrophobicContact CD1-CD2 3.93Å; L303-L337 HydrophobicContact CD1-CD1 4.41Å; L303-F345 HydrophobicContact CB-CE1 4.03Å; L303-F345 HydrophobicContact CB-CZ 4.18Å; L303-F345 HydrophobicContact CD2-CE1 3.83Å; L303-F345 HydrophobicContact CD2-CZ 3.81Å; L303-F345 HydrophobicContact CG-CZ 4.48Å
304	R	97	Very high	91.7	Very high	11 Å²	11	22 Å²	22	4%	0.042	11%	0.112	C	C	.	.	H	α-helix	trans	-60.1	-32.1	174.9	-62.3	176.8	-165.4	169.4	6.2	112.4	L207 D210 L272 E277 P300 H301 L302 F306 V307 R308	L207-R304 HydrophobicContact CD2-CG 4.39Å; D210-R304 VanDerWaalsContact CG-NH2 3.31Å; D210-R304 IonicContact OD1-CZ 3.71Å; D210-R304 IonicContact OD1-NE 3.12Å; D210-R304 IonicContact OD1-NH2 3.02Å; D210-R304 PolarHBondContact OD1-NH2 3.29Å; D210-R304 IonicContact OD2-CZ 3.15Å; D210-R304 VanDerWaalsContact OD2-CZ 3.27Å; D210-R304 IonicContact OD2-NE 2.72Å; D210-R304 PolarHBondContact OD2-NE 3.11Å; D210-R304 IonicContact OD2-NH2 3.03Å; D210-R304 PolarHBondContact OD2-NH2 3.22Å; D210-R304 VanDerWaalsContact OD2-NH2 3.12Å; L272-R304 WeakPolarHBondContact O-CD 3.5Å; L272-R304 PolarHBondContact O-NH1 3.31Å; E277-R304 VanDerWaalsContact CD-NH1 3.34Å; E277-R304 IonicContact OE1-CZ 2.72Å; E277-R304 IonicContact OE1-NH1 3.4Å; E277-R304 PolarHBondContact OE1-NH1 2.72Å; E277-R304 VanDerWaalsContact OE1-NH1 3.11Å; E277-R304 IonicContact OE1-NH2 3.08Å; E277-R304 PolarHBondContact OE1-NH2 3.42Å; E277-R304 VanDerWaalsContact OE1-NH2 3.15Å; E277-R304 IonicContact OE2-CZ 3.41Å; E277-R304 IonicContact OE2-NH1 2.74Å; E277-R304 PolarHBondContact OE2-NH1 3.13Å; E277-R304 IonicContact OE2-NH2 3.88Å; P300-R304 WeakPolarHBondContact O-CG 3.29Å; P300-R304 PolarHBondContact O-N 3.25Å; P300-R304 VanDerWaalsContact O-N 3.13Å; H301-R304 PolarHBondContact CD2-NH1 2.98Å; H301-R304 WeakPolarHBondContact O-CB 3.12Å; H301-R304 PolarHBondContact O-N 2.87Å; L302-R304 VanDerWaalsContact C-N 3.33Å; L302-R304 PolarHBondContact O-N 3.13Å; R304-F306 VanDerWaalsContact C-N 3.29Å; R304-F306 PolarHBondContact O-N 2.97Å; R304-V307 WeakPolarHBondContact O-CB 3.49Å; R304-V307 PolarHBondContact O-N 3.3Å; R304-V307 VanDerWaalsContact O-N 3.13Å; R304-R308 PolarHBondContact O-N 2.94Å
305	L	95.9	Very high	90.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-54.8	-45.8	174.5	176.1	63.4	0	0	0	111.3	I260 F264 M267 L272 H301 L302 L303 V307 R308 I309	I260-L305 HydrophobicContact CG2-CD2 4.04Å; F264-L305 HydrophobicContact CB-CD2 4.02Å; F264-L305 HydrophobicContact CD2-CB 4.39Å; F264-L305 HydrophobicContact CD2-CD2 4.32Å; M267-L305 HydrophobicContact CB-CD1 4.24Å; M267-L305 HydrophobicContact CE-CD1 4.28Å; M267-L305 HydrophobicContact CG-CD1 4.39Å; M267-L305 HydrophobicContact SD-CD1 3.44Å; M267-L305 WeakPolarHBondContact SD-CD1 3.46Å; L272-L305 HydrophobicContact CD1-CB 3.92Å; L272-L305 HydrophobicContact CD1-CD1 4.19Å; L272-L305 HydrophobicContact CD2-CB 4.41Å; L272-L305 HydrophobicContact CD2-CD1 4.47Å; H301-L305 PolarHBondContact O-N 3.43Å; L302-L305 HydrophobicContact CD1-CD2 4.32Å; L302-L305 VanDerWaalsContact O-CB 3.24Å; L302-L305 WeakPolarHBondContact O-CB 3.41Å; L302-L305 PolarHBondContact O-N 3.44Å; L303-L305 PolarHBondContact O-N 3.38Å; L305-V307 PolarHBondContact O-N 2.97Å; L305-R308 CarbonylContact O-C 3.54Å; L305-R308 PolarHBondContact O-N 3.11Å; L305-I309 HydrophobicContact CD1-CB 4.24Å; L305-I309 HydrophobicContact CD1-CD1 4.4Å; L305-I309 HydrophobicContact CD1-CG1 4.49Å; L305-I309 HydrophobicContact CD2-CD1 4.44Å; L305-I309 HydrophobicContact CG-CB 4.37Å; L305-I309 HydrophobicContact CG-CD1 4.31Å; L305-I309 WeakPolarHBondContact O-CB 3.37Å; L305-I309 PolarHBondContact O-N 3.3Å
306	F	94.8	Very high	89.6	Confident	3 Å²	3	23.9 Å²	23.9	1%	0.013	12%	0.121	C	C	.	.	H	α-helix	trans	-67.6	-18.3	-177.2	-66.8	-85.2	0	0	0	113.9	V197 I199 I260 L302 L303 R304 I309 L330 F333 L334 L337	V197-F306 HydrophobicContact CG1-CD1 4.47Å; I199-F306 HydrophobicContact CD1-CB 3.69Å; I260-F306 HydrophobicContact CD1-CE1 4.47Å; I260-F306 HydrophobicContact CD1-CZ 4.07Å; I260-F306 HydrophobicContact CG1-CZ 4.33Å; I260-F306 HydrophobicContact CG2-CZ 4.19Å; L302-F306 HydrophobicContact CD1-CE2 4.2Å; L302-F306 HydrophobicContact CG-CE2 4.23Å; L302-F306 VanDerWaalsContact O-CD2 3.24Å; L302-F306 WeakPolarHBondContact O-CD2 3.46Å; L303-F306 PolarHBondContact O-N 3Å; L303-F306 VanDerWaalsContact O-N 3.15Å; R304-F306 VanDerWaalsContact C-N 3.29Å; R304-F306 PolarHBondContact O-N 2.97Å; F306-I309 HydrophobicContact CD1-CG2 4.48Å; F306-L330 HydrophobicContact CE1-CB 4.36Å; F306-L330 HydrophobicContact CE1-CD2 3.93Å; F306-F333 HydrophobicContact CE1-CD1 4.04Å; F306-F333 AromaticContact CE2-CD1 3.74Å; F306-F333 HydrophobicContact CE2-CD1 3.74Å; F306-F333 AromaticContact CE2-CE1 3.61Å; F306-F333 HydrophobicContact CE2-CE1 3.61Å; F306-F333 AromaticContact CZ-CD1 3.26Å; F306-F333 HydrophobicContact CZ-CD1 3.26Å; F306-F333 AromaticContact CZ-CE1 3.52Å; F306-F333 HydrophobicContact CZ-CE1 3.52Å; F306-F333 HydrophobicContact CZ-CG 4.39Å; F306-L334 HydrophobicContact CB-CD1 4.27Å; F306-L334 HydrophobicContact CB-CD2 3.85Å; F306-L334 HydrophobicContact CB-CG 4.46Å; F306-L334 HydrophobicContact CD1-CD1 4.03Å; F306-L334 HydrophobicContact CD1-CD2 4.1Å; F306-L334 HydrophobicContact CD1-CG 3.97Å; F306-L334 HydrophobicContact CD2-CD2 3.92Å; F306-L334 HydrophobicContact CE1-CG 4.41Å; F306-L334 HydrophobicContact CG-CD1 4.27Å; F306-L334 HydrophobicContact CG-CD2 3.68Å; F306-L334 HydrophobicContact CG-CG 4.08Å; F306-L337 HydrophobicContact CE2-CD1 4.47Å
