A0A087Y963_POEFO Loading...

E3 ubiquitin-protein ligase ZNRF3

AlphaFold DB , UniProt , Accession A0A087Y963, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 746 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	L	86.1	Confident	84.5	Confident	45 Å²	45	50.2 Å²	50.2	24%	0.236	26%	0.262	C	S	.	.				0	126.4	0	-89.7	162.6	0	0	0	104.4	V24 V26 A103 A105	L1-V24 CarbonylContact C-O 3.51Å; L1-V24 WeakPolarHBondContact CA-O 3.07Å; L1-V24 HydrophobicContact CD2-CB 3.91Å; L1-V24 HydrophobicContact CD2-CG1 3.74Å; L1-V26 HydrophobicContact CD2-CG2 3.54Å; L1-A103 HydrophobicContact CB-CB 4.35Å; L1-A103 VanDerWaalsContact CB-O 3.28Å; L1-A103 WeakPolarHBondContact CB-O 3.38Å; L1-A103 HydrophobicContact CD1-CB 3.76Å; L1-A103 PolarHBondContact N-O 3.35Å; L1-A105 HydrophobicContact CD1-CB 4.02Å; L1-A105 HydrophobicContact CD2-CB 3.79Å; L1-A105 HydrophobicContact CG-CB 4.02Å
2	F	87.1	Confident	82.9	Confident	88 Å²	88	56.3 Å²	56.3	39%	0.386	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.2	-179.3	-73	-99.6	0	0	0	107.9	Y19 W23 V24 G25 V26	F2-Y19 AromaticContact CD1-CD1 3.97Å; F2-Y19 HydrophobicContact CD1-CD1 3.97Å; F2-Y19 AromaticContact CD1-CE1 3.98Å; F2-Y19 HydrophobicContact CD1-CE1 3.98Å; F2-Y19 HydrophobicContact CD1-CG 4.47Å; F2-Y19 AromaticContact CE1-CD1 3.9Å; F2-Y19 HydrophobicContact CE1-CD1 3.9Å; F2-Y19 HydrophobicContact CE1-CE1 4.21Å; F2-W23 HydrophobicContact CB-CE3 4.18Å; F2-W23 HydrophobicContact CD2-CB 3.67Å; F2-W23 HydrophobicContact CD2-CG 4.44Å; F2-W23 HydrophobicContact CE2-CB 3.87Å; F2-V24 PolarHBondContact N-O 2.86Å; F2-G25 CarbonylContact O-C 3.57Å; F2-G25 WeakPolarHBondContact O-CA 3.42Å; F2-V26 PolarHBondContact O-N 3.46Å
3	Q	89.5	Confident	81.4	Confident	98 Å²	98	59.5 Å²	59.5	46%	0.458	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	134.2	170.1	-169.4	-179.2	-20.5	0	0	108.2	V26 M94 V97 N98	Q3-V26 CarbonylContact C-O 3.57Å; Q3-V26 WeakPolarHBondContact CA-O 3.11Å; Q3-M94 VanDerWaalsContact NE2-CE 3.3Å; Q3-V97 HydrophobicContact CB-CG1 3.69Å; Q3-V97 HydrophobicContact CG-CG1 4.08Å; Q3-N98 PolarHBondContact OE1-OD1 2.76Å
4	M	87.6	Confident	79.6	Confident	10 Å²	10	60.8 Å²	60.8	5%	0.049	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	138.8	173.8	-55.9	-174.5	81.6	0	0	110	L9 Y19 W23 V26 V27	M4-L9 HydrophobicContact CE-CD2 3.5Å; M4-L9 HydrophobicContact CE-CG 3.93Å; M4-L9 HydrophobicContact SD-CD1 4.34Å; M4-L9 HydrophobicContact SD-CD2 3.82Å; M4-L9 HydrophobicContact SD-CG 4.15Å; M4-Y19 HydrophobicContact CE-CE2 4.19Å; M4-W23 HydrophobicContact CE-CH2 4.07Å; M4-W23 HydrophobicContact CG-CZ3 4.34Å; M4-W23 HydrophobicContact SD-CH2 3.34Å; M4-W23 WeakPolarHBondContact SD-CH2 3.36Å; M4-W23 HydrophobicContact SD-CZ3 3.45Å; M4-W23 WeakPolarHBondContact SD-CZ3 3.21Å; M4-V26 PolarHBondContact N-O 2.76Å; M4-V27 HydrophobicContact CB-CG2 4.32Å
5	H	87.5	Confident	78.1	Confident	102 Å²	102	68.7 Å²	68.7	47%	0.472	35%	0.354	S	S	.	.			trans	-67.1	142.1	167.1	-156	-98.4	0	0	0	109.6	L7 G8	H5-L7 PolarHBondContact ND1-N 3.34Å; H5-L7 PolarHBondContact O-N 2.91Å; H5-G8 PolarHBondContact O-N 3.44Å
6	P	85.5	Confident	76.7	Confident	3 Å²	3	73.5 Å²	73.5	2%	0.019	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-30	174.2	-29.8	37	0	0	0	113.9	V27 K28 E30 K44	P6-V27 HydrophobicContact CB-CG1 4.44Å; P6-V27 HydrophobicContact CG-CG1 4.03Å; P6-K28 WeakPolarHBondContact CG-O 3.47Å; P6-E30 HydrophobicContact CG-CG 4.48Å; P6-K44 PolarHBondContact O-NZ 2.69Å
7	L	84.6	Confident	75.8	Confident	77 Å²	77	73.3 Å²	73.3	40%	0.403	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-21.6	176.7	-56.2	177.6	0	0	0	114	H5 L9 C10	H5-L7 PolarHBondContact ND1-N 3.34Å; H5-L7 PolarHBondContact O-N 2.91Å; L7-L9 PolarHBondContact O-N 2.82Å; L7-C10 WeakPolarHBondContact O-CB 3.05Å; L7-C10 PolarHBondContact O-N 3.2Å
8	G	83.8	Confident	75	Confident	24 Å²	24	77.7 Å²	77.7	25%	0.247	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-23.1	175.8	0	0	0	0	0	113	H5 C10 R51	H5-G8 PolarHBondContact O-N 3.44Å; G8-C10 VanDerWaalsContact C-N 3.33Å; G8-R51 PolarHBondContact O-NH1 3.33Å; G8-R51 PolarHBondContact O-NH2 2.82Å
9	L	84.9	Confident	74.8	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-2.3	172.3	-68.5	169	0	0	0	113.7	M4 L7 V27 K44 A48	M4-L9 HydrophobicContact CE-CD2 3.5Å; M4-L9 HydrophobicContact CE-CG 3.93Å; M4-L9 HydrophobicContact SD-CD1 4.34Å; M4-L9 HydrophobicContact SD-CD2 3.82Å; M4-L9 HydrophobicContact SD-CG 4.15Å; L7-L9 PolarHBondContact O-N 2.82Å; L9-V27 HydrophobicContact CD1-CG2 3.79Å; L9-K44 HydrophobicContact CB-CB 4.26Å; L9-K44 HydrophobicContact CB-CG 4.38Å; L9-K44 HydrophobicContact CD1-CB 4.03Å; L9-A48 HydrophobicContact CD1-CB 4.39Å; L9-A48 HydrophobicContact CD2-CB 3.73Å
10	C	81.4	Confident	75	Confident	34 Å²	34	81.7 Å²	81.7	23%	0.23	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-24.6	173.8	-58.2	0	0	0	0	113.7	L7 G8 C38	L7-C10 WeakPolarHBondContact O-CB 3.05Å; L7-C10 PolarHBondContact O-N 3.2Å; G8-C10 VanDerWaalsContact C-N 3.33Å; C10-C38 WeakPolarHBondContact CA-SG 3.43Å; C10-C38 HydrophobicContact CB-CB 3.55Å; C10-C38 WeakPolarHBondContact CB-SG 3.22Å; C10-C38 WeakPolarHBondContact SG-CB 3.32Å; C10-C38 CovalentContact SG-SG 2.01Å; C10-C38 PolarHBondContact SG-SG 2.88Å
11	N	71.4	Confident	75.4	Confident	71 Å²	71	85.9 Å²	85.9	38%	0.38	42%	0.424	S	S	.	.			trans	-73.6	135.4	-171.4	-164.1	-0.5	0	0	0	111.4	N13 R51	N11-N13 PolarHBondContact OD1-N 3.47Å; N11-R51 PolarHBondContact O-NH2 3.17Å
12	N	65	Low	75.3	Confident	124 Å²	124	85.4 Å²	85.4	66%	0.663	43%	0.43	S	S	*	.			trans	-91	-7.4	175	-72.8	-34	0	0	0	113	D14	N12-D14 PolarHBondContact O-N 3.34Å; N12-D14 VanDerWaalsContact O-N 3.16Å
13	N	63.8	Low	75.5	Confident	97 Å²	97	81.8 Å²	81.8	52%	0.519	41%	0.413	S	S	.	.			trans	-66.7	111.7	165.7	-69.3	4.9	0	0	0	108.7	N11	N11-N13 PolarHBondContact OD1-N 3.47Å
14	D	56.9	Low	75.7	Confident	78 Å²	78	77.9 Å²	77.9	42%	0.417	40%	0.396	S	S	.	.			trans	-95.7	8	178.5	-73.4	-42.7	0	0	0	113.2	N12 R47 R51	N12-D14 PolarHBondContact O-N 3.34Å; N12-D14 VanDerWaalsContact O-N 3.16Å; D14-R47 IonicContact OD1-CZ 2.64Å; D14-R47 IonicContact OD1-NE 2.68Å; D14-R47 IonicContact OD1-NH2 3.4Å; D14-R47 PolarHBondContact OD1-NH2 2.87Å; D14-R47 IonicContact OD2-CZ 3.97Å; D14-R47 IonicContact OD2-NH2 3.47Å; D14-R47 PolarHBondContact OD2-NH2 3.29Å; D14-R51 IonicContact OD1-NE 2.7Å; D14-R51 PolarHBondContact OD1-NE 2.81Å
15	E	56.4	Low	76	Confident	179 Å²	179	77.5 Å²	77.5	84%	0.836	39%	0.394	S	S	*	.	S	Bend	trans	-94	-25.8	-175.3	-60.2	-165.1	126	0	0	115
16	E	56	Low	76.3	Confident	146 Å²	146	72.7 Å²	72.7	68%	0.682	37%	0.372	S	S	*	.	S	Bend	trans	-88.4	-19.9	-170.7	-67.3	-179.4	111.7	0	0	114.8
17	D	61.1	Low	76.7	Confident	70 Å²	70	72.6 Å²	72.6	37%	0.374	37%	0.372	S	S	.	.			trans	-130.9	48.5	-173	-87.9	-49.1	0	0	0	112.5	Y19	D17-Y19 VanDerWaalsContact C-N 3.32Å; D17-Y19 HydrophobicContact CB-CE1 4.37Å; D17-Y19 HydrophobicContact CB-CE2 4.11Å; D17-Y19 PolarHBondContact O-N 2.84Å; D17-Y19 WeakPolarHBondContact OD1-CE1 3.48Å; D17-Y19 PolarHBondContact OD1-OH 2.81Å
18	L	61.7	Low	77.1	Confident	152 Å²	152	72 Å²	72	80%	0.796	37%	0.366	S	S	*	.			trans	-76.2	76.4	174.7	-90.2	162.3	0	0	0	112
19	Y	70.8	Confident	77.5	Confident	57 Å²	57	71 Å²	71	22%	0.224	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-69.9	143.7	176.1	-53.3	-52.1	0	0	0	113.2	F2 M4 D17 Y21 W23	F2-Y19 AromaticContact CD1-CD1 3.97Å; F2-Y19 HydrophobicContact CD1-CD1 3.97Å; F2-Y19 AromaticContact CD1-CE1 3.98Å; F2-Y19 HydrophobicContact CD1-CE1 3.98Å; F2-Y19 HydrophobicContact CD1-CG 4.47Å; F2-Y19 AromaticContact CE1-CD1 3.9Å; F2-Y19 HydrophobicContact CE1-CD1 3.9Å; F2-Y19 HydrophobicContact CE1-CE1 4.21Å; M4-Y19 HydrophobicContact CE-CE2 4.19Å; D17-Y19 VanDerWaalsContact C-N 3.32Å; D17-Y19 HydrophobicContact CB-CE1 4.37Å; D17-Y19 HydrophobicContact CB-CE2 4.11Å; D17-Y19 PolarHBondContact O-N 2.84Å; D17-Y19 WeakPolarHBondContact OD1-CE1 3.48Å; D17-Y19 PolarHBondContact OD1-OH 2.81Å; Y19-Y21 PolarHBondContact O-N 2.76Å; Y19-W23 HydrophobicContact CD2-CD2 4.21Å; Y19-W23 AromaticContact CD2-CE2 3.83Å; Y19-W23 HydrophobicContact CD2-CH2 4.37Å; Y19-W23 AromaticContact CD2-CZ2 3.94Å; Y19-W23 HydrophobicContact CD2-CZ2 3.94Å
20	E	78	Confident	77.7	Confident	179 Å²	179	74.5 Å²	74.5	84%	0.836	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-55.5	128.3	173	-64	-177.3	155.3	0	0	112	W23	E20-W23 VanDerWaalsContact O-CD1 3.29Å
21	Y	85.1	Confident	77.8	Confident	170 Å²	170	77.1 Å²	77.1	67%	0.667	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	139.2	-174.4	-176.1	-90.1	0	0	0	113.5	Y19 R80	Y19-Y21 PolarHBondContact O-N 2.76Å; Y21-R80 PolarHBondContact OH-NH2 2.74Å
22	G	84.2	Confident	78	Confident	35 Å²	35	77.6 Å²	77.6	36%	0.361	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.1	8.9	177.8	0	0	0	0	0	114.5	G52 T54	G22-G52 PolarHBondContact N-O 3.43Å; G22-G52 VanDerWaalsContact N-O 3.07Å; G22-T54 VanDerWaalsContact O-CG2 3.24Å; G22-T54 WeakPolarHBondContact O-CG2 3.29Å
23	W	91.3	Very high	78.4	Confident	11 Å²	11	80.5 Å²	80.5	4%	0.042	40%	0.396	C	S	.	.			trans	-64.2	155.8	172.4	60.4	-86.1	0	0	0	112.7	F2 M4 Y19 E20 G25 A48 R51 A53 T54	F2-W23 HydrophobicContact CB-CE3 4.18Å; F2-W23 HydrophobicContact CD2-CB 3.67Å; F2-W23 HydrophobicContact CD2-CG 4.44Å; F2-W23 HydrophobicContact CE2-CB 3.87Å; M4-W23 HydrophobicContact CE-CH2 4.07Å; M4-W23 HydrophobicContact CG-CZ3 4.34Å; M4-W23 HydrophobicContact SD-CH2 3.34Å; M4-W23 WeakPolarHBondContact SD-CH2 3.36Å; M4-W23 HydrophobicContact SD-CZ3 3.45Å; M4-W23 WeakPolarHBondContact SD-CZ3 3.21Å; Y19-W23 HydrophobicContact CD2-CD2 4.21Å; Y19-W23 AromaticContact CD2-CE2 3.83Å; Y19-W23 HydrophobicContact CD2-CH2 4.37Å; Y19-W23 AromaticContact CD2-CZ2 3.94Å; Y19-W23 HydrophobicContact CD2-CZ2 3.94Å; E20-W23 VanDerWaalsContact O-CD1 3.29Å; W23-G25 VanDerWaalsContact CZ3-CA 3.5Å; W23-A48 HydrophobicContact CH2-CB 4.19Å; W23-A48 WeakPolarHBondContact CZ2-O 3.48Å; W23-R51 HydrophobicContact CZ2-CB 4.01Å; W23-R51 WeakPolarHBondContact CZ2-O 3.35Å; W23-R51 PolarHBondContact NE1-O 2.93Å; W23-A53 HydrophobicContact CD2-CB 3.98Å; W23-A53 HydrophobicContact CE3-CB 4.03Å; W23-A53 HydrophobicContact CH2-CB 3.75Å; W23-A53 HydrophobicContact CZ2-CB 3.72Å; W23-A53 HydrophobicContact CZ3-CB 3.92Å; W23-A53 CarbonylContact O-C 3.5Å; W23-A53 WeakPolarHBondContact O-CA 3.42Å; W23-T54 PolarHBondContact O-N 3.07Å
24	V	93.7	Very high	78.9	Confident	17 Å²	17	81.8 Å²	81.8	10%	0.103	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121	171.6	177.8	0	0	0	0	108	L1 F2 T54 A55 I57 A105 I107	L1-V24 CarbonylContact C-O 3.51Å; L1-V24 WeakPolarHBondContact CA-O 3.07Å; L1-V24 HydrophobicContact CD2-CB 3.91Å; L1-V24 HydrophobicContact CD2-CG1 3.74Å; F2-V24 PolarHBondContact N-O 2.86Å; V24-T54 HydrophobicContact CG2-CG2 3.69Å; V24-A55 HydrophobicContact CG1-CB 4.26Å; V24-A55 HydrophobicContact CG2-CB 4.34Å; V24-I57 HydrophobicContact CG1-CD1 3.96Å; V24-I57 HydrophobicContact CG1-CG1 4.11Å; V24-A105 HydrophobicContact CB-CB 4.45Å; V24-A105 HydrophobicContact CG1-CB 4.18Å; V24-A105 HydrophobicContact CG2-CB 4.43Å; V24-I107 HydrophobicContact CG1-CD1 4.47Å
25	G	93.1	Very high	79.4	Confident	1 Å²	1	78.7 Å²	78.7	1%	0.01	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	142.3	178.8	0	0	0	0	0	112.4	F2 W23 A55 I57	F2-G25 CarbonylContact O-C 3.57Å; F2-G25 WeakPolarHBondContact O-CA 3.42Å; W23-G25 VanDerWaalsContact CZ3-CA 3.5Å; G25-A55 PolarHBondContact N-O 3.39Å; G25-A55 VanDerWaalsContact N-O 3.08Å; G25-I57 PolarHBondContact O-N 2.81Å
26	V	94.5	Very high	79.7	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.006	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120.3	168.8	-174.6	0	0	0	0	108.3	L1 F2 Q3 M4 I57 L93 V97	L1-V26 HydrophobicContact CD2-CG2 3.54Å; F2-V26 PolarHBondContact O-N 3.46Å; Q3-V26 CarbonylContact C-O 3.57Å; Q3-V26 WeakPolarHBondContact CA-O 3.11Å; M4-V26 PolarHBondContact N-O 2.76Å; V26-I57 CarbonylContact C-O 3.52Å; V26-I57 WeakPolarHBondContact CA-O 3.24Å; V26-I57 HydrophobicContact CG2-CB 4.47Å; V26-L93 HydrophobicContact CG1-CD2 4.01Å; V26-L93 HydrophobicContact CG1-CG 4.44Å; V26-L93 HydrophobicContact CG2-CD2 4.46Å; V26-V97 HydrophobicContact CG2-CG2 4.19Å
27	V	93.5	Very high	80.1	Confident	1 Å²	1	72.2 Å²	72.2	1%	0.006	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	115.7	179.4	-172.6	0	0	0	0	107.6	M4 P6 L9 L29 V56 I57 F58 D59	M4-V27 HydrophobicContact CB-CG2 4.32Å; P6-V27 HydrophobicContact CB-CG1 4.44Å; P6-V27 HydrophobicContact CG-CG1 4.03Å; L9-V27 HydrophobicContact CD1-CG2 3.79Å; V27-L29 HydrophobicContact CG1-CD2 4.15Å; V27-L29 PolarHBondContact O-N 3.14Å; V27-V56 HydrophobicContact CG2-CG1 4.41Å; V27-I57 PolarHBondContact N-O 3.44Å; V27-F58 HydrophobicContact CB-CD1 3.72Å; V27-F58 HydrophobicContact CB-CE1 3.85Å; V27-F58 HydrophobicContact CG1-CD1 4.11Å; V27-F58 HydrophobicContact CG1-CE1 4.06Å; V27-F58 HydrophobicContact CG2-CD1 4.32Å; V27-F58 HydrophobicContact CG2-CE1 4.03Å; V27-F58 CarbonylContact O-C 3.54Å; V27-F58 WeakPolarHBondContact O-CA 3.41Å; V27-D59 PolarHBondContact O-N 2.83Å
28	K	93.3	Very high	81	Confident	66 Å²	66	71.9 Å²	71.9	29%	0.287	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.5	164	-177.9	174.8	-172.7	-157.7	0	107.9	P6 D59 E62 M94	P6-K28 WeakPolarHBondContact CG-O 3.47Å; K28-D59 HydrophobicContact CB-CB 4.31Å; K28-D59 WeakPolarHBondContact CE-OD2 3.41Å; K28-D59 HydrophobicContact CG-CB 4.22Å; K28-D59 WeakPolarHBondContact CG-OD2 3.29Å; K28-E62 IonicContact NZ-OE1 3.37Å; K28-E62 PolarHBondContact NZ-OE1 3.07Å; K28-M94 HydrophobicContact CB-CE 4.05Å; K28-M94 HydrophobicContact CB-SD 4.43Å; K28-M94 HydrophobicContact CD-CE 4.38Å
29	L	91.2	Very high	82.1	Confident	2 Å²	2	68 Å²	68	1%	0.01	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-73.1	144.7	171	-62.3	-176.4	0	0	0	109.8	V27 V41 F58 D59 V60 E62 N63 A66	V27-L29 HydrophobicContact CG1-CD2 4.15Å; V27-L29 PolarHBondContact O-N 3.14Å; L29-V41 HydrophobicContact CD1-CG1 4Å; L29-V41 HydrophobicContact CD1-CG2 4Å; L29-F58 HydrophobicContact CD1-CD1 4.26Å; L29-F58 HydrophobicContact CD2-CD1 3.72Å; L29-F58 HydrophobicContact CD2-CE1 4.03Å; L29-F58 HydrophobicContact CG-CD1 3.94Å; L29-D59 PolarHBondContact N-O 2.72Å; L29-V60 HydrophobicContact CD1-CG1 4.04Å; L29-E62 WeakPolarHBondContact O-CB 3.36Å; L29-N63 HydrophobicContact CB-CB 3.97Å; L29-N63 HydrophobicContact CD1-CB 4.34Å; L29-A66 HydrophobicContact CD1-CB 3.37Å
30	E	88.7	Confident	83	Confident	74 Å²	74	69.2 Å²	69.2	35%	0.346	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-97.3	166.2	172.5	-62.7	179.8	137.1	0	0	109.4	P6 D35 N63	P6-E30 HydrophobicContact CG-CG 4.48Å; E30-D35 HydrophobicContact CB-CB 4.39Å; E30-N63 PolarHBondContact O-ND2 3.13Å
31	Q	83.3	Confident	83.5	Confident	88 Å²	88	61.2 Å²	61.2	41%	0.411	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-62.6	140.7	179.5	-58.1	177.8	-0	0	0	109.1	E33 L34 D35 E62	Q31-E33 PolarHBondContact O-N 3.5Å; Q31-L34 HydrophobicContact CB-CD1 4.35Å; Q31-L34 PolarHBondContact O-N 3.34Å; Q31-D35 PolarHBondContact O-N 3.46Å; Q31-E62 HydrophobicContact CG-CB 3.85Å; Q31-E62 PolarHBondContact NE2-OE2 2.81Å
32	P	77.1	Confident	83.7	Confident	82 Å²	82	55.2 Å²	55.2	53%	0.532	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-12.8	-171.4	26.5	-35	0	0	0	114.3
33	E	73.6	Confident	83.9	Confident	184 Å²	184	54.4 Å²	54.4	86%	0.86	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-15.4	172.7	-58.1	-177.1	178	0	0	113.1	Q31	Q31-E33 PolarHBondContact O-N 3.5Å
34	L	73.1	Confident	83.8	Confident	125 Å²	125	54 Å²	54	65%	0.654	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	-29.5	-176	-72.8	165.3	0	0	0	113.6	Q31 P36	Q31-L34 HydrophobicContact CB-CD1 4.35Å; Q31-L34 PolarHBondContact O-N 3.34Å; L34-P36 WeakPolarHBondContact O-CD 3.48Å
35	D	67	Low	83.7	Confident	13 Å²	13	53.2 Å²	53.2	7%	0.07	30%	0.298	C	S	.	.			trans	-94	103.7	174.5	178.1	12.3	0	0	0	110.6	E30 Q31 S37 K44	E30-D35 HydrophobicContact CB-CB 4.39Å; Q31-D35 PolarHBondContact O-N 3.46Å; D35-S37 PolarHBondContact O-N 3.43Å; D35-S37 WeakPolarHBondContact OD1-CA 3.37Å; D35-K44 IonicContact OD1-NZ 2.69Å; D35-K44 PolarHBondContact OD1-NZ 3.42Å; D35-K44 IonicContact OD2-NZ 3.07Å; D35-K44 PolarHBondContact OD2-NZ 3.07Å
36	P	63.9	Low	83.5	Confident	114 Å²	114	55.8 Å²	55.8	74%	0.74	31%	0.309	S	S	*	.			trans	-70.2	75.1	168.9	31	-35.3	0	0	0	109.5	L34 C38	L34-P36 WeakPolarHBondContact O-CD 3.48Å; P36-C38 PolarHBondContact O-N 2.88Å
37	S	64.5	Low	83.3	Confident	74 Å²	74	58 Å²	58	52%	0.517	32%	0.317	S	S	.	.			trans	-64.8	108.2	-159.5	68.8	0	0	0	0	112.8	D35 L39	D35-S37 PolarHBondContact O-N 3.43Å; D35-S37 WeakPolarHBondContact OD1-CA 3.37Å; S37-L39 PolarHBondContact O-N 3Å; S37-L39 VanDerWaalsContact O-N 3.11Å
38	C	80.3	Confident	83.1	Confident	64 Å²	64	57.9 Å²	57.9	43%	0.432	32%	0.317	S	S	.	.	S	Bend	trans	-56	-25	177.9	64.7	0	0	0	0	114.9	C10 P36	C10-C38 WeakPolarHBondContact CA-SG 3.43Å; C10-C38 HydrophobicContact CB-CB 3.55Å; C10-C38 WeakPolarHBondContact CB-SG 3.22Å; C10-C38 WeakPolarHBondContact SG-CB 3.32Å; C10-C38 CovalentContact SG-SG 2.01Å; C10-C38 PolarHBondContact SG-SG 2.88Å; P36-C38 PolarHBondContact O-N 2.88Å
39	L	85.1	Confident	83	Confident	69 Å²	69	56.4 Å²	56.4	36%	0.361	31%	0.313	S	S	.	.	S	Bend	trans	-152.1	146.1	-171.3	-69.9	176	0	0	0	107.2	S37 K44	S37-L39 PolarHBondContact O-N 3Å; S37-L39 VanDerWaalsContact O-N 3.11Å; L39-K44 HydrophobicContact CB-CG 3.95Å; L39-K44 VanDerWaalsContact O-CE 3.32Å; L39-K44 WeakPolarHBondContact O-CE 3.17Å
40	T	88.3	Confident	82.9	Confident	84 Å²	84	63 Å²	63	52%	0.515	34%	0.344	S	S	.	.			trans	-59.7	161.9	170.4	63.5	0	0	0	0	111	L42 G43 K44	T40-L42 PolarHBondContact O-N 2.87Å; T40-G43 CarbonylContact O-C 3.55Å; T40-G43 WeakPolarHBondContact O-CA 3.32Å; T40-G43 PolarHBondContact O-N 3.32Å; T40-G43 PolarHBondContact OG1-N 3.19Å; T40-G43 VanDerWaalsContact OG1-N 3.13Å; T40-K44 PolarHBondContact O-N 2.81Å
41	V	89.5	Confident	82.8	Confident	11 Å²	11	61.2 Å²	61.2	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-57.7	-38.8	179.4	-174.2	0	0	0	0	111.5	L29 K44 A45 F58 A66 L70	L29-V41 HydrophobicContact CD1-CG1 4Å; L29-V41 HydrophobicContact CD1-CG2 4Å; V41-K44 PolarHBondContact O-N 3.16Å; V41-A45 PolarHBondContact O-N 3.18Å; V41-F58 HydrophobicContact CG1-CD1 4.01Å; V41-F58 HydrophobicContact CG1-CD2 4.16Å; V41-F58 HydrophobicContact CG1-CE1 3.82Å; V41-F58 HydrophobicContact CG1-CE2 3.97Å; V41-F58 HydrophobicContact CG1-CG 4.18Å; V41-F58 HydrophobicContact CG1-CZ 3.8Å; V41-A66 HydrophobicContact CG1-CB 4.38Å; V41-A66 HydrophobicContact CG2-CB 3.87Å; V41-L70 HydrophobicContact CG1-CD1 4.06Å; V41-L70 HydrophobicContact CG1-CD2 4.06Å; V41-L70 HydrophobicContact CG1-CG 4.04Å
42	L	88.5	Confident	83.1	Confident	43 Å²	43	57.4 Å²	57.4	23%	0.225	32%	0.318	C	S	.	.	H	α-helix	trans	-66.5	-34.8	172.4	-173.9	65.3	0	0	0	112.8	T40 A45 K46 L70 A74 L78	T40-L42 PolarHBondContact O-N 2.87Å; L42-A45 WeakPolarHBondContact O-CB 3.29Å; L42-A45 PolarHBondContact O-N 2.98Å; L42-K46 PolarHBondContact O-N 3.04Å; L42-L70 HydrophobicContact CD1-CD2 4.45Å; L42-A74 HydrophobicContact CD2-CB 4.02Å; L42-L78 HydrophobicContact CD1-CD1 3.81Å
43	G	88.9	Confident	83.8	Confident	19 Å²	19	53.5 Å²	53.5	20%	0.196	29%	0.293	C	S	.	.	H	α-helix	trans	-65.6	-45.9	172.6	0	0	0	0	0	112.7	T40 A45 K46 R47	T40-G43 CarbonylContact O-C 3.55Å; T40-G43 WeakPolarHBondContact O-CA 3.32Å; T40-G43 PolarHBondContact O-N 3.32Å; T40-G43 PolarHBondContact OG1-N 3.19Å; T40-G43 VanDerWaalsContact OG1-N 3.13Å; G43-A45 VanDerWaalsContact C-N 3.26Å; G43-A45 PolarHBondContact O-N 3.49Å; G43-K46 PolarHBondContact O-N 2.92Å; G43-K46 VanDerWaalsContact O-N 3.14Å; G43-R47 PolarHBondContact O-N 2.98Å
44	K	89.9	Confident	84.8	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.009	26%	0.264	C	S	.	.	H	α-helix	trans	-57.5	-40.5	172.2	-64.8	-174.2	-176.9	-167.8	0	110.5	P6 L9 D35 L39 T40 V41 R47 A48	P6-K44 PolarHBondContact O-NZ 2.69Å; L9-K44 HydrophobicContact CB-CB 4.26Å; L9-K44 HydrophobicContact CB-CG 4.38Å; L9-K44 HydrophobicContact CD1-CB 4.03Å; D35-K44 IonicContact OD1-NZ 2.69Å; D35-K44 PolarHBondContact OD1-NZ 3.42Å; D35-K44 IonicContact OD2-NZ 3.07Å; D35-K44 PolarHBondContact OD2-NZ 3.07Å; L39-K44 HydrophobicContact CB-CG 3.95Å; L39-K44 VanDerWaalsContact O-CE 3.32Å; L39-K44 WeakPolarHBondContact O-CE 3.17Å; T40-K44 PolarHBondContact O-N 2.81Å; V41-K44 PolarHBondContact O-N 3.16Å; K44-R47 PolarHBondContact O-N 2.84Å; K44-A48 PolarHBondContact O-N 2.81Å
45	A	90.9	Very high	85.8	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.4	-44.4	173.5	0	0	0	0	0	113.4	V41 L42 G43 R47 A48 V49 F58 L78 V82	V41-A45 PolarHBondContact O-N 3.18Å; L42-A45 WeakPolarHBondContact O-CB 3.29Å; L42-A45 PolarHBondContact O-N 2.98Å; G43-A45 VanDerWaalsContact C-N 3.26Å; G43-A45 PolarHBondContact O-N 3.49Å; A45-R47 PolarHBondContact O-N 3.29Å; A45-A48 PolarHBondContact O-N 2.82Å; A45-V49 WeakPolarHBondContact O-CG2 3.19Å; A45-V49 PolarHBondContact O-N 2.97Å; A45-V49 VanDerWaalsContact O-N 3.11Å; A45-F58 HydrophobicContact CB-CE2 3.87Å; A45-F58 HydrophobicContact CB-CZ 3.97Å; A45-L78 HydrophobicContact CB-CD1 3.83Å; A45-V82 HydrophobicContact CB-CG2 3.88Å
46	K	89.6	Confident	87.1	Confident	56 Å²	56	40.3 Å²	40.3	24%	0.243	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-40.9	174.9	-76.3	-173.8	-179.1	-162.6	0	111.6	L42 G43 V49 Q50 D76 L78	L42-K46 PolarHBondContact O-N 3.04Å; G43-K46 PolarHBondContact O-N 2.92Å; G43-K46 VanDerWaalsContact O-N 3.14Å; K46-V49 PolarHBondContact O-N 2.71Å; K46-Q50 VanDerWaalsContact O-CG 3.28Å; K46-Q50 WeakPolarHBondContact O-CG 3.3Å; K46-Q50 PolarHBondContact O-N 3.22Å; K46-D76 PolarHBondContact NZ-O 3.35Å; K46-D76 IonicContact NZ-OD2 2.71Å; K46-D76 PolarHBondContact NZ-OD2 3.12Å; K46-L78 HydrophobicContact CB-CD2 4.49Å; K46-L78 HydrophobicContact CG-CD1 4.21Å; K46-L78 HydrophobicContact CG-CD2 3.68Å; K46-L78 HydrophobicContact CG-CG 4.02Å
47	R	89.1	Confident	88.6	Confident	46 Å²	46	35.5 Å²	35.5	17%	0.174	20%	0.199	C	C	.	.	H	α-helix	trans	-66.9	-39.6	176	-167.4	64.1	176.7	-170.2	3.3	113.1	D14 G43 K44 A45 V49 Q50 R51	D14-R47 IonicContact OD1-CZ 2.64Å; D14-R47 IonicContact OD1-NE 2.68Å; D14-R47 IonicContact OD1-NH2 3.4Å; D14-R47 PolarHBondContact OD1-NH2 2.87Å; D14-R47 IonicContact OD2-CZ 3.97Å; D14-R47 IonicContact OD2-NH2 3.47Å; D14-R47 PolarHBondContact OD2-NH2 3.29Å; G43-R47 PolarHBondContact O-N 2.98Å; K44-R47 PolarHBondContact O-N 2.84Å; A45-R47 PolarHBondContact O-N 3.29Å; R47-V49 PolarHBondContact O-N 3.25Å; R47-Q50 WeakPolarHBondContact O-CB 3.48Å; R47-Q50 PolarHBondContact O-N 2.71Å; R47-R51 PolarHBondContact O-N 2.94Å
48	A	90.1	Very high	90	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.3	-43	175.7	0	0	0	0	0	112.2	L9 W23 K44 A45 R51 G52 A53 V56	L9-A48 HydrophobicContact CD1-CB 4.39Å; L9-A48 HydrophobicContact CD2-CB 3.73Å; W23-A48 HydrophobicContact CH2-CB 4.19Å; W23-A48 WeakPolarHBondContact CZ2-O 3.48Å; K44-A48 PolarHBondContact O-N 2.81Å; A45-A48 PolarHBondContact O-N 2.82Å; A48-R51 CarbonylContact O-C 3.58Å; A48-R51 PolarHBondContact O-N 3.43Å; A48-G52 PolarHBondContact O-N 2.91Å; A48-A53 HydrophobicContact CB-CB 4.38Å; A48-A53 WeakPolarHBondContact O-CB 3.21Å; A48-A53 PolarHBondContact O-N 2.64Å; A48-A53 VanDerWaalsContact O-N 3.12Å; A48-V56 HydrophobicContact CB-CG2 3.69Å
49	V	90.6	Very high	90.7	Very high	34 Å²	34	29.4 Å²	29.4	21%	0.206	16%	0.156	C	C	.	.	H	α-helix	trans	-69.5	-34.8	176.9	174.5	0	0	0	0	111.9	A45 K46 R47 R51 G52 V56 L78 R80	A45-V49 WeakPolarHBondContact O-CG2 3.19Å; A45-V49 PolarHBondContact O-N 2.97Å; A45-V49 VanDerWaalsContact O-N 3.11Å; K46-V49 PolarHBondContact O-N 2.71Å; R47-V49 PolarHBondContact O-N 3.25Å; V49-R51 VanDerWaalsContact C-N 3.34Å; V49-G52 PolarHBondContact O-N 3.17Å; V49-G52 VanDerWaalsContact O-N 3.08Å; V49-V56 HydrophobicContact CG2-CG2 4.11Å; V49-L78 HydrophobicContact CB-CD2 4.24Å; V49-L78 HydrophobicContact CG1-CD2 4.44Å; V49-L78 HydrophobicContact CG2-CD2 4.13Å; V49-R80 HydrophobicContact CG1-CB 4.07Å; V49-R80 HydrophobicContact CG1-CG 3.74Å; V49-R80 HydrophobicContact CG2-CB 3.86Å; V49-R80 HydrophobicContact CG2-CG 4.34Å
50	Q	88.1	Confident	91.2	Very high	142 Å²	142	26.2 Å²	26.2	66%	0.664	14%	0.14	S	C	*	.	H	α-helix	trans	-61.6	-39.4	170.5	-75.2	168.5	-14	0	0	112.1	K46 R47 G52	K46-Q50 VanDerWaalsContact O-CG 3.28Å; K46-Q50 WeakPolarHBondContact O-CG 3.3Å; K46-Q50 PolarHBondContact O-N 3.22Å; R47-Q50 WeakPolarHBondContact O-CB 3.48Å; R47-Q50 PolarHBondContact O-N 2.71Å; Q50-G52 PolarHBondContact O-N 3.37Å; Q50-G52 VanDerWaalsContact O-N 3.15Å
51	R	88.1	Confident	91.4	Very high	35 Å²	35	24.6 Å²	24.6	13%	0.132	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	19	171.3	-67.6	-165.9	-173.4	150.9	6.5	114.2	G8 N11 D14 W23 R47 A48 V49	G8-R51 PolarHBondContact O-NH1 3.33Å; G8-R51 PolarHBondContact O-NH2 2.82Å; N11-R51 PolarHBondContact O-NH2 3.17Å; D14-R51 IonicContact OD1-NE 2.7Å; D14-R51 PolarHBondContact OD1-NE 2.81Å; W23-R51 HydrophobicContact CZ2-CB 4.01Å; W23-R51 WeakPolarHBondContact CZ2-O 3.35Å; W23-R51 PolarHBondContact NE1-O 2.93Å; R47-R51 PolarHBondContact O-N 2.94Å; A48-R51 CarbonylContact O-C 3.58Å; A48-R51 PolarHBondContact O-N 3.43Å; V49-R51 VanDerWaalsContact C-N 3.34Å
52	G	89.3	Confident	91.4	Very high	8 Å²	8	27.3 Å²	27.3	8%	0.082	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	9.8	169.9	0	0	0	0	0	116.7	G22 A48 V49 Q50 T54	G22-G52 PolarHBondContact N-O 3.43Å; G22-G52 VanDerWaalsContact N-O 3.07Å; A48-G52 PolarHBondContact O-N 2.91Å; V49-G52 PolarHBondContact O-N 3.17Å; V49-G52 VanDerWaalsContact O-N 3.08Å; Q50-G52 PolarHBondContact O-N 3.37Å; Q50-G52 VanDerWaalsContact O-N 3.15Å; G52-T54 PolarHBondContact O-N 3.48Å
53	A	91.9	Very high	91.5	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.008	14%	0.137	C	C	.	.			trans	-64.5	129.6	175.4	0	0	0	0	0	111.7	W23 A48 A55 V56	W23-A53 HydrophobicContact CD2-CB 3.98Å; W23-A53 HydrophobicContact CE3-CB 4.03Å; W23-A53 HydrophobicContact CH2-CB 3.75Å; W23-A53 HydrophobicContact CZ2-CB 3.72Å; W23-A53 HydrophobicContact CZ3-CB 3.92Å; W23-A53 CarbonylContact O-C 3.5Å; W23-A53 WeakPolarHBondContact O-CA 3.42Å; A48-A53 HydrophobicContact CB-CB 4.38Å; A48-A53 WeakPolarHBondContact O-CB 3.21Å; A48-A53 PolarHBondContact O-N 2.64Å; A48-A53 VanDerWaalsContact O-N 3.12Å; A53-A55 VanDerWaalsContact C-N 3.31Å; A53-V56 HydrophobicContact CB-CG2 4.44Å
54	T	93.6	Very high	91.5	Very high	41 Å²	41	28.7 Å²	28.7	25%	0.252	15%	0.151	S	C	.	.	S	Bend	trans	-78.1	-17.9	171.3	-165.1	0	0	0	0	113	G22 W23 V24 G52 R80	G22-T54 VanDerWaalsContact O-CG2 3.24Å; G22-T54 WeakPolarHBondContact O-CG2 3.29Å; W23-T54 PolarHBondContact O-N 3.07Å; V24-T54 HydrophobicContact CG2-CG2 3.69Å; G52-T54 PolarHBondContact O-N 3.48Å; T54-R80 WeakPolarHBondContact O-CD 3.22Å; T54-R80 PolarHBondContact OG1-NH1 2.88Å
55	A	94.1	Very high	91.5	Very high	4 Å²	4	33.3 Å²	33.3	3%	0.033	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	157.3	174.7	0	0	0	0	0	110.5	V24 G25 A53 P81 I107	V24-A55 HydrophobicContact CG1-CB 4.26Å; V24-A55 HydrophobicContact CG2-CB 4.34Å; G25-A55 PolarHBondContact N-O 3.39Å; G25-A55 VanDerWaalsContact N-O 3.08Å; A53-A55 VanDerWaalsContact C-N 3.31Å; A55-P81 WeakPolarHBondContact CA-O 3.3Å; A55-P81 HydrophobicContact CB-CG 3.93Å; A55-I107 HydrophobicContact CB-CD1 3.47Å; A55-I107 VanDerWaalsContact CB-CD1 3.47Å
56	V	94.4	Very high	91.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	133.9	176.3	-171.9	0	0	0	0	109.4	V27 A48 V49 A53 F58 P81 V82 V83	V27-V56 HydrophobicContact CG2-CG1 4.41Å; A48-V56 HydrophobicContact CB-CG2 3.69Å; V49-V56 HydrophobicContact CG2-CG2 4.11Å; A53-V56 HydrophobicContact CB-CG2 4.44Å; V56-F58 HydrophobicContact CB-CE2 4.43Å; V56-F58 HydrophobicContact CG1-CD2 4.14Å; V56-F58 HydrophobicContact CG1-CE1 4.41Å; V56-F58 HydrophobicContact CG1-CE2 3.63Å; V56-F58 HydrophobicContact CG1-CZ 3.78Å; V56-P81 PolarHBondContact N-O 2.9Å; V56-P81 VanDerWaalsContact N-O 3.14Å; V56-V82 WeakPolarHBondContact O-CA 3.25Å; V56-V83 PolarHBondContact O-N 2.83Å
57	I	95.4	Very high	91.4	Very high	12 Å²	12	31.7 Å²	31.7	6%	0.062	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	120.4	174	-49.6	176.5	0	0	0	108.8	V24 G25 V26 V27 V83 V85 L93 I107	V24-I57 HydrophobicContact CG1-CD1 3.96Å; V24-I57 HydrophobicContact CG1-CG1 4.11Å; G25-I57 PolarHBondContact O-N 2.81Å; V26-I57 CarbonylContact C-O 3.52Å; V26-I57 WeakPolarHBondContact CA-O 3.24Å; V26-I57 HydrophobicContact CG2-CB 4.47Å; V27-I57 PolarHBondContact N-O 3.44Å; I57-V83 CarbonylContact C-O 3.57Å; I57-V83 VanDerWaalsContact CA-O 3.3Å; I57-V83 WeakPolarHBondContact CA-O 3.47Å; I57-V83 HydrophobicContact CG1-CB 4.49Å; I57-V85 HydrophobicContact CG2-CG1 4.16Å; I57-V85 HydrophobicContact CG2-CG2 4.03Å; I57-L93 HydrophobicContact CB-CD2 4.46Å; I57-L93 HydrophobicContact CD1-CD2 4.39Å; I57-L93 HydrophobicContact CG2-CD2 3.69Å; I57-I107 HydrophobicContact CD1-CD1 4.3Å; I57-I107 HydrophobicContact CG1-CD1 4.21Å
58	F	95.3	Very high	91.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	125.7	171.8	-68.4	-79	0	0	0	110.7	V27 L29 V41 A45 V56 V60 L70 V82 V83 Y84 V85	V27-F58 HydrophobicContact CB-CD1 3.72Å; V27-F58 HydrophobicContact CB-CE1 3.85Å; V27-F58 HydrophobicContact CG1-CD1 4.11Å; V27-F58 HydrophobicContact CG1-CE1 4.06Å; V27-F58 HydrophobicContact CG2-CD1 4.32Å; V27-F58 HydrophobicContact CG2-CE1 4.03Å; V27-F58 CarbonylContact O-C 3.54Å; V27-F58 WeakPolarHBondContact O-CA 3.41Å; L29-F58 HydrophobicContact CD1-CD1 4.26Å; L29-F58 HydrophobicContact CD2-CD1 3.72Å; L29-F58 HydrophobicContact CD2-CE1 4.03Å; L29-F58 HydrophobicContact CG-CD1 3.94Å; V41-F58 HydrophobicContact CG1-CD1 4.01Å; V41-F58 HydrophobicContact CG1-CD2 4.16Å; V41-F58 HydrophobicContact CG1-CE1 3.82Å; V41-F58 HydrophobicContact CG1-CE2 3.97Å; V41-F58 HydrophobicContact CG1-CG 4.18Å; V41-F58 HydrophobicContact CG1-CZ 3.8Å; A45-F58 HydrophobicContact CB-CE2 3.87Å; A45-F58 HydrophobicContact CB-CZ 3.97Å; V56-F58 HydrophobicContact CB-CE2 4.43Å; V56-F58 HydrophobicContact CG1-CD2 4.14Å; V56-F58 HydrophobicContact CG1-CE1 4.41Å; V56-F58 HydrophobicContact CG1-CE2 3.63Å; V56-F58 HydrophobicContact CG1-CZ 3.78Å; F58-V60 HydrophobicContact CB-CG1 3.81Å; F58-V60 PolarHBondContact O-N 2.97Å; F58-L70 HydrophobicContact CD2-CD1 4.06Å; F58-L70 HydrophobicContact CE2-CD2 4.5Å; F58-V82 HydrophobicContact CD2-CG1 3.64Å; F58-V82 HydrophobicContact CE2-CG1 3.61Å; F58-V83 PolarHBondContact N-O 3.18Å; F58-Y84 CarbonylContact O-C 3.6Å; F58-Y84 VanDerWaalsContact O-CA 3.28Å; F58-Y84 WeakPolarHBondContact O-CA 3.47Å; F58-V85 PolarHBondContact O-N 3.48Å
59	D	95	Very high	91.1	Very high	10 Å²	10	37.1 Å²	37.1	5%	0.053	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	113	155.9	169.7	19.1	0	0	0	107.7	V27 K28 L29 S61 V85 A90	V27-D59 PolarHBondContact O-N 2.83Å; K28-D59 HydrophobicContact CB-CB 4.31Å; K28-D59 WeakPolarHBondContact CE-OD2 3.41Å; K28-D59 HydrophobicContact CG-CB 4.22Å; K28-D59 WeakPolarHBondContact CG-OD2 3.29Å; L29-D59 PolarHBondContact N-O 2.72Å; D59-S61 WeakPolarHBondContact OD1-CB 3.43Å; D59-S61 PolarHBondContact OD1-N 3.25Å; D59-S61 PolarHBondContact OD1-OG 3.49Å; D59-V85 WeakPolarHBondContact CA-O 3.19Å; D59-V85 HydrophobicContact CB-CG2 4.27Å; D59-A90 HydrophobicContact CB-CB 4.14Å; D59-A90 VanDerWaalsContact OD1-CB 3.24Å; D59-A90 WeakPolarHBondContact OD1-CB 3.32Å
60	V	93.9	Very high	90.9	Very high	2 Å²	2	37 Å²	37	1%	0.012	20%	0.198	C	C	.	.			trans	-104.3	14.9	-177.2	-58.2	0	0	0	0	112	L29 F58 E62 N63 A66 I67 Y84 V85 K86	L29-V60 HydrophobicContact CD1-CG1 4.04Å; F58-V60 HydrophobicContact CB-CG1 3.81Å; F58-V60 PolarHBondContact O-N 2.97Å; V60-E62 VanDerWaalsContact C-N 3.28Å; V60-E62 PolarHBondContact O-N 3.21Å; V60-N63 CarbonylContact O-C 3.19Å; V60-N63 PolarHBondContact O-N 3.38Å; V60-N63 VanDerWaalsContact O-N 3.11Å; V60-A66 HydrophobicContact CG1-CB 4.03Å; V60-I67 HydrophobicContact CB-CG1 4.39Å; V60-I67 HydrophobicContact CG2-CD1 3.87Å; V60-I67 HydrophobicContact CG2-CG1 3.81Å; V60-Y84 HydrophobicContact CG2-CD2 4.17Å; V60-Y84 HydrophobicContact CG2-CG 4.49Å; V60-V85 WeakPolarHBondContact CG2-O 3.49Å; V60-V85 PolarHBondContact N-O 2.81Å; V60-K86 HydrophobicContact CG2-CB 4.09Å
61	S	92.8	Very high	90.7	Very high	50 Å²	50	34.8 Å²	34.8	35%	0.35	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.9	-175.1	-53.5	0	0	0	0	113.7	D59 K86 G87 A90	D59-S61 WeakPolarHBondContact OD1-CB 3.43Å; D59-S61 PolarHBondContact OD1-N 3.25Å; D59-S61 PolarHBondContact OD1-OG 3.49Å; S61-K86 WeakPolarHBondContact OG-CA 3.45Å; S61-G87 PolarHBondContact OG-N 3.08Å; S61-A90 WeakPolarHBondContact OG-CB 3.39Å
62	E	90.2	Very high	90.4	Very high	69 Å²	69	41.4 Å²	41.4	32%	0.322	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-9.9	176.4	-52.8	-68.6	168.3	0	0	112.9	K28 L29 Q31 V60	K28-E62 IonicContact NZ-OE1 3.37Å; K28-E62 PolarHBondContact NZ-OE1 3.07Å; L29-E62 WeakPolarHBondContact O-CB 3.36Å; Q31-E62 HydrophobicContact CG-CB 3.85Å; Q31-E62 PolarHBondContact NE2-OE2 2.81Å; V60-E62 VanDerWaalsContact C-N 3.28Å; V60-E62 PolarHBondContact O-N 3.21Å
63	N	89.9	Confident	89	Confident	13 Å²	13	48 Å²	48	7%	0.07	25%	0.254	C	S	.	.			trans	-148.3	71.8	-169.1	-165	-39.1	0	0	0	109.4	L29 E30 V60 D65 A66	L29-N63 HydrophobicContact CB-CB 3.97Å; L29-N63 HydrophobicContact CD1-CB 4.34Å; E30-N63 PolarHBondContact O-ND2 3.13Å; V60-N63 CarbonylContact O-C 3.19Å; V60-N63 PolarHBondContact O-N 3.38Å; V60-N63 VanDerWaalsContact O-N 3.11Å; N63-D65 VanDerWaalsContact C-N 3.28Å; N63-D65 PolarHBondContact O-N 2.91Å; N63-A66 WeakPolarHBondContact O-CB 3.28Å; N63-A66 PolarHBondContact O-N 2.8Å; N63-A66 PolarHBondContact OD1-N 2.9Å
64	P	90	Very high	87.8	Confident	78 Å²	78	49.6 Å²	49.6	51%	0.506	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-32.7	-174.9	25.8	-33.7	0	0	0	112.3	A66 I67	P64-A66 PolarHBondContact O-N 3.46Å; P64-A66 VanDerWaalsContact O-N 3.1Å; P64-I67 VanDerWaalsContact O-CB 3.22Å; P64-I67 WeakPolarHBondContact O-CB 3.47Å; P64-I67 VanDerWaalsContact O-CG1 3.27Å; P64-I67 WeakPolarHBondContact O-CG1 3.32Å; P64-I67 PolarHBondContact O-N 3.35Å
65	D	88.4	Confident	86.5	Confident	99 Å²	99	57.4 Å²	57.4	53%	0.529	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.2	179	-56	3.8	0	0	0	112.9	N63 I67 D68 Q69	N63-D65 VanDerWaalsContact C-N 3.28Å; N63-D65 PolarHBondContact O-N 2.91Å; D65-I67 PolarHBondContact O-N 3.27Å; D65-D68 PolarHBondContact O-N 2.9Å; D65-Q69 PolarHBondContact O-N 3.23Å
66	A	88.7	Confident	85.7	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-57.4	-29.7	169	0	0	0	0	0	113	L29 V41 V60 N63 P64 Q69 L70	L29-A66 HydrophobicContact CD1-CB 3.37Å; V41-A66 HydrophobicContact CG1-CB 4.38Å; V41-A66 HydrophobicContact CG2-CB 3.87Å; V60-A66 HydrophobicContact CG1-CB 4.03Å; N63-A66 WeakPolarHBondContact O-CB 3.28Å; N63-A66 PolarHBondContact O-N 2.8Å; N63-A66 PolarHBondContact OD1-N 2.9Å; P64-A66 PolarHBondContact O-N 3.46Å; P64-A66 VanDerWaalsContact O-N 3.1Å; A66-Q69 PolarHBondContact O-N 3.49Å; A66-L70 WeakPolarHBondContact O-CB 3.47Å; A66-L70 WeakPolarHBondContact O-CG 3.49Å; A66-L70 PolarHBondContact O-N 3.13Å
67	I	90.4	Very high	85	Confident	22 Å²	22	66.6 Å²	66.6	11%	0.113	36%	0.355	C	S	.	.	H	α-helix	trans	-61.6	-45.5	175.8	-63	171.5	0	0	0	109.8	V60 P64 D65 Q69 L70 N71 Y84 K86	V60-I67 HydrophobicContact CB-CG1 4.39Å; V60-I67 HydrophobicContact CG2-CD1 3.87Å; V60-I67 HydrophobicContact CG2-CG1 3.81Å; P64-I67 VanDerWaalsContact O-CB 3.22Å; P64-I67 WeakPolarHBondContact O-CB 3.47Å; P64-I67 VanDerWaalsContact O-CG1 3.27Å; P64-I67 WeakPolarHBondContact O-CG1 3.32Å; P64-I67 PolarHBondContact O-N 3.35Å; D65-I67 PolarHBondContact O-N 3.27Å; I67-Q69 VanDerWaalsContact C-N 3.33Å; I67-Q69 PolarHBondContact O-N 2.97Å; I67-L70 PolarHBondContact O-N 3.47Å; I67-L70 VanDerWaalsContact O-N 3.16Å; I67-N71 VanDerWaalsContact CG2-ND2 3.32Å; I67-N71 WeakPolarHBondContact CG2-ND2 3.31Å; I67-N71 WeakPolarHBondContact O-CB 3.45Å; I67-N71 VanDerWaalsContact O-CG 3.24Å; I67-N71 PolarHBondContact O-N 3.17Å; I67-N71 PolarHBondContact O-ND2 2.89Å; I67-Y84 HydrophobicContact CD1-CD2 4.09Å; I67-Y84 HydrophobicContact CD1-CE2 3.97Å; I67-Y84 HydrophobicContact CG1-CD2 3.95Å; I67-Y84 HydrophobicContact CG1-CE2 4.05Å; I67-Y84 HydrophobicContact CG1-CG 4.26Å; I67-Y84 HydrophobicContact CG2-CE1 4.16Å; I67-Y84 HydrophobicContact CG2-CE2 4.23Å; I67-K86 HydrophobicContact CD1-CD 4.47Å
68	D	88.3	Confident	84.5	Confident	100 Å²	100	68.1 Å²	68.1	54%	0.535	36%	0.363	S	S	.	.	H	α-helix	trans	-71.5	-29.2	178.8	-67.3	-22.1	0	0	0	112.2	D65 L70 R72	D65-D68 PolarHBondContact O-N 2.9Å; D68-L70 VanDerWaalsContact C-N 3.32Å; D68-R72 VanDerWaalsContact O-CG 3.24Å; D68-R72 WeakPolarHBondContact O-CG 3.43Å; D68-R72 PolarHBondContact O-N 2.93Å; D68-R72 PolarHBondContact O-NE 2.79Å
69	Q	85	Confident	84.1	Confident	60 Å²	60	78 Å²	78	28%	0.28	41%	0.406	S	S	.	.	H	α-helix	trans	-67.2	-32.8	170.3	-64.9	-175.8	42.7	0	0	112.8	D65 A66 I67	D65-Q69 PolarHBondContact O-N 3.23Å; A66-Q69 PolarHBondContact O-N 3.49Å; I67-Q69 VanDerWaalsContact C-N 3.33Å; I67-Q69 PolarHBondContact O-N 2.97Å
70	L	86.1	Confident	84	Confident	31 Å²	31	81.3 Å²	81.3	16%	0.162	42%	0.418	C	S	.	.	H	α-helix	trans	-82.8	-30.1	177.4	-71.7	172	0	0	0	113	V41 L42 F58 A66 I67 D68 V82	V41-L70 HydrophobicContact CG1-CD1 4.06Å; V41-L70 HydrophobicContact CG1-CD2 4.06Å; V41-L70 HydrophobicContact CG1-CG 4.04Å; L42-L70 HydrophobicContact CD1-CD2 4.45Å; F58-L70 HydrophobicContact CD2-CD1 4.06Å; F58-L70 HydrophobicContact CE2-CD2 4.5Å; A66-L70 WeakPolarHBondContact O-CB 3.47Å; A66-L70 WeakPolarHBondContact O-CG 3.49Å; A66-L70 PolarHBondContact O-N 3.13Å; I67-L70 PolarHBondContact O-N 3.47Å; I67-L70 VanDerWaalsContact O-N 3.16Å; D68-L70 VanDerWaalsContact C-N 3.32Å; L70-V82 HydrophobicContact CD1-CG1 4.28Å; L70-V82 HydrophobicContact CD2-CG1 4.02Å
71	N	84.6	Confident	83.9	Confident	95 Å²	95	84.4 Å²	84.4	51%	0.508	44%	0.438	S	S	.	.	H	α-helix	trans	-84	-14.5	179.5	-72.5	-17.2	0	0	0	113.8	I67 V73	I67-N71 VanDerWaalsContact CG2-ND2 3.32Å; I67-N71 WeakPolarHBondContact CG2-ND2 3.31Å; I67-N71 WeakPolarHBondContact O-CB 3.45Å; I67-N71 VanDerWaalsContact O-CG 3.24Å; I67-N71 PolarHBondContact O-N 3.17Å; I67-N71 PolarHBondContact O-ND2 2.89Å; N71-V73 PolarHBondContact O-N 3.21Å
72	R	81.3	Confident	83.9	Confident	175 Å²	175	84.2 Å²	84.2	66%	0.66	43%	0.434	S	S	*	.	S	Bend	trans	-55.2	129.3	169.9	-81.8	161.1	-155.6	-161.7	3.1	109.7	D68 A74	D68-R72 VanDerWaalsContact O-CG 3.24Å; D68-R72 WeakPolarHBondContact O-CG 3.43Å; D68-R72 PolarHBondContact O-N 2.93Å; D68-R72 PolarHBondContact O-NE 2.79Å; R72-A74 PolarHBondContact O-N 3.37Å
73	V	60.1	Low	84	Confident	146 Å²	146	82.8 Å²	82.8	89%	0.885	43%	0.43	S	S	*	.			trans	-60.9	101.2	179.7	-178.5	0	0	0	0	109.4	N71	N71-V73 PolarHBondContact O-N 3.21Å
74	A	65.9	Low	84.2	Confident	34 Å²	34	85.5 Å²	85.5	28%	0.281	44%	0.44	S	S	.	.			trans	-78.4	123.9	174.5	0	0	0	0	0	109.5	L42 R72 D76	L42-A74 HydrophobicContact CD2-CB 4.02Å; R72-A74 PolarHBondContact O-N 3.37Å; A74-D76 PolarHBondContact O-N 3.15Å
75	E	66.4	Low	84.5	Confident	205 Å²	205	82.7 Å²	82.7	96%	0.958	42%	0.421	S	S	*	.	S	Bend	trans	-58.7	-28.2	174.9	-58.9	179.2	156.3	0	0	112.2
76	D	76.4	Confident	84.7	Confident	104 Å²	104	84.3 Å²	84.3	56%	0.556	42%	0.424	S	S	*	.	S	Bend	trans	-118.1	93.3	170.5	170	52	0	0	0	110.1	K46 A74	K46-D76 PolarHBondContact NZ-O 3.35Å; K46-D76 IonicContact NZ-OD2 2.71Å; K46-D76 PolarHBondContact NZ-OD2 3.12Å; A74-D76 PolarHBondContact O-N 3.15Å
77	P	81.1	Confident	84.9	Confident	93 Å²	93	86 Å²	86	60%	0.604	44%	0.44	S	S	*	.			trans	-75.9	144.9	177.3	30.7	-34.5	0	0	0	112.1	K79	P77-K79 PolarHBondContact O-N 3.31Å
78	L	84.8	Confident	85.1	Confident	44 Å²	44	91.1 Å²	91.1	23%	0.23	47%	0.468	C	S	.	.			trans	-64.8	128.7	-177.3	-87.8	160.2	0	0	0	113.1	L42 A45 K46 V49 R80 V82	L42-L78 HydrophobicContact CD1-CD1 3.81Å; A45-L78 HydrophobicContact CB-CD1 3.83Å; K46-L78 HydrophobicContact CB-CD2 4.49Å; K46-L78 HydrophobicContact CG-CD1 4.21Å; K46-L78 HydrophobicContact CG-CD2 3.68Å; K46-L78 HydrophobicContact CG-CG 4.02Å; V49-L78 HydrophobicContact CB-CD2 4.24Å; V49-L78 HydrophobicContact CG1-CD2 4.44Å; V49-L78 HydrophobicContact CG2-CD2 4.13Å; L78-R80 WeakPolarHBondContact CB-O 3.09Å; L78-R80 PolarHBondContact O-N 3.28Å; L78-V82 HydrophobicContact CD1-CG2 3.49Å; L78-V82 VanDerWaalsContact CD1-CG2 3.49Å
79	K	87.3	Confident	85.3	Confident	207 Å²	207	88.6 Å²	88.6	90%	0.9	46%	0.455	S	S	*	.	S	Bend	trans	-63.9	-6.8	173.1	-63.3	-174.5	180	-178.2	0	114.7	P77	P77-K79 PolarHBondContact O-N 3.31Å
80	R	91.5	Very high	85.7	Confident	81 Å²	81	85.8 Å²	85.8	31%	0.306	44%	0.442	S	S	.	.	S	Bend	trans	-128.4	140.6	178.6	-66.7	-56.8	-161.2	174.7	0.3	109.2	Y21 V49 T54 L78 V82	Y21-R80 PolarHBondContact OH-NH2 2.74Å; V49-R80 HydrophobicContact CG1-CB 4.07Å; V49-R80 HydrophobicContact CG1-CG 3.74Å; V49-R80 HydrophobicContact CG2-CB 3.86Å; V49-R80 HydrophobicContact CG2-CG 4.34Å; T54-R80 WeakPolarHBondContact O-CD 3.22Å; T54-R80 PolarHBondContact OG1-NH1 2.88Å; L78-R80 WeakPolarHBondContact CB-O 3.09Å; L78-R80 PolarHBondContact O-N 3.28Å; R80-V82 PolarHBondContact O-N 2.9Å
81	P	92.4	Very high	86	Confident	67 Å²	67	88.4 Å²	88.4	44%	0.435	46%	0.459	S	S	.	.			trans	-66.8	135.1	-174.6	26.6	-34.4	0	0	0	111.9	A55 V56	A55-P81 WeakPolarHBondContact CA-O 3.3Å; A55-P81 HydrophobicContact CB-CG 3.93Å; V56-P81 PolarHBondContact N-O 2.9Å; V56-P81 VanDerWaalsContact N-O 3.14Å
82	V	92.7	Very high	86.5	Confident	46 Å²	46	89 Å²	89	28%	0.279	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132	164.3	-177.8	0	0	0	0	107.7	A45 V56 F58 L70 L78 R80	A45-V82 HydrophobicContact CB-CG2 3.88Å; V56-V82 WeakPolarHBondContact O-CA 3.25Å; F58-V82 HydrophobicContact CD2-CG1 3.64Å; F58-V82 HydrophobicContact CE2-CG1 3.61Å; L70-V82 HydrophobicContact CD1-CG1 4.28Å; L70-V82 HydrophobicContact CD2-CG1 4.02Å; L78-V82 HydrophobicContact CD1-CG2 3.49Å; L78-V82 VanDerWaalsContact CD1-CG2 3.49Å; R80-V82 PolarHBondContact O-N 2.9Å
83	V	93.5	Very high	87.1	Confident	38 Å²	38	82 Å²	82	23%	0.23	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	143.7	177.6	-178.5	0	0	0	0	107.9	V56 I57 F58 I107	V56-V83 PolarHBondContact O-N 2.83Å; I57-V83 CarbonylContact C-O 3.57Å; I57-V83 VanDerWaalsContact CA-O 3.3Å; I57-V83 WeakPolarHBondContact CA-O 3.47Å; I57-V83 HydrophobicContact CG1-CB 4.49Å; F58-V83 PolarHBondContact N-O 3.18Å; V83-I107 HydrophobicContact CG2-CD1 4.08Å; V83-I107 HydrophobicContact CG2-CG2 3.94Å
84	Y	94	Very high	88.5	Confident	71 Å²	71	76.6 Å²	76.6	28%	0.278	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	147.5	166.5	60.5	-95.1	0	0	0	110.6	F58 V60 I67	F58-Y84 CarbonylContact O-C 3.6Å; F58-Y84 VanDerWaalsContact O-CA 3.28Å; F58-Y84 WeakPolarHBondContact O-CA 3.47Å; V60-Y84 HydrophobicContact CG2-CD2 4.17Å; V60-Y84 HydrophobicContact CG2-CG 4.49Å; I67-Y84 HydrophobicContact CD1-CD2 4.09Å; I67-Y84 HydrophobicContact CD1-CE2 3.97Å; I67-Y84 HydrophobicContact CG1-CD2 3.95Å; I67-Y84 HydrophobicContact CG1-CE2 4.05Å; I67-Y84 HydrophobicContact CG1-CG 4.26Å; I67-Y84 HydrophobicContact CG2-CE1 4.16Å; I67-Y84 HydrophobicContact CG2-CE2 4.23Å
85	V	94.8	Very high	89.8	Confident	19 Å²	19	78 Å²	78	12%	0.115	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.2	174.6	-66.2	0	0	0	0	109.3	I57 F58 D59 V60 A90 L93	I57-V85 HydrophobicContact CG2-CG1 4.16Å; I57-V85 HydrophobicContact CG2-CG2 4.03Å; F58-V85 PolarHBondContact O-N 3.48Å; D59-V85 WeakPolarHBondContact CA-O 3.19Å; D59-V85 HydrophobicContact CB-CG2 4.27Å; V60-V85 WeakPolarHBondContact CG2-O 3.49Å; V60-V85 PolarHBondContact N-O 2.81Å; V85-A90 HydrophobicContact CB-CB 4.24Å; V85-A90 HydrophobicContact CG2-CB 3.82Å; V85-L93 HydrophobicContact CG2-CD2 3.96Å
86	K	94.1	Very high	91	Very high	133 Å²	133	70.6 Å²	70.6	58%	0.578	37%	0.367	S	S	*	.			trans	-140.8	155.2	179.8	64.9	179.4	-178.1	177.5	0	112.3	V60 S61 I67	V60-K86 HydrophobicContact CG2-CB 4.09Å; S61-K86 WeakPolarHBondContact OG-CA 3.45Å; I67-K86 HydrophobicContact CD1-CD 4.47Å
87	G	93.4	Very high	91.7	Very high	34 Å²	34	66.7 Å²	66.7	35%	0.351	35%	0.347	S	S	.	.	H	α-helix	trans	58.8	-136.3	173.6	0	0	0	0	0	112.9	S61 D89 A90 V91	S61-G87 PolarHBondContact OG-N 3.08Å; G87-D89 PolarHBondContact O-N 3.04Å; G87-D89 VanDerWaalsContact O-N 3.09Å; G87-A90 WeakPolarHBondContact O-CB 3.47Å; G87-A90 PolarHBondContact O-N 3.17Å; G87-V91 WeakPolarHBondContact O-CG2 3.31Å; G87-V91 PolarHBondContact O-N 2.87Å
88	N	93.4	Very high	92.1	Very high	131 Å²	131	67.2 Å²	67.2	70%	0.701	35%	0.345	S	S	*	.	H	α-helix	trans	-56.4	-32.1	-170.9	-60.3	44.6	0	0	0	114	K92	N88-K92 VanDerWaalsContact O-CG 3.26Å; N88-K92 WeakPolarHBondContact O-CG 3.46Å; N88-K92 PolarHBondContact O-N 3.37Å
89	D	92.8	Very high	92.3	Very high	47 Å²	47	72.4 Å²	72.4	25%	0.251	37%	0.365	S	S	.	.	H	α-helix	trans	-80.3	-31.2	178.7	-70.9	-30.3	0	0	0	112.9	G87 K92 L93 V709	G87-D89 PolarHBondContact O-N 3.04Å; G87-D89 VanDerWaalsContact O-N 3.09Å; D89-K92 PolarHBondContact O-N 3.17Å; D89-K92 WeakPolarHBondContact OD1-CD 3.37Å; D89-K92 WeakPolarHBondContact OD1-CE 3.44Å; D89-K92 IonicContact OD1-NZ 2.83Å; D89-K92 PolarHBondContact OD1-NZ 3.26Å; D89-L93 WeakPolarHBondContact O-CB 3.39Å; D89-L93 PolarHBondContact O-N 2.99Å; D89-V709 HydrophobicContact CB-CG1 3.99Å
90	A	93.6	Very high	92.4	Very high	1 Å²	1	68 Å²	68	1%	0.008	35%	0.348	C	S	.	.	H	α-helix	trans	-64.9	-44.8	167.2	0	0	0	0	0	111.2	D59 S61 V85 G87 K92 L93 M94	D59-A90 HydrophobicContact CB-CB 4.14Å; D59-A90 VanDerWaalsContact OD1-CB 3.24Å; D59-A90 WeakPolarHBondContact OD1-CB 3.32Å; S61-A90 WeakPolarHBondContact OG-CB 3.39Å; V85-A90 HydrophobicContact CB-CB 4.24Å; V85-A90 HydrophobicContact CG2-CB 3.82Å; G87-A90 WeakPolarHBondContact O-CB 3.47Å; G87-A90 PolarHBondContact O-N 3.17Å; A90-K92 VanDerWaalsContact C-N 3.31Å; A90-K92 PolarHBondContact O-N 2.95Å; A90-L93 PolarHBondContact O-N 3.24Å; A90-L93 VanDerWaalsContact O-N 3.15Å; A90-M94 WeakPolarHBondContact O-CB 3.42Å; A90-M94 PolarHBondContact O-N 3.32Å
91	V	92.9	Very high	91.8	Very high	85 Å²	85	74.3 Å²	74.3	52%	0.515	38%	0.378	S	S	.	.	H	α-helix	trans	-60	-39.4	175.8	174.3	0	0	0	0	111.6	G87 N95	G87-V91 WeakPolarHBondContact O-CG2 3.31Å; G87-V91 PolarHBondContact O-N 2.87Å; V91-N95 WeakPolarHBondContact O-CB 3.34Å; V91-N95 PolarHBondContact O-N 2.92Å; V91-N95 PolarHBondContact O-ND2 2.85Å
92	K	93.8	Very high	91.5	Very high	108 Å²	108	77.4 Å²	77.4	47%	0.47	40%	0.395	S	S	.	.	H	α-helix	trans	-62.9	-49.6	172	-71.7	166.2	-156.2	164.6	0	111.7	N88 D89 A90 M94 N95 I96	N88-K92 VanDerWaalsContact O-CG 3.26Å; N88-K92 WeakPolarHBondContact O-CG 3.46Å; N88-K92 PolarHBondContact O-N 3.37Å; D89-K92 PolarHBondContact O-N 3.17Å; D89-K92 WeakPolarHBondContact OD1-CD 3.37Å; D89-K92 WeakPolarHBondContact OD1-CE 3.44Å; D89-K92 IonicContact OD1-NZ 2.83Å; D89-K92 PolarHBondContact OD1-NZ 3.26Å; A90-K92 VanDerWaalsContact C-N 3.31Å; A90-K92 PolarHBondContact O-N 2.95Å; K92-M94 PolarHBondContact O-N 3.28Å; K92-N95 WeakPolarHBondContact O-CB 3.43Å; K92-N95 PolarHBondContact O-N 2.85Å; K92-I96 WeakPolarHBondContact O-CG1 3.33Å; K92-I96 PolarHBondContact O-N 3.5Å
93	L	93.4	Very high	91.3	Very high	27 Å²	27	76.3 Å²	76.3	14%	0.141	39%	0.391	C	S	.	.	H	α-helix	trans	-59.4	-47.8	-179.9	179.9	63.9	0	0	0	111.4	V26 I57 V85 D89 A90 N95 I96 V97	V26-L93 HydrophobicContact CG1-CD2 4.01Å; V26-L93 HydrophobicContact CG1-CG 4.44Å; V26-L93 HydrophobicContact CG2-CD2 4.46Å; I57-L93 HydrophobicContact CB-CD2 4.46Å; I57-L93 HydrophobicContact CD1-CD2 4.39Å; I57-L93 HydrophobicContact CG2-CD2 3.69Å; V85-L93 HydrophobicContact CG2-CD2 3.96Å; D89-L93 WeakPolarHBondContact O-CB 3.39Å; D89-L93 PolarHBondContact O-N 2.99Å; A90-L93 PolarHBondContact O-N 3.24Å; A90-L93 VanDerWaalsContact O-N 3.15Å; L93-N95 VanDerWaalsContact C-N 3.32Å; L93-N95 PolarHBondContact O-N 3.17Å; L93-I96 WeakPolarHBondContact O-CB 3.31Å; L93-I96 PolarHBondContact O-N 3.45Å; L93-I96 VanDerWaalsContact O-N 3.11Å; L93-V97 HydrophobicContact CD1-CG2 4.39Å; L93-V97 HydrophobicContact CG-CG2 4.5Å; L93-V97 WeakPolarHBondContact O-CG2 3.33Å; L93-V97 PolarHBondContact O-N 3.27Å
94	M	91	Very high	91.1	Very high	33 Å²	33	85 Å²	85	16%	0.163	42%	0.42	C	S	.	.	H	α-helix	trans	-65	-35.7	179.3	-158.3	68.7	173.7	0	0	111.8	Q3 K28 A90 K92 V97 N98	Q3-M94 VanDerWaalsContact NE2-CE 3.3Å; K28-M94 HydrophobicContact CB-CE 4.05Å; K28-M94 HydrophobicContact CB-SD 4.43Å; K28-M94 HydrophobicContact CD-CE 4.38Å; A90-M94 WeakPolarHBondContact O-CB 3.42Å; A90-M94 PolarHBondContact O-N 3.32Å; K92-M94 PolarHBondContact O-N 3.28Å; M94-V97 PolarHBondContact O-N 2.93Å; M94-N98 VanDerWaalsContact O-CB 3.27Å; M94-N98 WeakPolarHBondContact O-CB 3.44Å; M94-N98 PolarHBondContact O-N 2.84Å; M94-N98 PolarHBondContact O-OD1 3.35Å
95	N	92.9	Very high	90.9	Very high	65 Å²	65	83 Å²	83	35%	0.348	42%	0.417	S	S	.	.	H	α-helix	trans	-63.4	-39.1	171.2	-93.5	-82.3	0	0	0	112.7	V91 K92 L93 K99	V91-N95 WeakPolarHBondContact O-CB 3.34Å; V91-N95 PolarHBondContact O-N 2.92Å; V91-N95 PolarHBondContact O-ND2 2.85Å; K92-N95 WeakPolarHBondContact O-CB 3.43Å; K92-N95 PolarHBondContact O-N 2.85Å; L93-N95 VanDerWaalsContact C-N 3.32Å; L93-N95 PolarHBondContact O-N 3.17Å; N95-K99 VanDerWaalsContact O-CB 3.24Å; N95-K99 WeakPolarHBondContact O-CB 3.45Å; N95-K99 WeakPolarHBondContact O-CD 3.45Å; N95-K99 VanDerWaalsContact O-CG 3.27Å; N95-K99 WeakPolarHBondContact O-CG 3.32Å; N95-K99 PolarHBondContact O-N 2.95Å; N95-K99 WeakPolarHBondContact OD1-CE 3.44Å; N95-K99 PolarHBondContact OD1-NZ 3.44Å