307	V	91.5	Very high	88.5	Confident	71 Å²	71	29.1 Å²	29.1	43%	0.43	16%	0.155	S	C	.	.	H	α-helix	trans	-75.9	-27.5	171.9	-176.7	0	0	0	0	111.3	I199 L207 R304 L305	I199-V307 HydrophobicContact CD1-CG2 4.39Å; I199-V307 HydrophobicContact CG1-CG2 4.4Å; L207-V307 HydrophobicContact CD1-CG2 3.7Å; L207-V307 HydrophobicContact CD2-CG2 4.12Å; R304-V307 WeakPolarHBondContact O-CB 3.49Å; R304-V307 PolarHBondContact O-N 3.3Å; R304-V307 VanDerWaalsContact O-N 3.13Å; L305-V307 PolarHBondContact O-N 2.97Å
308	R	87.8	Confident	87.4	Confident	142 Å²	142	32.2 Å²	32.2	54%	0.536	17%	0.171	S	C	.	.	H	α-helix	trans	-105.6	-28.1	-175.4	-64.4	-60.7	-173.3	-173.3	-0.1	114.4	M267 L272 R304 L305 G310 A311	M267-R308 HydrophobicContact CE-CB 3.81Å; L272-R308 HydrophobicContact CD2-CB 4.25Å; L272-R308 HydrophobicContact CD2-CG 4.15Å; R304-R308 PolarHBondContact O-N 2.94Å; L305-R308 CarbonylContact O-C 3.54Å; L305-R308 PolarHBondContact O-N 3.11Å; R308-G310 PolarHBondContact O-N 2.94Å; R308-G310 VanDerWaalsContact O-N 3.13Å; R308-A311 PolarHBondContact O-N 2.82Å
309	I	85.5	Confident	86.6	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-25.9	-172.8	-159.5	171.4	0	0	0	112.9	V197 Y263 L305 F306 A311 M312 L313	V197-I309 HydrophobicContact CG2-CG2 3.96Å; Y263-I309 HydrophobicContact CD1-CD1 4.36Å; Y263-I309 HydrophobicContact CD1-CG1 4.25Å; Y263-I309 HydrophobicContact CD2-CD1 4.29Å; Y263-I309 HydrophobicContact CG-CD1 4.03Å; Y263-I309 HydrophobicContact CG-CG1 4.42Å; L305-I309 HydrophobicContact CD1-CB 4.24Å; L305-I309 HydrophobicContact CD1-CD1 4.4Å; L305-I309 HydrophobicContact CD1-CG1 4.49Å; L305-I309 HydrophobicContact CD2-CD1 4.44Å; L305-I309 HydrophobicContact CG-CB 4.37Å; L305-I309 HydrophobicContact CG-CD1 4.31Å; L305-I309 WeakPolarHBondContact O-CB 3.37Å; L305-I309 PolarHBondContact O-N 3.3Å; F306-I309 HydrophobicContact CD1-CG2 4.48Å; I309-A311 VanDerWaalsContact C-N 3.28Å; I309-A311 PolarHBondContact O-N 3.19Å; I309-M312 WeakPolarHBondContact O-CA 3.46Å; I309-M312 WeakPolarHBondContact O-CB 3.37Å; I309-M312 PolarHBondContact O-N 3.06Å; I309-L313 HydrophobicContact CG1-CG 4.37Å; I309-L313 WeakPolarHBondContact O-CG 3.49Å; I309-L313 PolarHBondContact O-N 2.89Å
310	G	83.4	Confident	85.9	Confident	4 Å²	4	44.5 Å²	44.5	4%	0.041	23%	0.23	C	C	.	.	H	α-helix	trans	-57.4	-38	177.9	0	0	0	0	0	114.1	V195 R308	V195-G310 PolarHBondContact N-O 3.29Å; V195-G310 CarbonylContact O-C 3.41Å; V195-G310 WeakPolarHBondContact O-CA 3.45Å; R308-G310 PolarHBondContact O-N 2.94Å; R308-G310 VanDerWaalsContact O-N 3.13Å
311	A	81.7	Confident	85.3	Confident	36 Å²	36	52.4 Å²	52.4	30%	0.298	26%	0.264	S	S	.	.	H	α-helix	trans	-68.2	-36.9	173.6	0	0	0	0	0	111.6	R308 I309 A314 Y315	R308-A311 PolarHBondContact O-N 2.82Å; I309-A311 VanDerWaalsContact C-N 3.28Å; I309-A311 PolarHBondContact O-N 3.19Å; A311-A314 WeakPolarHBondContact O-CB 3.43Å; A311-A314 PolarHBondContact O-N 3.3Å; A311-Y315 WeakPolarHBondContact O-CD2 3.28Å; A311-Y315 WeakPolarHBondContact O-CE2 3.36Å
312	M	77.8	Confident	84.7	Confident	56 Å²	56	54.8 Å²	54.8	28%	0.276	28%	0.281	S	S	.	.	H	α-helix	trans	-70.8	-35.6	180	-62.3	-57	-65.8	0	0	112.9	Y263 M267 I309 A314 Y315	Y263-M312 HydrophobicContact CD1-CB 4.47Å; Y263-M312 HydrophobicContact CE1-CB 3.81Å; Y263-M312 HydrophobicContact CE1-CG 4.46Å; M267-M312 HydrophobicContact CE-CG 3.57Å; M267-M312 HydrophobicContact CE-SD 4.42Å; M267-M312 HydrophobicContact SD-CG 3.76Å; I309-M312 WeakPolarHBondContact O-CA 3.46Å; I309-M312 WeakPolarHBondContact O-CB 3.37Å; I309-M312 PolarHBondContact O-N 3.06Å; M312-A314 PolarHBondContact O-N 3.12Å; M312-Y315 PolarHBondContact O-N 3.25Å; M312-Y315 VanDerWaalsContact O-N 3.07Å
313	L	79.3	Confident	84	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.042	29%	0.291	C	S	.	.	H	α-helix	trans	-64.6	-26.4	178.4	-68.7	178.6	0	0	0	112.8	V195 V197 I309 Y315 T316 L326 L327 L330	V195-L313 HydrophobicContact CB-CB 4.07Å; V195-L313 HydrophobicContact CG1-CB 4.46Å; V195-L313 HydrophobicContact CG1-CD1 4.31Å; V195-L313 HydrophobicContact CG2-CB 4.08Å; V197-L313 HydrophobicContact CG2-CD1 4.38Å; I309-L313 HydrophobicContact CG1-CG 4.37Å; I309-L313 WeakPolarHBondContact O-CG 3.49Å; I309-L313 PolarHBondContact O-N 2.89Å; L313-Y315 PolarHBondContact O-N 2.97Å; L313-T316 PolarHBondContact O-N 3.37Å; L313-L326 HydrophobicContact CD1-CD2 4.43Å; L313-L326 HydrophobicContact CD2-CD2 3.71Å; L313-L327 HydrophobicContact CD1-CD2 4.49Å; L313-L330 HydrophobicContact CD1-CD1 3.83Å
314	A	75.6	Confident	83.5	Confident	10 Å²	10	58.9 Å²	58.9	8%	0.083	31%	0.309	C	S	.	.	H	α-helix	trans	-61.1	-32.7	174.1	0	0	0	0	0	111.7	R192 A311 M312	R192-A314 HydrophobicContact CB-CB 4.06Å; R192-A314 WeakPolarHBondContact CD-O 3.03Å; R192-A314 PolarHBondContact NH1-O 2.96Å; A311-A314 WeakPolarHBondContact O-CB 3.43Å; A311-A314 PolarHBondContact O-N 3.3Å; M312-A314 PolarHBondContact O-N 3.12Å
315	Y	73.1	Confident	83	Confident	98 Å²	98	62.9 Å²	62.9	38%	0.384	33%	0.331	S	S	.	.	H	α-helix	trans	-84.8	-10.1	-179.2	-54.9	-70.9	0	0	0	113.7	F189 A311 M312 L313	F189-Y315 HydrophobicContact CD1-CD1 4.12Å; F189-Y315 AromaticContact CE1-CD1 3.54Å; F189-Y315 HydrophobicContact CE1-CD1 3.54Å; F189-Y315 HydrophobicContact CE1-CE1 4.26Å; F189-Y315 HydrophobicContact CE1-CG 4.44Å; F189-Y315 AromaticContact CZ-CD1 3.94Å; F189-Y315 HydrophobicContact CZ-CD1 3.94Å; A311-Y315 WeakPolarHBondContact O-CD2 3.28Å; A311-Y315 WeakPolarHBondContact O-CE2 3.36Å; M312-Y315 PolarHBondContact O-N 3.25Å; M312-Y315 VanDerWaalsContact O-N 3.07Å; L313-Y315 PolarHBondContact O-N 2.97Å