96	I	92.1	Very high	90.7	Very high	49 Å²	49	91.6 Å²	91.6	25%	0.251	45%	0.447	S	S	.	.	H	α-helix	trans	-66	-48.1	175.8	-67.7	163.9	0	0	0	109.7	K92 L93 K99 Q100 A103	K92-I96 WeakPolarHBondContact O-CG1 3.33Å; K92-I96 PolarHBondContact O-N 3.5Å; L93-I96 WeakPolarHBondContact O-CB 3.31Å; L93-I96 PolarHBondContact O-N 3.45Å; L93-I96 VanDerWaalsContact O-N 3.11Å; I96-K99 PolarHBondContact O-N 3.44Å; I96-Q100 HydrophobicContact CG2-CG 4.15Å; I96-Q100 VanDerWaalsContact O-CB 3.29Å; I96-Q100 WeakPolarHBondContact O-CB 3.33Å; I96-Q100 WeakPolarHBondContact O-CG 3.31Å; I96-Q100 PolarHBondContact O-N 3.22Å; I96-A103 HydrophobicContact CG2-CB 4.19Å
97	V	90.6	Very high	90.5	Very high	22 Å²	22	88.8 Å²	88.8	13%	0.133	44%	0.438	C	S	.	.	H	α-helix	trans	-61.3	-45	-179.9	170.6	0	0	0	0	111.9	Q3 V26 L93 M94 K99	Q3-V97 HydrophobicContact CB-CG1 3.69Å; Q3-V97 HydrophobicContact CG-CG1 4.08Å; V26-V97 HydrophobicContact CG2-CG2 4.19Å; L93-V97 HydrophobicContact CD1-CG2 4.39Å; L93-V97 HydrophobicContact CG-CG2 4.5Å; L93-V97 WeakPolarHBondContact O-CG2 3.33Å; L93-V97 PolarHBondContact O-N 3.27Å; M94-V97 PolarHBondContact O-N 2.93Å; V97-K99 VanDerWaalsContact C-N 3.35Å; V97-K99 PolarHBondContact O-N 3.42Å
98	N	89.1	Confident	90.2	Very high	104 Å²	104	93.3 Å²	93.3	56%	0.556	45%	0.45	S	S	*	.	H	α-helix	trans	-72.9	-22.5	-179.3	-68.9	-5.9	0	0	0	114	Q3 M94	Q3-N98 PolarHBondContact OE1-OD1 2.76Å; M94-N98 VanDerWaalsContact O-CB 3.27Å; M94-N98 WeakPolarHBondContact O-CB 3.44Å; M94-N98 PolarHBondContact O-N 2.84Å; M94-N98 PolarHBondContact O-OD1 3.35Å
99	K	89.6	Confident	89.7	Confident	152 Å²	152	94.7 Å²	94.7	66%	0.661	45%	0.452	S	S	*	.	H	α-helix	trans	-104.7	-29.2	-174.4	-68.8	172.8	173.7	163.6	0	114.1	N95 I96 V97	N95-K99 VanDerWaalsContact O-CB 3.24Å; N95-K99 WeakPolarHBondContact O-CB 3.45Å; N95-K99 WeakPolarHBondContact O-CD 3.45Å; N95-K99 VanDerWaalsContact O-CG 3.27Å; N95-K99 WeakPolarHBondContact O-CG 3.32Å; N95-K99 PolarHBondContact O-N 2.95Å; N95-K99 WeakPolarHBondContact OD1-CE 3.44Å; N95-K99 PolarHBondContact OD1-NZ 3.44Å; I96-K99 PolarHBondContact O-N 3.44Å; V97-K99 VanDerWaalsContact C-N 3.35Å; V97-K99 PolarHBondContact O-N 3.42Å
100	Q	88.3	Confident	89	Confident	115 Å²	115	99.3 Å²	99.3	54%	0.537	47%	0.466	S	S	.	.			trans	-98	121.6	-176	-60.4	-63.9	-7.3	0	0	111.1	I96 V102 A103	I96-Q100 HydrophobicContact CG2-CG 4.15Å; I96-Q100 VanDerWaalsContact O-CB 3.29Å; I96-Q100 WeakPolarHBondContact O-CB 3.33Å; I96-Q100 WeakPolarHBondContact O-CG 3.31Å; I96-Q100 PolarHBondContact O-N 3.22Å; Q100-V102 PolarHBondContact O-N 2.89Å; Q100-A103 HydrophobicContact CB-CB 4.37Å
101	K	79.3	Confident	87.8	Confident	214 Å²	214	103.5 Å²	103.5	93%	0.93	49%	0.493	S	S	*	.	S	Bend	trans	-59	-31.6	179	-66.2	-172.6	177.4	-174.7	0	113.3
102	V	85.7	Confident	86.2	Confident	131 Å²	131	103.6 Å²	103.6	79%	0.794	50%	0.495	S	S	*	.	S	Bend	trans	-144.2	131.8	174.4	-177.3	0	0	0	0	108.3	Q100	Q100-V102 PolarHBondContact O-N 2.89Å
103	A	88.4	Confident	84.2	Confident	23 Å²	23	109.6 Å²	109.6	19%	0.19	52%	0.515	C	S	.	.			trans	-139.9	149	174.3	0	0	0	0	0	111.4	L1 I96 Q100	L1-A103 HydrophobicContact CB-CB 4.35Å; L1-A103 VanDerWaalsContact CB-O 3.28Å; L1-A103 WeakPolarHBondContact CB-O 3.38Å; L1-A103 HydrophobicContact CD1-CB 3.76Å; L1-A103 PolarHBondContact N-O 3.35Å; I96-A103 HydrophobicContact CG2-CB 4.19Å; Q100-A103 HydrophobicContact CB-CB 4.37Å
104	R	89.1	Confident	82.2	Confident	222 Å²	222	116.2 Å²	116.2	84%	0.838	55%	0.545	S	S	*	.			trans	-120.8	116.4	179.8	-175.3	173.1	-174.7	150.5	3.8	110.8
105	A	91.1	Very high	80.4	Confident	27 Å²	27	120.5 Å²	120.5	22%	0.223	58%	0.575	C	S	.	*			trans	-77.7	149.9	170.1	0	0	0	0	0	111.6	L1 V24	L1-A105 HydrophobicContact CD1-CB 4.02Å; L1-A105 HydrophobicContact CD2-CB 3.79Å; L1-A105 HydrophobicContact CG-CB 4.02Å; V24-A105 HydrophobicContact CB-CB 4.45Å; V24-A105 HydrophobicContact CG1-CB 4.18Å; V24-A105 HydrophobicContact CG2-CB 4.43Å
106	R	90.1	Very high	78.5	Confident	200 Å²	200	121.3 Å²	121.3	76%	0.755	58%	0.583	S	S	*	*			trans	-129.4	103.1	164.9	-69.8	179.4	173.9	178.5	-1.7	107.5
107	I	90.9	Very high	76.9	Confident	74 Å²	74	126.4 Å²	126.4	38%	0.379	61%	0.605	S	S	.	*			trans	-84	123.7	178.4	-64.2	164.9	0	0	0	107.9	V24 A55 I57 V83	V24-I107 HydrophobicContact CG1-CD1 4.47Å; A55-I107 HydrophobicContact CB-CD1 3.47Å; A55-I107 VanDerWaalsContact CB-CD1 3.47Å; I57-I107 HydrophobicContact CD1-CD1 4.3Å; I57-I107 HydrophobicContact CG1-CD1 4.21Å; V83-I107 HydrophobicContact CG2-CD1 4.08Å; V83-I107 HydrophobicContact CG2-CG2 3.94Å
108	Q	87.1	Confident	75.4	Confident	130 Å²	130	134.8 Å²	134.8	61%	0.607	64%	0.636	S	S	*	*			trans	-114.5	115.8	175.9	-67.4	-177.4	-2.4	0	0	109	R110	Q108-R110 VanDerWaalsContact C-N 3.33Å; Q108-R110 PolarHBondContact O-N 3.13Å
109	H	82.4	Confident	74	Confident	159 Å²	159	137.3 Å²	137.3	74%	0.736	64%	0.643	S	S	*	*			trans	-73.3	90.7	167.4	-179.9	-86.1	0	0	0	109.2
110	R	77.8	Confident	73.1	Confident	145 Å²	145	134.5 Å²	134.5	55%	0.547	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-81.1	119.8	161.1	-66	-179.9	-175	164.8	3.9	106.7	Q108 N710	Q108-R110 VanDerWaalsContact C-N 3.33Å; Q108-R110 PolarHBondContact O-N 3.13Å; R110-N710 PolarHBondContact NH1-OD1 3.41Å
111	P	67.2	Low	72.7	Confident	88 Å²	88	135 Å²	135	57%	0.571	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-56.4	149.7	166	27.4	-33.9	0	0	0	108.5	R113	P111-R113 PolarHBondContact O-N 3.01Å
112	P	59.8	Low	73	Confident	88 Å²	88	126.7 Å²	126.7	57%	0.571	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-54	134.5	176.1	24	-33.7	0	0	0	108.8	Q114	P112-Q114 PolarHBondContact O-N 2.81Å
113	R	53.3	Low	73.1	Confident	234 Å²	234	125.6 Å²	125.6	88%	0.883	60%	0.602	S	S	*	*			trans	-61.2	107.9	165.3	-75.6	-179.6	175.5	146.9	-3	105.9	P111	P111-R113 PolarHBondContact O-N 3.01Å
114	Q	50.5	Low	73.1	Confident	166 Å²	166	130.1 Å²	130.1	78%	0.776	62%	0.618	S	S	*	*			trans	-49.5	128.6	165.7	-70.3	172.5	-39.6	0	0	106.9	P112 T116	P112-Q114 PolarHBondContact O-N 2.81Å; Q114-T116 PolarHBondContact O-N 2.95Å
115	P	53.1	Low	73.2	Confident	122 Å²	122	125 Å²	125	79%	0.792	61%	0.607	S	S	*	*			trans	-56.8	118.7	173.5	24.7	-32.2	0	0	0	106.5	E117	P115-E117 PolarHBondContact O-N 3.03Å
116	T	53	Low	73.3	Confident	83 Å²	83	126.4 Å²	126.4	51%	0.509	62%	0.618	S	S	.	*			trans	-70.5	108.4	-166	49.5	0	0	0	0	109.3	Q114 Y118 F119	Q114-T116 PolarHBondContact O-N 2.95Å; T116-Y118 PolarHBondContact O-N 3.29Å; T116-F119 PolarHBondContact O-N 3.4Å; T116-F119 VanDerWaalsContact OG1-CD2 3.25Å; T116-F119 WeakPolarHBondContact OG1-CD2 3.29Å; T116-F119 WeakPolarHBondContact OG1-CE2 3.33Å
117	E	57.9	Low	73.5	Confident	155 Å²	155	123.3 Å²	123.3	72%	0.724	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.3	-23.2	178	-57.3	176	140.6	0	0	113	P115 F119 D120 M121	P115-E117 PolarHBondContact O-N 3.03Å; E117-F119 PolarHBondContact O-N 3.18Å; E117-D120 PolarHBondContact O-N 3.37Å; E117-M121 WeakPolarHBondContact O-CG 3.21Å; E117-M121 PolarHBondContact O-N 3.37Å; E117-M121 VanDerWaalsContact O-N 3.09Å
118	Y	59.5	Low	73.8	Confident	198 Å²	198	126.2 Å²	126.2	78%	0.776	62%	0.62	S	S	*	*	H	α-helix	trans	-51.4	-28.9	170	-130.3	-85.1	0	0	0	115.3	T116 G122	T116-Y118 PolarHBondContact O-N 3.29Å; Y118-G122 PolarHBondContact O-N 2.94Å
119	F	60.7	Low	74.2	Confident	158 Å²	158	123.7 Å²	123.7	69%	0.693	61%	0.614	S	S	*	*	H	α-helix	trans	-68	-48.6	175.9	-83.9	-68.1	0	0	0	111.5	T116 E117 G122 I123	T116-F119 PolarHBondContact O-N 3.4Å; T116-F119 VanDerWaalsContact OG1-CD2 3.25Å; T116-F119 WeakPolarHBondContact OG1-CD2 3.29Å; T116-F119 WeakPolarHBondContact OG1-CE2 3.33Å; E117-F119 PolarHBondContact O-N 3.18Å; F119-G122 PolarHBondContact O-N 3.31Å; F119-I123 WeakPolarHBondContact O-CG1 3.32Å; F119-I123 PolarHBondContact O-N 3.2Å; F119-I123 VanDerWaalsContact O-N 3.08Å
120	D	70.9	Confident	74.9	Confident	93 Å²	93	120.4 Å²	120.4	50%	0.497	60%	0.604	S	S	.	*	H	α-helix	trans	-63.9	-43.5	175.7	-73.9	-50.7	0	0	0	111.6	E117 G122 I123 F124	E117-D120 PolarHBondContact O-N 3.37Å; D120-G122 PolarHBondContact O-N 2.84Å; D120-I123 PolarHBondContact O-N 3.02Å; D120-F124 HydrophobicContact CB-CD2 4.28Å; D120-F124 HydrophobicContact CB-CE2 3.95Å; D120-F124 WeakPolarHBondContact O-CD2 3.49Å; D120-F124 PolarHBondContact O-N 2.84Å
121	M	78.7	Confident	75.8	Confident	125 Å²	125	116.3 Å²	116.3	62%	0.616	60%	0.596	S	S	*	*	H	α-helix	trans	-57.7	-37.4	176	-65.2	-65.9	173.3	0	0	112.2	E117 L125	E117-M121 WeakPolarHBondContact O-CG 3.21Å; E117-M121 PolarHBondContact O-N 3.37Å; E117-M121 VanDerWaalsContact O-N 3.09Å; M121-L125 WeakPolarHBondContact O-CB 3.5Å; M121-L125 PolarHBondContact O-N 2.89Å
122	G	85.8	Confident	77.2	Confident	39 Å²	39	115.7 Å²	115.7	40%	0.402	59%	0.593	S	S	.	*	H	α-helix	trans	-65.9	-42.3	173.3	0	0	0	0	0	113.3	Y118 F119 D120 L125 A126	Y118-G122 PolarHBondContact O-N 2.94Å; F119-G122 PolarHBondContact O-N 3.31Å; D120-G122 PolarHBondContact O-N 2.84Å; G122-L125 PolarHBondContact O-N 3.49Å; G122-A126 WeakPolarHBondContact O-CB 3.36Å; G122-A126 PolarHBondContact O-N 2.8Å
123	I	87	Confident	79	Confident	109 Å²	109	116 Å²	116	56%	0.559	59%	0.59	S	S	*	*	H	α-helix	trans	-65.4	-46.1	178.1	-66.8	164.2	0	0	0	110.8	F119 D120 A126 F127	F119-I123 WeakPolarHBondContact O-CG1 3.32Å; F119-I123 PolarHBondContact O-N 3.2Å; F119-I123 VanDerWaalsContact O-N 3.08Å; D120-I123 PolarHBondContact O-N 3.02Å; I123-A126 PolarHBondContact O-N 2.86Å; I123-F127 PolarHBondContact O-N 3.06Å
124	F	89.1	Confident	81.1	Confident	117 Å²	117	108.6 Å²	108.6	51%	0.513	57%	0.57	S	S	.	*	H	α-helix	trans	-62.3	-44.3	176.6	-69	-55.9	0	0	0	112	D120 A126 F127 F128	D120-F124 HydrophobicContact CB-CD2 4.28Å; D120-F124 HydrophobicContact CB-CE2 3.95Å; D120-F124 WeakPolarHBondContact O-CD2 3.49Å; D120-F124 PolarHBondContact O-N 2.84Å; F124-A126 PolarHBondContact O-N 3.33Å; F124-F127 PolarHBondContact O-N 3.48Å; F124-F128 HydrophobicContact CB-CE2 4.44Å; F124-F128 WeakPolarHBondContact O-CD2 3.32Å; F124-F128 PolarHBondContact O-N 3.28Å
125	L	91.2	Very high	83.3	Confident	116 Å²	116	103.8 Å²	103.8	61%	0.607	55%	0.554	S	S	*	*	H	α-helix	trans	-60.9	-43.6	177.2	-176	63.3	0	0	0	111.8	M121 G122 F127 F128 V129	M121-L125 WeakPolarHBondContact O-CB 3.5Å; M121-L125 PolarHBondContact O-N 2.89Å; G122-L125 PolarHBondContact O-N 3.49Å; L125-F127 VanDerWaalsContact C-N 3.34Å; L125-F127 PolarHBondContact O-N 3.31Å; L125-F128 PolarHBondContact O-N 2.87Å; L125-V129 WeakPolarHBondContact O-CG2 3.5Å; L125-V129 PolarHBondContact O-N 2.92Å
126	A	92.6	Very high	85.3	Confident	56 Å²	56	102.5 Å²	102.5	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-60.2	-43.1	175.4	0	0	0	0	0	112	G122 I123 F124 V129 V130	G122-A126 WeakPolarHBondContact O-CB 3.36Å; G122-A126 PolarHBondContact O-N 2.8Å; I123-A126 PolarHBondContact O-N 2.86Å; F124-A126 PolarHBondContact O-N 3.33Å; A126-V129 PolarHBondContact O-N 3.22Å; A126-V130 WeakPolarHBondContact O-CG2 3.26Å; A126-V130 PolarHBondContact O-N 2.88Å
127	F	95.5	Very high	87.4	Confident	134 Å²	134	102.9 Å²	102.9	59%	0.588	54%	0.538	S	S	*	.	H	α-helix	trans	-61	-47	176.3	-175.8	-99.3	0	0	0	112.2	I123 F124 L125 V129 V130 V131	I123-F127 PolarHBondContact O-N 3.06Å; F124-F127 PolarHBondContact O-N 3.48Å; L125-F127 VanDerWaalsContact C-N 3.34Å; L125-F127 PolarHBondContact O-N 3.31Å; F127-V129 VanDerWaalsContact C-N 3.33Å; F127-V129 PolarHBondContact O-N 2.92Å; F127-V130 PolarHBondContact O-N 2.82Å; F127-V131 HydrophobicContact CD1-CG2 4.13Å; F127-V131 HydrophobicContact CE1-CG2 3.76Å; F127-V131 HydrophobicContact CE2-CG2 4.21Å; F127-V131 HydrophobicContact CZ-CG2 3.8Å; F127-V131 WeakPolarHBondContact O-CG2 3.37Å; F127-V131 PolarHBondContact O-N 3.35Å
128	F	96.1	Very high	89.2	Confident	135 Å²	135	100.1 Å²	100.1	59%	0.592	53%	0.528	S	S	*	.	H	α-helix	trans	-61	-38.6	177	-75.9	-62.2	0	0	0	112.9	F124 L125 S132	F124-F128 HydrophobicContact CB-CE2 4.44Å; F124-F128 WeakPolarHBondContact O-CD2 3.32Å; F124-F128 PolarHBondContact O-N 3.28Å; L125-F128 PolarHBondContact O-N 2.87Å; F128-S132 VanDerWaalsContact O-CB 3.26Å; F128-S132 WeakPolarHBondContact O-CB 3.43Å; F128-S132 PolarHBondContact O-N 3.28Å; F128-S132 PolarHBondContact O-OG 3.23Å
129	V	96.6	Very high	90.8	Very high	78 Å²	78	95.9 Å²	95.9	47%	0.473	52%	0.518	S	S	.	.	H	α-helix	trans	-65.2	-45.6	176	170.6	0	0	0	0	111.3	L125 A126 F127 S132 L133	L125-V129 WeakPolarHBondContact O-CG2 3.5Å; L125-V129 PolarHBondContact O-N 2.92Å; A126-V129 PolarHBondContact O-N 3.22Å; F127-V129 VanDerWaalsContact C-N 3.33Å; F127-V129 PolarHBondContact O-N 2.92Å; V129-S132 PolarHBondContact O-N 2.91Å; V129-L133 HydrophobicContact CG1-CD1 4.04Å; V129-L133 WeakPolarHBondContact O-CG 3.48Å; V129-L133 PolarHBondContact O-N 3.39Å
130	V	96.8	Very high	92.5	Very high	89 Å²	89	92.6 Å²	92.6	54%	0.539	51%	0.507	S	S	.	.	H	α-helix	trans	-63.1	-46.7	178.2	171	0	0	0	0	111.5	A126 F127 S132 L133 V134	A126-V130 WeakPolarHBondContact O-CG2 3.26Å; A126-V130 PolarHBondContact O-N 2.88Å; F127-V130 PolarHBondContact O-N 2.82Å; V130-S132 VanDerWaalsContact C-N 3.34Å; V130-S132 PolarHBondContact O-N 3.45Å; V130-L133 PolarHBondContact O-N 3.39Å; V130-V134 WeakPolarHBondContact O-CG2 3.34Å; V130-V134 PolarHBondContact O-N 3Å
131	V	96.9	Very high	93.5	Very high	60 Å²	60	95.1 Å²	95.1	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-60.7	-44	176.7	172.2	0	0	0	0	110.9	F127 L133 V134 C135	F127-V131 HydrophobicContact CD1-CG2 4.13Å; F127-V131 HydrophobicContact CE1-CG2 3.76Å; F127-V131 HydrophobicContact CE2-CG2 4.21Å; F127-V131 HydrophobicContact CZ-CG2 3.8Å; F127-V131 WeakPolarHBondContact O-CG2 3.37Å; F127-V131 PolarHBondContact O-N 3.35Å; V131-L133 PolarHBondContact O-N 2.84Å; V131-V134 PolarHBondContact O-N 2.8Å; V131-C135 WeakPolarHBondContact O-CB 3.47Å; V131-C135 PolarHBondContact O-N 3.34Å; V131-C135 PolarHBondContact O-SG 3.39Å; V131-C135 VanDerWaalsContact O-SG 3.39Å
132	S	96.1	Very high	94.2	Very high	75 Å²	75	94.1 Å²	94.1	52%	0.524	51%	0.509	S	S	.	.	H	α-helix	trans	-61.5	-41.9	178.5	-61.1	0	0	0	0	112.5	F128 V129 V130 C135 L136	F128-S132 VanDerWaalsContact O-CB 3.26Å; F128-S132 WeakPolarHBondContact O-CB 3.43Å; F128-S132 PolarHBondContact O-N 3.28Å; F128-S132 PolarHBondContact O-OG 3.23Å; V129-S132 PolarHBondContact O-N 2.91Å; V130-S132 VanDerWaalsContact C-N 3.34Å; V130-S132 PolarHBondContact O-N 3.45Å; S132-C135 PolarHBondContact O-N 3.47Å; S132-L136 WeakPolarHBondContact O-CB 3.38Å; S132-L136 PolarHBondContact O-N 3.35Å
133	L	97.1	Very high	94.4	Very high	95 Å²	95	99 Å²	99	50%	0.497	52%	0.52	S	S	.	.	H	α-helix	trans	-63	-44.5	174.9	-77.6	165.7	0	0	0	112	V129 V130 V131 L136 I137	V129-L133 HydrophobicContact CG1-CD1 4.04Å; V129-L133 WeakPolarHBondContact O-CG 3.48Å; V129-L133 PolarHBondContact O-N 3.39Å; V130-L133 PolarHBondContact O-N 3.39Å; V131-L133 PolarHBondContact O-N 2.84Å; L133-L136 PolarHBondContact O-N 2.99Å; L133-I137 WeakPolarHBondContact O-CB 3.26Å; L133-I137 WeakPolarHBondContact O-CD1 3.26Å; L133-I137 VanDerWaalsContact O-CG1 3.26Å; L133-I137 WeakPolarHBondContact O-CG1 3.48Å; L133-I137 PolarHBondContact O-N 3.37Å
134	V	97.2	Very high	94.4	Very high	77 Å²	77	98.7 Å²	98.7	47%	0.467	52%	0.519	S	S	.	.	H	α-helix	trans	-62	-45.9	176.5	172.1	0	0	0	0	110.9	V130 V131 L136 I137 L138	V130-V134 WeakPolarHBondContact O-CG2 3.34Å; V130-V134 PolarHBondContact O-N 3Å; V131-V134 PolarHBondContact O-N 2.8Å; V134-L136 PolarHBondContact O-N 2.71Å; V134-I137 PolarHBondContact O-N 2.97Å; V134-L138 HydrophobicContact CG1-CD1 4.02Å; V134-L138 WeakPolarHBondContact O-CB 3.48Å; V134-L138 VanDerWaalsContact O-CG 3.3Å; V134-L138 WeakPolarHBondContact O-CG 3.38Å; V134-L138 PolarHBondContact O-N 3.45Å
135	C	96.6	Very high	94.2	Very high	65 Å²	65	101 Å²	101	44%	0.439	53%	0.528	S	S	.	.	H	α-helix	trans	-59.1	-44.4	175	-72.8	0	0	0	0	112.2	V131 S132 L138 L139	V131-C135 WeakPolarHBondContact O-CB 3.47Å; V131-C135 PolarHBondContact O-N 3.34Å; V131-C135 PolarHBondContact O-SG 3.39Å; V131-C135 VanDerWaalsContact O-SG 3.39Å; S132-C135 PolarHBondContact O-N 3.47Å; C135-L138 PolarHBondContact O-N 3.06Å; C135-L139 WeakPolarHBondContact O-CB 3.08Å; C135-L139 VanDerWaalsContact O-CG 3.32Å; C135-L139 WeakPolarHBondContact O-CG 3.33Å; C135-L139 PolarHBondContact O-N 2.98Å
136	L	96.5	Very high	93.8	Very high	96 Å²	96	100.7 Å²	100.7	50%	0.503	52%	0.524	S	S	.	.	H	α-helix	trans	-65	-42.3	178.8	-174.7	148.1	0	0	0	111.9	S132 L133 V134 L138 L139 I140	S132-L136 WeakPolarHBondContact O-CB 3.38Å; S132-L136 PolarHBondContact O-N 3.35Å; L133-L136 PolarHBondContact O-N 2.99Å; V134-L136 PolarHBondContact O-N 2.71Å; L136-L138 VanDerWaalsContact C-N 3.34Å; L136-L138 PolarHBondContact O-N 3.36Å; L136-L139 PolarHBondContact O-N 3.31Å; L136-I140 HydrophobicContact CD2-CD1 3.57Å; L136-I140 HydrophobicContact CD2-CG1 4.37Å; L136-I140 HydrophobicContact CG-CD1 4.47Å; L136-I140 WeakPolarHBondContact O-CG1 3.39Å; L136-I140 PolarHBondContact O-N 3.46Å
137	I	96.4	Very high	93.1	Very high	90 Å²	90	107.1 Å²	107.1	46%	0.462	54%	0.536	S	S	.	.	H	α-helix	trans	-63	-40.3	175	-69.5	164	0	0	0	111.2	L133 V134 K141	L133-I137 WeakPolarHBondContact O-CB 3.26Å; L133-I137 WeakPolarHBondContact O-CD1 3.26Å; L133-I137 VanDerWaalsContact O-CG1 3.26Å; L133-I137 WeakPolarHBondContact O-CG1 3.48Å; L133-I137 PolarHBondContact O-N 3.37Å; V134-I137 PolarHBondContact O-N 2.97Å; I137-K141 WeakPolarHBondContact O-CB 3.3Å; I137-K141 PolarHBondContact O-N 3.44Å
138	L	95.3	Very high	92.2	Very high	97 Å²	97	110.8 Å²	110.8	51%	0.508	55%	0.546	S	S	.	.	H	α-helix	trans	-65.7	-44.6	175.4	-72.1	171.5	0	0	0	111.7	V134 C135 L136 I140 K141 I142	V134-L138 HydrophobicContact CG1-CD1 4.02Å; V134-L138 WeakPolarHBondContact O-CB 3.48Å; V134-L138 VanDerWaalsContact O-CG 3.3Å; V134-L138 WeakPolarHBondContact O-CG 3.38Å; V134-L138 PolarHBondContact O-N 3.45Å; C135-L138 PolarHBondContact O-N 3.06Å; L136-L138 VanDerWaalsContact C-N 3.34Å; L136-L138 PolarHBondContact O-N 3.36Å; L138-I140 PolarHBondContact O-N 3.25Å; L138-K141 PolarHBondContact O-N 3.32Å; L138-I142 WeakPolarHBondContact O-CB 3.42Å; L138-I142 VanDerWaalsContact O-CG1 3.26Å; L138-I142 WeakPolarHBondContact O-CG1 3.45Å; L138-I142 PolarHBondContact O-N 2.96Å
139	L	94.6	Very high	91.2	Very high	110 Å²	110	107.6 Å²	107.6	58%	0.576	54%	0.54	S	S	*	.	H	α-helix	trans	-62.2	-41.9	176	-72.5	171.8	0	0	0	112	C135 L136 I142 K143	C135-L139 WeakPolarHBondContact O-CB 3.08Å; C135-L139 VanDerWaalsContact O-CG 3.32Å; C135-L139 WeakPolarHBondContact O-CG 3.33Å; C135-L139 PolarHBondContact O-N 2.98Å; L136-L139 PolarHBondContact O-N 3.31Å; L139-I142 PolarHBondContact O-N 2.91Å; L139-K143 WeakPolarHBondContact O-CB 3.25Å; L139-K143 WeakPolarHBondContact O-CG 3.37Å; L139-K143 PolarHBondContact O-N 3.37Å
140	I	94.9	Very high	90.1	Very high	88 Å²	88	108.6 Å²	108.6	45%	0.451	54%	0.54	S	S	.	.	H	α-helix	trans	-61.2	-47.5	172.5	-72.3	176.7	0	0	0	110.5	L136 L138 I142 K143 L144	L136-I140 HydrophobicContact CD2-CD1 3.57Å; L136-I140 HydrophobicContact CD2-CG1 4.37Å; L136-I140 HydrophobicContact CG-CD1 4.47Å; L136-I140 WeakPolarHBondContact O-CG1 3.39Å; L136-I140 PolarHBondContact O-N 3.46Å; L138-I140 PolarHBondContact O-N 3.25Å; I140-I142 VanDerWaalsContact C-N 3.32Å; I140-I142 PolarHBondContact O-N 3.03Å; I140-K143 PolarHBondContact O-N 3.1Å; I140-L144 HydrophobicContact CG2-CD1 3.68Å; I140-L144 HydrophobicContact CG2-CG 4.15Å; I140-L144 WeakPolarHBondContact O-CB 3.44Å; I140-L144 VanDerWaalsContact O-CG 3.29Å; I140-L144 WeakPolarHBondContact O-CG 3.41Å; I140-L144 PolarHBondContact O-N 2.91Å
141	K	92.9	Very high	88.8	Confident	147 Å²	147	108.1 Å²	108.1	64%	0.639	54%	0.541	S	S	*	.	H	α-helix	trans	-62.1	-37	177.3	-83.6	-176.2	170.6	175.7	0	112.7	I137 L138 K145	I137-K141 WeakPolarHBondContact O-CB 3.3Å; I137-K141 PolarHBondContact O-N 3.44Å; L138-K141 PolarHBondContact O-N 3.32Å; K141-K145 WeakPolarHBondContact O-CB 3.1Å; K141-K145 PolarHBondContact O-N 3.44Å
142	I	92.1	Very high	87.9	Confident	103 Å²	103	107.6 Å²	107.6	53%	0.528	54%	0.54	S	S	.	.	H	α-helix	trans	-65.2	-50.4	173.9	-69.6	162.9	0	0	0	110.4	L138 L139 I140 L144 K145 Q146	L138-I142 WeakPolarHBondContact O-CB 3.42Å; L138-I142 VanDerWaalsContact O-CG1 3.26Å; L138-I142 WeakPolarHBondContact O-CG1 3.45Å; L138-I142 PolarHBondContact O-N 2.96Å; L139-I142 PolarHBondContact O-N 2.91Å; I140-I142 VanDerWaalsContact C-N 3.32Å; I140-I142 PolarHBondContact O-N 3.03Å; I142-L144 PolarHBondContact O-N 2.91Å; I142-K145 PolarHBondContact O-N 3.18Å; I142-Q146 VanDerWaalsContact O-CB 3.31Å; I142-Q146 WeakPolarHBondContact O-CB 3.36Å; I142-Q146 PolarHBondContact O-N 2.84Å
143	K	90.2	Very high	86.8	Confident	142 Å²	142	108.1 Å²	108.1	62%	0.617	54%	0.535	S	S	*	.	H	α-helix	trans	-62.5	-40	178.5	-73.6	-73.6	-173.5	176.2	0	112.5	L139 I140 Q146 R147	L139-K143 WeakPolarHBondContact O-CB 3.25Å; L139-K143 WeakPolarHBondContact O-CG 3.37Å; L139-K143 PolarHBondContact O-N 3.37Å; I140-K143 PolarHBondContact O-N 3.1Å; K143-Q146 PolarHBondContact O-N 2.94Å; K143-R147 WeakPolarHBondContact O-CB 3.43Å; K143-R147 PolarHBondContact O-N 3.05Å
144	L	88.4	Confident	85.7	Confident	103 Å²	103	106.4 Å²	106.4	54%	0.539	53%	0.526	S	S	.	.	H	α-helix	trans	-67.3	-42.3	174.8	-70.7	175.9	0	0	0	111.9	I140 I142 R147 R148	I140-L144 HydrophobicContact CG2-CD1 3.68Å; I140-L144 HydrophobicContact CG2-CG 4.15Å; I140-L144 WeakPolarHBondContact O-CB 3.44Å; I140-L144 VanDerWaalsContact O-CG 3.29Å; I140-L144 WeakPolarHBondContact O-CG 3.41Å; I140-L144 PolarHBondContact O-N 2.91Å; I142-L144 PolarHBondContact O-N 2.91Å; L144-R147 PolarHBondContact O-N 3.25Å; L144-R148 VanDerWaalsContact O-CB 3.32Å; L144-R148 WeakPolarHBondContact O-CB 3.45Å; L144-R148 PolarHBondContact O-N 3.12Å
145	K	85.1	Confident	85	Confident	166 Å²	166	110.4 Å²	110.4	72%	0.722	53%	0.533	S	S	*	.	H	α-helix	trans	-63.1	-41.5	174	-174.1	178.2	179.7	-178.1	0	111.3	K141 I142 R148 S149	K141-K145 WeakPolarHBondContact O-CB 3.1Å; K141-K145 PolarHBondContact O-N 3.44Å; I142-K145 PolarHBondContact O-N 3.18Å; K145-R148 PolarHBondContact O-N 3.09Å; K145-S149 WeakPolarHBondContact O-CB 3.32Å; K145-S149 PolarHBondContact O-N 3.05Å
146	Q	81.3	Confident	84.1	Confident	108 Å²	108	111.8 Å²	111.8	51%	0.505	53%	0.534	S	S	.	.	H	α-helix	trans	-63.2	-49.1	175.5	-172.1	178.2	11.3	0	0	111.2	I142 K143 R148 S149 Q150	I142-Q146 VanDerWaalsContact O-CB 3.31Å; I142-Q146 WeakPolarHBondContact O-CB 3.36Å; I142-Q146 PolarHBondContact O-N 2.84Å; K143-Q146 PolarHBondContact O-N 2.94Å; Q146-R148 VanDerWaalsContact C-N 3.34Å; Q146-R148 PolarHBondContact O-N 3.26Å; Q146-S149 WeakPolarHBondContact O-CB 3.49Å; Q146-S149 PolarHBondContact O-N 3.21Å; Q146-Q150 WeakPolarHBondContact O-CB 3.24Å; Q146-Q150 PolarHBondContact O-N 3.49Å
147	R	79.7	Confident	83.1	Confident	191 Å²	191	107.2 Å²	107.2	72%	0.721	51%	0.51	S	S	*	.	H	α-helix	trans	-61.4	-39.3	177.2	-167.8	178	-173.9	-171.3	2.2	112.1	K143 L144 S151	K143-R147 WeakPolarHBondContact O-CB 3.43Å; K143-R147 PolarHBondContact O-N 3.05Å; L144-R147 PolarHBondContact O-N 3.25Å; R147-S151 WeakPolarHBondContact O-CB 3.5Å; R147-S151 PolarHBondContact O-N 3.36Å
148	R	75.8	Confident	82.4	Confident	211 Å²	211	107.4 Å²	107.4	80%	0.796	51%	0.511	S	S	*	.	H	α-helix	trans	-68.4	-39.2	175.6	-163.8	176.1	-168.1	176.5	4.8	112.2	L144 K145 Q146 S152	L144-R148 VanDerWaalsContact O-CB 3.32Å; L144-R148 WeakPolarHBondContact O-CB 3.45Å; L144-R148 PolarHBondContact O-N 3.12Å; K145-R148 PolarHBondContact O-N 3.09Å; Q146-R148 VanDerWaalsContact C-N 3.34Å; Q146-R148 PolarHBondContact O-N 3.26Å; R148-S152 PolarHBondContact O-N 2.87Å; R148-S152 VanDerWaalsContact O-N 3.13Å
149	S	75.5	Confident	81.7	Confident	68 Å²	68	107.5 Å²	107.5	48%	0.476	51%	0.509	S	S	.	.	H	α-helix	trans	-63.1	-49.7	173.3	-172.4	0	0	0	0	111.4	K145 Q146 S151 S152 M153	K145-S149 WeakPolarHBondContact O-CB 3.32Å; K145-S149 PolarHBondContact O-N 3.05Å; Q146-S149 WeakPolarHBondContact O-CB 3.49Å; Q146-S149 PolarHBondContact O-N 3.21Å; S149-S151 PolarHBondContact O-N 3.08Å; S149-S152 WeakPolarHBondContact O-CA 3.24Å; S149-S152 WeakPolarHBondContact O-CB 3.33Å; S149-S152 PolarHBondContact O-N 3.02Å; S149-M153 PolarHBondContact O-N 3.19Å