316	T	75.7	Confident	82.6	Confident	40 Å²	40	64.7 Å²	64.7	25%	0.245	34%	0.34	C	S	.	.	S	Bend	trans	-83.8	128.3	179.1	-51.3	0	0	0	0	109.7	Y263 L313 L318	Y263-T316 PolarHBondContact OH-OG1 3.41Å; Y263-T316 VanDerWaalsContact OH-OG1 3.1Å; L313-T316 PolarHBondContact O-N 3.37Å; T316-L318 VanDerWaalsContact C-N 3.29Å; T316-L318 HydrophobicContact CG2-CD1 4.13Å; T316-L318 HydrophobicContact CG2-CD2 4.23Å; T316-L318 HydrophobicContact CG2-CG 3.81Å; T316-L318 PolarHBondContact O-N 3.11Å
317	P	73.8	Confident	82.4	Confident	115 Å²	115	66.1 Å²	66.1	75%	0.747	35%	0.348	S	S	*	.			trans	-73.8	82.2	178.7	31.2	-34.8	0	0	0	110.6
318	L	75.5	Confident	82.4	Confident	66 Å²	66	67.9 Å²	67.9	35%	0.346	36%	0.355	S	S	.	.			trans	-111.3	137.5	174.8	-62.9	173.8	0	0	0	109.8	T316 L323 L326	T316-L318 VanDerWaalsContact C-N 3.29Å; T316-L318 HydrophobicContact CG2-CD1 4.13Å; T316-L318 HydrophobicContact CG2-CD2 4.23Å; T316-L318 HydrophobicContact CG2-CG 3.81Å; T316-L318 PolarHBondContact O-N 3.11Å; L318-L323 HydrophobicContact CB-CB 4.27Å; L318-L323 HydrophobicContact CD1-CD1 4.16Å; L318-L326 HydrophobicContact CD1-CD2 3.66Å
319	D	80.6	Confident	82.6	Confident	89 Å²	89	62.7 Å²	62.7	48%	0.476	34%	0.336	S	S	.	.			trans	-72.5	160.1	167.6	71.2	-58	0	0	0	110.6	K321 S322 L323	D319-K321 PolarHBondContact O-N 3.22Å; D319-K321 VanDerWaalsContact O-N 3.14Å; D319-K321 WeakPolarHBondContact OD2-CB 3.45Å; D319-S322 PolarHBondContact O-N 2.98Å; D319-S322 VanDerWaalsContact O-N 3.15Å; D319-S322 WeakPolarHBondContact OD1-CB 3.38Å; D319-S322 PolarHBondContact OD1-OG 2.92Å; D319-L323 WeakPolarHBondContact O-CB 3.26Å; D319-L323 PolarHBondContact O-N 3.38Å
320	E	83.1	Confident	83	Confident	172 Å²	172	62.7 Å²	62.7	80%	0.804	34%	0.336	S	S	*	.	H	α-helix	trans	-56.6	-35.4	-173.9	-171	177.5	-173.3	0	0	113	A324	E320-A324 WeakPolarHBondContact O-CB 3.5Å; E320-A324 PolarHBondContact O-N 3.48Å
321	K	84.8	Confident	83.5	Confident	173 Å²	173	64.6 Å²	64.6	75%	0.752	34%	0.343	S	S	*	.	H	α-helix	trans	-71.1	-46.1	179.4	-62.9	178.1	-179.5	174.3	0	111.4	D319 L323 A324 L325	D319-K321 PolarHBondContact O-N 3.22Å; D319-K321 VanDerWaalsContact O-N 3.14Å; D319-K321 WeakPolarHBondContact OD2-CB 3.45Å; K321-L323 VanDerWaalsContact C-N 3.34Å; K321-A324 PolarHBondContact O-N 3.14Å; K321-L325 WeakPolarHBondContact O-CB 3.39Å; K321-L325 PolarHBondContact O-N 2.9Å
322	S	85.6	Confident	84.2	Confident	50 Å²	50	65.2 Å²	65.2	35%	0.35	34%	0.342	S	S	.	.	H	α-helix	trans	-66.5	-37.6	177.2	-58.2	0	0	0	0	111.5	D319 L325 L326	D319-S322 PolarHBondContact O-N 2.98Å; D319-S322 VanDerWaalsContact O-N 3.15Å; D319-S322 WeakPolarHBondContact OD1-CB 3.38Å; D319-S322 PolarHBondContact OD1-OG 2.92Å; S322-L325 PolarHBondContact O-N 3.15Å; S322-L326 WeakPolarHBondContact O-CB 3.46Å; S322-L326 PolarHBondContact O-N 3.37Å
323	L	84.6	Confident	85.1	Confident	41 Å²	41	62.6 Å²	62.6	22%	0.215	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-45.4	174.7	-177.7	62.2	0	0	0	111.7	V195 L318 D319 K321 L325 L326 L327	V195-L323 HydrophobicContact CG1-CD1 4.11Å; V195-L323 HydrophobicContact CG2-CD1 4.25Å; V195-L323 HydrophobicContact CG2-CD2 4.11Å; L318-L323 HydrophobicContact CB-CB 4.27Å; L318-L323 HydrophobicContact CD1-CD1 4.16Å; D319-L323 WeakPolarHBondContact O-CB 3.26Å; D319-L323 PolarHBondContact O-N 3.38Å; K321-L323 VanDerWaalsContact C-N 3.34Å; L323-L325 VanDerWaalsContact C-N 3.33Å; L323-L325 PolarHBondContact O-N 2.91Å; L323-L326 PolarHBondContact O-N 3.14Å; L323-L327 HydrophobicContact CG-CD1 4.31Å; L323-L327 WeakPolarHBondContact O-CB 3.14Å; L323-L327 WeakPolarHBondContact O-CG 3.34Å; L323-L327 PolarHBondContact O-N 3.44Å
324	A	87.1	Confident	85.9	Confident	48 Å²	48	62.2 Å²	62.2	40%	0.397	33%	0.327	S	S	.	.	H	α-helix	trans	-62.3	-40.9	175.8	0	0	0	0	0	111.8	E320 K321 L327 N328	E320-A324 WeakPolarHBondContact O-CB 3.5Å; E320-A324 PolarHBondContact O-N 3.48Å; K321-A324 PolarHBondContact O-N 3.14Å; A324-L327 PolarHBondContact O-N 2.82Å; A324-N328 VanDerWaalsContact O-CG 3.25Å; A324-N328 PolarHBondContact O-N 3.46Å; A324-N328 PolarHBondContact O-ND2 3.39Å
325	L	86.5	Confident	86.9	Confident	94 Å²	94	67.6 Å²	67.6	49%	0.492	35%	0.348	S	S	.	.	H	α-helix	trans	-64	-47	176.2	-176	62	0	0	0	111.5	K321 S322 L323 L327 N328 Y329	K321-L325 WeakPolarHBondContact O-CB 3.39Å; K321-L325 PolarHBondContact O-N 2.9Å; S322-L325 PolarHBondContact O-N 3.15Å; L323-L325 VanDerWaalsContact C-N 3.33Å; L323-L325 PolarHBondContact O-N 2.91Å; L325-L327 PolarHBondContact O-N 3.39Å; L325-N328 WeakPolarHBondContact O-CB 3.23Å; L325-N328 PolarHBondContact O-N 2.97Å; L325-Y329 HydrophobicContact CD1-CD2 4.18Å; L325-Y329 HydrophobicContact CD1-CE2 3.67Å; L325-Y329 HydrophobicContact CD2-CE2 4.41Å; L325-Y329 HydrophobicContact CG-CD2 4.1Å; L325-Y329 HydrophobicContact CG-CE2 3.81Å; L325-Y329 VanDerWaalsContact O-CD2 3.24Å; L325-Y329 WeakPolarHBondContact O-CD2 3.48Å; L325-Y329 PolarHBondContact O-N 2.95Å; L325-Y329 VanDerWaalsContact O-N 3.13Å
326	L	87.8	Confident	88	Confident	39 Å²	39	64 Å²	64	20%	0.204	33%	0.334	C	S	.	.	H	α-helix	trans	-57.7	-48.9	175.7	177.4	61.2	0	0	0	110.9	V256 L313 L318 S322 L323 N328 Y329 L330	V256-L326 HydrophobicContact CG2-CD1 4.1Å; L313-L326 HydrophobicContact CD1-CD2 4.43Å; L313-L326 HydrophobicContact CD2-CD2 3.71Å; L318-L326 HydrophobicContact CD1-CD2 3.66Å; S322-L326 WeakPolarHBondContact O-CB 3.46Å; S322-L326 PolarHBondContact O-N 3.37Å; L323-L326 PolarHBondContact O-N 3.14Å; L326-N328 VanDerWaalsContact C-N 3.27Å; L326-N328 PolarHBondContact O-N 3.19Å; L326-Y329 PolarHBondContact O-N 3.04Å; L326-L330 HydrophobicContact CD1-CD1 4.43Å; L326-L330 HydrophobicContact CD1-CD2 4.33Å; L326-L330 HydrophobicContact CD1-CG 4.19Å; L326-L330 HydrophobicContact CG-CD1 4.14Å; L326-L330 HydrophobicContact CG-CG 4.3Å; L326-L330 WeakPolarHBondContact O-CG 3.23Å; L326-L330 PolarHBondContact O-N 3.48Å
327	L	90.1	Very high	89.1	Confident	32 Å²	32	62.1 Å²	62.1	17%	0.168	32%	0.323	C	S	.	.	H	α-helix	trans	-59.1	-37.6	178	-75.2	173.9	0	0	0	112.7	V195 V197 L313 L323 A324 L325 Y329 L330 H331	V195-L327 HydrophobicContact CG1-CD1 3.83Å; V195-L327 HydrophobicContact CG1-CD2 3.73Å; V195-L327 HydrophobicContact CG1-CG 4.17Å; V197-L327 HydrophobicContact CG2-CD2 4.1Å; L313-L327 HydrophobicContact CD1-CD2 4.49Å; L323-L327 HydrophobicContact CG-CD1 4.31Å; L323-L327 WeakPolarHBondContact O-CB 3.14Å; L323-L327 WeakPolarHBondContact O-CG 3.34Å; L323-L327 PolarHBondContact O-N 3.44Å; A324-L327 PolarHBondContact O-N 2.82Å; L325-L327 PolarHBondContact O-N 3.39Å; L327-Y329 VanDerWaalsContact C-N 3.35Å; L327-L330 HydrophobicContact CD2-CD1 4.48Å; L327-L330 PolarHBondContact O-N 2.93Å; L327-H331 WeakPolarHBondContact O-CB 3.48Å; L327-H331 PolarHBondContact O-CD2 3.34Å; L327-H331 VanDerWaalsContact O-CG 3.24Å; L327-H331 PolarHBondContact O-N 3.13Å
328	N	90.8	Very high	90.2	Very high	108 Å²	108	57.3 Å²	57.3	58%	0.578	29%	0.293	S	S	*	.	H	α-helix	trans	-61.9	-42.7	174.4	-72.6	-32	0	0	0	111.8	A324 L325 L326 D332	A324-N328 VanDerWaalsContact O-CG 3.25Å; A324-N328 PolarHBondContact O-N 3.46Å; A324-N328 PolarHBondContact O-ND2 3.39Å; L325-N328 WeakPolarHBondContact O-CB 3.23Å; L325-N328 PolarHBondContact O-N 2.97Å; L326-N328 VanDerWaalsContact C-N 3.27Å; L326-N328 PolarHBondContact O-N 3.19Å; N328-D332 VanDerWaalsContact O-CB 3.28Å; N328-D332 WeakPolarHBondContact O-CB 3.44Å; N328-D332 PolarHBondContact O-N 3.14Å
329	Y	92.2	Very high	91.2	Very high	34 Å²	34	60.6 Å²	60.6	13%	0.133	30%	0.304	C	S	.	.	H	α-helix	trans	-67.2	-42.1	175.6	-78	-72.9	0	0	0	112.4	A252 V253 V256 L325 L326 L327 H331 D332 F333	A252-Y329 HydrophobicContact CB-CE2 4.08Å; A252-Y329 WeakPolarHBondContact CB-OH 3.28Å; V253-Y329 HydrophobicContact CG2-CD1 4.27Å; V253-Y329 HydrophobicContact CG2-CE1 3.71Å; V256-Y329 HydrophobicContact CG2-CD2 4.12Å; V256-Y329 HydrophobicContact CG2-CG 4.01Å; L325-Y329 HydrophobicContact CD1-CD2 4.18Å; L325-Y329 HydrophobicContact CD1-CE2 3.67Å; L325-Y329 HydrophobicContact CD2-CE2 4.41Å; L325-Y329 HydrophobicContact CG-CD2 4.1Å; L325-Y329 HydrophobicContact CG-CE2 3.81Å; L325-Y329 VanDerWaalsContact O-CD2 3.24Å; L325-Y329 WeakPolarHBondContact O-CD2 3.48Å; L325-Y329 PolarHBondContact O-N 2.95Å; L325-Y329 VanDerWaalsContact O-N 3.13Å; L326-Y329 PolarHBondContact O-N 3.04Å; L327-Y329 VanDerWaalsContact C-N 3.35Å; Y329-H331 PolarHBondContact O-N 3.39Å; Y329-D332 PolarHBondContact O-N 3.48Å; Y329-F333 WeakPolarHBondContact O-CB 3.41Å; Y329-F333 PolarHBondContact O-N 3.47Å
330	L	93.4	Very high	91.9	Very high	4 Å²	4	58.9 Å²	58.9	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-62.9	-41.4	176.5	-61.7	179.3	0	0	0	111.6	V256 I260 F306 L313 L326 L327 F333 L334	V256-L330 HydrophobicContact CG1-CD2 4.3Å; I260-L330 HydrophobicContact CD1-CD2 4.02Å; I260-L330 HydrophobicContact CG1-CD2 4.01Å; F306-L330 HydrophobicContact CE1-CB 4.36Å; F306-L330 HydrophobicContact CE1-CD2 3.93Å; L313-L330 HydrophobicContact CD1-CD1 3.83Å; L326-L330 HydrophobicContact CD1-CD1 4.43Å; L326-L330 HydrophobicContact CD1-CD2 4.33Å; L326-L330 HydrophobicContact CD1-CG 4.19Å; L326-L330 HydrophobicContact CG-CD1 4.14Å; L326-L330 HydrophobicContact CG-CG 4.3Å; L326-L330 WeakPolarHBondContact O-CG 3.23Å; L326-L330 PolarHBondContact O-N 3.48Å; L327-L330 HydrophobicContact CD2-CD1 4.48Å; L327-L330 PolarHBondContact O-N 2.93Å; L330-F333 PolarHBondContact O-N 2.82Å; L330-L334 WeakPolarHBondContact O-CB 3.36Å; L330-L334 WeakPolarHBondContact O-CG 3.27Å; L330-L334 PolarHBondContact O-N 3.31Å
331	H	95.1	Very high	92.4	Very high	43 Å²	43	51.9 Å²	51.9	20%	0.199	27%	0.265	C	S	.	.	H	α-helix	trans	-70.7	-33.4	176.8	-66.9	174.6	0	0	0	112.1	K198 L327 Y329 K335	K198-H331 PolarHBondContact N-NE2 2.99Å; L327-H331 WeakPolarHBondContact O-CB 3.48Å; L327-H331 PolarHBondContact O-CD2 3.34Å; L327-H331 VanDerWaalsContact O-CG 3.24Å; L327-H331 PolarHBondContact O-N 3.13Å; Y329-H331 PolarHBondContact O-N 3.39Å; H331-K335 VanDerWaalsContact O-CG 3.28Å; H331-K335 WeakPolarHBondContact O-CG 3.4Å; H331-K335 PolarHBondContact O-N 2.86Å
332	D	95	Very high	92.8	Very high	50 Å²	50	47.9 Å²	47.9	27%	0.267	26%	0.264	S	S	.	.	H	α-helix	trans	-66.1	-41.8	172.8	-177	81.8	0	0	0	111.6	Y236 K240 N328 Y329 K335 Y336	Y236-D332 WeakPolarHBondContact CE2-OD2 3.19Å; Y236-D332 PolarHBondContact OH-OD2 2.97Å; K240-D332 WeakPolarHBondContact CD-OD2 3.33Å; K240-D332 WeakPolarHBondContact CE-OD2 3.41Å; K240-D332 VanDerWaalsContact NZ-CG 3.31Å; K240-D332 IonicContact NZ-OD1 2.75Å; K240-D332 PolarHBondContact NZ-OD1 3.07Å; K240-D332 IonicContact NZ-OD2 2.65Å; K240-D332 PolarHBondContact NZ-OD2 3.26Å; N328-D332 VanDerWaalsContact O-CB 3.28Å; N328-D332 WeakPolarHBondContact O-CB 3.44Å; N328-D332 PolarHBondContact O-N 3.14Å; Y329-D332 PolarHBondContact O-N 3.48Å; D332-K335 WeakPolarHBondContact O-CB 3.26Å; D332-K335 PolarHBondContact O-N 2.76Å; D332-Y336 PolarHBondContact O-N 2.8Å