150	Q	73.1	Confident	80.9	Confident	99 Å²	99	103.1 Å²	103.1	46%	0.463	49%	0.489	S	S	.	.	H	α-helix	trans	-61.9	-40.9	178.7	-168	174.1	13.4	0	0	111.9	Q146 S152 M153 N154	Q146-Q150 WeakPolarHBondContact O-CB 3.24Å; Q146-Q150 PolarHBondContact O-N 3.49Å; Q150-S152 VanDerWaalsContact C-N 3.29Å; Q150-S152 PolarHBondContact O-N 3.06Å; Q150-M153 PolarHBondContact O-N 3Å; Q150-N154 VanDerWaalsContact O-CG 3.28Å; Q150-N154 PolarHBondContact O-N 3.46Å; Q150-N154 PolarHBondContact O-OD1 3.22Å
151	S	69.9	Low	80.1	Confident	80 Å²	80	99.5 Å²	99.5	56%	0.559	47%	0.47	S	S	*	.	H	α-helix	trans	-58.3	-38.7	171.1	175.1	0	0	0	0	112.6	R147 S149 R155	R147-S151 WeakPolarHBondContact O-CB 3.5Å; R147-S151 PolarHBondContact O-N 3.36Å; S149-S151 PolarHBondContact O-N 3.08Å; S151-R155 PolarHBondContact O-N 3.02Å
152	S	77.3	Confident	79.3	Confident	49 Å²	49	99.8 Å²	99.8	34%	0.343	47%	0.474	S	S	.	.	H	α-helix	trans	-68.7	-37.8	174.6	-168.5	0	0	0	0	113	R148 S149 Q150 R155 M156	R148-S152 PolarHBondContact O-N 2.87Å; R148-S152 VanDerWaalsContact O-N 3.13Å; S149-S152 WeakPolarHBondContact O-CA 3.24Å; S149-S152 WeakPolarHBondContact O-CB 3.33Å; S149-S152 PolarHBondContact O-N 3.02Å; Q150-S152 VanDerWaalsContact C-N 3.29Å; Q150-S152 PolarHBondContact O-N 3.06Å; S152-R155 PolarHBondContact O-N 3.45Å; S152-M156 PolarHBondContact O-N 3.19Å
153	M	72.3	Confident	78.6	Confident	86 Å²	86	103 Å²	103	42%	0.424	48%	0.484	S	S	.	.	H	α-helix	trans	-68.6	-43.1	175.9	-61.8	-163.6	-49.2	0	0	111.5	S149 Q150 R155 M156 A157	S149-M153 PolarHBondContact O-N 3.19Å; Q150-M153 PolarHBondContact O-N 3Å; M153-R155 PolarHBondContact O-N 3.27Å; M153-M156 CarbonylContact O-C 3.57Å; M153-M156 WeakPolarHBondContact O-CA 3.33Å; M153-M156 WeakPolarHBondContact O-CB 3.19Å; M153-M156 PolarHBondContact O-N 2.98Å; M153-A157 PolarHBondContact O-N 2.9Å
154	N	75.8	Confident	78	Confident	58 Å²	58	97 Å²	97	31%	0.31	46%	0.459	S	S	.	.	H	α-helix	trans	-57.2	-38.6	174.7	-69.7	9.9	0	0	0	111.6	Q150 M156 A157 I158	Q150-N154 VanDerWaalsContact O-CG 3.28Å; Q150-N154 PolarHBondContact O-N 3.46Å; Q150-N154 PolarHBondContact O-OD1 3.22Å; N154-M156 PolarHBondContact O-N 3.03Å; N154-A157 PolarHBondContact O-N 3.21Å; N154-I158 VanDerWaalsContact O-CG1 3.32Å; N154-I158 WeakPolarHBondContact O-CG1 3.28Å; N154-I158 PolarHBondContact O-N 2.63Å
155	R	80.6	Confident	77.4	Confident	161 Å²	161	96.9 Å²	96.9	61%	0.608	46%	0.455	S	S	*	.	H	α-helix	trans	-64.7	-37.4	174.7	-165.3	178.6	70.5	-179.9	2.7	112.6	S151 S152 M153 Q159	S151-R155 PolarHBondContact O-N 3.02Å; S152-R155 PolarHBondContact O-N 3.45Å; M153-R155 PolarHBondContact O-N 3.27Å; R155-Q159 WeakPolarHBondContact O-CG 3.28Å; R155-Q159 PolarHBondContact O-N 3.19Å
156	M	78.5	Confident	77.2	Confident	94 Å²	94	91.9 Å²	91.9	46%	0.463	44%	0.439	S	S	.	.	H	α-helix	trans	-69.6	-37.7	173.4	-67.8	176.9	173.5	0	0	111.9	S152 M153 N154 Q159 A160 I240	S152-M156 PolarHBondContact O-N 3.19Å; M153-M156 CarbonylContact O-C 3.57Å; M153-M156 WeakPolarHBondContact O-CA 3.33Å; M153-M156 WeakPolarHBondContact O-CB 3.19Å; M153-M156 PolarHBondContact O-N 2.98Å; N154-M156 PolarHBondContact O-N 3.03Å; M156-Q159 PolarHBondContact O-N 2.88Å; M156-A160 PolarHBondContact O-N 2.93Å; M156-I240 HydrophobicContact CB-CD1 4.42Å; M156-I240 HydrophobicContact CB-CG2 4.39Å
157	A	76.1	Confident	77.2	Confident	0 Å²	0	92.5 Å²	92.5	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-62.6	-43.3	174.9	0	0	0	0	0	111.9	M153 N154 Q159 A160 L161 H230 I240	M153-A157 PolarHBondContact O-N 2.9Å; N154-A157 PolarHBondContact O-N 3.21Å; A157-Q159 PolarHBondContact O-N 2.96Å; A157-A160 PolarHBondContact O-N 3.28Å; A157-L161 WeakPolarHBondContact O-CB 3.47Å; A157-L161 VanDerWaalsContact O-CG 3.25Å; A157-L161 WeakPolarHBondContact O-CG 3.33Å; A157-L161 PolarHBondContact O-N 3.44Å; A157-H230 WeakPolarHBondContact CB-ND1 3.48Å; A157-I240 HydrophobicContact CB-CD1 4.24Å
158	I	80.5	Confident	77.4	Confident	95 Å²	95	90 Å²	90	49%	0.487	43%	0.43	S	S	.	.	H	α-helix	trans	-57.9	-48.1	174	-68.3	162.4	0	0	0	110.6	N154 A160 L161 E162 L227	N154-I158 VanDerWaalsContact O-CG1 3.32Å; N154-I158 WeakPolarHBondContact O-CG1 3.28Å; N154-I158 PolarHBondContact O-N 2.63Å; I158-A160 VanDerWaalsContact C-N 3.29Å; I158-A160 PolarHBondContact O-N 2.88Å; I158-L161 PolarHBondContact O-N 3.32Å; I158-L161 VanDerWaalsContact O-N 3.15Å; I158-E162 PolarHBondContact O-N 3.02Å; I158-L227 HydrophobicContact CD1-CD2 4.42Å; I158-L227 HydrophobicContact CG1-CD2 3.49Å; I158-L227 VanDerWaalsContact CG1-CD2 3.49Å
159	Q	81.9	Confident	77.6	Confident	98 Å²	98	81.9 Å²	81.9	46%	0.458	40%	0.401	S	S	.	.	H	α-helix	trans	-65.5	-27.8	177.3	-71.6	-178.6	-19.8	0	0	113.7	R155 M156 A157 K163	R155-Q159 WeakPolarHBondContact O-CG 3.28Å; R155-Q159 PolarHBondContact O-N 3.19Å; M156-Q159 PolarHBondContact O-N 2.88Å; A157-Q159 PolarHBondContact O-N 2.96Å; Q159-K163 WeakPolarHBondContact O-CD 3.45Å; Q159-K163 VanDerWaalsContact O-CG 3.31Å; Q159-K163 WeakPolarHBondContact O-CG 3.3Å
160	A	76.6	Confident	77.6	Confident	19 Å²	19	87 Å²	87	16%	0.157	42%	0.415	C	S	.	.	H	α-helix	trans	-74.2	-38.3	172.2	0	0	0	0	0	111.7	M156 A157 I158 K163 M164 I239	M156-A160 PolarHBondContact O-N 2.93Å; A157-A160 PolarHBondContact O-N 3.28Å; I158-A160 VanDerWaalsContact C-N 3.29Å; I158-A160 PolarHBondContact O-N 2.88Å; A160-K163 PolarHBondContact O-N 3.25Å; A160-M164 HydrophobicContact CB-CE 4.14Å; A160-M164 WeakPolarHBondContact O-CE 3.27Å; A160-M164 WeakPolarHBondContact O-CG 3.32Å; A160-M164 PolarHBondContact O-N 2.88Å; A160-M164 VanDerWaalsContact O-N 3.12Å; A160-I239 HydrophobicContact CB-CG1 4.42Å
161	L	77.9	Confident	77.6	Confident	11 Å²	11	84.7 Å²	84.7	6%	0.058	41%	0.412	C	S	.	.	H	α-helix	trans	-70.3	-38.4	178.8	-71	164.9	0	0	0	112.4	A157 I158 K163 M164 R209 L226 L227	A157-L161 WeakPolarHBondContact O-CB 3.47Å; A157-L161 VanDerWaalsContact O-CG 3.25Å; A157-L161 WeakPolarHBondContact O-CG 3.33Å; A157-L161 PolarHBondContact O-N 3.44Å; I158-L161 PolarHBondContact O-N 3.32Å; I158-L161 VanDerWaalsContact O-N 3.15Å; L161-K163 PolarHBondContact O-N 3.18Å; L161-M164 HydrophobicContact CD2-CE 3.71Å; L161-M164 HydrophobicContact CD2-SD 4.27Å; L161-M164 HydrophobicContact CG-CE 4.16Å; L161-M164 PolarHBondContact O-N 3.43Å; L161-R209 VanDerWaalsContact O-CZ 3.27Å; L161-R209 PolarHBondContact O-NH2 2.86Å; L161-L226 HydrophobicContact CD1-CB 4.22Å; L161-L226 HydrophobicContact CD2-CB 3.7Å; L161-L226 HydrophobicContact CD2-CD1 3.59Å; L161-L226 HydrophobicContact CD2-CG 4.29Å; L161-L226 HydrophobicContact CG-CB 4.43Å; L161-L227 HydrophobicContact CD1-CD2 3.57Å; L161-L227 HydrophobicContact CD1-CG 3.67Å
162	E	77.5	Confident	77.3	Confident	154 Å²	154	90.8 Å²	90.8	72%	0.72	43%	0.429	S	S	*	.	H	α-helix	trans	-58.6	-36.1	171.1	-174.3	177.9	-159.7	0	0	112.1	I158	I158-E162 PolarHBondContact O-N 3.02Å
163	K	76.8	Confident	76.1	Confident	170 Å²	170	91.5 Å²	91.5	74%	0.739	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-5.4	178.6	-67.1	174.2	-175.4	178.2	0	114.5	Q159 A160 L161	Q159-K163 WeakPolarHBondContact O-CD 3.45Å; Q159-K163 VanDerWaalsContact O-CG 3.31Å; Q159-K163 WeakPolarHBondContact O-CG 3.3Å; A160-K163 PolarHBondContact O-N 3.25Å; L161-K163 PolarHBondContact O-N 3.18Å
164	M	76.9	Confident	75	Confident	17 Å²	17	98 Å²	98	8%	0.084	47%	0.47	C	S	.	.	S	Bend	trans	-84	128.3	179	-89.6	-177.3	-112.6	0	0	111.7	A160 L161 T166 R209 L226 I239	A160-M164 HydrophobicContact CB-CE 4.14Å; A160-M164 WeakPolarHBondContact O-CE 3.27Å; A160-M164 WeakPolarHBondContact O-CG 3.32Å; A160-M164 PolarHBondContact O-N 2.88Å; A160-M164 VanDerWaalsContact O-N 3.12Å; L161-M164 HydrophobicContact CD2-CE 3.71Å; L161-M164 HydrophobicContact CD2-SD 4.27Å; L161-M164 HydrophobicContact CG-CE 4.16Å; L161-M164 PolarHBondContact O-N 3.43Å; M164-T166 PolarHBondContact O-N 3.3Å; M164-R209 HydrophobicContact CB-CG 4.23Å; M164-R209 HydrophobicContact SD-CG 4.42Å; M164-L226 HydrophobicContact SD-CD1 4.36Å; M164-I239 HydrophobicContact CE-CB 3.75Å; M164-I239 HydrophobicContact CE-CD1 3.89Å; M164-I239 HydrophobicContact CE-CG1 4.15Å; M164-I239 HydrophobicContact CE-CG2 3.97Å
165	E	77.6	Confident	73.5	Confident	100 Å²	100	98.6 Å²	98.6	47%	0.467	49%	0.49	S	S	.	.			trans	-59.9	129.9	-179.1	-163	-170.4	165.5	0	0	111.8	R167 V210	E165-R167 HydrophobicContact CG-CG 4.28Å; E165-R167 WeakPolarHBondContact OE1-CG 3.22Å; E165-R167 IonicContact OE1-CZ 3.9Å; E165-R167 IonicContact OE1-NE 3.35Å; E165-R167 PolarHBondContact OE1-NE 2.93Å; E165-R167 IonicContact OE1-NH2 3.43Å; E165-R167 PolarHBondContact OE1-NH2 3.14Å; E165-R167 IonicContact OE2-CZ 3.47Å; E165-R167 IonicContact OE2-NE 3.93Å; E165-R167 PolarHBondContact OE2-NE 3.06Å; E165-R167 IonicContact OE2-NH2 2.76Å; E165-R167 PolarHBondContact OE2-NH2 3.48Å; E165-V210 PolarHBondContact O-N 3.43Å
166	T	80.4	Confident	72.2	Confident	61 Å²	61	99.1 Å²	99.1	37%	0.374	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	122.3	169.3	55.8	0	0	0	0	109.9	M164 L208 R209 K219	M164-T166 PolarHBondContact O-N 3.3Å; T166-L208 CarbonylContact C-O 3.48Å; T166-L208 VanDerWaalsContact CA-O 3.24Å; T166-L208 WeakPolarHBondContact CA-O 3.39Å; T166-R209 HydrophobicContact CG2-CB 4.36Å; T166-K219 HydrophobicContact CG2-CD 4.04Å
167	R	81	Confident	70.6	Confident	120 Å²	120	106.2 Å²	106.2	45%	0.453	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137.2	179	-64.4	-174.8	-179.4	175.3	6.9	109.5	E165 L208 V210	E165-R167 HydrophobicContact CG-CG 4.28Å; E165-R167 WeakPolarHBondContact OE1-CG 3.22Å; E165-R167 IonicContact OE1-CZ 3.9Å; E165-R167 IonicContact OE1-NE 3.35Å; E165-R167 PolarHBondContact OE1-NE 2.93Å; E165-R167 IonicContact OE1-NH2 3.43Å; E165-R167 PolarHBondContact OE1-NH2 3.14Å; E165-R167 IonicContact OE2-CZ 3.47Å; E165-R167 IonicContact OE2-NE 3.93Å; E165-R167 PolarHBondContact OE2-NE 3.06Å; E165-R167 IonicContact OE2-NH2 2.76Å; E165-R167 PolarHBondContact OE2-NH2 3.48Å; R167-L208 PolarHBondContact N-O 2.87Å; R167-L208 PolarHBondContact O-N 3.04Å; R167-V210 HydrophobicContact CG-CG2 4.19Å
168	K	83.4	Confident	69.4	Low	138 Å²	138	114.7 Å²	114.7	60%	0.6	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.4	130.3	169	-66.4	-165.7	176.5	-165.5	0	109.8	E206 E207	K168-E206 CarbonylContact C-O 3.55Å; K168-E206 VanDerWaalsContact CA-O 3.29Å; K168-E206 WeakPolarHBondContact CA-O 3.42Å; K168-E207 WeakPolarHBondContact CE-OE1 3.32Å; K168-E207 HydrophobicContact CG-CG 4.25Å; K168-E207 IonicContact NZ-OE1 2.72Å
169	F	80.6	Confident	67.7	Low	41 Å²	41	116 Å²	116	18%	0.18	58%	0.583	C	S	.	*			trans	-67.7	145	175.4	-170.1	-103	0	0	0	110.6	A171 Y202 G205 E206 L208	F169-A171 HydrophobicContact CE1-CB 4.04Å; F169-Y202 HydrophobicContact CD2-CD2 4.22Å; F169-Y202 HydrophobicContact CD2-CG 4.24Å; F169-Y202 WeakPolarHBondContact CE1-O 3.34Å; F169-Y202 HydrophobicContact CE2-CD2 4.09Å; F169-Y202 HydrophobicContact CE2-CG 4.39Å; F169-G205 PolarHBondContact O-N 3.31Å; F169-E206 PolarHBondContact N-O 3.28Å; F169-L208 HydrophobicContact CB-CD1 4.04Å; F169-L208 HydrophobicContact CB-CG 4.25Å; F169-L208 HydrophobicContact CD2-CD1 3.88Å; F169-L208 HydrophobicContact CG-CD1 4.36Å
170	K	75.8	Confident	66.5	Low	176 Å²	176	116.7 Å²	116.7	77%	0.765	60%	0.598	S	S	*	*			trans	-139.9	116.1	167.1	-71.8	-170	175.6	-172.1	0	106.9	K172	K170-K172 PolarHBondContact O-N 3.31Å
171	A	71.9	Confident	64.5	Low	50 Å²	50	122 Å²	122	41%	0.413	63%	0.633	S	S	.	*			trans	-61.5	135.1	169.8	0	0	0	0	0	108.5	F169 G173 D204	F169-A171 HydrophobicContact CE1-CB 4.04Å; A171-G173 VanDerWaalsContact C-N 3.28Å; A171-G173 PolarHBondContact O-N 3.16Å; A171-D204 WeakPolarHBondContact CA-OD1 3.48Å; A171-D204 WeakPolarHBondContact CB-OD1 3.43Å; A171-D204 PolarHBondContact N-OD1 2.79Å; A171-D204 PolarHBondContact N-OD2 2.99Å
172	K	63.7	Low	62.3	Low	209 Å²	209	124.8 Å²	124.8	91%	0.909	67%	0.665	S	S	*	*			trans	-73.9	90.9	169.3	-163.7	177.3	-175.8	-176.5	0	107	K170 K174	K170-K172 PolarHBondContact O-N 3.31Å; K172-K174 PolarHBondContact O-N 3.47Å
173	G	53.2	Low	60.7	Low	64 Å²	64	122.1 Å²	122.1	66%	0.66	67%	0.669	S	S	*	*			trans	-48.3	137.4	-176.7	0	0	0	0	0	111.7	A171 G175	A171-G173 VanDerWaalsContact C-N 3.28Å; A171-G173 PolarHBondContact O-N 3.16Å; G173-G175 VanDerWaalsContact C-N 3.26Å; G173-G175 PolarHBondContact O-N 3.18Å
174	K	49.4	Very low	59.1	Low	222 Å²	222	119.3 Å²	119.3	97%	0.965	67%	0.67	S	S	*	*			trans	-67.9	79	-175.7	-83.3	-170.6	171	-175	0	111.9	K172	K172-K174 PolarHBondContact O-N 3.47Å
175	G	43.4	Very low	57.1	Low	71 Å²	71	125.9 Å²	125.9	73%	0.732	71%	0.706	S	S	*	*			trans	-71.3	126	160.6	0	0	0	0	0	110	G173 R177	G173-G175 VanDerWaalsContact C-N 3.26Å; G173-G175 PolarHBondContact O-N 3.18Å; G175-R177 PolarHBondContact O-N 3.45Å
176	L	53.3	Low	55.5	Low	172 Å²	172	126.8 Å²	126.8	90%	0.901	72%	0.723	S	S	*	*			trans	-66.1	117.3	179.5	172.8	66.8	0	0	0	111.6
177	R	44.2	Very low	53.7	Low	242 Å²	242	131.6 Å²	131.6	91%	0.913	75%	0.746	S	S	*	*			trans	-155.5	144.9	137.2	-151.7	172.5	178.5	-171.6	-1.9	112.4	G175	G175-R177 PolarHBondContact O-N 3.45Å
178	E	51	Low	51.8	Low	178 Å²	178	130.8 Å²	130.8	83%	0.832	76%	0.758	S	S	*	*			trans	-103.9	138.1	-178.6	173.1	178.7	-138.3	0	0	110.7
179	S	44.6	Very low	49.8	Very low	124 Å²	124	127.8 Å²	127.8	87%	0.867	76%	0.755	S	S	*	*			trans	-176.5	162	149.8	-165.1	0	0	0	0	111
180	S	56.7	Low	47.9	Very low	111 Å²	111	131.7 Å²	131.7	78%	0.776	79%	0.787	S	S	*	*			trans	-105.2	116.8	-171	159.8	0	0	0	0	114.5
181	C	34.9	Very low	46.7	Very low	131 Å²	131	125.7 Å²	125.7	89%	0.885	77%	0.768	S	S	*	*			trans	-176.5	158.8	141.4	56.2	0	0	0	0	109.1
182	G	33	Very low	46.2	Very low	70 Å²	70	126.4 Å²	126.4	72%	0.722	77%	0.767	S	S	*	*			cis	166.7	106.8	-8.3	0	0	0	0	0	111.4
183	A	42	Very low	46.5	Very low	98 Å²	98	119.1 Å²	119.1	81%	0.81	74%	0.743	S	S	*	*			trans	65	156	176.9	0	0	0	0	0	118.5
184	S	44.8	Very low	48	Very low	110 Å²	110	118.6 Å²	118.6	77%	0.769	72%	0.724	S	S	*	*			trans	62.4	92	164.3	-49.9	0	0	0	0	119
185	D	35.2	Very low	49.8	Very low	155 Å²	155	108 Å²	108	83%	0.829	68%	0.679	S	S	*	*			trans	173.7	53.9	135.8	-95.2	-10.6	0	0	0	113.1
186	S	43	Very low	51.9	Low	119 Å²	119	107.3 Å²	107.3	83%	0.832	67%	0.666	S	S	*	*	S	Bend	trans	-92.7	15.3	-174.5	53.5	0	0	0	0	115.7
187	L	42.4	Very low	53.5	Low	162 Å²	162	102.3 Å²	102.3	85%	0.848	64%	0.639	S	S	*	*	S	Bend	trans	-128.5	0.8	-172.3	-73.7	174.5	0	0	0	116.8
188	S	41.2	Very low	55.7	Low	103 Å²	103	93 Å²	93	72%	0.72	61%	0.611	S	S	*	*	S	Bend	trans	-137.5	24.8	-171.6	-64.5	0	0	0	0	116.1
189	S	40.7	Very low	57.5	Low	75 Å²	75	91.3 Å²	91.3	52%	0.524	61%	0.606	S	S	.	*			trans	-147.3	17.4	-177.3	-82.3	0	0	0	0	117.7	S191 T192	S189-S191 PolarHBondContact O-N 2.84Å; S189-T192 WeakPolarHBondContact O-CG2 3.17Å; S189-T192 PolarHBondContact O-OG1 3.37Å
190	S	42.5	Very low	59.6	Low	123 Å²	123	90.9 Å²	90.9	86%	0.86	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-5.8	171.5	48.4	0	0	0	0	114.9
191	S	50.5	Low	61	Low	51 Å²	51	92.5 Å²	92.5	36%	0.357	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.7	15.7	-178.6	56.2	0	0	0	0	114.3	S189	S189-S191 PolarHBondContact O-N 2.84Å
192	T	61.2	Low	63.5	Low	65 Å²	65	87 Å²	87	40%	0.399	55%	0.545	S	S	.	.	S	Bend	trans	-95.2	-22.6	-164.6	54.5	0	0	0	0	115.9	S189	S189-T192 WeakPolarHBondContact O-CG2 3.17Å; S189-T192 PolarHBondContact O-OG1 3.37Å
193	S	68.4	Low	65.9	Low	56 Å²	56	89 Å²	89	39%	0.392	54%	0.537	S	S	.	.	S	Bend	trans	-120.4	-12.6	-174.2	53.6	0	0	0	0	115.7	K201 Y202	S193-K201 WeakPolarHBondContact O-CA 3.45Å; S193-Y202 VanDerWaalsContact O-CD2 3.22Å; S193-Y202 WeakPolarHBondContact O-CD2 3.34Å; S193-Y202 PolarHBondContact O-N 3.08Å
194	D	85.1	Confident	67.8	Low	52 Å²	52	88.7 Å²	88.7	28%	0.278	52%	0.523	S	S	.	.	B	Isolated β-bridge	trans	-132.8	147.7	-168.9	-60.5	51.5	0	0	0	110.1	E200 K201 Y202	D194-E200 CarbonylContact C-O 3.59Å; D194-E200 WeakPolarHBondContact CA-O 3.34Å; D194-K201 VanDerWaalsContact CG-CG 3.47Å; D194-K201 WeakPolarHBondContact OD2-CE 3.5Å; D194-K201 WeakPolarHBondContact OD2-CG 3.46Å; D194-Y202 PolarHBondContact O-OH 3.17Å
195	C	88.4	Confident	69.5	Low	1 Å²	1	85.5 Å²	85.5	1%	0.007	51%	0.507	C	S	.	.			trans	-92.2	114	-178.7	-173.9	0	0	0	0	111.8	I197 C198 L199 E200 Y202 H218	C195-I197 PolarHBondContact O-N 3.07Å; C195-C198 PolarHBondContact O-N 3.12Å; C195-L199 WeakPolarHBondContact O-CA 3.45Å; C195-L199 PolarHBondContact O-N 3.08Å; C195-E200 PolarHBondContact N-O 3.48Å; C195-Y202 WeakPolarHBondContact CA-OH 3.42Å; C195-Y202 HydrophobicContact CB-CD1 4.48Å; C195-Y202 HydrophobicContact CB-CE1 3.63Å; C195-H218 WeakPolarHBondContact CB-ND1 3.41Å; C195-H218 PolarHBondContact SG-N 2.88Å; C195-H218 PolarHBondContact SG-ND1 3.24Å
196	A	87.1	Confident	71.9	Confident	56 Å²	56	80.9 Å²	80.9	46%	0.463	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	21.1	-179	0	0	0	0	0	115.7	F217	A196-F217 HydrophobicContact CB-CE1 4.16Å
197	I	86.7	Confident	74	Confident	67 Å²	67	78.8 Å²	78.8	34%	0.344	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-52.5	173.8	-60	169.2	0	0	0	111	C195 F217 C221 V222 P233	C195-I197 PolarHBondContact O-N 3.07Å; I197-F217 HydrophobicContact CD1-CB 4.23Å; I197-F217 HydrophobicContact CD1-CD1 3.55Å; I197-F217 HydrophobicContact CD1-CE1 4.13Å; I197-F217 HydrophobicContact CD1-CG 4.06Å; I197-F217 HydrophobicContact CG1-CD1 3.69Å; I197-F217 HydrophobicContact CG1-CE1 4.02Å; I197-C221 HydrophobicContact CB-CB 4.01Å; I197-C221 HydrophobicContact CD1-CB 4.08Å; I197-C221 HydrophobicContact CG2-CB 3.9Å; I197-V222 HydrophobicContact CD1-CB 3.7Å; I197-V222 HydrophobicContact CD1-CG2 3.86Å; I197-P233 HydrophobicContact CD1-CG 4.05Å; I197-P233 HydrophobicContact CG1-CG 4.35Å
198	C	89.6	Confident	76.3	Confident	46 Å²	46	71.4 Å²	71.4	31%	0.311	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-10.3	174.9	53.8	0	0	0	0	113.8	C195 E200	C195-C198 PolarHBondContact O-N 3.12Å; C198-E200 HydrophobicContact CB-CG 4.09Å; C198-E200 WeakPolarHBondContact CB-OE2 3.43Å; C198-E200 PolarHBondContact O-N 3.42Å; C198-E200 PolarHBondContact SG-OE2 3.15Å
199	L	88.8	Confident	78.5	Confident	142 Å²	142	67.3 Å²	67.3	74%	0.743	39%	0.387	S	S	*	.			trans	62.7	17.8	-174.9	-47.8	180	0	0	0	114.1	C195	C195-L199 WeakPolarHBondContact O-CA 3.45Å; C195-L199 PolarHBondContact O-N 3.08Å
200	E	88.6	Confident	80.7	Confident	116 Å²	116	64.8 Å²	64.8	54%	0.542	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-91.8	152	178.4	-61.4	171	136.1	0	0	112	D194 C195 C198	D194-E200 CarbonylContact C-O 3.59Å; D194-E200 WeakPolarHBondContact CA-O 3.34Å; C195-E200 PolarHBondContact N-O 3.48Å; C198-E200 HydrophobicContact CB-CG 4.09Å; C198-E200 WeakPolarHBondContact CB-OE2 3.43Å; C198-E200 PolarHBondContact O-N 3.42Å; C198-E200 PolarHBondContact SG-OE2 3.15Å
201	K	87.4	Confident	82.9	Confident	145 Å²	145	59 Å²	59	63%	0.63	33%	0.328	S	S	*	.	B	Isolated β-bridge	trans	-76.9	142.3	175.5	-76	174.1	178.7	174.8	0	111.6	S193 D194	S193-K201 WeakPolarHBondContact O-CA 3.45Å; D194-K201 VanDerWaalsContact CG-CG 3.47Å; D194-K201 WeakPolarHBondContact OD2-CE 3.5Å; D194-K201 WeakPolarHBondContact OD2-CG 3.46Å
202	Y	86.4	Confident	84.4	Confident	15 Å²	15	59.9 Å²	59.9	6%	0.059	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-68.3	131.7	175.1	-57.6	-49.6	0	0	0	111.3	F169 S193 D194 C195 E206 L208 R216 H218	F169-Y202 HydrophobicContact CD2-CD2 4.22Å; F169-Y202 HydrophobicContact CD2-CG 4.24Å; F169-Y202 WeakPolarHBondContact CE1-O 3.34Å; F169-Y202 HydrophobicContact CE2-CD2 4.09Å; F169-Y202 HydrophobicContact CE2-CG 4.39Å; S193-Y202 VanDerWaalsContact O-CD2 3.22Å; S193-Y202 WeakPolarHBondContact O-CD2 3.34Å; S193-Y202 PolarHBondContact O-N 3.08Å; D194-Y202 PolarHBondContact O-OH 3.17Å; C195-Y202 WeakPolarHBondContact CA-OH 3.42Å; C195-Y202 HydrophobicContact CB-CD1 4.48Å; C195-Y202 HydrophobicContact CB-CE1 3.63Å; Y202-E206 WeakPolarHBondContact CA-OE2 3.01Å; Y202-L208 HydrophobicContact CD1-CD1 3.84Å; Y202-L208 HydrophobicContact CD1-CD2 3.32Å; Y202-L208 HydrophobicContact CD1-CG 4.23Å; Y202-L208 HydrophobicContact CD2-CD1 3.9Å; Y202-L208 HydrophobicContact CE1-CD1 3.95Å; Y202-L208 HydrophobicContact CE1-CD2 3.46Å; Y202-L208 VanDerWaalsContact CE1-CD2 3.46Å; Y202-L208 HydrophobicContact CE1-CG 4.34Å; Y202-L208 HydrophobicContact CE2-CD1 4.06Å; Y202-L208 HydrophobicContact CG-CD1 3.81Å; Y202-L208 HydrophobicContact CG-CD2 4.08Å; Y202-R216 PolarHBondContact OH-O 3.43Å; Y202-H218 AromaticContact CD1-CE1 3.76Å; Y202-H218 AromaticContact CD1-NE2 3.68Å; Y202-H218 AromaticContact CE1-CE1 3.96Å; Y202-H218 AromaticContact CE1-ND1 3.98Å
203	I	84.9	Confident	85.6	Confident	111 Å²	111	58.2 Å²	58.2	57%	0.569	32%	0.323	S	S	*	.			trans	-108.5	150.1	-179.6	-51	177.8	0	0	0	109.5	G205 E206	I203-G205 PolarHBondContact O-N 3.28Å; I203-E206 HydrophobicContact CB-CG 3.98Å; I203-E206 PolarHBondContact N-OE2 3.47Å; I203-E206 WeakPolarHBondContact O-CB 3.46Å; I203-E206 WeakPolarHBondContact O-CG 2.94Å; I203-E206 PolarHBondContact O-N 2.98Å; I203-E206 VanDerWaalsContact O-N 3.13Å
204	D	81.8	Confident	86.4	Confident	93 Å²	93	59 Å²	59	50%	0.497	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	129.1	-179.5	-83.5	43.1	0	0	0	112.8	A171	A171-D204 WeakPolarHBondContact CA-OD1 3.48Å; A171-D204 WeakPolarHBondContact CB-OD1 3.43Å; A171-D204 PolarHBondContact N-OD1 2.79Å; A171-D204 PolarHBondContact N-OD2 2.99Å
205	G	78.9	Confident	86.5	Confident	42 Å²	42	58.7 Å²	58.7	43%	0.433	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	-10.3	-177.4	0	0	0	0	0	115.2	F169 I203	F169-G205 PolarHBondContact O-N 3.31Å; I203-G205 PolarHBondContact O-N 3.28Å
206	E	86.4	Confident	86.5	Confident	58 Å²	58	64 Å²	64	27%	0.271	35%	0.35	S	S	.	.			trans	-66.2	141.6	-179.9	-70.2	-168.4	130.8	0	0	113.4	K168 F169 Y202 I203 L208 H218	K168-E206 CarbonylContact C-O 3.55Å; K168-E206 VanDerWaalsContact CA-O 3.29Å; K168-E206 WeakPolarHBondContact CA-O 3.42Å; F169-E206 PolarHBondContact N-O 3.28Å; Y202-E206 WeakPolarHBondContact CA-OE2 3.01Å; I203-E206 HydrophobicContact CB-CG 3.98Å; I203-E206 PolarHBondContact N-OE2 3.47Å; I203-E206 WeakPolarHBondContact O-CB 3.46Å; I203-E206 WeakPolarHBondContact O-CG 2.94Å; I203-E206 PolarHBondContact O-N 2.98Å; I203-E206 VanDerWaalsContact O-N 3.13Å; E206-L208 PolarHBondContact O-N 3.48Å; E206-H218 IonicContact OE1-CD2 2.71Å; E206-H218 IonicContact OE1-NE2 3.39Å; E206-H218 PolarHBondContact OE1-NE2 2.98Å; E206-H218 IonicContact OE2-CD2 3.22Å; E206-H218 PolarHBondContact OE2-CD2 3.44Å; E206-H218 IonicContact OE2-CE1 2.71Å; E206-H218 IonicContact OE2-NE2 3.25Å; E206-H218 PolarHBondContact OE2-NE2 3.11Å
207	E	88.1	Confident	86.7	Confident	76 Å²	76	61.3 Å²	61.3	36%	0.355	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	109.3	-180	-65.4	-170.5	174.6	0	0	111.6	K168 K219	K168-E207 WeakPolarHBondContact CE-OE1 3.32Å; K168-E207 HydrophobicContact CG-CG 4.25Å; K168-E207 IonicContact NZ-OE1 2.72Å; E207-K219 HydrophobicContact CB-CB 4.3Å; E207-K219 HydrophobicContact CB-CD 4.04Å; E207-K219 VanDerWaalsContact O-CB 3.29Å; E207-K219 WeakPolarHBondContact O-CB 3.44Å; E207-K219 PolarHBondContact O-N 2.89Å; E207-K219 VanDerWaalsContact OE2-CD 3.3Å; E207-K219 WeakPolarHBondContact OE2-CD 3.37Å; E207-K219 IonicContact OE2-NZ 3.65Å; E207-K219 PolarHBondContact OE2-NZ 3.34Å
208	L	88.8	Confident	86.9	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.031	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	135.5	174.5	-48.8	-170.6	0	0	0	110	T166 R167 F169 Y202 E206 F217	T166-L208 CarbonylContact C-O 3.48Å; T166-L208 VanDerWaalsContact CA-O 3.24Å; T166-L208 WeakPolarHBondContact CA-O 3.39Å; R167-L208 PolarHBondContact N-O 2.87Å; R167-L208 PolarHBondContact O-N 3.04Å; F169-L208 HydrophobicContact CB-CD1 4.04Å; F169-L208 HydrophobicContact CB-CG 4.25Å; F169-L208 HydrophobicContact CD2-CD1 3.88Å; F169-L208 HydrophobicContact CG-CD1 4.36Å; Y202-L208 HydrophobicContact CD1-CD1 3.84Å; Y202-L208 HydrophobicContact CD1-CD2 3.32Å; Y202-L208 HydrophobicContact CD1-CG 4.23Å; Y202-L208 HydrophobicContact CD2-CD1 3.9Å; Y202-L208 HydrophobicContact CE1-CD1 3.95Å; Y202-L208 HydrophobicContact CE1-CD2 3.46Å; Y202-L208 VanDerWaalsContact CE1-CD2 3.46Å; Y202-L208 HydrophobicContact CE1-CG 4.34Å; Y202-L208 HydrophobicContact CE2-CD1 4.06Å; Y202-L208 HydrophobicContact CG-CD1 3.81Å; Y202-L208 HydrophobicContact CG-CD2 4.08Å; E206-L208 PolarHBondContact O-N 3.48Å; L208-F217 CarbonylContact C-O 3.48Å; L208-F217 WeakPolarHBondContact CA-O 3.47Å