333	F	96.7	Very high	93.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-46.3	172.4	-176.3	-102.5	0	0	0	112.1	I232 L233 Y236 I260 L302 F306 Y329 L330 K335 Y336 L337	I232-F333 HydrophobicContact CG2-CZ 4.22Å; L233-F333 HydrophobicContact CD2-CE2 3.88Å; L233-F333 HydrophobicContact CD2-CZ 3.73Å; Y236-F333 AromaticContact CD1-CD2 3.53Å; Y236-F333 HydrophobicContact CD1-CD2 3.53Å; Y236-F333 HydrophobicContact CD1-CE2 4.03Å; Y236-F333 AromaticContact CD2-CD2 3.66Å; Y236-F333 HydrophobicContact CD2-CD2 3.66Å; Y236-F333 HydrophobicContact CD2-CE2 4.27Å; Y236-F333 HydrophobicContact CE1-CB 4.4Å; Y236-F333 AromaticContact CE1-CD2 3.86Å; Y236-F333 HydrophobicContact CE1-CD2 3.86Å; Y236-F333 HydrophobicContact CE2-CB 4.28Å; Y236-F333 AromaticContact CE2-CD2 3.99Å; Y236-F333 HydrophobicContact CE2-CD2 3.99Å; Y236-F333 AromaticContact CG-CD2 3.4Å; Y236-F333 HydrophobicContact CG-CD2 3.4Å; Y236-F333 VanDerWaalsContact CG-CD2 3.4Å; Y236-F333 AromaticContact CG-CE2 3.74Å; Y236-F333 HydrophobicContact CG-CE2 3.74Å; I260-F333 HydrophobicContact CD1-CD1 4.33Å; I260-F333 HydrophobicContact CD1-CG 4.35Å; L302-F333 HydrophobicContact CD2-CE1 4.06Å; L302-F333 HydrophobicContact CD2-CZ 3.89Å; L302-F333 HydrophobicContact CG-CE1 4.47Å; F306-F333 HydrophobicContact CE1-CD1 4.04Å; F306-F333 AromaticContact CE2-CD1 3.74Å; F306-F333 HydrophobicContact CE2-CD1 3.74Å; F306-F333 AromaticContact CE2-CE1 3.61Å; F306-F333 HydrophobicContact CE2-CE1 3.61Å; F306-F333 AromaticContact CZ-CD1 3.26Å; F306-F333 HydrophobicContact CZ-CD1 3.26Å; F306-F333 AromaticContact CZ-CE1 3.52Å; F306-F333 HydrophobicContact CZ-CE1 3.52Å; F306-F333 HydrophobicContact CZ-CG 4.39Å; Y329-F333 WeakPolarHBondContact O-CB 3.41Å; Y329-F333 PolarHBondContact O-N 3.47Å; L330-F333 PolarHBondContact O-N 2.82Å; F333-K335 VanDerWaalsContact C-N 3.28Å; F333-K335 PolarHBondContact O-N 3.12Å; F333-Y336 HydrophobicContact CE2-CD1 4.44Å; F333-Y336 CarbonylContact O-C 3.58Å; F333-Y336 WeakPolarHBondContact O-CA 3.35Å; F333-Y336 VanDerWaalsContact O-CB 3.29Å; F333-Y336 WeakPolarHBondContact O-CB 3.46Å; F333-Y336 PolarHBondContact O-N 3.29Å; F333-L337 HydrophobicContact CD1-CD1 4.12Å; F333-L337 HydrophobicContact CD1-CG 4.21Å; F333-L337 HydrophobicContact CE1-CD1 3.67Å; F333-L337 HydrophobicContact CE1-CD2 4.02Å; F333-L337 HydrophobicContact CE1-CG 3.84Å; F333-L337 HydrophobicContact CZ-CD1 4.38Å; F333-L337 HydrophobicContact CZ-CD2 3.88Å; F333-L337 HydrophobicContact CZ-CG 4.18Å; F333-L337 PolarHBondContact O-N 3.36Å
334	L	97.1	Very high	93.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60	-37.7	175.3	-78.3	168	0	0	0	112.4	V197 I199 P200 L203 L303 F306 L330 Y336 L337 A338	V197-L334 HydrophobicContact CG1-CD1 3.71Å; I199-L334 HydrophobicContact CD1-CD1 4.09Å; I199-L334 HydrophobicContact CD1-CD2 4.18Å; P200-L334 HydrophobicContact CG-CB 3.85Å; L203-L334 HydrophobicContact CD1-CD2 4.32Å; L303-L334 HydrophobicContact CD1-CD2 3.93Å; F306-L334 HydrophobicContact CB-CD1 4.27Å; F306-L334 HydrophobicContact CB-CD2 3.85Å; F306-L334 HydrophobicContact CB-CG 4.46Å; F306-L334 HydrophobicContact CD1-CD1 4.03Å; F306-L334 HydrophobicContact CD1-CD2 4.1Å; F306-L334 HydrophobicContact CD1-CG 3.97Å; F306-L334 HydrophobicContact CD2-CD2 3.92Å; F306-L334 HydrophobicContact CE1-CG 4.41Å; F306-L334 HydrophobicContact CG-CD1 4.27Å; F306-L334 HydrophobicContact CG-CD2 3.68Å; F306-L334 HydrophobicContact CG-CG 4.08Å; L330-L334 WeakPolarHBondContact O-CB 3.36Å; L330-L334 WeakPolarHBondContact O-CG 3.27Å; L330-L334 PolarHBondContact O-N 3.31Å; L334-Y336 VanDerWaalsContact C-N 3.33Å; L334-L337 HydrophobicContact CD2-CD1 4.4Å; L334-L337 PolarHBondContact O-N 3.39Å; L334-A338 WeakPolarHBondContact O-CB 3.42Å; L334-A338 PolarHBondContact O-N 3.42Å
335	K	96.6	Very high	94.1	Very high	124 Å²	124	48 Å²	48	54%	0.539	26%	0.258	S	S	.	.	H	α-helix	trans	-66.3	-34.9	172.4	-75	170.2	-175.9	174	0	112.2	H331 D332 F333 A338 K339	H331-K335 VanDerWaalsContact O-CG 3.28Å; H331-K335 WeakPolarHBondContact O-CG 3.4Å; H331-K335 PolarHBondContact O-N 2.86Å; D332-K335 WeakPolarHBondContact O-CB 3.26Å; D332-K335 PolarHBondContact O-N 2.76Å; F333-K335 VanDerWaalsContact C-N 3.28Å; F333-K335 PolarHBondContact O-N 3.12Å; K335-A338 PolarHBondContact O-N 3.43Å; K335-K339 VanDerWaalsContact O-CG 3.29Å; K335-K339 WeakPolarHBondContact O-CG 3.5Å; K335-K339 PolarHBondContact O-N 3.3Å
336	Y	96.8	Very high	94.4	Very high	22 Å²	22	45.2 Å²	45.2	9%	0.086	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-45.1	172.4	169.7	-91.7	0	0	0	111.1	D235 Y236 Y239 D332 F333 L334 A338 K339 N340	D235-Y336 WeakPolarHBondContact CB-OH 3.31Å; Y236-Y336 AromaticContact CD2-CD1 3.89Å; Y236-Y336 HydrophobicContact CD2-CD1 3.89Å; Y236-Y336 HydrophobicContact CD2-CD2 4.08Å; Y236-Y336 AromaticContact CD2-CG 3.65Å; Y236-Y336 HydrophobicContact CD2-CG 3.65Å; Y236-Y336 HydrophobicContact CE2-CG 4.38Å; Y236-Y336 HydrophobicContact CG-CD1 4.44Å; Y239-Y336 AromaticContact CD1-CD2 3.68Å; Y239-Y336 HydrophobicContact CD1-CD2 3.68Å; Y239-Y336 HydrophobicContact CD1-CE2 4.1Å; Y239-Y336 HydrophobicContact CD2-CD2 4.49Å; Y239-Y336 HydrophobicContact CD2-CE2 4.34Å; Y239-Y336 HydrophobicContact CE1-CD2 4Å; Y239-Y336 AromaticContact CG-CD2 3.94Å; Y239-Y336 HydrophobicContact CG-CD2 3.94Å; Y239-Y336 AromaticContact CG-CE2 3.88Å; Y239-Y336 HydrophobicContact CG-CE2 3.88Å; D332-Y336 PolarHBondContact O-N 2.8Å; F333-Y336 HydrophobicContact CE2-CD1 4.44Å; F333-Y336 CarbonylContact O-C 3.58Å; F333-Y336 WeakPolarHBondContact O-CA 3.35Å; F333-Y336 VanDerWaalsContact O-CB 3.29Å; F333-Y336 WeakPolarHBondContact O-CB 3.46Å; F333-Y336 PolarHBondContact O-N 3.29Å; L334-Y336 VanDerWaalsContact C-N 3.33Å; Y336-A338 VanDerWaalsContact C-N 3.32Å; Y336-A338 PolarHBondContact O-N 3.04Å; Y336-K339 PolarHBondContact O-N 3.16Å; Y336-N340 WeakPolarHBondContact CD2-ND2 3.37Å; Y336-N340 WeakPolarHBondContact CE2-ND2 3.23Å; Y336-N340 PolarHBondContact O-N 3.05Å; Y336-N340 VanDerWaalsContact O-N 3.12Å; Y336-N340 PolarHBondContact O-ND2 3.23Å
337	L	97.4	Very high	94.5	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-43.6	173.7	-63.8	-176.1	0	0	0	111.7	L203 I232 L303 F306 F333 L334 K339 N340 S341 L344	L203-L337 HydrophobicContact CD1-CB 4.03Å; I232-L337 HydrophobicContact CG2-CD2 3.91Å; L303-L337 HydrophobicContact CD1-CD1 4.41Å; F306-L337 HydrophobicContact CE2-CD1 4.47Å; F333-L337 HydrophobicContact CD1-CD1 4.12Å; F333-L337 HydrophobicContact CD1-CG 4.21Å; F333-L337 HydrophobicContact CE1-CD1 3.67Å; F333-L337 HydrophobicContact CE1-CD2 4.02Å; F333-L337 HydrophobicContact CE1-CG 3.84Å; F333-L337 HydrophobicContact CZ-CD1 4.38Å; F333-L337 HydrophobicContact CZ-CD2 3.88Å; F333-L337 HydrophobicContact CZ-CG 4.18Å; F333-L337 PolarHBondContact O-N 3.36Å; L334-L337 HydrophobicContact CD2-CD1 4.4Å; L334-L337 PolarHBondContact O-N 3.39Å; L337-K339 PolarHBondContact O-N 3.48Å; L337-N340 CarbonylContact O-C 3.59Å; L337-N340 PolarHBondContact O-N 2.78Å; L337-S341 WeakPolarHBondContact O-CA 3.44Å; L337-S341 PolarHBondContact O-N 3.24Å; L337-L344 HydrophobicContact CD2-CD1 3.65Å
338	A	96.3	Very high	94.7	Very high	15 Å²	15	48.2 Å²	48.2	12%	0.124	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-43.3	178.3	0	0	0	0	0	112.5	P200 E202 L203 L334 K335 Y336 N340 S341	P200-A338 HydrophobicContact CB-CB 4.25Å; P200-A338 HydrophobicContact CG-CB 4.47Å; E202-A338 HydrophobicContact CB-CB 4.44Å; L203-A338 HydrophobicContact CD1-CB 4.11Å; L203-A338 HydrophobicContact CD2-CB 4.28Å; L203-A338 HydrophobicContact CG-CB 3.96Å; L334-A338 WeakPolarHBondContact O-CB 3.42Å; L334-A338 PolarHBondContact O-N 3.42Å; K335-A338 PolarHBondContact O-N 3.43Å; Y336-A338 VanDerWaalsContact C-N 3.32Å; Y336-A338 PolarHBondContact O-N 3.04Å; A338-N340 VanDerWaalsContact C-N 3.29Å; A338-N340 PolarHBondContact O-N 3.4Å; A338-S341 VanDerWaalsContact O-CB 3.25Å; A338-S341 WeakPolarHBondContact O-CB 3.37Å; A338-S341 PolarHBondContact O-N 2.61Å; A338-S341 PolarHBondContact O-OG 2.96Å
339	K	96.5	Very high	94.9	Very high	135 Å²	135	44.4 Å²	44.4	59%	0.587	26%	0.257	S	S	*	.	H	α-helix	trans	-64.4	-32.9	177.6	-75.3	171.2	-179.2	175.1	0	113.2	K335 Y336 L337	K335-K339 VanDerWaalsContact O-CG 3.29Å; K335-K339 WeakPolarHBondContact O-CG 3.5Å; K335-K339 PolarHBondContact O-N 3.3Å; Y336-K339 PolarHBondContact O-N 3.16Å; L337-K339 PolarHBondContact O-N 3.48Å
340	N	95.9	Very high	95.1	Very high	53 Å²	53	43.7 Å²	43.7	28%	0.283	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	20.2	179.5	-59.3	-75.4	0	0	0	111.6	Y336 L337 A338 A342 T343 L344	Y336-N340 WeakPolarHBondContact CD2-ND2 3.37Å; Y336-N340 WeakPolarHBondContact CE2-ND2 3.23Å; Y336-N340 PolarHBondContact O-N 3.05Å; Y336-N340 VanDerWaalsContact O-N 3.12Å; Y336-N340 PolarHBondContact O-ND2 3.23Å; L337-N340 CarbonylContact O-C 3.59Å; L337-N340 PolarHBondContact O-N 2.78Å; A338-N340 VanDerWaalsContact C-N 3.29Å; A338-N340 PolarHBondContact O-N 3.4Å; N340-A342 VanDerWaalsContact C-N 3.29Å; N340-A342 PolarHBondContact O-N 3.21Å; N340-T343 PolarHBondContact O-N 3.46Å; N340-T343 VanDerWaalsContact O-N 3.13Å; N340-T343 PolarHBondContact O-OG1 3.09Å; N340-L344 HydrophobicContact CB-CD1 3.77Å; N340-L344 HydrophobicContact CB-CG 4.12Å; N340-L344 WeakPolarHBondContact O-CB 3.25Å; N340-L344 WeakPolarHBondContact O-CG 3.47Å; N340-L344 PolarHBondContact O-N 3.37Å
341	S	94.3	Very high	95.2	Very high	25 Å²	25	48.5 Å²	48.5	18%	0.175	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-36.5	-171.7	51.4	0	0	0	0	112.8	L337 A338 T343 L344 F345	L337-S341 WeakPolarHBondContact O-CA 3.44Å; L337-S341 PolarHBondContact O-N 3.24Å; A338-S341 VanDerWaalsContact O-CB 3.25Å; A338-S341 WeakPolarHBondContact O-CB 3.37Å; A338-S341 PolarHBondContact O-N 2.61Å; A338-S341 PolarHBondContact O-OG 2.96Å; S341-T343 PolarHBondContact O-N 2.87Å; S341-L344 PolarHBondContact O-N 3.42Å; S341-F345 WeakPolarHBondContact O-CD2 3.27Å; S341-F345 PolarHBondContact O-N 3.46Å
342	A	93.6	Very high	95.2	Very high	89 Å²	89	51 Å²	51	74%	0.736	29%	0.294	S	S	*	.	H	α-helix	trans	-64	-24.4	178.6	0	0	0	0	0	114.2	N340	N340-A342 VanDerWaalsContact C-N 3.29Å; N340-A342 PolarHBondContact O-N 3.21Å
343	T	94.2	Very high	95.3	Very high	112 Å²	112	48.9 Å²	48.9	69%	0.687	28%	0.284	S	S	*	.	H	α-helix	trans	-99.6	-27.7	178.3	59	0	0	0	0	112.4	N340 S341	N340-T343 PolarHBondContact O-N 3.46Å; N340-T343 VanDerWaalsContact O-N 3.13Å; N340-T343 PolarHBondContact O-OG1 3.09Å; S341-T343 PolarHBondContact O-N 2.87Å
344	L	93.9	Very high	95.1	Very high	19 Å²	19	52.1 Å²	52.1	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-89	-29.3	-177.2	-67.8	176.1	0	0	0	113.4	I232 A299 L337 N340 S341	I232-L344 HydrophobicContact CD1-CD2 4.04Å; I232-L344 HydrophobicContact CG1-CD2 3.88Å; A299-L344 HydrophobicContact CB-CB 3.92Å; A299-L344 HydrophobicContact CB-CD2 4.45Å; A299-L344 WeakPolarHBondContact CB-O 3.44Å; L337-L344 HydrophobicContact CD2-CD1 3.65Å; N340-L344 HydrophobicContact CB-CD1 3.77Å; N340-L344 HydrophobicContact CB-CG 4.12Å; N340-L344 WeakPolarHBondContact O-CB 3.25Å; N340-L344 WeakPolarHBondContact O-CG 3.47Å; N340-L344 PolarHBondContact O-N 3.37Å; S341-L344 PolarHBondContact O-N 3.42Å