209	R	87.8	Confident	87	Confident	17 Å²	17	59.6 Å²	59.6	6%	0.064	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	134.1	169.2	173.8	157.4	-80.9	154.7	-1.1	109.5	L161 M164 T166 F217 V222 D223	L161-R209 VanDerWaalsContact O-CZ 3.27Å; L161-R209 PolarHBondContact O-NH2 2.86Å; M164-R209 HydrophobicContact CB-CG 4.23Å; M164-R209 HydrophobicContact SD-CG 4.42Å; T166-R209 HydrophobicContact CG2-CB 4.36Å; R209-F217 PolarHBondContact N-O 3.13Å; R209-F217 PolarHBondContact O-N 2.84Å; R209-V222 HydrophobicContact CB-CG1 3.94Å; R209-V222 HydrophobicContact CG-CG1 4.33Å; R209-D223 IonicContact CZ-OD1 2.63Å; R209-D223 IonicContact CZ-OD2 2.68Å; R209-D223 IonicContact NE-OD1 3.02Å; R209-D223 IonicContact NH1-OD1 3.63Å; R209-D223 PolarHBondContact NH1-OD1 2.93Å; R209-D223 IonicContact NH1-OD2 3.78Å; R209-D223 PolarHBondContact NH1-OD2 2.84Å
210	V	87.1	Confident	87	Confident	22 Å²	22	62 Å²	62	13%	0.133	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	118.2	174.5	-169.5	0	0	0	0	108.5	E165 R167 R216	E165-V210 PolarHBondContact O-N 3.43Å; R167-V210 HydrophobicContact CG-CG2 4.19Å; V210-R216 HydrophobicContact CG2-CG 4.42Å
211	I	88.3	Confident	87	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.01	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-80	150.4	176.6	-55	-172.2	0	0	0	108.8	C213 A214 H215 F217 V222 L226 C232 I239	I211-C213 WeakPolarHBondContact CG2-SG 3.28Å; I211-C213 PolarHBondContact O-N 2.92Å; I211-A214 WeakPolarHBondContact O-CA 3.33Å; I211-A214 PolarHBondContact O-N 3.14Å; I211-H215 PolarHBondContact N-O 3.39Å; I211-F217 HydrophobicContact CD1-CD2 3.86Å; I211-F217 HydrophobicContact CD1-CE2 3.55Å; I211-F217 HydrophobicContact CG1-CD2 4.29Å; I211-F217 HydrophobicContact CG1-CE2 4.27Å; I211-V222 HydrophobicContact CD1-CG2 4.01Å; I211-L226 HydrophobicContact CD1-CD1 3.97Å; I211-L226 HydrophobicContact CD1-CD2 4.13Å; I211-L226 HydrophobicContact CG1-CD1 4.24Å; I211-C232 HydrophobicContact CD1-CB 4.07Å; I211-C232 HydrophobicContact CG2-CB 4.27Å; I211-I239 HydrophobicContact CG2-CG2 3.97Å
212	P	83.4	Confident	87.1	Confident	70 Å²	70	51.2 Å²	51.2	46%	0.455	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-21.3	177.1	-33.1	37.5	0	0	0	116.5	A214	P212-A214 PolarHBondContact O-N 2.9Å
213	C	85.8	Confident	87.3	Confident	29 Å²	29	52.2 Å²	52.2	20%	0.196	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	23.8	170.6	60.9	0	0	0	0	114.1	I211 H215 C235 H237	I211-C213 WeakPolarHBondContact CG2-SG 3.28Å; I211-C213 PolarHBondContact O-N 2.92Å; C213-H215 PolarHBondContact O-N 3.37Å; C213-H215 PolarHBondContact O-ND1 2.98Å; C213-C235 PolarHBondContact SG-SG 3.39Å; C213-H237 HydrophobicContact CB-CB 3.91Å
214	A	85.1	Confident	87.5	Confident	73 Å²	73	50.4 Å²	50.4	60%	0.603	27%	0.274	S	S	*	.	S	Bend	trans	59.9	-6.1	-178.3	0	0	0	0	0	117.9	I211 P212	I211-A214 WeakPolarHBondContact O-CA 3.33Å; I211-A214 PolarHBondContact O-N 3.14Å; P212-A214 PolarHBondContact O-N 2.9Å
215	H	87.7	Confident	87.8	Confident	45 Å²	45	50.9 Å²	50.9	21%	0.208	27%	0.269	C	S	.	.			trans	-67	145.3	177.7	-70.2	72.1	0	0	0	111.6	I211 C213 F217 H234	I211-H215 PolarHBondContact N-O 3.39Å; C213-H215 PolarHBondContact O-N 3.37Å; C213-H215 PolarHBondContact O-ND1 2.98Å; H215-F217 HydrophobicContact CB-CE2 3.79Å; H215-F217 HydrophobicContact CB-CZ 4.32Å; H215-H234 AromaticContact CD2-CD2 3.66Å; H215-H234 AromaticContact CD2-CG 3.48Å; H215-H234 VanDerWaalsContact CD2-CG 3.48Å; H215-H234 AromaticContact NE2-CG 3.67Å; H215-H234 AromaticContact NE2-ND1 3.72Å
216	R	88.8	Confident	88.2	Confident	112 Å²	112	48.9 Å²	48.9	42%	0.423	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	144.2	-175.3	-53.5	-178.2	-169.6	165.1	5.4	110.4	Y202 V210	Y202-R216 PolarHBondContact OH-O 3.43Å; V210-R216 HydrophobicContact CG2-CG 4.42Å
217	F	91.1	Very high	88.1	Confident	1 Å²	1	49.3 Å²	49.3	0%	0.004	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	160.1	177.6	-55.2	-93.6	0	0	0	108.7	A196 I197 L208 R209 I211 H215 K219 V222 P233 H234	A196-F217 HydrophobicContact CB-CE1 4.16Å; I197-F217 HydrophobicContact CD1-CB 4.23Å; I197-F217 HydrophobicContact CD1-CD1 3.55Å; I197-F217 HydrophobicContact CD1-CE1 4.13Å; I197-F217 HydrophobicContact CD1-CG 4.06Å; I197-F217 HydrophobicContact CG1-CD1 3.69Å; I197-F217 HydrophobicContact CG1-CE1 4.02Å; L208-F217 CarbonylContact C-O 3.48Å; L208-F217 WeakPolarHBondContact CA-O 3.47Å; R209-F217 PolarHBondContact N-O 3.13Å; R209-F217 PolarHBondContact O-N 2.84Å; I211-F217 HydrophobicContact CD1-CD2 3.86Å; I211-F217 HydrophobicContact CD1-CE2 3.55Å; I211-F217 HydrophobicContact CG1-CD2 4.29Å; I211-F217 HydrophobicContact CG1-CE2 4.27Å; H215-F217 HydrophobicContact CB-CE2 3.79Å; H215-F217 HydrophobicContact CB-CZ 4.32Å; F217-K219 PolarHBondContact O-N 3.28Å; F217-V222 HydrophobicContact CB-CB 3.65Å; F217-V222 HydrophobicContact CB-CG1 3.93Å; F217-V222 HydrophobicContact CB-CG2 4.07Å; F217-V222 HydrophobicContact CD2-CB 4.3Å; F217-V222 HydrophobicContact CD2-CG2 3.76Å; F217-V222 HydrophobicContact CE2-CG2 4.32Å; F217-V222 HydrophobicContact CG-CB 4.03Å; F217-V222 HydrophobicContact CG-CG2 3.87Å; F217-P233 HydrophobicContact CE1-CB 4.12Å; F217-P233 HydrophobicContact CE1-CG 3.99Å; F217-P233 HydrophobicContact CE2-CG 4.48Å; F217-P233 HydrophobicContact CZ-CB 4.11Å; F217-P233 HydrophobicContact CZ-CG 3.9Å; F217-H234 HydrophobicContact CZ-CB 3.94Å
218	H	91.3	Very high	87.7	Confident	13 Å²	13	52.3 Å²	52.3	6%	0.06	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	131.5	163.9	-63.2	105.8	0	0	0	110.3	C195 Y202 E206 K220 C221 V222	C195-H218 WeakPolarHBondContact CB-ND1 3.41Å; C195-H218 PolarHBondContact SG-N 2.88Å; C195-H218 PolarHBondContact SG-ND1 3.24Å; Y202-H218 AromaticContact CD1-CE1 3.76Å; Y202-H218 AromaticContact CD1-NE2 3.68Å; Y202-H218 AromaticContact CE1-CE1 3.96Å; Y202-H218 AromaticContact CE1-ND1 3.98Å; E206-H218 IonicContact OE1-CD2 2.71Å; E206-H218 IonicContact OE1-NE2 3.39Å; E206-H218 PolarHBondContact OE1-NE2 2.98Å; E206-H218 IonicContact OE2-CD2 3.22Å; E206-H218 PolarHBondContact OE2-CD2 3.44Å; E206-H218 IonicContact OE2-CE1 2.71Å; E206-H218 IonicContact OE2-NE2 3.25Å; E206-H218 PolarHBondContact OE2-NE2 3.11Å; H218-K220 VanDerWaalsContact C-N 3.28Å; H218-K220 PolarHBondContact O-N 3.28Å; H218-C221 HydrophobicContact CB-CB 4.14Å; H218-C221 PolarHBondContact O-N 3.39Å; H218-V222 PolarHBondContact O-N 3Å
219	K	89.7	Confident	87.5	Confident	64 Å²	64	56.2 Å²	56.2	28%	0.278	28%	0.284	S	S	.	.	H	α-helix	trans	-49.6	-48.1	175.4	179	-179.2	173.4	179.3	0	111.8	T166 E207 F217 C221 V222 D223	T166-K219 HydrophobicContact CG2-CD 4.04Å; E207-K219 HydrophobicContact CB-CB 4.3Å; E207-K219 HydrophobicContact CB-CD 4.04Å; E207-K219 VanDerWaalsContact O-CB 3.29Å; E207-K219 WeakPolarHBondContact O-CB 3.44Å; E207-K219 PolarHBondContact O-N 2.89Å; E207-K219 VanDerWaalsContact OE2-CD 3.3Å; E207-K219 WeakPolarHBondContact OE2-CD 3.37Å; E207-K219 IonicContact OE2-NZ 3.65Å; E207-K219 PolarHBondContact OE2-NZ 3.34Å; F217-K219 PolarHBondContact O-N 3.28Å; K219-C221 PolarHBondContact O-N 3.15Å; K219-V222 PolarHBondContact O-N 3.08Å; K219-D223 WeakPolarHBondContact CG-OD2 3.26Å; K219-D223 WeakPolarHBondContact O-CB 3.36Å; K219-D223 PolarHBondContact O-N 3.1Å
220	K	89.5	Confident	87.5	Confident	192 Å²	192	56.3 Å²	56.3	84%	0.835	29%	0.286	S	S	*	.	H	α-helix	trans	-57	-32.9	177.8	-65.4	178.3	-177.3	171	0	113.9	H218 P224	H218-K220 VanDerWaalsContact C-N 3.28Å; H218-K220 PolarHBondContact O-N 3.28Å; K220-P224 WeakPolarHBondContact O-CD 3.49Å
221	C	88.3	Confident	87.6	Confident	35 Å²	35	57 Å²	57	24%	0.236	29%	0.29	C	S	.	.	H	α-helix	trans	-89	-35.4	-174.2	-57.3	0	0	0	0	112.2	I197 H218 K219	I197-C221 HydrophobicContact CB-CB 4.01Å; I197-C221 HydrophobicContact CD1-CB 4.08Å; I197-C221 HydrophobicContact CG2-CB 3.9Å; H218-C221 HydrophobicContact CB-CB 4.14Å; H218-C221 PolarHBondContact O-N 3.39Å; K219-C221 PolarHBondContact O-N 3.15Å
222	V	90.9	Very high	87.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-93.7	-24.8	-174.3	79.2	0	0	0	0	113.9	I197 R209 I211 F217 H218 K219 W225 L226 P233	I197-V222 HydrophobicContact CD1-CB 3.7Å; I197-V222 HydrophobicContact CD1-CG2 3.86Å; R209-V222 HydrophobicContact CB-CG1 3.94Å; R209-V222 HydrophobicContact CG-CG1 4.33Å; I211-V222 HydrophobicContact CD1-CG2 4.01Å; F217-V222 HydrophobicContact CB-CB 3.65Å; F217-V222 HydrophobicContact CB-CG1 3.93Å; F217-V222 HydrophobicContact CB-CG2 4.07Å; F217-V222 HydrophobicContact CD2-CB 4.3Å; F217-V222 HydrophobicContact CD2-CG2 3.76Å; F217-V222 HydrophobicContact CE2-CG2 4.32Å; F217-V222 HydrophobicContact CG-CB 4.03Å; F217-V222 HydrophobicContact CG-CG2 3.87Å; H218-V222 PolarHBondContact O-N 3Å; K219-V222 PolarHBondContact O-N 3.08Å; V222-W225 PolarHBondContact O-N 3.47Å; V222-L226 HydrophobicContact CG1-CD1 4.32Å; V222-L226 HydrophobicContact CG2-CD1 3.88Å; V222-L226 HydrophobicContact CG2-CG 3.99Å; V222-L226 WeakPolarHBondContact O-CG 3.39Å; V222-L226 PolarHBondContact O-N 3.09Å; V222-P233 HydrophobicContact CG2-CG 4.11Å
223	D	88.9	Confident	87.9	Confident	35 Å²	35	55.4 Å²	55.4	19%	0.187	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-45.3	-179	-72	13.8	0	0	0	113.2	R209 K219 W225 L226 L227	R209-D223 IonicContact CZ-OD1 2.63Å; R209-D223 IonicContact CZ-OD2 2.68Å; R209-D223 IonicContact NE-OD1 3.02Å; R209-D223 IonicContact NH1-OD1 3.63Å; R209-D223 PolarHBondContact NH1-OD1 2.93Å; R209-D223 IonicContact NH1-OD2 3.78Å; R209-D223 PolarHBondContact NH1-OD2 2.84Å; K219-D223 WeakPolarHBondContact CG-OD2 3.26Å; K219-D223 WeakPolarHBondContact O-CB 3.36Å; K219-D223 PolarHBondContact O-N 3.1Å; D223-W225 VanDerWaalsContact C-N 3.35Å; D223-W225 PolarHBondContact O-N 3.37Å; D223-L226 PolarHBondContact O-N 3.35Å; D223-L227 VanDerWaalsContact O-CG 3.29Å; D223-L227 WeakPolarHBondContact O-CG 3.5Å; D223-L227 PolarHBondContact O-N 2.82Å
224	P	89.1	Confident	87.9	Confident	74 Å²	74	58.9 Å²	58.9	48%	0.481	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-42.2	175.3	-21.5	33.9	0	0	0	112.4	K220 L226 L227 Q228	K220-P224 WeakPolarHBondContact O-CD 3.49Å; P224-L226 PolarHBondContact O-N 2.68Å; P224-L227 PolarHBondContact O-N 2.71Å; P224-Q228 PolarHBondContact O-N 2.68Å
225	W	88.9	Confident	87.9	Confident	102 Å²	102	58 Å²	58	39%	0.386	28%	0.282	S	S	.	.	H	α-helix	trans	-61.8	-44.7	179.1	178	-81.9	0	0	0	111.9	V222 D223 Q228 H229 T231 P233	V222-W225 PolarHBondContact O-N 3.47Å; D223-W225 VanDerWaalsContact C-N 3.35Å; D223-W225 PolarHBondContact O-N 3.37Å; W225-Q228 PolarHBondContact O-N 2.88Å; W225-H229 AromaticContact CD2-CD2 3.88Å; W225-H229 AromaticContact CE3-CD2 3.91Å; W225-H229 HydrophobicContact CZ2-CB 4.46Å; W225-H229 WeakPolarHBondContact O-CB 3.38Å; W225-H229 PolarHBondContact O-N 2.83Å; W225-T231 PolarHBondContact NE1-O 3.02Å; W225-P233 HydrophobicContact CD2-CG 4.24Å; W225-P233 HydrophobicContact CG-CG 3.98Å
226	L	87.4	Confident	87.9	Confident	0 Å²	0	66 Å²	66	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-72.3	-29.9	-179.2	-65.2	176.1	0	0	0	112.7	L161 M164 I211 V222 D223 P224 Q228 H230 T231 I239	L161-L226 HydrophobicContact CD1-CB 4.22Å; L161-L226 HydrophobicContact CD2-CB 3.7Å; L161-L226 HydrophobicContact CD2-CD1 3.59Å; L161-L226 HydrophobicContact CD2-CG 4.29Å; L161-L226 HydrophobicContact CG-CB 4.43Å; M164-L226 HydrophobicContact SD-CD1 4.36Å; I211-L226 HydrophobicContact CD1-CD1 3.97Å; I211-L226 HydrophobicContact CD1-CD2 4.13Å; I211-L226 HydrophobicContact CG1-CD1 4.24Å; V222-L226 HydrophobicContact CG1-CD1 4.32Å; V222-L226 HydrophobicContact CG2-CD1 3.88Å; V222-L226 HydrophobicContact CG2-CG 3.99Å; V222-L226 WeakPolarHBondContact O-CG 3.39Å; V222-L226 PolarHBondContact O-N 3.09Å; D223-L226 PolarHBondContact O-N 3.35Å; P224-L226 PolarHBondContact O-N 2.68Å; L226-Q228 VanDerWaalsContact C-N 3.3Å; L226-Q228 PolarHBondContact O-N 2.88Å; L226-H230 VanDerWaalsContact O-CA 3.3Å; L226-H230 WeakPolarHBondContact O-CA 3.48Å; L226-H230 PolarHBondContact O-N 2.78Å; L226-H230 VanDerWaalsContact O-N 3.13Å; L226-H230 PolarHBondContact O-ND1 3.49Å; L226-T231 VanDerWaalsContact CD2-O 3.28Å; L226-T231 WeakPolarHBondContact CD2-O 3.46Å; L226-I239 HydrophobicContact CB-CD1 3.9Å; L226-I239 HydrophobicContact CD2-CD1 4.18Å; L226-I239 HydrophobicContact CD2-CG2 3.86Å; L226-I239 HydrophobicContact CG-CD1 4.47Å
227	L	83.6	Confident	87.7	Confident	68 Å²	68	64.9 Å²	64.9	36%	0.356	31%	0.31	S	S	.	.	H	α-helix	trans	-65.1	-31	169.9	-72.9	169.2	0	0	0	112.9	I158 L161 D223 P224 H230	I158-L227 HydrophobicContact CD1-CD2 4.42Å; I158-L227 HydrophobicContact CG1-CD2 3.49Å; I158-L227 VanDerWaalsContact CG1-CD2 3.49Å; L161-L227 HydrophobicContact CD1-CD2 3.57Å; L161-L227 HydrophobicContact CD1-CG 3.67Å; D223-L227 VanDerWaalsContact O-CG 3.29Å; D223-L227 WeakPolarHBondContact O-CG 3.5Å; D223-L227 PolarHBondContact O-N 2.82Å; P224-L227 PolarHBondContact O-N 2.71Å; L227-H230 PolarHBondContact O-CE1 3.02Å; L227-H230 VanDerWaalsContact O-CE1 3.23Å
228	Q	81.3	Confident	87.4	Confident	138 Å²	138	66.7 Å²	66.7	65%	0.645	32%	0.319	S	S	*	.	H	α-helix	trans	-97.7	-37.8	-175.3	-173.6	169.8	-8.4	0	0	114.3	P224 W225 L226	P224-Q228 PolarHBondContact O-N 2.68Å; W225-Q228 PolarHBondContact O-N 2.88Å; L226-Q228 VanDerWaalsContact C-N 3.3Å; L226-Q228 PolarHBondContact O-N 2.88Å
229	H	83.6	Confident	87	Confident	88 Å²	88	66.1 Å²	66.1	41%	0.407	32%	0.317	S	S	.	.	H	α-helix	trans	-117.7	-8.3	-171.8	-62.1	-74.1	0	0	0	114.4	W225 T231	W225-H229 AromaticContact CD2-CD2 3.88Å; W225-H229 AromaticContact CE3-CD2 3.91Å; W225-H229 HydrophobicContact CZ2-CB 4.46Å; W225-H229 WeakPolarHBondContact O-CB 3.38Å; W225-H229 PolarHBondContact O-N 2.83Å; H229-T231 WeakPolarHBondContact O-CB 3.04Å; H229-T231 WeakPolarHBondContact O-CG2 3.4Å; H229-T231 PolarHBondContact O-N 2.95Å; H229-T231 PolarHBondContact O-OG1 2.96Å
230	H	87.4	Confident	86.5	Confident	20 Å²	20	65.8 Å²	65.8	9%	0.093	32%	0.317	C	S	.	.			trans	53.1	17.3	175.4	-47.2	-24.8	0	0	0	115.6	A157 L226 L227 N238 I239 I240	A157-H230 WeakPolarHBondContact CB-ND1 3.48Å; L226-H230 VanDerWaalsContact O-CA 3.3Å; L226-H230 WeakPolarHBondContact O-CA 3.48Å; L226-H230 PolarHBondContact O-N 2.78Å; L226-H230 VanDerWaalsContact O-N 3.13Å; L226-H230 PolarHBondContact O-ND1 3.49Å; L227-H230 PolarHBondContact O-CE1 3.02Å; L227-H230 VanDerWaalsContact O-CE1 3.23Å; H230-N238 WeakPolarHBondContact O-CA 3.48Å; H230-N238 PolarHBondContact O-OD1 2.93Å; H230-I239 HydrophobicContact CB-CD1 4.34Å; H230-I239 HydrophobicContact CB-CG1 4.36Å; H230-I239 WeakPolarHBondContact O-CG1 3.24Å; H230-I239 PolarHBondContact O-N 3.49Å; H230-I240 HydrophobicContact CB-CD1 3.93Å; H230-I240 HydrophobicContact CB-CG1 4.3Å
231	T	89.5	Confident	85.6	Confident	36 Å²	36	63.2 Å²	63.2	22%	0.221	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-138	144.9	-168.6	45.1	0	0	0	0	110.9	W225 L226 H229 R236 H237 N238	W225-T231 PolarHBondContact NE1-O 3.02Å; L226-T231 VanDerWaalsContact CD2-O 3.28Å; L226-T231 WeakPolarHBondContact CD2-O 3.46Å; H229-T231 WeakPolarHBondContact O-CB 3.04Å; H229-T231 WeakPolarHBondContact O-CG2 3.4Å; H229-T231 PolarHBondContact O-N 2.95Å; H229-T231 PolarHBondContact O-OG1 2.96Å; T231-R236 VanDerWaalsContact CG2-O 3.31Å; T231-R236 WeakPolarHBondContact CG2-O 3.16Å; T231-H237 CarbonylContact C-O 3.53Å; T231-H237 WeakPolarHBondContact CA-O 3.19Å; T231-N238 HydrophobicContact CG2-CB 4.22Å
232	C	89	Confident	84.2	Confident	0 Å²	0	69 Å²	69	0%	0	33%	0.332	C	S	.	.			trans	-59	127.9	176.2	179.6	0	0	0	0	111.3	I211 H234 C235 R236 H237	I211-C232 HydrophobicContact CD1-CB 4.07Å; I211-C232 HydrophobicContact CG2-CB 4.27Å; C232-H234 PolarHBondContact O-N 3.28Å; C232-H234 PolarHBondContact SG-N 3.4Å; C232-C235 VanDerWaalsContact CB-SG 3.59Å; C232-R236 WeakPolarHBondContact O-CA 3.46Å; C232-R236 PolarHBondContact O-N 2.64Å; C232-H237 HydrophobicContact CB-CB 4.42Å; C232-H237 PolarHBondContact N-O 2.01Å
233	P	88.7	Confident	82.2	Confident	39 Å²	39	76.2 Å²	76.2	25%	0.253	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-37.6	176.5	-23.2	28.7	0	0	0	113.5	I197 F217 V222 W225	I197-P233 HydrophobicContact CD1-CG 4.05Å; I197-P233 HydrophobicContact CG1-CG 4.35Å; F217-P233 HydrophobicContact CE1-CB 4.12Å; F217-P233 HydrophobicContact CE1-CG 3.99Å; F217-P233 HydrophobicContact CE2-CG 4.48Å; F217-P233 HydrophobicContact CZ-CB 4.11Å; F217-P233 HydrophobicContact CZ-CG 3.9Å; V222-P233 HydrophobicContact CG2-CG 4.11Å; W225-P233 HydrophobicContact CD2-CG 4.24Å; W225-P233 HydrophobicContact CG-CG 3.98Å
234	H	85.6	Confident	80	Confident	101 Å²	101	85.3 Å²	85.3	47%	0.468	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-26.7	-168.9	-165.6	-37.1	0	0	0	113.9	H215 F217 C232	H215-H234 AromaticContact CD2-CD2 3.66Å; H215-H234 AromaticContact CD2-CG 3.48Å; H215-H234 VanDerWaalsContact CD2-CG 3.48Å; H215-H234 AromaticContact NE2-CG 3.67Å; H215-H234 AromaticContact NE2-ND1 3.72Å; F217-H234 HydrophobicContact CZ-CB 3.94Å; C232-H234 PolarHBondContact O-N 3.28Å; C232-H234 PolarHBondContact SG-N 3.4Å
235	C	86.1	Confident	77.9	Confident	56 Å²	56	83.7 Å²	83.7	38%	0.378	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.7	6.6	-177.2	70.9	0	0	0	0	114.9	C213 C232 H237	C213-C235 PolarHBondContact SG-SG 3.39Å; C232-C235 VanDerWaalsContact CB-SG 3.59Å; C235-H237 PolarHBondContact O-N 3.11Å
236	R	88	Confident	75.4	Confident	212 Å²	212	86.3 Å²	86.3	80%	0.8	42%	0.419	S	S	*	.			trans	57.4	7.7	178	-57.2	-178.1	-179.5	178.7	-0.3	116.5	T231 C232 N238	T231-R236 VanDerWaalsContact CG2-O 3.31Å; T231-R236 WeakPolarHBondContact CG2-O 3.16Å; C232-R236 WeakPolarHBondContact O-CA 3.46Å; C232-R236 PolarHBondContact O-N 2.64Å; R236-N238 PolarHBondContact O-N 3.32Å
237	H	84.4	Confident	73.5	Confident	89 Å²	89	92 Å²	92	41%	0.412	46%	0.459	S	S	.	.			trans	-59.3	126	176.6	-173	83.1	0	0	0	111.6	C213 T231 C232 C235	C213-H237 HydrophobicContact CB-CB 3.91Å; T231-H237 CarbonylContact C-O 3.53Å; T231-H237 WeakPolarHBondContact CA-O 3.19Å; C232-H237 HydrophobicContact CB-CB 4.42Å; C232-H237 PolarHBondContact N-O 2.01Å; C235-H237 PolarHBondContact O-N 3.11Å
238	N	84.3	Confident	71.1	Confident	38 Å²	38	91.8 Å²	91.8	20%	0.203	47%	0.473	C	S	.	.	B	Isolated β-bridge	trans	-73.3	129	-178.5	-175.1	-16.3	0	0	0	111.1	H230 T231 R236 I240 E241	H230-N238 WeakPolarHBondContact O-CA 3.48Å; H230-N238 PolarHBondContact O-OD1 2.93Å; T231-N238 HydrophobicContact CG2-CB 4.22Å; R236-N238 PolarHBondContact O-N 3.32Å; N238-I240 PolarHBondContact OD1-N 3.01Å; N238-E241 HydrophobicContact CB-CB 4.13Å; N238-E241 HydrophobicContact CB-CG 4.28Å; N238-E241 WeakPolarHBondContact ND2-CG 3.49Å; N238-E241 PolarHBondContact ND2-OE1 3.11Å
239	I	82.5	Confident	69.5	Low	2 Å²	2	91.6 Å²	91.6	1%	0.01	48%	0.484	C	S	.	.	S	Bend	trans	-78.3	-19.4	-178.2	71.9	-167	0	0	0	113.8	A160 M164 I211 L226 H230	A160-I239 HydrophobicContact CB-CG1 4.42Å; M164-I239 HydrophobicContact CE-CB 3.75Å; M164-I239 HydrophobicContact CE-CD1 3.89Å; M164-I239 HydrophobicContact CE-CG1 4.15Å; M164-I239 HydrophobicContact CE-CG2 3.97Å; I211-I239 HydrophobicContact CG2-CG2 3.97Å; L226-I239 HydrophobicContact CB-CD1 3.9Å; L226-I239 HydrophobicContact CD2-CD1 4.18Å; L226-I239 HydrophobicContact CD2-CG2 3.86Å; L226-I239 HydrophobicContact CG-CD1 4.47Å; H230-I239 HydrophobicContact CB-CD1 4.34Å; H230-I239 HydrophobicContact CB-CG1 4.36Å; H230-I239 WeakPolarHBondContact O-CG1 3.24Å; H230-I239 PolarHBondContact O-N 3.49Å
240	I	78.8	Confident	67.5	Low	56 Å²	56	92.4 Å²	92.4	29%	0.287	51%	0.506	S	S	.	.	S	Bend	trans	-91.8	-29.9	-176.3	-52.5	-178.9	0	0	0	110.5	M156 A157 H230 N238 Q242	M156-I240 HydrophobicContact CB-CD1 4.42Å; M156-I240 HydrophobicContact CB-CG2 4.39Å; A157-I240 HydrophobicContact CB-CD1 4.24Å; H230-I240 HydrophobicContact CB-CD1 3.93Å; H230-I240 HydrophobicContact CB-CG1 4.3Å; N238-I240 PolarHBondContact OD1-N 3.01Å; I240-Q242 VanDerWaalsContact C-N 3.26Å; I240-Q242 PolarHBondContact O-N 3.16Å
241	E	72.2	Confident	64.7	Low	139 Å²	139	97.5 Å²	97.5	65%	0.65	54%	0.543	S	S	*	.			trans	-79.5	64.5	177.1	-72.9	169	-149.3	0	0	112.1	N238 K243	N238-E241 HydrophobicContact CB-CB 4.13Å; N238-E241 HydrophobicContact CB-CG 4.28Å; N238-E241 WeakPolarHBondContact ND2-CG 3.49Å; N238-E241 PolarHBondContact ND2-OE1 3.11Å; E241-K243 PolarHBondContact O-N 3.23Å
242	Q	57.4	Low	62.6	Low	155 Å²	155	104.6 Å²	104.6	72%	0.724	58%	0.575	S	S	*	*			trans	-67.5	99.9	174	-72.6	-157.4	-9.5	0	0	111.7	I240 K244	I240-Q242 VanDerWaalsContact C-N 3.26Å; I240-Q242 PolarHBondContact O-N 3.16Å; Q242-K244 PolarHBondContact O-N 3.49Å
243	K	49.2	Very low	59.8	Low	153 Å²	153	112.4 Å²	112.4	67%	0.665	62%	0.617	S	S	*	*			trans	-5.2	97.4	163.6	-167.2	-166.3	-178.6	-143.2	0	115.2	E241 G245 N246	E241-K243 PolarHBondContact O-N 3.23Å; K243-G245 WeakPolarHBondContact CD-O 3.19Å; K243-G245 WeakPolarHBondContact CE-O 3.38Å; K243-G245 PolarHBondContact NZ-O 2.97Å; K243-G245 PolarHBondContact O-N 2.71Å; K243-N246 PolarHBondContact NZ-O 2.6Å
244	K	43.7	Very low	57.7	Low	225 Å²	225	116.4 Å²	116.4	98%	0.978	64%	0.643	S	S	*	*	S	Bend	trans	-71.9	68	161.7	-170.3	-174.5	177.5	-179.8	0	110.1	Q242	Q242-K244 PolarHBondContact O-N 3.49Å
245	G	43.8	Very low	55.2	Low	40 Å²	40	114.7 Å²	114.7	41%	0.412	65%	0.653	S	S	.	*	S	Bend	trans	-171.6	120.4	-177	0	0	0	0	0	112	K243	K243-G245 WeakPolarHBondContact CD-O 3.19Å; K243-G245 WeakPolarHBondContact CE-O 3.38Å; K243-G245 PolarHBondContact NZ-O 2.97Å; K243-G245 PolarHBondContact O-N 2.71Å
246	N	36.8	Very low	52.5	Low	158 Å²	158	118.2 Å²	118.2	85%	0.845	68%	0.678	S	S	*	*			trans	-41.2	148.7	-170.6	-117.2	16.6	0	0	0	115.9	K243	K243-N246 PolarHBondContact NZ-O 2.6Å
247	S	47.7	Very low	50.1	Low	118 Å²	118	113.5 Å²	113.5	83%	0.825	68%	0.677	S	S	*	*			trans	-100.9	114.1	160.7	52.5	0	0	0	0	109.4
248	G	33.7	Very low	47.9	Very low	64 Å²	64	117.1 Å²	117.1	66%	0.66	70%	0.699	S	S	*	*			trans	-143.6	147.1	167.7	0	0	0	0	0	108.8
249	P	47.1	Very low	45.7	Very low	135 Å²	135	124 Å²	124	88%	0.877	73%	0.729	S	S	*	*			trans	-72	166.8	178.8	31.6	-35.3	0	0	0	111.8
250	A	41.3	Very low	43.4	Very low	104 Å²	104	126.8 Å²	126.8	86%	0.86	76%	0.759	S	S	*	*			trans	-82	147.9	-170.5	0	0	0	0	0	114.3
251	C	29.8	Very low	41.6	Very low	128 Å²	128	136.8 Å²	136.8	87%	0.865	79%	0.793	S	S	*	*			trans	-143.6	148.3	145.2	52	0	0	0	0	107.9
252	M	44.7	Very low	39.7	Very low	185 Å²	185	138.3 Å²	138.3	91%	0.911	80%	0.8	S	S	*	*			trans	-109.6	133.9	172.5	-66.4	-166	74.4	0	0	109.2
253	D	29.4	Very low	38.5	Very low	164 Å²	164	142.4 Å²	142.4	88%	0.877	81%	0.809	S	S	*	*			trans	-159.8	147.1	150.7	-118.4	-29.9	0	0	0	109.9
254	P	45.8	Very low	37.6	Very low	123 Å²	123	140.9 Å²	140.9	80%	0.799	81%	0.812	S	S	*	*			trans	-100.6	112.6	-178.9	34.6	-26.5	0	0	0	111.7
255	G	31.8	Very low	37.3	Very low	65 Å²	65	136.7 Å²	136.7	67%	0.67	81%	0.805	S	S	*	*			trans	-164.1	118.6	-179.5	0	0	0	0	0	117.3
256	S	29.8	Very low	36.7	Very low	129 Å²	129	141.3 Å²	141.3	90%	0.902	82%	0.82	S	S	*	*			trans	68.3	146.3	160.5	75.2	0	0	0	0	119.4
257	S	38.7	Very low	36.4	Very low	113 Å²	113	138.6 Å²	138.6	79%	0.79	81%	0.811	S	S	*	*			trans	-94.8	143.5	-177.8	-49.7	0	0	0	0	111.8
258	L	38	Very low	35.6	Very low	166 Å²	166	139 Å²	139	87%	0.869	81%	0.808	S	S	*	*			trans	175.9	106.9	134.8	-98.2	160.3	0	0	0	111.2
259	H	38.5	Very low	35.6	Very low	181 Å²	181	144.2 Å²	144.2	84%	0.838	82%	0.815	S	S	*	*			trans	-131.5	143.4	154.6	-83.8	33.9	0	0	0	106.3
260	G	32.8	Very low	34.8	Very low	62 Å²	62	147.8 Å²	147.8	64%	0.639	81%	0.812	S	S	*	*			cis	111.8	96.4	19.5	0	0	0	0	0	108.1	Q262	G260-Q262 PolarHBondContact O-N 2.82Å
261	R	41.4	Very low	34.8	Very low	266 Å²	266	148.7 Å²	148.7	100%	1.004	81%	0.809	S	S	*	*			trans	-50	109	-169.8	-88.5	177.8	161.9	168.3	-5.6	112.6
262	Q	32	Very low	34.8	Very low	170 Å²	170	145.8 Å²	145.8	79%	0.794	80%	0.802	S	S	*	*			trans	-108.2	122.1	168.5	-163.3	156.5	3.4	0	0	110	G260 V264	G260-Q262 PolarHBondContact O-N 2.82Å; Q262-V264 PolarHBondContact O-N 2.92Å
263	R	31.6	Very low	34.3	Very low	242 Å²	242	148.3 Å²	148.3	91%	0.913	80%	0.801	S	S	*	*			trans	-72.3	112.5	177.8	-80.5	178.1	161	129.3	-8.8	109.7
264	V	30.9	Very low	34.3	Very low	120 Å²	120	146.5 Å²	146.5	73%	0.727	80%	0.795	S	S	*	*			trans	-82.8	123.2	167.5	-179.6	0	0	0	0	108.6	Q262 L266	Q262-V264 PolarHBondContact O-N 2.92Å; V264-L266 HydrophobicContact CG1-CD1 3.93Å
265	V	37.2	Very low	33.7	Very low	138 Å²	138	149.1 Å²	149.1	84%	0.836	80%	0.797	S	S	*	*			trans	-92.9	107	166.1	178	0	0	0	0	107
266	L	31.3	Very low	33.7	Very low	136 Å²	136	156.1 Å²	156.1	71%	0.712	80%	0.803	S	S	*	*			trans	-80.8	132.1	178.9	-139.9	75.5	0	0	0	110	V264 V268	V264-L266 HydrophobicContact CG1-CD1 3.93Å; L266-V268 PolarHBondContact O-N 3.11Å
267	P	30.2	Very low	33.9	Very low	101 Å²	101	154.3 Å²	154.3	66%	0.656	80%	0.795	S	S	*	*			trans	-65.7	125.4	173.7	-20.7	33.2	0	0	0	111.4	H269	P267-H269 PolarHBondContact O-N 3.44Å
268	V	32.1	Very low	33.9	Very low	128 Å²	128	154.2 Å²	154.2	78%	0.776	80%	0.795	S	S	*	*			trans	-73.9	106.6	172.2	179.1	0	0	0	0	108.8	L266 Y270	L266-V268 PolarHBondContact O-N 3.11Å; V268-Y270 PolarHBondContact O-N 3.15Å
269	H	33.1	Very low	34.2	Very low	172 Å²	172	155.7 Å²	155.7	80%	0.796	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-72.7	118.4	170.6	-90.5	-99.8	0	0	0	110.3	P267	P267-H269 PolarHBondContact O-N 3.44Å
270	Y	30.3	Very low	34.2	Very low	210 Å²	210	151.8 Å²	151.8	82%	0.824	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-72.9	125.5	165.6	-78.7	-95.4	0	0	0	109.5	V268	V268-Y270 PolarHBondContact O-N 3.15Å
271	P	40.3	Very low	34.5	Very low	123 Å²	123	153.6 Å²	153.6	80%	0.799	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-67.8	141	171	28.1	-33.2	0	0	0	110.5
272	G	29.8	Very low	34.6	Very low	68 Å²	68	143 Å²	143	70%	0.701	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-66.3	148.2	-179	0	0	0	0	0	113.1	V274	G272-V274 PolarHBondContact O-N 2.99Å
273	R	34.8	Very low	34.7	Very low	238 Å²	238	142.4 Å²	142.4	90%	0.898	75%	0.746	S	S	*	*			trans	-70.3	97.6	176.5	-178.3	-172.4	-72.6	-173.1	-4.8	110.5
274	V	30.8	Very low	35.2	Very low	125 Å²	125	135.3 Å²	135.3	76%	0.758	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-73	137.7	162.7	-178.2	0	0	0	0	108.8	G272 R276	G272-V274 PolarHBondContact O-N 2.99Å; V274-R276 PolarHBondContact O-N 3.01Å
275	H	31.2	Very low	36.2	Very low	178 Å²	178	134.5 Å²	134.5	82%	0.824	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-68.8	121.1	172.1	-77.6	-115.8	0	0	0	109.6
276	R	33.8	Very low	36.6	Very low	213 Å²	213	137.2 Å²	137.2	80%	0.804	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-95.5	131.9	170.4	-97.4	-167.1	173	105	-0.9	110.6	V274	V274-R276 PolarHBondContact O-N 3.01Å
277	A	33.8	Very low	37.5	Very low	90 Å²	90	135.3 Å²	135.3	74%	0.744	72%	0.716	S	S	*	*	S	Bend	trans	-79.2	155	140.6	0	0	0	0	0	109
278	S	37	Very low	38.5	Very low	112 Å²	112	133.3 Å²	133.3	78%	0.783	70%	0.704	S	S	*	*	S	Bend	trans	65.9	136.8	177.8	-55.8	0	0	0	0	117.1
279	Q	44.4	Very low	39.7	Very low	197 Å²	197	133.3 Å²	133.3	92%	0.921	70%	0.697	S	S	*	*			trans	-87.3	117.8	-175.2	-66.2	165.1	-39.9	0	0	111.7
280	V	39.8	Very low	40.8	Very low	98 Å²	98	127 Å²	127	59%	0.594	67%	0.67	S	S	*	*			trans	-145.1	121.5	150.4	-176.5	0	0	0	0	107.7	V301	V280-V301 HydrophobicContact CG1-CG1 4.3Å
281	T	38.7	Very low	41.6	Very low	101 Å²	101	123.3 Å²	123.3	62%	0.62	67%	0.671	S	S	*	*			trans	-97.6	119.8	170.7	47.5	0	0	0	0	109.9
282	A	42.5	Very low	42.3	Very low	44 Å²	44	125.2 Å²	125.2	36%	0.364	67%	0.669	S	S	.	*			trans	-128.4	141.3	172.9	0	0	0	0	0	109.4	V301	A282-V301 HydrophobicContact CB-CG2 4.3Å
283	Y	36	Very low	43.3	Very low	156 Å²	156	124.1 Å²	124.1	61%	0.612	66%	0.658	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-120.7	135.8	-174.5	-51	-75.4	0	0	0	110.1	T285	Y283-T285 PolarHBondContact O-N 3.27Å
284	P	41	Very low	44.4	Very low	94 Å²	94	117.1 Å²	117.1	61%	0.61	64%	0.638	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.5	102.8	-179.5	30.7	-33.3	0	0	0	111	T297 L299	P284-T297 HydrophobicContact CB-CG2 4.08Å; P284-L299 HydrophobicContact CB-CD2 4.1Å
285	T	51.1	Low	45.3	Very low	102 Å²	102	115.6 Å²	115.6	63%	0.626	63%	0.631	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.9	-23.6	-174.6	18.7	0	0	0	0	114.4	Y283 T300	Y283-T285 PolarHBondContact O-N 3.27Å; T285-T300 PolarHBondContact OG1-OG1 3.25Å
286	R	46	Very low	46.2	Very low	196 Å²	196	111.2 Å²	111.2	74%	0.74	61%	0.613	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-158.7	143.8	175.4	-158.1	169.8	179.9	176.7	-0.6	113.9	V298	R286-V298 PolarHBondContact O-N 2.95Å; R286-V298 VanDerWaalsContact O-N 3.12Å
287	T	51	Low	46.9	Very low	96 Å²	96	105 Å²	105	59%	0.589	60%	0.598	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.6	138	162.4	52.8	0	0	0	0	110.4	I296 T297	T287-I296 WeakPolarHBondContact CA-O 3.46Å; T287-T297 HydrophobicContact CG2-CG2 4.25Å
288	S	51.1	Low	47.4	Very low	59 Å²	59	104.4 Å²	104.4	41%	0.413	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.3	156.6	170.5	55.5	0	0	0	0	110.3	I296	S288-I296 PolarHBondContact N-O 3.28Å; S288-I296 PolarHBondContact O-N 3.07Å
289	M	57.3	Low	47.5	Very low	127 Å²	127	104.3 Å²	104.3	63%	0.626	58%	0.575	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.8	148.5	169.2	-62	-53.6	-155.4	0	0	110.9	N294 P295	M289-N294 CarbonylContact C-O 3.58Å; M289-N294 WeakPolarHBondContact CA-O 3.27Å; M289-N294 VanDerWaalsContact SD-C 3.58Å; M289-P295 HydrophobicContact CE-CB 4.45Å; M289-P295 VanDerWaalsContact SD-CA 3.52Å; M289-P295 HydrophobicContact SD-CB 3.79Å
290	D	57	Low	47.6	Very low	41 Å²	41	98.8 Å²	98.8	22%	0.219	56%	0.556	C	S	.	*			trans	-74.5	172.2	160.4	76.8	4.8	0	0	0	111.2	H292 G293 N294 I296	D290-H292 PolarHBondContact O-N 3.48Å; D290-H292 VanDerWaalsContact OD1-C 3.24Å; D290-H292 VanDerWaalsContact OD1-CA 3.31Å; D290-H292 WeakPolarHBondContact OD1-CA 3.42Å; D290-H292 PolarHBondContact OD1-N 3.16Å; D290-G293 PolarHBondContact O-N 2.87Å; D290-G293 PolarHBondContact OD1-N 2.87Å; D290-N294 PolarHBondContact N-O 3.37Å; D290-N294 PolarHBondContact OD1-N 2.83Å; D290-N294 PolarHBondContact OD1-ND2 3.03Å; D290-N294 WeakPolarHBondContact OD2-CB 3.29Å; D290-N294 PolarHBondContact OD2-ND2 2.93Å; D290-I296 HydrophobicContact CB-CD1 3.9Å; D290-I296 HydrophobicContact CB-CG1 4.47Å
291	P	46	Very low	47.7	Very low	131 Å²	131	98.3 Å²	98.3	85%	0.851	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-7.2	176.9	-24	36	0	0	0	115.5
292	H	54.2	Low	47.6	Very low	163 Å²	163	100.3 Å²	100.3	76%	0.755	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	-1.4	-179.9	-59.7	-64.4	0	0	0	112.9	D290	D290-H292 PolarHBondContact O-N 3.48Å; D290-H292 VanDerWaalsContact OD1-C 3.24Å; D290-H292 VanDerWaalsContact OD1-CA 3.31Å; D290-H292 WeakPolarHBondContact OD1-CA 3.42Å; D290-H292 PolarHBondContact OD1-N 3.16Å
293	G	51.6	Low	47.4	Very low	45 Å²	45	107.1 Å²	107.1	46%	0.464	58%	0.584	S	S	.	*	S	Bend	trans	97.5	8.8	174.3	0	0	0	0	0	115.8	D290	D290-G293 PolarHBondContact O-N 2.87Å; D290-G293 PolarHBondContact OD1-N 2.87Å
294	N	58.6	Low	47.3	Very low	91 Å²	91	107.6 Å²	107.6	49%	0.487	59%	0.591	S	S	.	*			trans	-88.1	135.4	-179.3	-52.2	-68.1	0	0	0	111.8	M289 D290 I296	M289-N294 CarbonylContact C-O 3.58Å; M289-N294 WeakPolarHBondContact CA-O 3.27Å; M289-N294 VanDerWaalsContact SD-C 3.58Å; D290-N294 PolarHBondContact N-O 3.37Å; D290-N294 PolarHBondContact OD1-N 2.83Å; D290-N294 PolarHBondContact OD1-ND2 3.03Å; D290-N294 WeakPolarHBondContact OD2-CB 3.29Å; D290-N294 PolarHBondContact OD2-ND2 2.93Å; N294-I296 PolarHBondContact O-N 3.47Å
295	P	49.3	Very low	47.1	Very low	93 Å²	93	108 Å²	108	60%	0.604	60%	0.596	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78	110.9	180	29.9	-33.6	0	0	0	112.2	M289	M289-P295 HydrophobicContact CE-CB 4.45Å; M289-P295 VanDerWaalsContact SD-CA 3.52Å; M289-P295 HydrophobicContact SD-CB 3.79Å
296	I	49.8	Very low	46.2	Very low	86 Å²	86	109.8 Å²	109.8	44%	0.441	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.4	133.6	170.6	-61.7	-180	0	0	0	109.1	T287 S288 D290 N294 V298	T287-I296 WeakPolarHBondContact CA-O 3.46Å; S288-I296 PolarHBondContact N-O 3.28Å; S288-I296 PolarHBondContact O-N 3.07Å; D290-I296 HydrophobicContact CB-CD1 3.9Å; D290-I296 HydrophobicContact CB-CG1 4.47Å; N294-I296 PolarHBondContact O-N 3.47Å; I296-V298 HydrophobicContact CG2-CG2 4.46Å
297	T	48.3	Very low	45.9	Very low	82 Å²	82	105.7 Å²	105.7	50%	0.503	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.3	122.6	173.3	-44.6	0	0	0	0	108.7	P284 T287	P284-T297 HydrophobicContact CB-CG2 4.08Å; T287-T297 HydrophobicContact CG2-CG2 4.25Å
298	V	45.4	Very low	45.1	Very low	78 Å²	78	110.9 Å²	110.9	47%	0.473	62%	0.618	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.3	130.2	176.5	-176.5	0	0	0	0	109	R286 I296	R286-V298 PolarHBondContact O-N 2.95Å; R286-V298 VanDerWaalsContact O-N 3.12Å; I296-V298 HydrophobicContact CG2-CG2 4.46Å
299	L	37.9	Very low	44	Very low	110 Å²	110	111.5 Å²	111.5	58%	0.576	63%	0.634	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.6	116.7	176.8	-66.9	172	0	0	0	109.1	P284	P284-L299 HydrophobicContact CB-CD2 4.1Å
300	T	46.9	Very low	42.9	Very low	82 Å²	82	113.9 Å²	113.9	50%	0.503	65%	0.648	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.9	144.2	166.2	-23.5	0	0	0	0	109.4	T285	T285-T300 PolarHBondContact OG1-OG1 3.25Å
301	V	41.6	Very low	41.7	Very low	87 Å²	87	122.3 Å²	122.3	53%	0.527	68%	0.678	S	S	.	*			trans	-118.4	112.9	172.4	-179.9	0	0	0	0	107.5	V280 A282	V280-V301 HydrophobicContact CG1-CG1 4.3Å; A282-V301 HydrophobicContact CB-CG2 4.3Å
302	D	36.8	Very low	41.8	Very low	144 Å²	144	120.8 Å²	120.8	77%	0.77	67%	0.669	S	S	*	*			trans	-79.8	127.5	169.2	-84.7	-58.7	0	0	0	109.8
303	Q	38.4	Very low	40.8	Very low	187 Å²	187	119.2 Å²	119.2	87%	0.874	67%	0.673	S	S	*	*			trans	-94.1	96.8	163.7	-74.7	-173.1	-14.4	0	0	108.2	S305	Q303-S305 PolarHBondContact O-N 2.89Å
304	H	34.2	Very low	39.8	Very low	166 Å²	166	125.9 Å²	125.9	77%	0.769	69%	0.692	S	S	*	*			trans	-76.1	107.3	173.3	-148.2	-90.4	0	0	0	109.2	D306	H304-D306 IonicContact CE1-OD1 3.62Å; H304-D306 IonicContact ND1-OD1 2.68Å; H304-D306 PolarHBondContact ND1-OD1 3.06Å
305	S	37.5	Very low	38.4	Very low	102 Å²	102	126.6 Å²	126.6	71%	0.713	70%	0.704	S	S	*	*			trans	-93.6	106.8	173.4	58.1	0	0	0	0	109.6	Q303 P307	Q303-S305 PolarHBondContact O-N 2.89Å; S305-P307 WeakPolarHBondContact O-CD 3.27Å
306	D	31.1	Very low	37.4	Very low	139 Å²	139	129.3 Å²	129.3	74%	0.743	72%	0.719	S	S	*	*			trans	-73.1	128.3	178.2	-70.9	-20.1	0	0	0	111.2	H304	H304-D306 IonicContact CE1-OD1 3.62Å; H304-D306 IonicContact ND1-OD1 2.68Å; H304-D306 PolarHBondContact ND1-OD1 3.06Å
307	P	40.6	Very low	36.4	Very low	111 Å²	111	130.7 Å²	130.7	72%	0.721	74%	0.736	S	S	*	*			trans	-107.5	118.8	-176.1	35.8	-27.7	0	0	0	113	S305	S305-P307 WeakPolarHBondContact O-CD 3.27Å
308	Q	33.2	Very low	35.4	Very low	205 Å²	205	131.7 Å²	131.7	96%	0.958	75%	0.753	S	S	*	*			trans	-171.1	109.7	133.1	-105.6	163.8	22.1	0	0	112.8
309	G	28.7	Very low	34.5	Very low	71 Å²	71	137 Å²	137	73%	0.732	77%	0.77	S	S	*	*			trans	-163.1	134.8	168.8	0	0	0	0	0	107.4
310	L	33.1	Very low	33.9	Very low	177 Å²	177	138.2 Å²	138.2	93%	0.927	78%	0.776	S	S	*	*			trans	-92	146	-161.9	-68.4	167.1	0	0	0	114.2
311	Y	33.6	Very low	32.8	Very low	218 Å²	218	144.5 Å²	144.5	86%	0.855	79%	0.791	S	S	*	*			trans	-58.2	174.9	-179.5	-84.3	-79.4	0	0	0	116.8
312	P	46.8	Very low	32	Very low	100 Å²	100	145.5 Å²	145.5	65%	0.649	80%	0.801	S	S	*	*			cis	-128	-174.7	-12	40.6	-23.7	0	0	0	113.1
313	P	34	Very low	31.4	Very low	129 Å²	129	149.4 Å²	149.4	84%	0.838	81%	0.807	S	S	*	*				-132.5	175.6	84	37.6	-25.3	0	0	0	114.4
314	Q	29.7	Very low	30.9	Very low	185 Å²	185	148.9 Å²	148.9	86%	0.864	80%	0.804	S	S	*	*			trans	-84.1	145.1	-155.9	-68.4	163.9	-19.4	0	0	116.5
315	S	30.1	Very low	31	Very low	107 Å²	107	146.7 Å²	146.7	75%	0.748	81%	0.805	S	S	*	*			trans	-41.5	152.2	162.6	54.2	0	0	0	0	117.7
316	T	27.4	Very low	30.5	Very low	150 Å²	150	146.4 Å²	146.4	92%	0.92	81%	0.808	S	S	*	*				-146.6	156.2	127.7	10.2	0	0	0	0	109.9
317	S	29.4	Very low	30.5	Very low	114 Å²	114	148.1 Å²	148.1	80%	0.797	82%	0.817	S	S	*	*			trans	-122.1	148.2	-163.7	52.2	0	0	0	0	113.9
318	A	26.9	Very low	29.7	Very low	103 Å²	103	151.4 Å²	151.4	85%	0.851	82%	0.822	S	S	*	*			trans	-147	153.9	167.5	0	0	0	0	0	111.2
319	F	26.2	Very low	29.4	Very low	191 Å²	191	148.5 Å²	148.5	84%	0.838	81%	0.812	S	S	*	*			trans	-100.8	164.7	-160	-97	-97.7	0	0	0	115.3
320	L	25.3	Very low	29.2	Very low	135 Å²	135	152.3 Å²	152.3	71%	0.707	81%	0.811	S	S	*	*			trans	87.8	123.2	141.2	-82.3	163.2	0	0	0	123.4
321	R	24.7	Very low	28.9	Very low	214 Å²	214	151.3 Å²	151.3	81%	0.808	80%	0.801	S	S	*	*			trans	51.7	118.2	138	-84.7	-178.7	-177	151.7	0.7	121.8
322	S	24.4	Very low	28.6	Very low	107 Å²	107	146 Å²	146	75%	0.748	80%	0.796	S	S	*	*			trans	-66.8	153.5	153.1	54	0	0	0	0	114.5
323	Y	25	Very low	27.7	Very low	227 Å²	227	148.6 Å²	148.6	89%	0.89	80%	0.804	S	S	*	*			trans	-144.5	152.6	149.6	-111	-83.3	0	0	0	111.9
324	H	27.5	Very low	27.5	Very low	176 Å²	176	149.8 Å²	149.8	82%	0.815	80%	0.803	S	S	*	*			trans	-75.8	164.7	177.4	-90.1	-70.3	0	0	0	112.1
325	P	36.5	Very low	27.6	Very low	120 Å²	120	145.8 Å²	145.8	78%	0.779	79%	0.793	S	S	*	*				-154.5	157.2	78.3	41.2	-20.3	0	0	0	120.5
326	A	26.2	Very low	27.5	Very low	95 Å²	95	150.1 Å²	150.1	79%	0.785	80%	0.801	S	S	*	*			trans	55.2	136.6	136.5	0	0	0	0	0	123.6
327	L	30.2	Very low	27.5	Very low	176 Å²	176	151.9 Å²	151.9	92%	0.921	80%	0.798	S	S	*	*			trans	-90	152.3	150	-71.3	167.5	0	0	0	109.7
328	H	25.4	Very low	27.4	Very low	180 Å²	180	152 Å²	152	83%	0.833	80%	0.798	S	S	*	*			trans	-132.7	146.1	160.3	-162.1	-85.8	0	0	0	109.9
329	L	27	Very low	27.2	Very low	143 Å²	143	156.9 Å²	156.9	75%	0.749	79%	0.794	S	S	*	*			trans	-94.6	149.6	-179.4	-170.7	75.3	0	0	0	109.8
330	E	24.2	Very low	27.5	Very low	152 Å²	152	154.8 Å²	154.8	71%	0.71	79%	0.791	S	S	*	*			trans	-170.1	160.6	145.3	-107.5	-67.3	70.3	0	0	112.5
331	H	26.4	Very low	27.6	Very low	155 Å²	155	155.5 Å²	155.5	72%	0.718	79%	0.791	S	S	*	*			trans	-63.5	153.2	-174	-65	79.2	0	0	0	114.2
332	S	26.3	Very low	27.9	Very low	106 Å²	106	153.7 Å²	153.7	74%	0.741	79%	0.791	S	S	*	*				175.9	152.2	77.6	44.5	0	0	0	0	116
333	L	29.3	Very low	28.1	Very low	156 Å²	156	160.5 Å²	160.5	82%	0.817	80%	0.801	S	S	*	*			trans	56.4	96.5	144.6	-65	169.7	0	0	0	122.7
334	N	28.9	Very low	28.2	Very low	153 Å²	153	152.9 Å²	152.9	82%	0.818	79%	0.791	S	S	*	*				72	174.4	122.5	-113.1	0.3	0	0	0	119.1
335	P	32.5	Very low	29	Very low	102 Å²	102	150.4 Å²	150.4	66%	0.662	79%	0.79	S	S	*	*				-103.8	167.1	-122.6	41.1	-39	0	0	0	115.9	H337	P335-H337 PolarHBondContact O-N 2.58Å; P335-H337 VanDerWaalsContact O-N 3.16Å
336	H	27.3	Very low	29.2	Very low	198 Å²	198	150.7 Å²	150.7	92%	0.917	79%	0.792	S	S	*	*			trans	-57.3	113.2	172.8	-68.8	-87.6	0	0	0	112.7
337	H	27.2	Very low	29.5	Very low	186 Å²	186	150.5 Å²	150.5	86%	0.861	79%	0.79	S	S	*	*			trans	-81.1	119.2	158	-113.5	-74.2	0	0	0	109.5	P335	P335-H337 PolarHBondContact O-N 2.58Å; P335-H337 VanDerWaalsContact O-N 3.16Å
338	C	27.3	Very low	29.5	Very low	117 Å²	117	152.7 Å²	152.7	79%	0.791	79%	0.788	S	S	*	*			trans	-72.6	127.7	167.1	-178.5	0	0	0	0	109.5
339	R	24.5	Very low	29.9	Very low	205 Å²	205	149.1 Å²	149.1	77%	0.774	78%	0.784	S	S	*	*			trans	-151	120.9	152.3	-154.6	170.2	175.6	153.5	-0.4	113	E341	R339-E341 IonicContact CZ-OE1 3.49Å; R339-E341 IonicContact NE-OE1 3.81Å; R339-E341 PolarHBondContact NE-OE1 3Å; R339-E341 VanDerWaalsContact NE-OE1 3.07Å; R339-E341 IonicContact NH2-OE1 2.64Å; R339-E341 PolarHBondContact NH2-OE1 2.92Å
340	L	32.3	Very low	30.2	Very low	148 Å²	148	146.5 Å²	146.5	78%	0.775	78%	0.782	S	S	*	*			trans	-72.7	132.8	162.5	-166.4	84.7	0	0	0	108.9
341	E	26.8	Very low	30.6	Very low	150 Å²	150	146.2 Å²	146.2	70%	0.701	78%	0.781	S	S	*	*			trans	-165.2	156.1	153.3	-113.7	160.9	-120.3	0	0	112.4	R339	R339-E341 IonicContact CZ-OE1 3.49Å; R339-E341 IonicContact NE-OE1 3.81Å; R339-E341 PolarHBondContact NE-OE1 3Å; R339-E341 VanDerWaalsContact NE-OE1 3.07Å; R339-E341 IonicContact NH2-OE1 2.64Å; R339-E341 PolarHBondContact NH2-OE1 2.92Å
342	H	30.3	Very low	31	Very low	175 Å²	175	146.3 Å²	146.3	81%	0.81	78%	0.782	S	S	*	*			trans	-94	147.6	-169.1	-58.1	-105.6	0	0	0	113.1
343	R	28.2	Very low	31.4	Very low	251 Å²	251	146.7 Å²	146.7	95%	0.947	77%	0.772	S	S	*	*			trans	-152.3	144.3	143.6	-132.1	175.1	-179.3	99.1	-1.5	113.2
344	G	27.8	Very low	31.5	Very low	66 Å²	66	147 Å²	147	68%	0.68	77%	0.769	S	S	*	*			trans	-87.6	-178.7	177	0	0	0	0	0	114
345	P	43.8	Very low	31.8	Very low	124 Å²	124	145 Å²	145	81%	0.805	76%	0.762	S	S	*	*			trans	-89.7	160.1	-167.6	36.1	-37.3	0	0	0	114.4
346	P	42.3	Very low	32	Very low	127 Å²	127	144 Å²	144	83%	0.825	76%	0.762	S	S	*	*			trans	-88	154.1	153.8	35.6	-30.1	0	0	0	111.5
347	A	32.5	Very low	32.2	Very low	90 Å²	90	143.3 Å²	143.3	74%	0.744	76%	0.757	S	S	*	*			trans	-105.8	-175.8	171.6	0	0	0	0	0	110.8
348	Y	29.6	Very low	32.3	Very low	222 Å²	222	143.8 Å²	143.8	87%	0.871	76%	0.757	S	S	*	*				-176.7	127.2	125.2	-116.5	-104.4	0	0	0	112.7
349	S	33.8	Very low	32.5	Very low	106 Å²	106	149.5 Å²	149.5	74%	0.741	76%	0.761	S	S	*	*			trans	51.2	151.9	136.9	68.7	0	0	0	0	122.6
350	A	32.4	Very low	33.3	Very low	87 Å²	87	145.3 Å²	145.3	72%	0.719	76%	0.761	S	S	*	*			cis	-139.5	137.8	12.5	0	0	0	0	0	109.7
351	Q	33	Very low	33.2	Very low	147 Å²	147	146 Å²	146	69%	0.687	76%	0.758	S	S	*	*				61.8	120.6	71.1	-157.2	63.1	-117.9	0	0	110.2	H353	Q351-H353 PolarHBondContact OE1-CE1 3.24Å; Q351-H353 PolarHBondContact OE1-ND1 2.76Å
352	Q	35.4	Very low	33.5	Very low	157 Å²	157	146.2 Å²	146.2	73%	0.734	76%	0.756	S	S	*	*				-123.3	-112.2	53.7	-71.4	-172.5	-103.6	0	0	117.4
353	H	33.7	Very low	33.4	Very low	114 Å²	114	145.4 Å²	145.4	53%	0.528	75%	0.753	S	S	.	*			trans	-132.7	-160.7	-150.3	-33.8	-48.4	0	0	0	111.6	Q351	Q351-H353 PolarHBondContact OE1-CE1 3.24Å; Q351-H353 PolarHBondContact OE1-ND1 2.76Å
354	H	33.1	Very low	33.4	Very low	162 Å²	162	136 Å²	136	75%	0.75	73%	0.733	S	S	*	*			cis	-129	-154.8	25.1	-106.4	-65.4	0	0	0	115.6
355	T	34	Very low	33.7	Very low	112 Å²	112	145.2 Å²	145.2	69%	0.687	75%	0.748	S	S	*	*			trans	-151.1	151.7	-132.7	42.7	0	0	0	0	116.5
356	A	36.1	Very low	33	Very low	80 Å²	80	144.5 Å²	144.5	66%	0.661	75%	0.746	S	S	*	*			trans	81.4	143.2	158.9	0	0	0	0	0	117.8
357	F	31.5	Very low	32.4	Very low	184 Å²	184	148.9 Å²	148.9	81%	0.807	75%	0.752	S	S	*	*			cis	-145.6	152	16.1	-100.2	-65.2	0	0	0	115.8
358	K	31	Very low	32.4	Very low	196 Å²	196	150.1 Å²	150.1	85%	0.852	76%	0.756	S	S	*	*			trans	74.3	150.5	150.3	-70.4	176.6	-178.8	178.5	0	122.2
359	R	30	Very low	32.3	Very low	236 Å²	236	151.2 Å²	151.2	89%	0.891	76%	0.758	S	S	*	*			trans	-156.8	158.6	179.3	-99	-173.2	178.3	172.3	0	109.1
360	P	41.5	Very low	32	Very low	117 Å²	117	150.5 Å²	150.5	76%	0.76	76%	0.759	S	S	*	*				-132.2	149.7	109.9	27.4	-10.5	0	0	0	111.3
361	K	30.7	Very low	31.8	Very low	163 Å²	163	150.7 Å²	150.7	71%	0.709	76%	0.76	S	S	*	*				53	130	69.7	-68.6	-169.1	174.6	-177	0	112.9
362	F	32.7	Very low	31.5	Very low	154 Å²	154	150.2 Å²	150.2	68%	0.675	77%	0.771	S	S	*	*			cis	-163.7	172.4	-8.8	-102	-25.9	0	0	0	106.8
363	H	29.3	Very low	31.1	Very low	158 Å²	158	152.2 Å²	152.2	73%	0.731	78%	0.778	S	S	*	*			cis	-149.8	-173	9.4	-119.2	-32.8	0	0	0	108
364	G	27.6	Very low	30.8	Very low	53 Å²	53	152.2 Å²	152.2	55%	0.546	79%	0.791	S	S	.	*			cis	176.1	-175.5	0.7	0	0	0	0	0	112
365	R	33.6	Very low	30.6	Very low	260 Å²	260	153.1 Å²	153.1	98%	0.981	80%	0.795	S	S	*	*			trans	69.3	150.9	-166	-57.9	-172.3	177.8	-165.8	-1.3	114
366	S	29.4	Very low	30.4	Very low	110 Å²	110	159.2 Å²	159.2	77%	0.769	81%	0.808	S	S	*	*			trans	-142.7	133.6	-152.2	51.2	0	0	0	0	113.2
367	F	29.8	Very low	30	Very low	218 Å²	218	164.6 Å²	164.6	96%	0.956	82%	0.819	S	S	*	*			trans	-128.3	144.7	168.8	-78.5	-83	0	0	0	110.4
368	S	31.7	Very low	29.9	Very low	116 Å²	116	162.6 Å²	162.6	81%	0.811	82%	0.822	S	S	*	*			trans	-107.9	128.1	-179.2	49.6	0	0	0	0	112.2
369	R	28.6	Very low	29.7	Very low	246 Å²	246	159.9 Å²	159.9	93%	0.928	81%	0.814	S	S	*	*			trans	-62.2	160.5	156.3	-71.7	171.6	78.7	142.9	0.6	109.6
370	A	27.9	Very low	29.6	Very low	91 Å²	91	159.5 Å²	159.5	75%	0.752	81%	0.814	S	S	*	*			cis	-172.9	164.3	-21.9	0	0	0	0	0	107.2
371	A	26.9	Very low	28.9	Very low	91 Å²	91	159.2 Å²	159.2	75%	0.752	80%	0.803	S	S	*	*			trans	-144.9	147.5	163.8	0	0	0	0	0	110
372	C	26.3	Very low	28.7	Very low	136 Å²	136	160.1 Å²	160.1	92%	0.919	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-81.1	141.1	179.5	-56.7	0	0	0	0	110.7
373	F	27.6	Very low	28.4	Very low	200 Å²	200	161.8 Å²	161.8	88%	0.877	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-102.3	138.5	167.2	-97.4	-93.9	0	0	0	110.6
374	S	28	Very low	28.2	Very low	114 Å²	114	164.9 Å²	164.9	80%	0.797	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-76.6	129.7	168.5	50	0	0	0	0	110.3	Y376	S374-Y376 PolarHBondContact O-N 2.9Å
375	Q	29.4	Very low	28.1	Very low	180 Å²	180	171.6 Å²	171.6	84%	0.841	83%	0.834	S	S	*	*			trans	-83.5	110.7	174.2	-62.5	174.1	-65.1	0	0	110.2
376	Y	28.8	Very low	27.8	Very low	240 Å²	240	167.2 Å²	167.2	94%	0.941	82%	0.824	S	S	*	*			trans	-167.7	87.1	148.2	-86	-55	0	0	0	110	S374	S374-Y376 PolarHBondContact O-N 2.9Å
377	E	27.4	Very low	27.7	Very low	194 Å²	194	165.2 Å²	165.2	91%	0.907	82%	0.821	S	S	*	*			trans	-145.2	146.3	160.3	-159	158.7	-139.8	0	0	109.7
378	T	30.7	Very low	27.6	Very low	141 Å²	141	163.4 Å²	163.4	87%	0.865	82%	0.82	S	S	*	*			trans	-100.9	130.1	-164.6	44.9	0	0	0	0	111.9
379	M	26.9	Very low	27.5	Very low	140 Å²	140	163.2 Å²	163.2	69%	0.69	82%	0.819	S	S	*	*			trans	-119.2	100.2	179.2	-165.2	173.2	69.3	0	0	111.8	Q381	M379-Q381 HydrophobicContact CE-CB 4.49Å; M379-Q381 VanDerWaalsContact CE-OE1 3.23Å; M379-Q381 HydrophobicContact CG-CB 4.35Å; M379-Q381 HydrophobicContact CG-CG 4.44Å; M379-Q381 HydrophobicContact SD-CG 4.46Å
380	Y	27	Very low	27.5	Very low	228 Å²	228	161.1 Å²	161.1	89%	0.894	82%	0.817	S	S	*	*			trans	-68.3	131	152.6	-105	-100.8	0	0	0	108
381	Q	27.5	Very low	27.8	Very low	110 Å²	110	162.7 Å²	162.7	51%	0.514	82%	0.82	S	S	.	*			trans	-144.8	120.8	171	-128.9	175.8	17	0	0	112	M379 Y383	M379-Q381 HydrophobicContact CE-CB 4.49Å; M379-Q381 VanDerWaalsContact CE-OE1 3.23Å; M379-Q381 HydrophobicContact CG-CB 4.35Å; M379-Q381 HydrophobicContact CG-CG 4.44Å; M379-Q381 HydrophobicContact SD-CG 4.46Å; Q381-Y383 HydrophobicContact CB-CE2 4.13Å; Q381-Y383 PolarHBondContact OE1-OH 3.04Å
382	H	24.8	Very low	27.9	Very low	182 Å²	182	167.4 Å²	167.4	84%	0.843	83%	0.826	S	S	*	*			trans	-74.5	139.3	166.3	-72.6	-110.8	0	0	0	109.2
383	Y	27.7	Very low	28.1	Very low	189 Å²	189	170 Å²	170	74%	0.741	83%	0.825	S	S	*	*			trans	-114	117.2	174.6	-86.7	-90.6	0	0	0	111.7	Q381	Q381-Y383 HydrophobicContact CB-CE2 4.13Å; Q381-Y383 PolarHBondContact OE1-OH 3.04Å
384	Y	23.7	Very low	28.6	Very low	224 Å²	224	165.9 Å²	165.9	88%	0.878	82%	0.818	S	S	*	*			trans	-156.6	116.5	154.4	-111.1	-80.5	0	0	0	108
385	F	26.1	Very low	28.6	Very low	193 Å²	193	170 Å²	170	85%	0.846	83%	0.825	S	S	*	*			trans	-167	112	131.9	-117.3	-78.7	0	0	0	112.3
386	Q	28	Very low	28.6	Very low	168 Å²	168	165.1 Å²	165.1	79%	0.785	82%	0.823	S	S	*	*			trans	16.8	119	143	-159.5	171.1	2.8	0	0	120.9
387	G	26.5	Very low	28.6	Very low	68 Å²	68	158 Å²	158	70%	0.701	81%	0.814	S	S	*	*				93	106.9	115.3	0	0	0	0	0	119.8
388	L	28.8	Very low	28.8	Very low	180 Å²	180	158 Å²	158	94%	0.942	81%	0.814	S	S	*	*			trans	-134.1	156	149.8	-77.2	178.6	0	0	0	110.1
389	S	28.1	Very low	28.7	Very low	113 Å²	113	154.6 Å²	154.6	79%	0.79	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-94.4	151.2	-165.3	48.4	0	0	0	0	114.8
390	F	28.9	Very low	29.4	Very low	201 Å²	201	153.7 Å²	153.7	88%	0.882	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-81.1	146.7	166.4	-82.9	-93.4	0	0	0	111.7
391	P	34.8	Very low	29.6	Very low	124 Å²	124	150.6 Å²	150.6	81%	0.805	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-80.9	143.4	174	33.2	-34	0	0	0	111.9
392	Q	29.7	Very low	29.8	Very low	190 Å²	190	150.6 Å²	150.6	89%	0.888	83%	0.828	S	S	*	*			trans	-118.3	126.1	169.3	-176.4	171.7	-2.4	0	0	108.2
393	Q	29.3	Very low	30.1	Very low	191 Å²	191	145.8 Å²	145.8	89%	0.893	83%	0.828	S	S	*	*			trans	-81.3	153.5	173.8	-89.3	-168.6	-82.2	0	0	111.7
394	P	39.2	Very low	30.3	Very low	113 Å²	113	145.5 Å²	145.5	73%	0.734	83%	0.834	S	S	*	*			trans	-103.9	164.9	-157.1	39.6	-36.2	0	0	0	114.7
395	E	27.4	Very low	30.7	Very low	200 Å²	200	143 Å²	143	94%	0.935	84%	0.835	S	S	*	*			trans	-122.9	153.1	151.9	-76	-157.7	126.9	0	0	110.7
396	G	28.7	Very low	30.9	Very low	79 Å²	79	137.7 Å²	137.7	81%	0.814	83%	0.834	S	S	*	*			trans	99.9	96.6	154	0	0	0	0	0	117.8
397	A	30.4	Very low	31	Very low	90 Å²	90	133.7 Å²	133.7	74%	0.744	84%	0.838	S	S	*	*				-177.2	159.6	116.3	0	0	0	0	0	112.8
398	Q	30.7	Very low	31.2	Very low	193 Å²	193	134.2 Å²	134.2	90%	0.902	84%	0.843	S	S	*	*			trans	76.4	111.9	164.6	-49.7	-177.4	20.2	0	0	118.3
399	G	27.9	Very low	31.4	Very low	71 Å²	71	131 Å²	131	73%	0.732	84%	0.843	S	S	*	*			trans	-88	-171.1	151.4	0	0	0	0	0	111.1
400	P	42.8	Very low	31.4	Very low	120 Å²	120	129.4 Å²	129.4	78%	0.779	84%	0.844	S	S	*	*			cis	-144.4	-167.9	45.4	36.4	-14.1	0	0	0	116.2
401	L	29.9	Very low	31.7	Very low	164 Å²	164	123.8 Å²	123.8	86%	0.859	84%	0.835	S	S	*	*			trans	96.3	117.3	158.2	-63.5	162	0	0	0	121.1
402	A	32.6	Very low	31.6	Very low	109 Å²	109	125.7 Å²	125.7	90%	0.901	83%	0.832	S	S	*	*			trans	69.4	127.4	140.2	0	0	0	0	0	122.8
403	G	30	Very low	31.7	Very low	81 Å²	81	125.9 Å²	125.9	84%	0.835	83%	0.83	S	S	*	*			trans	153.7	125.8	160.1	0	0	0	0	0	116