345	F	94.9	Very high	94.9	Very high	9 Å²	9	56.6 Å²	56.6	4%	0.039	33%	0.334	C	S	.	.			trans	-120.2	118.5	-178.4	-51.3	-77.3	0	0	0	109.4	L203 W206 A299 P300 L303 S341	L203-F345 HydrophobicContact CD2-CD2 4.25Å; L203-F345 HydrophobicContact CD2-CE2 3.61Å; L203-F345 HydrophobicContact CD2-CZ 4.23Å; W206-F345 HydrophobicContact CD2-CB 3.52Å; W206-F345 HydrophobicContact CD2-CG 4.14Å; W206-F345 HydrophobicContact CE3-CB 3.54Å; W206-F345 HydrophobicContact CE3-CG 4.43Å; W206-F345 HydrophobicContact CG-CB 4.15Å; W206-F345 HydrophobicContact CG-CD2 4.42Å; W206-F345 HydrophobicContact CG-CG 4.25Å; W206-F345 HydrophobicContact CH2-CB 3.89Å; W206-F345 WeakPolarHBondContact CH2-O 3.45Å; W206-F345 HydrophobicContact CZ2-CB 3.88Å; W206-F345 WeakPolarHBondContact CZ2-O 3.26Å; W206-F345 HydrophobicContact CZ3-CB 3.72Å; A299-F345 HydrophobicContact CB-CD1 4.23Å; A299-F345 HydrophobicContact CB-CE1 3.82Å; A299-F345 HydrophobicContact CB-CZ 4.23Å; P300-F345 HydrophobicContact CG-CD1 4.36Å; L303-F345 HydrophobicContact CB-CE1 4.03Å; L303-F345 HydrophobicContact CB-CZ 4.18Å; L303-F345 HydrophobicContact CD2-CE1 3.83Å; L303-F345 HydrophobicContact CD2-CZ 3.81Å; L303-F345 HydrophobicContact CG-CZ 4.48Å; S341-F345 WeakPolarHBondContact O-CD2 3.27Å; S341-F345 PolarHBondContact O-N 3.46Å
346	S	93.1	Very high	94.7	Very high	37 Å²	37	55.4 Å²	55.4	26%	0.259	33%	0.33	S	S	.	.			trans	-142.3	136.6	174	-175.1	0	0	0	0	110.3	S348 D349	S346-S348 PolarHBondContact O-N 2.91Å; S346-S348 WeakPolarHBondContact OG-CB 3.24Å; S346-S348 PolarHBondContact OG-N 3.5Å; S346-S348 PolarHBondContact OG-OG 3.07Å; S346-D349 PolarHBondContact O-N 3.27Å
347	A	91.5	Very high	94.6	Very high	55 Å²	55	55 Å²	55	46%	0.455	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-64.7	-22.1	170.5	0	0	0	0	0	111.9	L213 D349 Y350	L213-A347 HydrophobicContact CD1-CB 4.49Å; A347-D349 PolarHBondContact O-N 3.27Å; A347-Y350 PolarHBondContact O-N 2.89Å; A347-Y350 VanDerWaalsContact O-N 3.13Å
348	S	93.6	Very high	94.2	Very high	79 Å²	79	58 Å²	58	55%	0.552	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-68.6	-11.7	175.6	68.7	0	0	0	0	113.8	S346	S346-S348 PolarHBondContact O-N 2.91Å; S346-S348 WeakPolarHBondContact OG-CB 3.24Å; S346-S348 PolarHBondContact OG-N 3.5Å; S346-S348 PolarHBondContact OG-OG 3.07Å
349	D	94.8	Very high	93.9	Very high	27 Å²	27	66 Å²	66	14%	0.144	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-89.1	10.9	174.6	-62.3	-42.5	0	0	0	112.3	F221 Y222 K226 S346 A347	F221-D349 WeakPolarHBondContact CA-O 3.26Å; F221-D349 HydrophobicContact CD2-CB 4.18Å; F221-D349 WeakPolarHBondContact CD2-O 3.11Å; F221-D349 HydrophobicContact CE2-CB 3.6Å; F221-D349 HydrophobicContact CZ-CB 4.22Å; Y222-D349 VanDerWaalsContact CD2-C 3.46Å; Y222-D349 WeakPolarHBondContact CD2-O 3.38Å; Y222-D349 PolarHBondContact N-O 2.71Å; K226-D349 IonicContact NZ-OD1 3.59Å; K226-D349 PolarHBondContact NZ-OD1 3.11Å; S346-D349 PolarHBondContact O-N 3.27Å; A347-D349 PolarHBondContact O-N 3.27Å
350	Y	96.6	Very high	93.5	Very high	19 Å²	19	65.7 Å²	65.7	8%	0.075	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	146.4	172.8	-63.2	-102.3	0	0	0	110.7	D210 L213 I214 L220 F221 P300 A347	D210-Y350 PolarHBondContact OD1-OH 3.26Å; L213-Y350 HydrophobicContact CB-CD1 4.24Å; L213-Y350 HydrophobicContact CB-CE1 4.45Å; L213-Y350 HydrophobicContact CD1-CD1 4.36Å; L213-Y350 HydrophobicContact CD1-CD2 3.88Å; L213-Y350 HydrophobicContact CD1-CE1 4.43Å; L213-Y350 HydrophobicContact CD1-CE2 3.96Å; L213-Y350 HydrophobicContact CD1-CG 4.09Å; I214-Y350 HydrophobicContact CD1-CD1 3.84Å; I214-Y350 HydrophobicContact CD1-CE1 3.66Å; I214-Y350 HydrophobicContact CG1-CE1 4.22Å; L220-Y350 CarbonylContact O-C 3.53Å; L220-Y350 WeakPolarHBondContact O-CA 3.41Å; F221-Y350 HydrophobicContact CB-CD1 4.19Å; F221-Y350 HydrophobicContact CB-CE1 3.96Å; F221-Y350 HydrophobicContact CD2-CD1 4.48Å; F221-Y350 HydrophobicContact CD2-CD2 4.32Å; F221-Y350 HydrophobicContact CD2-CE1 4.05Å; F221-Y350 AromaticContact CD2-CE2 3.88Å; F221-Y350 HydrophobicContact CD2-CE2 3.88Å; F221-Y350 AromaticContact CD2-CZ 3.72Å; F221-Y350 HydrophobicContact CE2-CE2 4.44Å; P300-Y350 WeakPolarHBondContact CB-OH 3.21Å; P300-Y350 VanDerWaalsContact CG-OH 3.26Å; P300-Y350 WeakPolarHBondContact CG-OH 3.43Å; A347-Y350 PolarHBondContact O-N 2.89Å; A347-Y350 VanDerWaalsContact O-N 3.13Å
351	E	95.4	Very high	92.7	Very high	106 Å²	106	63.7 Å²	63.7	50%	0.495	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.3	173.2	-164.1	173	179.6	0	0	110.5	Q219 L220 Y222 A353	Q219-E351 CarbonylContact C-O 3.46Å; Q219-E351 WeakPolarHBondContact CA-O 3.34Å; Q219-E351 WeakPolarHBondContact CB-O 3.45Å; L220-E351 PolarHBondContact N-O 2.79Å; L220-E351 PolarHBondContact O-N 2.98Å; Y222-E351 HydrophobicContact CE1-CB 3.95Å; Y222-E351 HydrophobicContact CE1-CG 4.5Å; Y222-E351 WeakPolarHBondContact CE1-OE2 3.34Å; Y222-E351 HydrophobicContact CE2-CB 4.03Å; Y222-E351 WeakPolarHBondContact OH-CB 3.48Å; Y222-E351 WeakPolarHBondContact OH-CG 2.97Å; Y222-E351 PolarHBondContact OH-OE2 2.88Å; E351-A353 PolarHBondContact O-N 2.95Å
352	V	96	Very high	91.2	Very high	94 Å²	94	70 Å²	70	57%	0.57	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.9	124.4	170	-179.7	0	0	0	0	109.2	Q219	Q219-V352 HydrophobicContact CG-CG2 4.18Å
353	A	95.1	Very high	91.1	Very high	6 Å²	6	69.1 Å²	69.1	5%	0.05	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-63.9	135.9	-179.2	0	0	0	0	0	110.7	K218 L220 F276 E351 Y357 H358	K218-A353 VanDerWaalsContact O-CB 3.27Å; K218-A353 WeakPolarHBondContact O-CB 3.07Å; K218-A353 PolarHBondContact O-N 2.9Å; L220-A353 HydrophobicContact CD1-CB 3.74Å; L220-A353 HydrophobicContact CG-CB 4.04Å; F276-A353 HydrophobicContact CE1-CB 3.82Å; F276-A353 HydrophobicContact CZ-CB 3.7Å; E351-A353 PolarHBondContact O-N 2.95Å; A353-Y357 HydrophobicContact CB-CD1 3.78Å; A353-Y357 HydrophobicContact CB-CG 4.19Å; A353-H358 PolarHBondContact O-NE2 3.13Å