404	Q	33.3	Very low	31.6	Very low	184 Å²	184	119.6 Å²	119.6	86%	0.86	82%	0.817	S	S	*	*			trans	-84.9	165.1	174.3	-61.8	144.8	-97.8	0	0	111.1
405	L	32.3	Very low	31.2	Very low	172 Å²	172	122.6 Å²	122.6	90%	0.901	82%	0.82	S	S	*	*			cis	-141.8	176.7	15.6	-83.6	93	0	0	0	110.3
406	G	29.8	Very low	31.5	Very low	81 Å²	81	121.4 Å²	121.4	84%	0.835	82%	0.815	S	S	*	*			cis	160	3.3	-9.1	0	0	0	0	0	120.5
407	G	30.4	Very low	31.6	Very low	84 Å²	84	122 Å²	122	87%	0.866	81%	0.806	S	S	*	*			trans	-167.7	168	178.6	0	0	0	0	0	114.4
408	G	29.8	Very low	31.6	Very low	79 Å²	79	129.3 Å²	129.3	81%	0.814	82%	0.815	S	S	*	*			cis	-170.9	166.7	-1.3	0	0	0	0	0	112.4
409	A	32.8	Very low	31.5	Very low	113 Å²	113	123.7 Å²	123.7	93%	0.934	80%	0.801	S	S	*	*			trans	-67.7	156.6	-172.8	0	0	0	0	0	114.8
410	G	29.1	Very low	31.4	Very low	78 Å²	78	129.3 Å²	129.3	80%	0.804	81%	0.806	S	S	*	*				116.7	169.3	68.8	0	0	0	0	0	109.7
411	A	34	Very low	30.7	Very low	84 Å²	84	130.8 Å²	130.8	69%	0.694	80%	0.802	S	S	*	*			cis	-170.5	172.6	-14.5	0	0	0	0	0	111.1
412	H	33.3	Very low	30.7	Very low	164 Å²	164	131.1 Å²	131.1	76%	0.759	80%	0.799	S	S	*	*			trans	79.8	130.9	153.3	-65.4	-50.6	0	0	0	125.8
413	K	32.7	Very low	30.4	Very low	194 Å²	194	129.1 Å²	129.1	84%	0.843	79%	0.789	S	S	*	*			trans	63.7	155	139.1	-64.1	171.7	-177.8	177.9	0	119.8
414	G	26.9	Very low	30.4	Very low	59 Å²	59	133 Å²	133	61%	0.608	79%	0.79	S	S	*	*			cis	163.7	168.8	-6.8	0	0	0	0	0	113.7
415	H	30.9	Very low	30.3	Very low	175 Å²	175	131 Å²	131	81%	0.81	78%	0.784	S	S	*	*			trans	77	137	179.3	-54.4	-86.9	0	0	0	116.2
416	H	32.4	Very low	30.2	Very low	175 Å²	175	131.4 Å²	131.4	81%	0.81	78%	0.775	S	S	*	*			cis	78.7	136.2	39.2	-66.9	-70.2	0	0	0	114.3
417	S	31.1	Very low	31.5	Very low	91 Å²	91	132.2 Å²	132.2	64%	0.636	77%	0.766	S	S	*	*			cis	-179.5	171.7	-12.8	56.2	0	0	0	0	111.7
418	R	30.7	Very low	31.5	Very low	245 Å²	245	132.5 Å²	132.5	93%	0.925	75%	0.751	S	S	*	*			trans	78.2	163.3	168.1	-64.3	178.1	170.9	175.2	-3.2	118
419	A	29.1	Very low	31.6	Very low	74 Å²	74	135.1 Å²	135.1	61%	0.612	75%	0.751	S	S	*	*			cis	-176.5	178.5	-31.3	0	0	0	0	0	110.9
420	F	24.9	Very low	31.4	Very low	190 Å²	190	134.9 Å²	134.9	83%	0.833	74%	0.737	S	S	*	*			trans	71.2	136.5	177.9	-68.6	-95.3	0	0	0	116.7
421	Q	29.6	Very low	31.5	Very low	150 Å²	150	138.6 Å²	138.6	70%	0.701	73%	0.733	S	S	*	*			cis	105.7	131.9	-0.3	-151.4	-157.9	-8.9	0	0	117.7
422	Q	30	Very low	31.1	Very low	172 Å²	172	142.9 Å²	142.9	80%	0.804	74%	0.741	S	S	*	*			trans	78.3	148.5	169.9	-44.7	-172.9	7.4	0	0	117
423	G	26.2	Very low	30.8	Very low	66 Å²	66	139.3 Å²	139.3	68%	0.68	74%	0.74	S	S	*	*			cis	171	163	-10.4	0	0	0	0	0	116
424	L	29.6	Very low	31.5	Very low	163 Å²	163	135.7 Å²	135.7	85%	0.853	74%	0.736	S	S	*	*			trans	37.3	134	133.6	-60.2	179.2	0	0	0	120.6
425	L	30.8	Very low	32.3	Very low	142 Å²	142	138.2 Å²	138.2	74%	0.743	74%	0.742	S	S	*	*			cis	-142.7	-164.6	-2.9	-58.3	99.7	0	0	0	108.1
426	Y	31	Very low	32.2	Very low	181 Å²	181	135.3 Å²	135.3	71%	0.71	74%	0.742	S	S	*	*			cis	-146.4	-145.9	1.6	-149.2	176.1	0	0	0	108.4
427	P	55.8	Low	31.9	Very low	98 Å²	98	132.3 Å²	132.3	64%	0.636	74%	0.74	S	S	*	*			cis	-103.4	-169.4	3.6	32.5	-11.5	0	0	0	112.5
428	T	31.2	Very low	31.8	Very low	90 Å²	90	133.3 Å²	133.3	55%	0.552	75%	0.747	S	S	*	*			cis	64.3	151.5	33.5	24.8	0	0	0	0	114.8
429	V	31.2	Very low	31.6	Very low	134 Å²	134	132.9 Å²	132.9	81%	0.812	75%	0.745	S	S	*	*			cis	-119.4	-135.5	17.6	-157.7	0	0	0	0	112.5
430	V	29.3	Very low	31.4	Very low	108 Å²	108	136.2 Å²	136.2	66%	0.655	76%	0.758	S	S	*	*			trans	-153.5	143.6	-162.4	-146.6	0	0	0	0	108.3
431	H	30.4	Very low	31.5	Very low	156 Å²	156	130.4 Å²	130.4	72%	0.722	75%	0.752	S	S	*	*				-167.9	155.1	62.7	-115.8	-72	0	0	0	116.5
432	M	26.3	Very low	31.3	Very low	173 Å²	173	130.8 Å²	130.8	85%	0.852	76%	0.759	S	S	*	*			trans	73.6	157.7	156.3	-66	-59.1	-174.2	0	0	121
433	A	27.4	Very low	31.4	Very low	90 Å²	90	128.2 Å²	128.2	74%	0.744	76%	0.759	S	S	*	*			trans	-144	-159.9	-172.9	0	0	0	0	0	108
434	P	46.3	Very low	31.4	Very low	117 Å²	117	128.7 Å²	128.7	76%	0.76	77%	0.765	S	S	*	*			cis	-131.8	-131.8	-7.1	31.7	-5.3	0	0	0	112.1
435	P	44.6	Very low	31.4	Very low	112 Å²	112	126 Å²	126	73%	0.727	76%	0.76	S	S	*	*				-112	-168.8	-87	35.8	-17	0	0	0	112.3
436	S	27.7	Very low	31.5	Very low	115 Å²	115	125.2 Å²	125.2	80%	0.804	76%	0.761	S	S	*	*			cis	-150.6	162.4	14.2	-34.4	0	0	0	0	111.7
437	S	27.8	Very low	31.5	Very low	111 Å²	111	122.8 Å²	122.8	78%	0.776	77%	0.77	S	S	*	*			trans	-146.4	-178.4	173.7	-169.5	0	0	0	0	111.4
438	S	27.4	Very low	30.2	Very low	112 Å²	112	121.9 Å²	121.9	78%	0.783	78%	0.778	S	S	*	*			trans	73.2	140.2	156.5	54.1	0	0	0	0	120.8
439	R	26.9	Very low	30.1	Very low	236 Å²	236	126 Å²	126	89%	0.891	80%	0.796	S	S	*	*			trans	-85.4	-178.8	159.9	-60.2	168.6	171.6	166.4	-5.3	109.6
440	V	26.1	Very low	29.9	Very low	145 Å²	145	124.7 Å²	124.7	88%	0.879	79%	0.793	S	S	*	*			trans	105	120.7	154.4	-176	0	0	0	0	116
441	G	25.6	Very low	29.9	Very low	68 Å²	68	125.7 Å²	125.7	70%	0.701	80%	0.803	S	S	*	*			trans	84.7	148.4	158	0	0	0	0	0	117
442	D	27	Very low	29.8	Very low	158 Å²	158	128.8 Å²	128.8	85%	0.845	81%	0.81	S	S	*	*			cis	-163.7	170.3	-20.1	-147.6	-22.2	0	0	0	111.3
443	S	30.2	Very low	30	Very low	117 Å²	117	130.1 Å²	130.1	82%	0.818	81%	0.814	S	S	*	*			trans	70.2	133.6	167.5	73.4	0	0	0	0	118.5
444	G	27.5	Very low	30.1	Very low	77 Å²	77	128.7 Å²	128.7	79%	0.794	81%	0.808	S	S	*	*			trans	-174.2	-9.8	-175.2	0	0	0	0	0	119.7
445	S	29.8	Very low	29.2	Very low	107 Å²	107	133 Å²	133	75%	0.748	82%	0.818	S	S	*	*			trans	63.8	114.2	164	-152.7	0	0	0	0	120.7
446	T	31.8	Very low	28.4	Very low	125 Å²	125	138.6 Å²	138.6	77%	0.767	82%	0.824	S	S	*	*				150.8	137.9	117.4	49.5	0	0	0	0	115.7
447	S	30.8	Very low	28.4	Very low	129 Å²	129	138.2 Å²	138.2	90%	0.902	82%	0.822	S	S	*	*			trans	69.5	148.1	160.2	78.2	0	0	0	0	120.4
448	G	28.4	Very low	28.4	Very low	79 Å²	79	139 Å²	139	81%	0.814	82%	0.821	S	S	*	*			trans	133.6	94.9	170.5	0	0	0	0	0	115.3
449	L	28.7	Very low	28.4	Very low	177 Å²	177	139.6 Å²	139.6	93%	0.927	82%	0.824	S	S	*	*			trans	-77	148.1	-172.4	-87.9	146.1	0	0	0	116.4
450	S	28.2	Very low	28.5	Very low	107 Å²	107	134 Å²	134	75%	0.748	82%	0.822	S	S	*	*			trans	76.8	134	149.8	-157.5	0	0	0	0	119.4
451	C	29.9	Very low	28.6	Very low	128 Å²	128	130.1 Å²	130.1	87%	0.865	81%	0.811	S	S	*	*			trans	-136	149.3	-179.5	-53.1	0	0	0	0	111.1
452	Y	28.5	Very low	28.9	Very low	222 Å²	222	138.2 Å²	138.2	87%	0.871	82%	0.822	S	S	*	*			trans	-119.6	125.8	171.4	-101.9	-89	0	0	0	110.1
453	H	30.3	Very low	29	Very low	200 Å²	200	138.4 Å²	138.4	93%	0.926	82%	0.822	S	S	*	*			trans	-159.1	138.6	147.6	-109.4	-81.8	0	0	0	107.7
454	G	29.1	Very low	29	Very low	61 Å²	61	136.1 Å²	136.1	63%	0.629	81%	0.81	S	S	*	*			trans	-114.3	171.3	-173.8	0	0	0	0	0	113.5
455	H	27.7	Very low	29.1	Very low	206 Å²	206	140 Å²	140	95%	0.954	81%	0.812	S	S	*	*			trans	-153.6	172.7	163.1	-104.8	-81.5	0	0	0	110.8
456	R	26.4	Very low	29.1	Very low	231 Å²	231	140.6 Å²	140.6	87%	0.872	82%	0.815	S	S	*	*			trans	-86.3	155	-176.6	-80	175.8	154.8	-173.9	-5.5	113.5
457	S	27.6	Very low	29.9	Very low	107 Å²	107	141 Å²	141	75%	0.748	82%	0.82	S	S	*	*			trans	104.3	139.7	132.7	74.6	0	0	0	0	122.1
458	V	28.4	Very low	30	Very low	127 Å²	127	137.9 Å²	137.9	77%	0.77	81%	0.809	S	S	*	*			trans	66.3	118.4	151.3	-72.2	0	0	0	0	124.4
459	C	27.5	Very low	30.2	Very low	124 Å²	124	139.5 Å²	139.5	84%	0.838	81%	0.807	S	S	*	*				101	151.1	125.9	-79.2	0	0	0	0	122.3
460	S	29.9	Very low	30.3	Very low	120 Å²	120	138.2 Å²	138.2	84%	0.839	80%	0.801	S	S	*	*			trans	67.2	123.2	-178.4	-136	0	0	0	0	116.2
461	G	28.3	Very low	30.6	Very low	63 Å²	63	139 Å²	139	65%	0.649	81%	0.807	S	S	*	*			cis	118.5	106.9	-6.9	0	0	0	0	0	113.5
462	Y	30.9	Very low	30.7	Very low	237 Å²	237	138.2 Å²	138.2	93%	0.929	80%	0.803	S	S	*	*			trans	-149.1	147.3	169.1	-110.8	-83.6	0	0	0	113
463	L	29.3	Very low	30.9	Very low	163 Å²	163	133.1 Å²	133.1	85%	0.853	80%	0.8	S	S	*	*			trans	-90.6	164.9	170.8	-78.4	164.7	0	0	0	109.2
464	A	29.2	Very low	30.9	Very low	68 Å²	68	129.1 Å²	129.1	56%	0.562	79%	0.794	S	S	*	*			cis	-164.5	-156.9	-6.7	0	0	0	0	0	109.4
465	D	30.7	Very low	31	Very low	159 Å²	159	131.4 Å²	131.4	85%	0.85	80%	0.8	S	S	*	*			trans	90.2	125.2	153.4	-56.8	-29.8	0	0	0	120.3
466	C	29	Very low	31.4	Very low	119 Å²	119	127.4 Å²	127.4	80%	0.804	80%	0.796	S	S	*	*			trans	-89.6	176.4	162.2	-52.8	0	0	0	0	109.7
467	P	50.2	Low	31.7	Very low	133 Å²	133	120.2 Å²	120.2	86%	0.864	79%	0.794	S	S	*	*				-138.8	168	97.7	38.4	-28.2	0	0	0	113.8
468	G	31.8	Very low	31.9	Very low	65 Å²	65	123.6 Å²	123.6	67%	0.67	80%	0.798	S	S	*	*			trans	-118.7	164	169.7	0	0	0	0	0	112.3
469	S	32.6	Very low	32	Very low	112 Å²	112	123.5 Å²	123.5	78%	0.783	80%	0.802	S	S	*	*			trans	-160.6	121.9	163.7	-65.7	0	0	0	0	105.8
470	D	31.4	Very low	32.1	Very low	150 Å²	150	125 Å²	125	80%	0.802	80%	0.796	S	S	*	*				78.8	103.4	58.6	-69.9	-13.4	0	0	0	113.6
471	S	33.6	Very low	31.9	Very low	125 Å²	125	124.6 Å²	124.6	87%	0.874	79%	0.791	S	S	*	*			trans	-177.4	161.3	140.1	-83	0	0	0	0	111
472	S	32.5	Very low	31.9	Very low	110 Å²	110	126.4 Å²	126.4	77%	0.769	79%	0.794	S	S	*	*			trans	-140.1	175.4	-169.6	-52.8	0	0	0	0	112.6
473	S	31.7	Very low	32	Very low	116 Å²	116	119.8 Å²	119.8	81%	0.811	78%	0.783	S	S	*	*			trans	72.2	166.9	162	78.7	0	0	0	0	118.2
474	S	30.4	Very low	32.1	Very low	116 Å²	116	117.4 Å²	117.4	81%	0.811	78%	0.78	S	S	*	*			cis	-179.9	116.8	-47.5	-89	0	0	0	0	109.1
475	S	32.3	Very low	32.2	Very low	108 Å²	108	121.7 Å²	121.7	76%	0.755	79%	0.793	S	S	*	*			trans	-170.4	121.2	162.3	52.7	0	0	0	0	109.1
476	S	35	Very low	32.4	Very low	122 Å²	122	119.6 Å²	119.6	85%	0.853	79%	0.791	S	S	*	*				80.1	94.2	50.7	79.6	0	0	0	0	114.1
477	G	33.3	Very low	32.5	Very low	81 Å²	81	122.7 Å²	122.7	84%	0.835	80%	0.796	S	S	*	*			trans	-166.7	133	170.4	0	0	0	0	0	109.3
478	Q	32.2	Very low	31.6	Very low	177 Å²	177	124.1 Å²	124.1	83%	0.827	80%	0.796	S	S	*	*			trans	-148.1	126.2	-162.9	-175.2	173.7	-2	0	0	112.2
479	C	30.1	Very low	31.4	Very low	126 Å²	126	127.8 Å²	127.8	85%	0.851	80%	0.8	S	S	*	*			trans	-153	166	170.2	51	0	0	0	0	110.4
480	H	29.4	Very low	31.2	Very low	156 Å²	156	127.6 Å²	127.6	72%	0.722	80%	0.797	S	S	*	*			trans	-114.6	144.6	-146.5	-88.2	-97.4	0	0	0	116.8
481	C	26.6	Very low	31.3	Very low	110 Å²	110	126.9 Å²	126.9	74%	0.743	80%	0.798	S	S	*	*			trans	63.1	150.1	146.3	-60.3	0	0	0	0	118.3
482	S	28.3	Very low	31.1	Very low	101 Å²	101	130.5 Å²	130.5	71%	0.706	80%	0.801	S	S	*	*			cis	-172.1	165.5	-4.7	-104.7	0	0	0	0	108.1
483	S	31.8	Very low	31.2	Very low	98 Å²	98	131.6 Å²	131.6	69%	0.685	80%	0.803	S	S	*	*			cis	-165.3	174.5	-9.1	-99.7	0	0	0	0	108.3
484	S	31.7	Very low	31.2	Very low	113 Å²	113	131.2 Å²	131.2	79%	0.79	80%	0.8	S	S	*	*			trans	71.6	143.7	-179.7	-50	0	0	0	0	113.8
485	D	31.6	Very low	31.2	Very low	158 Å²	158	132.8 Å²	132.8	85%	0.845	80%	0.8	S	S	*	*			cis	-126.3	167.9	22.4	-87.6	-46.9	0	0	0	115.1
486	S	34.6	Very low	31.2	Very low	116 Å²	116	137 Å²	137	81%	0.811	81%	0.808	S	S	*	*			trans	-97.7	122.7	176.4	54.5	0	0	0	0	112.9
487	M	31.6	Very low	30.9	Very low	183 Å²	183	135 Å²	135	90%	0.901	81%	0.806	S	S	*	*			trans	-120.7	107.3	166.3	-76.8	-153.1	-59.3	0	0	112.2
488	L	30.8	Very low	30.8	Very low	164 Å²	164	137.8 Å²	137.8	86%	0.859	81%	0.807	S	S	*	*			trans	-144.5	114.5	144.8	-74	-177.5	0	0	0	104.7
489	D	27.3	Very low	30.7	Very low	142 Å²	142	140.4 Å²	140.4	76%	0.759	81%	0.811	S	S	*	*				99.7	175.8	77.7	-165.3	14.2	0	0	0	109.4
490	C	29.1	Very low	30.6	Very low	108 Å²	108	137.9 Å²	137.9	73%	0.73	81%	0.806	S	S	*	*			trans	73.1	85.2	-177	-56.6	0	0	0	0	115.9
491	T	32.8	Very low	30.7	Very low	134 Å²	134	136.4 Å²	136.4	82%	0.822	81%	0.813	S	S	*	*			trans	-9.3	127.7	134.3	52.9	0	0	0	0	117.6
492	E	29.8	Very low	30.8	Very low	201 Å²	201	137.6 Å²	137.6	94%	0.939	82%	0.821	S	S	*	*			trans	-154	171.7	133.8	-132.3	-175.9	170.9	0	0	112.4
493	V	34.7	Very low	30.9	Very low	133 Å²	133	137.6 Å²	137.6	81%	0.806	82%	0.821	S	S	*	*			trans	-114.4	133	-165.5	176	0	0	0	0	111.5
494	S	31.3	Very low	30.8	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	83%	0.829	S	S	*	*			trans	-156.8	151	150.4	-160.7	0	0	0	0	113.2
495	N	30.6	Very low	30.7	Very low	150 Å²	150	142.7 Å²	142.7	80%	0.802	83%	0.829	S	S	*	*			trans	-95.6	125.7	174	-74.2	-80.5	0	0	0	110.2
496	Q	32.3	Very low	30.6	Very low	196 Å²	196	146.9 Å²	146.9	92%	0.916	83%	0.833	S	S	*	*			trans	-146.7	116.7	157	-106	164.5	55.5	0	0	108.6
497	G	29.5	Very low	30.3	Very low	80 Å²	80	146.9 Å²	146.9	83%	0.825	83%	0.833	S	S	*	*			trans	-103.9	137.7	-172.9	0	0	0	0	0	113
498	V	31.8	Very low	30.2	Very low	139 Å²	139	143.5 Å²	143.5	84%	0.842	83%	0.827	S	S	*	*			trans	-134.6	131.3	165	-178.3	0	0	0	0	109
499	Y	29.3	Very low	30.3	Very low	232 Å²	232	144.2 Å²	144.2	91%	0.91	83%	0.831	S	S	*	*			trans	-11.4	136.9	169.4	-69.8	-100.9	0	0	0	119.4
500	G	28	Very low	30.4	Very low	73 Å²	73	142 Å²	142	75%	0.753	83%	0.826	S	S	*	*			trans	169.1	102.5	152	0	0	0	0	0	118.1
501	S	30.8	Very low	30.5	Very low	126 Å²	126	142.5 Å²	142.5	88%	0.881	83%	0.831	S	S	*	*			trans	53	114.2	146.6	-58.7	0	0	0	0	121.3
502	C	28.3	Very low	30.6	Very low	134 Å²	134	143.5 Å²	143.5	91%	0.905	83%	0.831	S	S	*	*			trans	-65.4	141.3	167.7	-42.3	0	0	0	0	112.5
503	S	30.3	Very low	30.5	Very low	102 Å²	102	144.7 Å²	144.7	71%	0.713	83%	0.829	S	S	*	*			trans	-137.3	125.8	163.1	-172.7	0	0	0	0	110.9
504	T	30.7	Very low	30.5	Very low	136 Å²	136	144.6 Å²	144.6	83%	0.834	82%	0.824	S	S	*	*			trans	-95.4	105.6	-173.5	50.5	0	0	0	0	111.9
505	F	29.1	Very low	30.8	Very low	181 Å²	181	143.6 Å²	143.6	79%	0.794	82%	0.815	S	S	*	*			trans	-113.9	118.9	165.3	-85.7	-91.4	0	0	0	110.9
506	R	29.3	Very low	30.8	Very low	247 Å²	247	147 Å²	147	93%	0.932	82%	0.818	S	S	*	*			trans	-94	104.5	162.5	-66.7	-175.8	75	-142	3.4	107.6	S508	R506-S508 PolarHBondContact O-N 2.68Å
507	S	29.1	Very low	30.9	Very low	115 Å²	115	144 Å²	144	80%	0.804	81%	0.812	S	S	*	*			trans	-69	126.2	170.9	-58.7	0	0	0	0	109.9
508	S	30.2	Very low	30.9	Very low	112 Å²	112	148.8 Å²	148.8	78%	0.783	81%	0.807	S	S	*	*			trans	-78.6	131.9	173.7	-61.9	0	0	0	0	110.5	R506	R506-S508 PolarHBondContact O-N 2.68Å
509	L	32.3	Very low	30.7	Very low	179 Å²	179	153.8 Å²	153.8	94%	0.937	81%	0.811	S	S	*	*			trans	-123.2	107.1	161.3	-73.8	177.9	0	0	0	109.1
510	S	29.9	Very low	30.8	Very low	95 Å²	95	145.7 Å²	145.7	66%	0.664	79%	0.788	S	S	*	*			trans	-152.5	108.8	162.3	53.7	0	0	0	0	107.7	D512	S510-D512 PolarHBondContact O-N 3.24Å
511	S	30.3	Very low	31	Very low	119 Å²	119	151.5 Å²	151.5	83%	0.832	79%	0.792	S	S	*	*			trans	-74	117.5	168.6	51	0	0	0	0	108.9
512	D	34.3	Very low	31	Very low	155 Å²	155	150.8 Å²	150.8	83%	0.829	79%	0.788	S	S	*	*			trans	-72.3	142.3	175.4	-67.7	-53.3	0	0	0	111.2	S510	S510-D512 PolarHBondContact O-N 3.24Å
513	Y	29	Very low	32.1	Very low	227 Å²	227	150.3 Å²	150.3	89%	0.89	78%	0.783	S	S	*	*			trans	-131.7	108.4	176	-149.4	-76.1	0	0	0	107.2
514	D	35	Very low	32.1	Very low	130 Å²	130	151.3 Å²	151.3	70%	0.695	79%	0.789	S	S	*	*			trans	-110.6	136.1	-173.5	177.1	39.3	0	0	0	111.1
515	P	37.4	Very low	32.1	Very low	87 Å²	87	156.6 Å²	156.6	57%	0.565	79%	0.793	S	S	*	*			trans	-134	136.1	150.1	37.2	-23.9	0	0	0	114.7
516	Y	30.6	Very low	31.9	Very low	223 Å²	223	151.6 Å²	151.6	88%	0.875	79%	0.793	S	S	*	*			trans	104	75.1	158.9	-58.7	-67	0	0	0	119.5
517	V	32.9	Very low	31.9	Very low	131 Å²	131	144.8 Å²	144.8	79%	0.794	78%	0.783	S	S	*	*			trans	-142.5	140.6	162.9	179	0	0	0	0	109.1
518	Y	29.4	Very low	31.9	Very low	181 Å²	181	145.8 Å²	145.8	71%	0.71	79%	0.785	S	S	*	*			cis	-167.6	151.5	-27.3	178	-111.6	0	0	0	109.1	S520	Y518-S520 WeakPolarHBondContact OH-CB 3.5Å
519	R	29.2	Very low	31.8	Very low	244 Å²	244	144.3 Å²	144.3	92%	0.921	79%	0.787	S	S	*	*			trans	-144.6	150.9	164	-86.2	-153.1	179.3	-130.2	2.2	112.9
520	S	30.4	Very low	31.7	Very low	62 Å²	62	144.3 Å²	144.3	43%	0.434	78%	0.782	S	S	.	*			trans	-161.7	161.4	-175.2	72.6	0	0	0	0	114	Y518	Y518-S520 WeakPolarHBondContact OH-CB 3.5Å
521	K	32.2	Very low	32.3	Very low	195 Å²	195	145.5 Å²	145.5	85%	0.848	79%	0.788	S	S	*	*			trans	71.4	147.6	160.7	-64.7	165.3	-175.1	174.5	0	116.3
522	S	30.5	Very low	32.2	Very low	112 Å²	112	143 Å²	143	78%	0.783	78%	0.781	S	S	*	*			cis	-157.7	169.8	-3.5	42.6	0	0	0	0	111.2
523	P	53	Low	32	Very low	123 Å²	123	140.2 Å²	140.2	80%	0.799	78%	0.779	S	S	*	*			trans	-106.2	168.9	-168	40.4	-35.4	0	0	0	115.9
524	C	28.4	Very low	32.1	Very low	124 Å²	124	135.6 Å²	135.6	84%	0.838	78%	0.78	S	S	*	*			trans	-167.2	116.1	152.8	-117.6	0	0	0	0	117.3
525	R	30.7	Very low	31.7	Very low	246 Å²	246	133.2 Å²	133.2	93%	0.928	79%	0.787	S	S	*	*				69.5	116.8	120.4	-158.3	-178.4	-161.7	-158.6	4.6	124.2
526	G	26.5	Very low	31.2	Very low	77 Å²	77	134.9 Å²	134.9	79%	0.794	80%	0.799	S	S	*	*			trans	97.1	155.4	145.4	0	0	0	0	0	117.6
527	S	29.3	Very low	31	Very low	103 Å²	103	130.3 Å²	130.3	72%	0.72	79%	0.794	S	S	*	*			cis	-166.3	144.9	-12.1	-172.1	0	0	0	0	112.1
528	T	29	Very low	30.7	Very low	137 Å²	137	130.3 Å²	130.3	84%	0.84	80%	0.795	S	S	*	*			trans	45	126.2	150.3	48.1	0	0	0	0	122.7
529	G	27.2	Very low	30.6	Very low	81 Å²	81	126 Å²	126	84%	0.835	80%	0.796	S	S	*	*			trans	146.3	89.5	144.7	0	0	0	0	0	119.6
530	E	30.3	Very low	31.4	Very low	179 Å²	179	119.9 Å²	119.9	84%	0.836	79%	0.788	S	S	*	*			trans	-85	170.3	151	-87.5	-77.7	131.8	0	0	109.3
531	P	42.4	Very low	31.5	Very low	119 Å²	119	120.3 Å²	120.3	77%	0.773	80%	0.796	S	S	*	*			cis	-141	-178.9	15.1	43.2	-25.4	0	0	0	117.8
532	G	28.1	Very low	31.5	Very low	67 Å²	67	119.3 Å²	119.3	69%	0.691	79%	0.794	S	S	*	*				127.6	104.2	129.1	0	0	0	0	0	122.3
533	A	30.4	Very low	31.3	Very low	96 Å²	96	121.2 Å²	121.2	79%	0.793	80%	0.795	S	S	*	*			trans	50.4	119	135.4	0	0	0	0	0	124.6
534	S	31.8	Very low	30.4	Very low	131 Å²	131	119.4 Å²	119.4	92%	0.916	79%	0.786	S	S	*	*				52.8	125.2	128.5	-55.5	0	0	0	0	124
535	G	26	Very low	31.5	Very low	80 Å²	80	119.7 Å²	119.7	83%	0.825	79%	0.786	S	S	*	*			trans	-155.6	152.7	158.4	0	0	0	0	0	111
536	C	26.6	Very low	31.7	Very low	121 Å²	121	115.2 Å²	115.2	82%	0.818	78%	0.779	S	S	*	*			trans	-151.4	177	-165.7	-163.8	0	0	0	0	114.4
537	T	27.8	Very low	33	Very low	127 Å²	127	117.4 Å²	117.4	78%	0.779	78%	0.779	S	S	*	*			trans	79	151.1	176.6	74.9	0	0	0	0	115.5
538	T	24.6	Very low	33.3	Very low	132 Å²	132	117.1 Å²	117.1	81%	0.81	78%	0.783	S	S	*	*			cis	-138.9	164.9	21.9	47.7	0	0	0	0	115.2
539	A	29.3	Very low	34.6	Very low	89 Å²	89	115.8 Å²	115.8	74%	0.736	78%	0.777	S	S	*	*			trans	-117.4	177.9	163	0	0	0	0	0	110.1
540	P	44.9	Very low	34.9	Very low	116 Å²	116	120.1 Å²	120.1	75%	0.753	78%	0.78	S	S	*	*				-136.3	171	68.9	26.7	-3.3	0	0	0	113.7
541	A	32.9	Very low	34.8	Very low	72 Å²	72	114.8 Å²	114.8	60%	0.595	77%	0.773	S	S	*	*			cis	80	150.5	29.4	0	0	0	0	0	114.3
542	E	31.3	Very low	34.4	Very low	174 Å²	174	117.2 Å²	117.2	81%	0.813	77%	0.773	S	S	*	*			cis	-98.7	-119.3	7.9	-52.4	-54	-37.1	0	0	113.8
543	D	25.9	Very low	34.4	Very low	151 Å²	151	120.6 Å²	120.6	81%	0.807	78%	0.776	S	S	*	*			cis	-157.8	-177.9	6.4	-164.8	2.7	0	0	0	111.3
544	S	34.9	Very low	34.4	Very low	86 Å²	86	120.9 Å²	120.9	60%	0.601	77%	0.771	S	S	*	*			trans	-155.1	-170.3	-175	-61.5	0	0	0	0	114.5
545	P	52.3	Low	34.3	Very low	130 Å²	130	121.7 Å²	121.7	84%	0.844	76%	0.764	S	S	*	*				-141.6	170.6	68.2	33.7	-11.8	0	0	0	116.3
546	I	34.9	Very low	34.4	Very low	152 Å²	152	125.8 Å²	125.8	78%	0.779	76%	0.762	S	S	*	*			trans	-134.7	139.8	-166	-53	177.6	0	0	0	113.5
547	P	54	Low	34.8	Very low	123 Å²	123	127 Å²	127	80%	0.799	76%	0.759	S	S	*	*			trans	-109.1	171.6	178.5	41	-35	0	0	0	116.3
548	A	34.2	Very low	35.6	Very low	96 Å²	96	126.6 Å²	126.6	79%	0.793	76%	0.759	S	S	*	*			trans	-159.8	-173.1	174.7	0	0	0	0	0	109.6
549	P	56.3	Low	36	Very low	110 Å²	110	125.2 Å²	125.2	71%	0.714	76%	0.761	S	S	*	*			cis	-146.3	-170.2	22.5	38.6	-13.8	0	0	0	118.9
550	L	34.3	Very low	35.9	Very low	172 Å²	172	124.4 Å²	124.4	90%	0.901	76%	0.761	S	S	*	*			trans	81.3	133.3	167.1	-51.9	172.4	0	0	0	118.4
551	G	28.3	Very low	35.1	Very low	67 Å²	67	125.8 Å²	125.8	69%	0.691	77%	0.768	S	S	*	*			cis	173.1	154.2	-12.6	0	0	0	0	0	116.6
552	H	34.3	Very low	35	Very low	169 Å²	169	128 Å²	128	78%	0.782	78%	0.779	S	S	*	*			trans	74.2	132.6	154.9	-82.9	-82.6	0	0	0	126.2
553	D	27.5	Very low	34.9	Very low	138 Å²	138	122.9 Å²	122.9	74%	0.738	77%	0.773	S	S	*	*			trans	66.7	153.6	144.1	-57	-13	0	0	0	124.2
554	C	29.8	Very low	35	Very low	102 Å²	102	125.8 Å²	125.8	69%	0.689	77%	0.774	S	S	*	*			cis	-170.6	156.4	-42.4	-142.1	0	0	0	0	113.4
555	L	30.7	Very low	34.8	Very low	148 Å²	148	128.6 Å²	128.6	78%	0.775	78%	0.782	S	S	*	*			trans	68.4	156.9	158.5	-57.7	-168.4	0	0	0	120.7
556	Q	28	Very low	33.8	Very low	167 Å²	167	128.1 Å²	128.1	78%	0.78	78%	0.782	S	S	*	*			cis	-168.4	170.1	-21.4	178	161.2	10.7	0	0	112.5
557	L	34.3	Very low	33.6	Very low	145 Å²	145	124.2 Å²	124.2	76%	0.759	78%	0.779	S	S	*	*			trans	-127.4	146.5	-177.8	-145.6	170.9	0	0	0	110.4
558	P	44.1	Very low	32.6	Very low	120 Å²	120	124.8 Å²	124.8	78%	0.779	78%	0.775	S	S	*	*			trans	-155.7	-166.3	131	39.9	-21.7	0	0	0	115.3
559	A	33.5	Very low	32.4	Very low	102 Å²	102	129 Å²	129	84%	0.843	78%	0.779	S	S	*	*				179.8	152.1	-74.8	0	0	0	0	0	112.5
560	G	27.6	Very low	31	Very low	73 Å²	73	132.1 Å²	132.1	75%	0.753	78%	0.783	S	S	*	*			trans	137.4	145.4	168.8	0	0	0	0	0	114.2
561	T	27.8	Very low	30.9	Very low	145 Å²	145	129.4 Å²	129.4	89%	0.89	78%	0.779	S	S	*	*			cis	-148.7	171.6	-0.6	41.7	0	0	0	0	112.3
562	S	31.6	Very low	30.8	Very low	117 Å²	117	133.2 Å²	133.2	82%	0.818	78%	0.783	S	S	*	*			trans	-63.4	167.9	179.3	51.3	0	0	0	0	116
563	G	27.6	Very low	30.5	Very low	67 Å²	67	130.9 Å²	130.9	69%	0.691	78%	0.784	S	S	*	*			cis	158.2	-165.3	1.9	0	0	0	0	0	112.6
564	Y	29	Very low	30.5	Very low	213 Å²	213	130.1 Å²	130.1	84%	0.835	79%	0.79	S	S	*	*			trans	85.1	117.8	175.2	-76.5	-92.3	0	0	0	121.3
565	N	29.5	Very low	30.3	Very low	144 Å²	144	132.6 Å²	132.6	77%	0.77	80%	0.795	S	S	*	*				35.2	155.4	124.5	-60.3	7.2	0	0	0	122.7
566	S	33.2	Very low	30.4	Very low	120 Å²	120	133.5 Å²	133.5	84%	0.839	80%	0.796	S	S	*	*			cis	177.5	155.2	-20.8	-175.7	0	0	0	0	108.9
567	G	28.9	Very low	31	Very low	70 Å²	70	130.6 Å²	130.6	72%	0.722	79%	0.791	S	S	*	*			trans	115.5	128.7	154.1	0	0	0	0	0	118
568	D	33.1	Very low	30.7	Very low	135 Å²	135	131.8 Å²	131.8	72%	0.722	80%	0.798	S	S	*	*			trans	-76.1	166.4	177.1	-49.5	-90	0	0	0	114.4
569	H	31.3	Very low	29.9	Very low	186 Å²	186	136.1 Å²	136.1	86%	0.861	80%	0.801	S	S	*	*				-177.6	169.5	108.5	-88.9	-38.4	0	0	0	114.1
570	H	27.1	Very low	29.6	Very low	175 Å²	175	136.1 Å²	136.1	81%	0.81	79%	0.794	S	S	*	*			trans	-97.3	171.6	-169	-67.4	172	0	0	0	115
571	S	30.7	Very low	29.7	Very low	115 Å²	115	137.9 Å²	137.9	80%	0.804	80%	0.795	S	S	*	*			trans	77.9	157.4	165.5	82.2	0	0	0	0	115.5
572	N	27.7	Very low	29.5	Very low	147 Å²	147	142.7 Å²	142.7	79%	0.786	80%	0.797	S	S	*	*			cis	-143.2	172	15.5	-159.6	1.8	0	0	0	112.9
573	C	27.1	Very low	29.2	Very low	119 Å²	119	142.5 Å²	142.5	80%	0.804	80%	0.796	S	S	*	*			trans	-70.4	151.1	-178.4	-54.7	0	0	0	0	113.7
574	S	27.4	Very low	29.2	Very low	122 Å²	122	144 Å²	144	85%	0.853	80%	0.796	S	S	*	*			trans	-150.9	140.6	141.9	-160.3	0	0	0	0	113.9
575	L	26.6	Very low	29.1	Very low	154 Å²	154	140.6 Å²	140.6	81%	0.806	79%	0.791	S	S	*	*			trans	-74	169.4	156.8	-73	146.9	0	0	0	108.7
576	E	32.7	Very low	28.9	Very low	168 Å²	168	142 Å²	142	79%	0.785	79%	0.793	S	S	*	*			cis	-149.7	-179.1	4.7	-129.8	-167.3	130.9	0	0	107.7
577	P	40.8	Very low	29.2	Very low	105 Å²	105	141.4 Å²	141.4	68%	0.682	79%	0.786	S	S	*	*			trans	-82.2	174.2	-175	37.1	-37.4	0	0	0	113.1
578	N	27.6	Very low	29.1	Very low	170 Å²	170	148.1 Å²	148.1	91%	0.909	79%	0.79	S	S	*	*			trans	-133.5	157.6	156.8	-116.1	-53.8	0	0	0	112.4
579	Y	28	Very low	28.8	Very low	212 Å²	212	147.8 Å²	147.8	83%	0.831	78%	0.784	S	S	*	*			trans	-129.5	154.9	-159	-163.4	-88.4	0	0	0	110.5
580	S	27.3	Very low	28.7	Very low	101 Å²	101	145.4 Å²	145.4	71%	0.706	78%	0.778	S	S	*	*			trans	117.6	100	163	-51.5	0	0	0	0	116.5
581	S	28	Very low	28.8	Very low	110 Å²	110	144.3 Å²	144.3	77%	0.769	78%	0.776	S	S	*	*			trans	-14.9	135.6	136.8	-36	0	0	0	0	117.4
582	R	25.2	Very low	28.8	Very low	246 Å²	246	145.2 Å²	145.2	93%	0.928	77%	0.772	S	S	*	*				-167.5	155.7	106.3	-109.7	177.9	173.8	178.7	-2.9	114.3
583	S	25.2	Very low	28.9	Very low	114 Å²	114	143.9 Å²	143.9	80%	0.797	77%	0.769	S	S	*	*			trans	-73.8	143.8	168.9	168.9	0	0	0	0	111.6
584	S	27.1	Very low	29.1	Very low	99 Å²	99	142.7 Å²	142.7	69%	0.692	76%	0.762	S	S	*	*			trans	-170	127.5	130.3	-170.6	0	0	0	0	112.7
585	L	26.6	Very low	29.4	Very low	140 Å²	140	142.1 Å²	142.1	73%	0.733	75%	0.754	S	S	*	*			trans	26.2	118.7	144.3	-55.6	170.1	0	0	0	121.1
586	E	26.5	Very low	29.6	Very low	174 Å²	174	140.9 Å²	140.9	81%	0.813	75%	0.753	S	S	*	*				49.6	166.2	121.8	-64.8	-159.1	133.9	0	0	123
587	P	39.2	Very low	29.7	Very low	107 Å²	107	138.2 Å²	138.2	70%	0.695	75%	0.753	S	S	*	*			cis	-130.2	174.8	-33	34.3	-17.9	0	0	0	113.2
588	R	25.6	Very low	29.3	Very low	212 Å²	212	138.1 Å²	138.1	80%	0.8	76%	0.761	S	S	*	*				171.4	126.8	126.9	-94.6	-168.4	107.9	137	9.2	114.9
589	E	26.7	Very low	29.3	Very low	127 Å²	127	133.7 Å²	133.7	59%	0.593	76%	0.755	S	S	*	*				30.7	124.7	127.9	-60.3	178.2	137.1	0	0	122.3
590	N	29.2	Very low	29.3	Very low	137 Å²	137	128.2 Å²	128.2	73%	0.733	75%	0.754	S	S	*	*			trans	60.3	123.7	131	-50.8	-14	0	0	0	121.1
591	I	29.6	Very low	31	Very low	151 Å²	151	129 Å²	129	77%	0.774	76%	0.757	S	S	*	*				-174.8	140.1	100.1	-93.6	163.3	0	0	0	112.5
592	N	30.9	Very low	31.2	Very low	134 Å²	134	132.6 Å²	132.6	72%	0.717	76%	0.761	S	S	*	*			trans	-6.3	145.9	157.3	-41.2	-21.7	0	0	0	118.7
593	T	29.3	Very low	31.5	Very low	120 Å²	120	125.2 Å²	125.2	74%	0.736	75%	0.753	S	S	*	*				-166.7	141.1	64.9	30.1	0	0	0	0	108.7
594	S	32	Very low	31.8	Very low	93 Å²	93	124.1 Å²	124.1	65%	0.65	75%	0.751	S	S	*	*				58.7	146.1	71.2	87.7	0	0	0	0	113.9
595	T	32.8	Very low	31.9	Very low	110 Å²	110	124.4 Å²	124.4	68%	0.675	76%	0.759	S	S	*	*			cis	-170.4	140.8	37.7	-21.6	0	0	0	0	112.7
596	T	32.1	Very low	32.2	Very low	129 Å²	129	122.5 Å²	122.5	79%	0.791	76%	0.763	S	S	*	*			trans	55	166.1	142.1	46.6	0	0	0	0	122.8
597	S	33.8	Very low	32.4	Very low	112 Å²	112	119.9 Å²	119.9	78%	0.783	76%	0.755	S	S	*	*			cis	177.1	171.3	-16.9	54.4	0	0	0	0	109.6
598	A	32.8	Very low	32.2	Very low	103 Å²	103	125.4 Å²	125.4	85%	0.851	76%	0.762	S	S	*	*			cis	-177.1	163.3	-32.1	0	0	0	0	0	110.5
599	G	26.6	Very low	32.5	Very low	76 Å²	76	118.5 Å²	118.5	78%	0.784	76%	0.757	S	S	*	*			trans	91.6	153.3	173.6	0	0	0	0	0	116.4
600	A	28.7	Very low	33	Very low	98 Å²	98	119.5 Å²	119.5	81%	0.81	77%	0.772	S	S	*	*			cis	71	154	-1.6	0	0	0	0	0	118.6
601	P	62.6	Low	32.9	Very low	118 Å²	118	116.2 Å²	116.2	77%	0.766	77%	0.77	S	S	*	*			cis	-144.6	-149.6	11	42.7	-19.3	0	0	0	117
602	E	32.9	Very low	33.1	Very low	185 Å²	185	113.5 Å²	113.5	86%	0.864	77%	0.77	S	S	*	*			trans	83.6	143.4	170.5	-58.9	-155.7	116.3	0	0	119.5
603	A	32.1	Very low	33.1	Very low	91 Å²	91	114.2 Å²	114.2	75%	0.752	77%	0.77	S	S	*	*			cis	-168.1	-172.4	-22.8	0	0	0	0	0	107.8
604	A	30.4	Very low	33.1	Very low	91 Å²	91	115.2 Å²	115.2	75%	0.752	77%	0.766	S	S	*	*			cis	-162.7	167.3	-0.4	0	0	0	0	0	111.4
605	A	29.6	Very low	33	Very low	104 Å²	104	119.3 Å²	119.3	86%	0.86	78%	0.775	S	S	*	*			trans	62.6	149.1	156.5	0	0	0	0	0	121.6
606	A	33.1	Very low	32.8	Very low	100 Å²	100	119 Å²	119	83%	0.826	78%	0.777	S	S	*	*			cis	-173.9	174.3	-22	0	0	0	0	0	106.9
607	D	30.6	Very low	32.5	Very low	120 Å²	120	116 Å²	116	64%	0.642	77%	0.772	S	S	*	*			cis	-153.3	168.3	-1.3	-172.1	13.9	0	0	0	108.2
608	R	35.6	Very low	32.2	Very low	222 Å²	222	119.4 Å²	119.4	84%	0.838	78%	0.776	S	S	*	*			trans	46.1	112.8	167.1	-69.3	162	-142.4	-136	-5.7	118.5
609	G	30.9	Very low	32.1	Very low	68 Å²	68	121.8 Å²	121.8	70%	0.701	77%	0.773	S	S	*	*			cis	137.4	179.8	14.9	0	0	0	0	0	109.2
610	T	36.6	Very low	32	Very low	147 Å²	147	121.9 Å²	121.9	90%	0.902	77%	0.774	S	S	*	*			cis	-179.1	149.6	-15.4	18.9	0	0	0	0	105.8
611	G	27.9	Very low	32	Very low	68 Å²	68	122.5 Å²	122.5	70%	0.701	78%	0.779	S	S	*	*			cis	163.7	170.3	-1.2	0	0	0	0	0	110.4
612	A	33.3	Very low	30.4	Very low	94 Å²	94	121.9 Å²	121.9	78%	0.777	78%	0.784	S	S	*	*			trans	70	139.5	174	0	0	0	0	0	117.6
613	Q	31.5	Very low	30.2	Very low	150 Å²	150	118 Å²	118	70%	0.701	78%	0.784	S	S	*	*			cis	-158.7	162.5	-8	-134.2	160.9	-71.9	0	0	112.1
614	E	29.1	Very low	29.8	Very low	140 Å²	140	119.6 Å²	119.6	65%	0.654	79%	0.788	S	S	*	*			trans	58.3	123.3	159.3	-80.7	130.6	-151	0	0	119.7
615	E	29.6	Very low	29.6	Very low	179 Å²	179	120 Å²	120	84%	0.836	79%	0.785	S	S	*	*				79.4	142.7	69.6	-84.5	-159.2	78.9	0	0	114.5
616	S	28.7	Very low	29.4	Very low	104 Å²	104	120.4 Å²	120.4	73%	0.727	78%	0.781	S	S	*	*			cis	-142.4	175.6	-2.8	55.5	0	0	0	0	109.9
617	G	26.1	Very low	29.2	Very low	67 Å²	67	121.1 Å²	121.1	69%	0.691	78%	0.778	S	S	*	*				82.3	134.4	81.3	0	0	0	0	0	112.5
618	E	28.4	Very low	29	Very low	182 Å²	182	124.7 Å²	124.7	85%	0.85	79%	0.788	S	S	*	*			cis	-160.8	-164.3	-2.8	-128.3	-158.4	110.1	0	0	112.3
619	L	29.6	Very low	28.6	Very low	154 Å²	154	122.1 Å²	122.1	81%	0.806	79%	0.786	S	S	*	*			trans	-65.8	166.9	-172.4	-72.5	86	0	0	0	116.3
620	G	24.9	Very low	28.3	Very low	77 Å²	77	125 Å²	125	79%	0.794	79%	0.79	S	S	*	*			trans	-107.2	159.8	166.1	0	0	0	0	0	114.2
621	A	27.6	Very low	27.7	Very low	112 Å²	112	125.4 Å²	125.4	93%	0.926	78%	0.784	S	S	*	*			trans	-148.8	168.2	174.6	0	0	0	0	0	110.9
622	A	29.3	Very low	28.4	Very low	104 Å²	104	127.8 Å²	127.8	86%	0.86	79%	0.788	S	S	*	*			trans	-136.7	125.4	-172.5	0	0	0	0	0	114.7
623	A	29.1	Very low	28.5	Very low	105 Å²	105	128.2 Å²	128.2	87%	0.868	78%	0.782	S	S	*	*			trans	179.6	167.7	163.1	0	0	0	0	0	108.4
624	C	23.3	Very low	28.1	Very low	124 Å²	124	128 Å²	128	84%	0.838	79%	0.786	S	S	*	*			cis	-162.6	154	-42.9	-169.4	0	0	0	0	106.5
625	S	27.4	Very low	28	Very low	98 Å²	98	125.9 Å²	125.9	69%	0.685	79%	0.792	S	S	*	*			trans	-60.2	143.3	-170.1	54.8	0	0	0	0	117.3
626	C	24.3	Very low	27.8	Very low	114 Å²	114	125.1 Å²	125.1	77%	0.77	79%	0.789	S	S	*	*				164.7	154.3	110.8	-90.4	0	0	0	0	116.7
627	C	28.5	Very low	27.8	Very low	115 Å²	115	125.8 Å²	125.8	78%	0.777	79%	0.793	S	S	*	*			trans	73.2	99.3	153.5	-64.8	0	0	0	0	123.6
628	F	27.3	Very low	27.7	Very low	195 Å²	195	132 Å²	132	86%	0.855	80%	0.801	S	S	*	*				55.7	125	119	-94.6	-92.6	0	0	0	125
629	E	26.2	Very low	27.6	Very low	168 Å²	168	126.2 Å²	126.2	79%	0.785	79%	0.791	S	S	*	*			trans	97.2	150	132.8	-139.4	170.6	-126.6	0	0	122.9
630	V	25.2	Very low	27.6	Very low	129 Å²	129	127.1 Å²	127.1	78%	0.782	79%	0.791	S	S	*	*			trans	85.3	146.6	166.6	-166.4	0	0	0	0	118.6
631	I	24.9	Very low	27.7	Very low	154 Å²	154	129.2 Å²	129.2	79%	0.79	78%	0.784	S	S	*	*			trans	-146.5	158.2	-172.1	-27.1	174.3	0	0	0	109.3
632	P	42.1	Very low	27.8	Very low	119 Å²	119	131 Å²	131	77%	0.773	78%	0.777	S	S	*	*			cis	-94.3	-92.1	-48	20.7	-0.8	0	0	0	111.4
633	P	35.7	Very low	27.8	Very low	102 Å²	102	131.9 Å²	131.9	66%	0.662	77%	0.767	S	S	*	*			cis	-125.3	178.4	-7.8	43.2	-27.1	0	0	0	116.5
634	N	23.1	Very low	27.9	Very low	147 Å²	147	135 Å²	135	79%	0.786	76%	0.764	S	S	*	*			trans	30.8	123.5	152.2	-65.1	6.6	0	0	0	123.8
635	A	27.1	Very low	28.1	Very low	94 Å²	94	133.4 Å²	133.4	78%	0.777	76%	0.76	S	S	*	*				164.3	112.1	110.3	0	0	0	0	0	109.7
636	E	23.9	Very low	28.2	Very low	164 Å²	164	132.1 Å²	132.1	77%	0.766	76%	0.762	S	S	*	*				81.6	93.3	65.2	-76.3	-154.9	93.4	0	0	116.7
637	S	29.3	Very low	29.2	Very low	117 Å²	117	132.7 Å²	132.7	82%	0.818	76%	0.764	S	S	*	*			trans	178.1	123.9	145.1	26.3	0	0	0	0	107.6
638	K	25.4	Very low	29.2	Very low	198 Å²	198	133.9 Å²	133.9	86%	0.861	77%	0.768	S	S	*	*			cis	69.5	117.7	14.7	-152.9	-178.2	-176.1	-178.9	0	113.2
639	G	25.6	Very low	29.3	Very low	61 Å²	61	128.6 Å²	128.6	63%	0.629	76%	0.76	S	S	*	*			cis	-179.9	-143.9	-1	0	0	0	0	0	111.8
640	Q	29.8	Very low	29.4	Very low	172 Å²	172	126.9 Å²	126.9	80%	0.804	77%	0.767	S	S	*	*			trans	81	141.8	170.9	-59.7	-172.5	-99.1	0	0	116.7
641	D	27.1	Very low	29.4	Very low	121 Å²	121	124.3 Å²	124.3	65%	0.647	77%	0.766	S	S	*	*			cis	-157.9	179.1	-2.2	-115.1	-8.2	0	0	0	115
642	L	29	Very low	29.5	Very low	151 Å²	151	125.4 Å²	125.4	79%	0.791	77%	0.768	S	S	*	*			trans	72.9	130.1	179.1	-61.4	103.4	0	0	0	115.8
643	D	29.1	Very low	28.7	Very low	122 Å²	122	123.7 Å²	123.7	65%	0.652	76%	0.757	S	S	*	*			cis	-169.5	163.9	-7.6	-123.7	-18.3	0	0	0	109
644	Q	32	Very low	28.2	Very low	169 Å²	169	126.2 Å²	126.2	79%	0.79	76%	0.76	S	S	*	*			cis	-149.6	-71.3	-9.6	-164.4	164.3	102.6	0	0	113.5
645	A	27.8	Very low	28.3	Very low	92 Å²	92	130.2 Å²	130.2	76%	0.76	76%	0.764	S	S	*	*			trans	-154	157.9	-167.9	0	0	0	0	0	112.3
646	G	29.3	Very low	28.2	Very low	71 Å²	71	129.4 Å²	129.4	73%	0.732	77%	0.766	S	S	*	*			cis	114	168.6	7.3	0	0	0	0	0	112.4
647	P	45.5	Very low	28.3	Very low	125 Å²	125	127.6 Å²	127.6	81%	0.812	77%	0.765	S	S	*	*			cis	-118.4	-171.8	-21	29.9	-7.3	0	0	0	111.5
648	V	28.3	Very low	28.1	Very low	140 Å²	140	128.4 Å²	128.4	85%	0.848	76%	0.761	S	S	*	*				-167.3	-170.5	83.4	161	0	0	0	0	109.7
649	A	29.8	Very low	28	Very low	85 Å²	85	126.7 Å²	126.7	70%	0.702	75%	0.754	S	S	*	*			trans	-147.6	-171.5	-156.3	0	0	0	0	0	115.5
650	S	27.4	Very low	28	Very low	131 Å²	131	131.2 Å²	131.2	92%	0.916	76%	0.758	S	S	*	*			trans	78.8	149.6	-178.9	79	0	0	0	0	115.7
651	G	26.1	Very low	27.7	Very low	75 Å²	75	127.8 Å²	127.8	77%	0.773	75%	0.753	S	S	*	*			cis	173	177.1	-2.4	0	0	0	0	0	110.9
652	H	26.8	Very low	27.6	Very low	178 Å²	178	127.7 Å²	127.7	82%	0.824	76%	0.762	S	S	*	*			cis	-168.5	139.9	-11.9	-175	71.8	0	0	0	111.5
653	C	24.1	Very low	27.5	Very low	82 Å²	82	125.9 Å²	125.9	55%	0.554	76%	0.762	S	S	*	*			trans	60.9	124.2	159.8	-83.6	0	0	0	0	125.5
654	Q	26.4	Very low	27.7	Very low	155 Å²	155	124.7 Å²	124.7	72%	0.724	76%	0.761	S	S	*	*				72.6	121.9	125.3	-66	-177.2	12.4	0	0	124.8
655	R	24.6	Very low	27.5	Very low	231 Å²	231	125.7 Å²	125.7	87%	0.872	76%	0.763	S	S	*	*				55.9	116	124.7	-172.1	-166.9	-73.8	172.1	-4.3	120
656	G	24.8	Very low	27.3	Very low	78 Å²	78	127.2 Å²	127.2	80%	0.804	76%	0.758	S	S	*	*			trans	-166.9	144.5	159.5	0	0	0	0	0	112.1
657	V	25.8	Very low	27.1	Very low	125 Å²	125	133.8 Å²	133.8	76%	0.758	76%	0.762	S	S	*	*			trans	-109.6	156.2	-170.4	-140.2	0	0	0	0	112.1
658	D	25.1	Very low	26.2	Very low	135 Å²	135	137.4 Å²	137.4	72%	0.722	77%	0.766	S	S	*	*			trans	79	144.9	143.7	-81.2	-39.6	0	0	0	124.2
659	F	24.4	Very low	26	Very low	162 Å²	162	136.5 Å²	136.5	71%	0.711	76%	0.761	S	S	*	*			trans	73.1	113.8	151.1	-94.2	-109.8	0	0	0	124
660	Q	25.1	Very low	26.2	Very low	155 Å²	155	138 Å²	138	72%	0.724	76%	0.763	S	S	*	*			trans	48.9	113.4	131.2	-70.7	-170.6	-14.2	0	0	122.1
661	S	23.3	Very low	26	Very low	101 Å²	101	139.3 Å²	139.3	71%	0.706	76%	0.755	S	S	*	*			trans	40.3	120.6	132.1	65.9	0	0	0	0	121
662	S	24.4	Very low	26	Very low	119 Å²	119	143.2 Å²	143.2	83%	0.832	75%	0.753	S	S	*	*				-173.2	139.4	102.2	37.8	0	0	0	0	112.5
663	S	26.9	Very low	25.9	Very low	112 Å²	112	142.5 Å²	142.5	78%	0.783	75%	0.754	S	S	*	*			trans	-82.2	154.9	160.6	58.8	0	0	0	0	109.5
664	P	34.7	Very low	26	Very low	98 Å²	98	148.6 Å²	148.6	64%	0.636	77%	0.767	S	S	*	*				-153.7	148.6	108	36.3	-19	0	0	0	116.9
665	K	26.4	Very low	26.2	Very low	190 Å²	190	146.7 Å²	146.7	83%	0.826	77%	0.768	S	S	*	*			trans	68	161	152.5	-62.7	158.1	-174.9	174.8	0	118
666	N	24.6	Very low	26.5	Very low	124 Å²	124	141.8 Å²	141.8	66%	0.663	77%	0.766	S	S	*	*			cis	173.3	146.4	-44.9	-101.4	16.5	0	0	0	107.2
667	Y	24.3	Very low	26.6	Very low	209 Å²	209	143 Å²	143	82%	0.82	76%	0.762	S	S	*	*			trans	66.2	126.6	179.8	-48.6	-72.7	0	0	0	113.3
668	F	26.5	Very low	26.7	Very low	200 Å²	200	146.4 Å²	146.4	88%	0.877	77%	0.77	S	S	*	*			cis	-139.8	162.3	46.7	-108.6	-102	0	0	0	114
669	T	24.5	Very low	26.9	Very low	122 Å²	122	148.4 Å²	148.4	75%	0.748	78%	0.775	S	S	*	*			trans	-121.7	152.8	163.1	50.1	0	0	0	0	108.7
670	P	33.1	Very low	27	Very low	116 Å²	116	147 Å²	147	75%	0.753	78%	0.779	S	S	*	*				-146	141.9	92.1	35.5	-17.9	0	0	0	117.3
671	E	23.6	Very low	26.9	Very low	159 Å²	159	145.3 Å²	145.3	74%	0.743	79%	0.785	S	S	*	*			trans	67.3	145.8	141.6	-62.4	-159.3	105.7	0	0	125.4
672	H	25.6	Very low	27.1	Very low	157 Å²	157	150.7 Å²	150.7	73%	0.727	79%	0.791	S	S	*	*			trans	58.7	104.8	162.3	-57.1	-40.3	0	0	0	120.8
673	L	25.5	Very low	27.2	Very low	162 Å²	162	154.5 Å²	154.5	85%	0.848	80%	0.796	S	S	*	*				-171	174.5	106.5	-96.1	162.8	0	0	0	111.6
674	Y	25.6	Very low	27.3	Very low	211 Å²	211	152.5 Å²	152.5	83%	0.827	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-59.1	149.2	-169.8	-73.9	-102.6	0	0	0	116.1
675	P	30.9	Very low	27	Very low	115 Å²	115	155.6 Å²	155.6	75%	0.747	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-86	145.9	165.3	35.3	-33.1	0	0	0	112.7
676	P	32.1	Very low	27.1	Very low	128 Å²	128	152.1 Å²	152.1	83%	0.831	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-91.2	171.9	172.1	37.1	-35.1	0	0	0	113.2
677	S	27	Very low	27.3	Very low	104 Å²	104	152.1 Å²	152.1	73%	0.727	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-83.8	148.6	173	55.8	0	0	0	0	113.5
678	E	27.3	Very low	27.4	Very low	195 Å²	195	147.5 Å²	147.5	91%	0.911	81%	0.805	S	S	*	*			trans	-126.4	146.6	155.6	-76.3	-165.6	131.2	0	0	111.5
679	Q	28.6	Very low	27.4	Very low	177 Å²	177	148.2 Å²	148.2	83%	0.827	81%	0.808	S	S	*	*			trans	-107	120.4	-180	-66.6	166.6	-17.2	0	0	107.6
680	V	27.4	Very low	27.6	Very low	132 Å²	132	153.3 Å²	153.3	80%	0.8	82%	0.816	S	S	*	*				48.7	99	93.1	-175.8	0	0	0	0	112.6
681	S	23.2	Very low	27.2	Very low	121 Å²	121	157 Å²	157	85%	0.846	82%	0.82	S	S	*	*			trans	-81.8	162	168	52.1	0	0	0	0	112.1
682	Y	27.1	Very low	27.4	Very low	214 Å²	214	156.4 Å²	156.4	84%	0.839	82%	0.817	S	S	*	*			trans	-122.7	109.7	-168	-128.4	-86.9	0	0	0	112.2
683	E	27.1	Very low	27.5	Very low	198 Å²	198	156.8 Å²	156.8	93%	0.925	82%	0.821	S	S	*	*			trans	-150	143.8	159.3	-68.6	-165.4	155.7	0	0	107.7
684	G	27.8	Very low	27.7	Very low	71 Å²	71	156 Å²	156	73%	0.732	81%	0.811	S	S	*	*			cis	-167.8	139.5	-10.3	0	0	0	0	0	108.9
685	L	28.9	Very low	28.1	Very low	163 Å²	163	151.9 Å²	151.9	85%	0.853	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-98.5	134.9	-170.7	-72.4	169.7	0	0	0	113.3
686	P	29.2	Very low	27.9	Very low	117 Å²	117	154.6 Å²	154.6	76%	0.76	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-81.3	127.1	166.3	31.9	-31.7	0	0	0	111.3
687	C	27.2	Very low	27.9	Very low	124 Å²	124	159.7 Å²	159.7	84%	0.838	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-73	137.5	-177.7	-59.3	0	0	0	0	113
688	C	27.8	Very low	28.1	Very low	111 Å²	111	159.4 Å²	159.4	75%	0.75	82%	0.816	S	S	*	*			trans	-119	134.9	169.2	-73.2	0	0	0	0	110.9
689	F	26	Very low	28.4	Very low	215 Å²	215	155 Å²	155	94%	0.943	81%	0.813	S	S	*	*			trans	-75.6	132.3	-179.8	-76.5	-98.4	0	0	0	111.9
690	Y	28.2	Very low	28.8	Very low	230 Å²	230	151.9 Å²	151.9	90%	0.902	82%	0.818	S	S	*	*			trans	-90.8	132.1	166	-75.1	-91.5	0	0	0	110.6
691	K	25.7	Very low	29	Very low	192 Å²	192	149.4 Å²	149.4	84%	0.835	82%	0.819	S	S	*	*			trans	-112.3	99.3	162.3	-175.1	174.3	-178.4	175.9	0	108.8	M693	K691-M693 PolarHBondContact O-N 3.21Å
692	E	28.1	Very low	29.6	Very low	147 Å²	147	151.7 Å²	151.7	69%	0.687	82%	0.816	S	S	*	*			trans	-65	132.2	172	-169.7	-174	-111	0	0	109.6	K694	E692-K694 WeakPolarHBondContact OE2-CE 3.33Å; E692-K694 IonicContact OE2-NZ 3.59Å; E692-K694 PolarHBondContact OE2-NZ 3.35Å
693	M	27.8	Very low	29.8	Very low	165 Å²	165	151.1 Å²	151.1	81%	0.813	81%	0.814	S	S	*	*			trans	-125.7	86.5	179.6	-166.8	163.1	-177.6	0	0	109.9	K691 V695	K691-M693 PolarHBondContact O-N 3.21Å; M693-V695 PolarHBondContact O-N 2.91Å; M693-V695 VanDerWaalsContact O-N 3.15Å
694	K	28.8	Very low	30.1	Very low	147 Å²	147	147.8 Å²	147.8	64%	0.639	81%	0.807	S	S	*	*			trans	-63.1	110.1	178.5	-77.1	179.3	164.8	104.9	0	111.1	E692 H696	E692-K694 WeakPolarHBondContact OE2-CE 3.33Å; E692-K694 IonicContact OE2-NZ 3.59Å; E692-K694 PolarHBondContact OE2-NZ 3.35Å; K694-H696 PolarHBondContact O-N 3.44Å
695	V	33.3	Very low	30.6	Very low	124 Å²	124	151.7 Å²	151.7	75%	0.752	81%	0.806	S	S	*	*			trans	-82	93.5	169.7	-178.6	0	0	0	0	108.7	M693 R697	M693-V695 PolarHBondContact O-N 2.91Å; M693-V695 VanDerWaalsContact O-N 3.15Å; V695-R697 PolarHBondContact O-N 2.87Å; V695-R697 VanDerWaalsContact O-N 3.16Å
696	H	26.7	Very low	30.8	Very low	172 Å²	172	150.8 Å²	150.8	80%	0.796	80%	0.802	S	S	*	*			trans	-68	109.6	169.4	-77.1	-71.9	0	0	0	110.3	K694	K694-H696 PolarHBondContact O-N 3.44Å
697	R	32.3	Very low	31.5	Very low	235 Å²	235	152.9 Å²	152.9	89%	0.887	80%	0.796	S	S	*	*			trans	-95.6	131.5	154.6	-81.4	-175	170.1	140	-1.8	108.9	V695	V695-R697 PolarHBondContact O-N 2.87Å; V695-R697 VanDerWaalsContact O-N 3.16Å
698	A	31.7	Very low	31.9	Very low	98 Å²	98	151.4 Å²	151.4	81%	0.81	79%	0.793	S	S	*	*			trans	-90.1	167.1	171.5	0	0	0	0	0	111
699	A	34.5	Very low	32.3	Very low	101 Å²	101	149.5 Å²	149.5	84%	0.835	78%	0.778	S	S	*	*	S	Bend	trans	71.9	102.9	174.3	0	0	0	0	0	117.7
700	A	36.7	Very low	32.4	Very low	113 Å²	113	143.1 Å²	143.1	93%	0.934	75%	0.753	S	S	*	*			trans	16.8	119.2	147.5	0	0	0	0	0	120.7
701	G	31.1	Very low	32.7	Very low	80 Å²	80	135.9 Å²	135.9	83%	0.825	73%	0.733	S	S	*	*			trans	179.9	139	162.5	0	0	0	0	0	111.5
702	H	35	Very low	32.7	Very low	169 Å²	169	135.1 Å²	135.1	78%	0.782	73%	0.732	S	S	*	*			trans	-87.4	140.2	-179.9	-93.8	-100.5	0	0	0	112.3
703	Y	31.6	Very low	32.8	Very low	201 Å²	201	135.1 Å²	135.1	79%	0.788	73%	0.727	S	S	*	*			trans	54.8	107.1	165.6	-55.2	-67.5	0	0	0	118.9
704	T	33.8	Very low	32.9	Very low	129 Å²	129	131.9 Å²	131.9	79%	0.791	73%	0.727	S	S	*	*				-178.2	142.6	91.4	38.1	0	0	0	0	110
705	E	38	Very low	32.9	Very low	153 Å²	153	132.8 Å²	132.8	72%	0.715	73%	0.733	S	S	*	*			trans	-90.3	110.5	174.6	-66.9	-178	137.2	0	0	111	Y707	E705-Y707 HydrophobicContact CB-CD2 4.13Å; E705-Y707 HydrophobicContact CB-CE2 3.72Å; E705-Y707 WeakPolarHBondContact O-CD2 3.24Å; E705-Y707 PolarHBondContact O-N 3.21Å; E705-Y707 PolarHBondContact OE2-OH 3Å
706	D	33.9	Very low	32.8	Very low	143 Å²	143	132 Å²	132	77%	0.765	73%	0.733	S	S	*	*			trans	-74.5	85.1	178.3	-90.6	-37.2	0	0	0	111.6	A708	D706-A708 PolarHBondContact O-N 3.43Å; D706-A708 VanDerWaalsContact O-N 3.08Å
707	Y	44.1	Very low	33	Very low	161 Å²	161	131.2 Å²	131.2	63%	0.631	73%	0.734	S	S	*	*			trans	-73.4	95.6	174.1	-74	-77.9	0	0	0	112.4	E705 V709	E705-Y707 HydrophobicContact CB-CD2 4.13Å; E705-Y707 HydrophobicContact CB-CE2 3.72Å; E705-Y707 WeakPolarHBondContact O-CD2 3.24Å; E705-Y707 PolarHBondContact O-N 3.21Å; E705-Y707 PolarHBondContact OE2-OH 3Å; Y707-V709 PolarHBondContact O-N 3.5Å
708	A	35.7	Very low	32.8	Very low	94 Å²	94	125.6 Å²	125.6	78%	0.777	73%	0.732	S	S	*	*			trans	-81.9	101.4	173.9	0	0	0	0	0	112.2	D706	D706-A708 PolarHBondContact O-N 3.43Å; D706-A708 VanDerWaalsContact O-N 3.08Å
709	V	34.8	Very low	32.9	Very low	71 Å²	71	128.8 Å²	128.8	43%	0.43	74%	0.735	S	S	.	*			trans	-80.3	126.8	165	-177.2	0	0	0	0	108.7	D89 Y707	D89-V709 HydrophobicContact CB-CG1 3.99Å; Y707-V709 PolarHBondContact O-N 3.5Å
710	N	29.6	Very low	32.6	Very low	80 Å²	80	128.1 Å²	128.1	43%	0.428	73%	0.729	S	S	.	*			trans	-119.1	95	-173.8	-175.6	86.1	0	0	0	110.7	R110 Q712	R110-N710 PolarHBondContact NH1-OD1 3.41Å; N710-Q712 PolarHBondContact O-N 2.89Å
711	V	33.2	Very low	32.1	Very low	79 Å²	79	129.5 Å²	129.5	48%	0.479	73%	0.73	S	S	.	*	P	Polyproline II helix	trans	-59.8	123.2	-178.4	-178	0	0	0	0	110.8
712	Q	26.1	Very low	32	Very low	175 Å²	175	131.6 Å²	131.6	82%	0.818	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-102.6	129.3	163.7	-77.5	-177.9	-68.1	0	0	109.4	N710	N710-Q712 PolarHBondContact O-N 2.89Å
713	Y	30.8	Very low	31.5	Very low	148 Å²	148	127 Å²	127	58%	0.58	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-79.3	120.6	165.9	-63.8	-89.1	0	0	0	108
714	A	30.2	Very low	31.5	Very low	97 Å²	97	127.2 Å²	127.2	80%	0.802	74%	0.739	S	S	*	*			trans	-84.9	114.3	167.8	0	0	0	0	0	108.3
715	H	28.5	Very low	31.1	Very low	166 Å²	166	124.7 Å²	124.7	77%	0.769	74%	0.739	S	S	*	*			trans	-70.6	136.1	158.9	-110.7	-104.1	0	0	0	108.2
716	S	30	Very low	30.5	Very low	108 Å²	108	123.4 Å²	123.4	76%	0.755	75%	0.746	S	S	*	*			trans	-97.5	102.2	168.7	53.7	0	0	0	0	108.3	S718	S716-S718 PolarHBondContact O-N 3.34Å
717	D	30.9	Very low	30.3	Very low	154 Å²	154	122.6 Å²	122.6	82%	0.824	75%	0.75	S	S	*	*			trans	-79.7	115.8	175.2	-63.8	-34.1	0	0	0	109.8
718	S	29.4	Very low	29.6	Very low	118 Å²	118	122.8 Å²	122.8	83%	0.825	76%	0.756	S	S	*	*			trans	-142.3	142.6	159	59.8	0	0	0	0	108.8	S716	S716-S718 PolarHBondContact O-N 3.34Å
719	D	32.5	Very low	29.2	Very low	165 Å²	165	125.6 Å²	125.6	88%	0.882	76%	0.758	S	S	*	*			trans	-92.6	161.4	-149.1	-133.8	-35.2	0	0	0	115.4
720	A	29.7	Very low	28.9	Very low	87 Å²	87	128.6 Å²	128.6	72%	0.719	77%	0.771	S	S	*	*			trans	58.1	103.4	158.6	0	0	0	0	0	120.4
721	C	25.1	Very low	28.8	Very low	141 Å²	141	132.1 Å²	132.1	95%	0.953	79%	0.785	S	S	*	*				-144.6	149.9	127.4	-121.3	0	0	0	0	110.7
722	S	28.2	Very low	28.6	Very low	124 Å²	124	139.9 Å²	139.9	87%	0.867	81%	0.805	S	S	*	*			trans	-122.5	143.9	-169.1	50.4	0	0	0	0	112.7
723	G	26.3	Very low	28.7	Very low	73 Å²	73	137.9 Å²	137.9	75%	0.753	80%	0.799	S	S	*	*			trans	145.9	90.7	168	0	0	0	0	0	117.6
724	Q	29.9	Very low	28.8	Very low	205 Å²	205	136.6 Å²	136.6	96%	0.958	81%	0.808	S	S	*	*				48.4	112.4	125.1	-171.2	175	5.3	0	0	120.4
725	G	26.2	Very low	28.7	Very low	77 Å²	77	138.5 Å²	138.5	79%	0.794	80%	0.804	S	S	*	*			trans	158.2	117.9	155.3	0	0	0	0	0	116
726	C	26.2	Very low	29	Very low	126 Å²	126	138 Å²	138	85%	0.851	81%	0.805	S	S	*	*			trans	-63.8	151.5	-179.5	-52.4	0	0	0	0	114.4
727	C	28.1	Very low	29.2	Very low	126 Å²	126	137.5 Å²	137.5	85%	0.851	80%	0.8	S	S	*	*				-167.2	127.2	106.1	-96.9	0	0	0	0	111.3
728	E	29.6	Very low	29.3	Very low	165 Å²	165	138.4 Å²	138.4	77%	0.771	80%	0.799	S	S	*	*			trans	-79.1	144.2	163.8	-71.3	-170.6	96.2	0	0	110.4	N730	E728-N730 PolarHBondContact OE1-ND2 2.83Å
729	L	27.9	Very low	29.3	Very low	153 Å²	153	140.7 Å²	140.7	80%	0.801	80%	0.802	S	S	*	*			trans	-146.6	69.7	160.1	-120.8	159.5	0	0	0	110.7	H731	L729-H731 PolarHBondContact O-N 3.45Å; L729-H731 VanDerWaalsContact O-N 3.1Å
730	N	29	Very low	29.3	Very low	133 Å²	133	138.4 Å²	138.4	71%	0.711	79%	0.794	S	S	*	*			trans	-61	108	170	-90	-63	0	0	0	110.1	E728	E728-N730 PolarHBondContact OE1-ND2 2.83Å
731	H	27.4	Very low	29.4	Very low	154 Å²	154	141.6 Å²	141.6	71%	0.713	80%	0.799	S	S	*	*			trans	-130.4	99.6	164	-95.1	51	0	0	0	109.9	L729	L729-H731 PolarHBondContact O-N 3.45Å; L729-H731 VanDerWaalsContact O-N 3.1Å
732	R	28.2	Very low	29.6	Very low	242 Å²	242	141.5 Å²	141.5	91%	0.913	80%	0.798	S	S	*	*			trans	-76.8	123.6	162	-73.5	-175	176.4	-165.5	-0.1	108.3
733	I	28.6	Very low	30	Very low	134 Å²	134	143.8 Å²	143.8	69%	0.687	80%	0.795	S	S	*	*			trans	-114.2	108.4	163.4	-55.4	179.8	0	0	0	107	I735	I733-I735 HydrophobicContact CG2-CD1 4.22Å; I733-I735 HydrophobicContact CG2-CG1 4.12Å
734	P	32.5	Very low	30.3	Very low	120 Å²	120	149.2 Å²	149.2	78%	0.779	80%	0.803	S	S	*	*			trans	-86.1	120.8	176.6	32.4	-29.8	0	0	0	110
735	I	28.2	Very low	30.5	Very low	138 Å²	138	142.9 Å²	142.9	71%	0.708	79%	0.793	S	S	*	*			trans	-134.2	96.4	167.9	-53	-179.7	0	0	0	109	I733 P737	I733-I735 HydrophobicContact CG2-CD1 4.22Å; I733-I735 HydrophobicContact CG2-CG1 4.12Å; I735-P737 HydrophobicContact CG2-CG 4.12Å
736	I	35.7	Very low	30.7	Very low	154 Å²	154	151.1 Å²	151.1	79%	0.79	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-98.3	120.1	145	-63.4	171.8	0	0	0	104.5
737	P	34.3	Very low	31	Very low	99 Å²	99	152.4 Å²	152.4	64%	0.643	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-77.6	127.5	157.1	-1.9	21.4	0	0	0	107.7	I735	I735-P737 HydrophobicContact CG2-CG 4.12Å
738	E	31.3	Very low	31.1	Very low	172 Å²	172	153.8 Å²	153.8	80%	0.804	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-83.7	122.1	163.1	-65.3	-176	142.6	0	0	107.7	T740	E738-T740 PolarHBondContact O-N 2.7Å
739	D	31.2	Very low	31.2	Very low	166 Å²	166	153.2 Å²	153.2	89%	0.888	82%	0.817	S	S	*	*			trans	-67.6	114	176.6	-71.3	-49	0	0	0	109.6
740	T	32.7	Very low	31.4	Very low	118 Å²	118	153.2 Å²	153.2	72%	0.724	82%	0.818	S	S	*	*			trans	-131.2	141.1	167.9	27.6	0	0	0	0	110.6	E738	E738-T740 PolarHBondContact O-N 2.7Å
741	D	30.6	Very low	31.5	Very low	154 Å²	154	154.4 Å²	154.4	82%	0.824	83%	0.825	S	S	*	*			trans	59.7	103.3	165.5	-54.6	-16.4	0	0	0	119.8
742	C	29.4	Very low	31.8	Very low	139 Å²	139	154.5 Å²	154.5	94%	0.939	83%	0.832	S	S	*	*			trans	-148.3	105.3	139.7	-104.4	0	0	0	0	109.8
743	E	36	Very low	32.1	Very low	172 Å²	172	148.2 Å²	148.2	80%	0.804	83%	0.826	S	S	*	*			trans	-80.1	173.6	164.2	-89.8	-158.3	131.6	0	0	111.7
744	M	33.5	Very low	32.3	Very low	186 Å²	186	149.3 Å²	149.3	92%	0.916	84%	0.837	S	S	*	*			trans	73.6	131.7	176.4	-62.3	166.4	-87.3	0	0	115.7
745	G	34.8	Very low	32.3	Very low	73 Å²	73	151.8 Å²	151.8	75%	0.753	84%	0.842	S	S	*	*			cis	150.8	121.7	-11.1	0	0	0	0	0	113.6
746	L	30.2	Very low	32.7	Very low	250 Å²	250	153 Å²	153	100%	1.309	85%	0.854	S	S	*	*			trans	-168.8	0	156.2	-108	165.8	0	0	0	109.5

Retrieved 746 of 746 residues in 303.7 ms (Link to these results)

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