354	P	93.9	Very high	91	Very high	69 Å²	69	66.8 Å²	66.8	45%	0.448	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-67.2	155.2	-179.6	27.2	-34	0	0	0	111.2	E356 Y357 H358	P354-E356 PolarHBondContact O-N 3.19Å; P354-E356 VanDerWaalsContact O-N 3.09Å; P354-Y357 WeakPolarHBondContact O-CA 3.33Å; P354-Y357 VanDerWaalsContact O-CB 3.26Å; P354-Y357 WeakPolarHBondContact O-CB 3.43Å; P354-Y357 PolarHBondContact O-N 3.31Å; P354-H358 PolarHBondContact O-CD2 2.89Å; P354-H358 PolarHBondContact O-N 3.5Å
355	P	91.9	Very high	90.8	Very high	93 Å²	93	69.5 Å²	69.5	60%	0.604	38%	0.378	S	S	*	.	H	α-helix	trans	-54.9	-31.2	179.9	-26.5	35.4	0	0	0	114.2	Y357 H358 R359	P355-Y357 VanDerWaalsContact C-N 3.3Å; P355-Y357 PolarHBondContact O-N 2.65Å; P355-H358 PolarHBondContact O-N 3.21Å; P355-R359 PolarHBondContact O-N 3.38Å
356	E	92.4	Very high	90.6	Very high	100 Å²	100	73.1 Å²	73.1	47%	0.467	40%	0.398	S	S	.	.	H	α-helix	trans	-58.1	-42.7	172.9	-67.8	58	-123.3	0	0	111.5	P354 R359	P354-E356 PolarHBondContact O-N 3.19Å; P354-E356 VanDerWaalsContact O-N 3.09Å; E356-R359 PolarHBondContact O-N 3.01Å; E356-R359 IonicContact OE1-NH2 3.74Å; E356-R359 PolarHBondContact OE1-NH2 3.13Å
357	Y	94.7	Very high	90.4	Very high	12 Å²	12	75.3 Å²	75.3	5%	0.047	41%	0.407	C	S	.	.	H	α-helix	trans	-68.2	-40.6	-179.6	-173.4	-85	0	0	0	111.4	L220 F276 P279 Q280 A353 P354 P355 R359 K360 A361	L220-Y357 HydrophobicContact CD1-CD1 3.74Å; L220-Y357 HydrophobicContact CD1-CD2 3.82Å; L220-Y357 HydrophobicContact CD1-CE1 3.51Å; L220-Y357 HydrophobicContact CD1-CE2 3.58Å; L220-Y357 HydrophobicContact CD1-CG 3.9Å; L220-Y357 VanDerWaalsContact CD1-CZ 3.41Å; L220-Y357 HydrophobicContact CD2-CE1 3.95Å; L220-Y357 HydrophobicContact CG-CE1 4.19Å; F276-Y357 HydrophobicContact CD1-CE1 4.37Å; F276-Y357 HydrophobicContact CD2-CE1 4.47Å; F276-Y357 HydrophobicContact CE1-CD1 4.31Å; F276-Y357 HydrophobicContact CE1-CE1 4.03Å; F276-Y357 HydrophobicContact CE2-CD1 4.23Å; F276-Y357 HydrophobicContact CE2-CE1 4.15Å; F276-Y357 AromaticContact CZ-CD1 3.86Å; F276-Y357 HydrophobicContact CZ-CD1 3.86Å; F276-Y357 AromaticContact CZ-CE1 3.91Å; F276-Y357 HydrophobicContact CZ-CE1 3.91Å; F276-Y357 VanDerWaalsContact O-CE1 3.24Å; F276-Y357 WeakPolarHBondContact O-CE1 3.41Å; F276-Y357 PolarHBondContact O-OH 3.47Å; P279-Y357 HydrophobicContact CB-CE2 3.79Å; P279-Y357 WeakPolarHBondContact CD-OH 3.35Å; P279-Y357 HydrophobicContact CG-CE1 4.43Å; Q280-Y357 HydrophobicContact CB-CE2 3.76Å; Q280-Y357 VanDerWaalsContact CB-OH 3.28Å; Q280-Y357 WeakPolarHBondContact CB-OH 2.95Å; Q280-Y357 PolarHBondContact N-OH 3.38Å; A353-Y357 HydrophobicContact CB-CD1 3.78Å; A353-Y357 HydrophobicContact CB-CG 4.19Å; P354-Y357 WeakPolarHBondContact O-CA 3.33Å; P354-Y357 VanDerWaalsContact O-CB 3.26Å; P354-Y357 WeakPolarHBondContact O-CB 3.43Å; P354-Y357 PolarHBondContact O-N 3.31Å; P355-Y357 VanDerWaalsContact C-N 3.3Å; P355-Y357 PolarHBondContact O-N 2.65Å; Y357-R359 PolarHBondContact O-N 3.26Å; Y357-K360 WeakPolarHBondContact O-CB 3.38Å; Y357-K360 PolarHBondContact O-N 2.99Å; Y357-A361 HydrophobicContact CD1-CB 4.22Å; Y357-A361 HydrophobicContact CE1-CB 3.94Å; Y357-A361 PolarHBondContact O-N 2.83Å; Y357-A361 VanDerWaalsContact O-N 3.13Å
358	H	89.1	Confident	90.3	Very high	63 Å²	63	76.7 Å²	76.7	29%	0.292	40%	0.403	S	S	.	.	H	α-helix	trans	-55.9	-39.3	177.6	-80.2	-119.3	0	0	0	112.2	F276 A353 P354 P355 K360 A361 V362	F276-H358 AromaticContact CZ-NE2 3.85Å; A353-H358 PolarHBondContact O-NE2 3.13Å; P354-H358 PolarHBondContact O-CD2 2.89Å; P354-H358 PolarHBondContact O-N 3.5Å; P355-H358 PolarHBondContact O-N 3.21Å; H358-K360 PolarHBondContact O-N 3.28Å; H358-A361 PolarHBondContact O-N 2.7Å; H358-A361 VanDerWaalsContact O-N 3.11Å; H358-V362 VanDerWaalsContact O-CG2 3.28Å; H358-V362 WeakPolarHBondContact O-CG2 3.49Å; H358-V362 PolarHBondContact O-N 3.17Å
359	R	89.9	Confident	90.1	Very high	183 Å²	183	76.5 Å²	76.5	69%	0.691	39%	0.393	S	S	*	.	H	α-helix	trans	-62.6	-29.8	177.9	-69.6	-179.3	-81.5	-167.7	-5.5	113.2	P355 E356 Y357	P355-R359 PolarHBondContact O-N 3.38Å; E356-R359 PolarHBondContact O-N 3.01Å; E356-R359 IonicContact OE1-NH2 3.74Å; E356-R359 PolarHBondContact OE1-NH2 3.13Å; Y357-R359 PolarHBondContact O-N 3.26Å
360	K	88.1	Confident	89.7	Confident	129 Å²	129	80.3 Å²	80.3	56%	0.561	41%	0.412	S	S	*	.	H	α-helix	trans	-81.9	-24.2	176.4	-60.9	175	175.6	174.6	0	112.7	P279 E283 Y357 H358	P279-K360 HydrophobicContact CB-CB 3.84Å; P279-K360 HydrophobicContact CG-CB 3.98Å; P279-K360 WeakPolarHBondContact CG-O 3.39Å; E283-K360 IonicContact OE1-NZ 3.11Å; E283-K360 PolarHBondContact OE1-NZ 2.75Å; Y357-K360 WeakPolarHBondContact O-CB 3.38Å; Y357-K360 PolarHBondContact O-N 2.99Å; H358-K360 PolarHBondContact O-N 3.28Å
361	A	79.4	Confident	89.2	Confident	12 Å²	12	85.4 Å²	85.4	10%	0.099	44%	0.44	C	S	.	.	H	α-helix	trans	-95.1	-10.3	-169.8	0	0	0	0	0	115.4	F276 P279 Y357 H358	F276-A361 HydrophobicContact CD2-CB 3.55Å; F276-A361 HydrophobicContact CE2-CB 3.6Å; P279-A361 HydrophobicContact CG-CB 3.84Å; Y357-A361 HydrophobicContact CD1-CB 4.22Å; Y357-A361 HydrophobicContact CE1-CB 3.94Å; Y357-A361 PolarHBondContact O-N 2.83Å; Y357-A361 VanDerWaalsContact O-N 3.13Å; H358-A361 PolarHBondContact O-N 2.7Å; H358-A361 VanDerWaalsContact O-N 3.11Å
362	V	63.9	Low	88.6	Confident	158 Å²	158	83.5 Å²	83.5	96%	0.958	44%	0.435	S	S	*	.			trans	-74	0	-177.1	170	0	0	0	0	111.7	K275 H358	K275-V362 PolarHBondContact NZ-OXT 2.65Å; H358-V362 VanDerWaalsContact O-CG2 3.28Å; H358-V362 WeakPolarHBondContact O-CG2 3.49Å; H358-V362 PolarHBondContact O-N 3.17Å

Retrieved 362 of 362 residues in 329.7 ms (Link to these results)

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