A0A077ZAQ7_TRITR Loading...

Putative transcriptional regulator

AlphaFold DB , UniProt , Accession A0A077ZAQ7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 570 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.1	Very low	26.5	Very low	241 Å²	241	151.1 Å²	151.1	100%	1.187	80%	0.801	S	S	*	*				0	153.2	0	-83.7	-177.7	165	0	0	108.6
2	N	26.2	Very low	26.4	Very low	158 Å²	158	148 Å²	148	85%	0.845	79%	0.785	S	S	*	*			trans	-89.7	136.9	-165.3	-55.6	-9.6	0	0	0	111.9
3	L	23.3	Very low	26.6	Very low	154 Å²	154	142.5 Å²	142.5	81%	0.806	77%	0.773	S	S	*	*			trans	-139	151.9	156.8	-75.9	173.8	0	0	0	107.5
4	F	29	Very low	26.6	Very low	203 Å²	203	145.6 Å²	145.6	89%	0.89	77%	0.77	S	S	*	*			trans	68.4	64	-176.4	-53.1	-71.4	0	0	0	115.9
5	S	23.6	Very low	26.6	Very low	119 Å²	119	146.5 Å²	146.5	83%	0.832	77%	0.769	S	S	*	*			trans	-100.7	131.4	153.3	54.3	0	0	0	0	109.6
6	G	24.8	Very low	26.6	Very low	69 Å²	69	142.8 Å²	142.8	71%	0.711	77%	0.765	S	S	*	*			trans	98.3	148.1	-173.1	0	0	0	0	0	112.2
7	E	27.3	Very low	26.7	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	75%	0.754	S	S	*	*			cis	-133.7	138.4	12.6	-73.2	-174.5	132.2	0	0	113.9
8	I	26.3	Very low	26.7	Very low	141 Å²	141	136.3 Å²	136.3	72%	0.723	73%	0.733	S	S	*	*			trans	57.7	96.1	146.6	-53.2	169.7	0	0	0	117.5	N10	I8-N10 PolarHBondContact O-N 3.45Å
9	Y	24.9	Very low	26.9	Very low	223 Å²	223	136.5 Å²	136.5	88%	0.875	73%	0.732	S	S	*	*			trans	-54.4	120.1	144.2	-96	-115.4	0	0	0	109.2	A11	Y9-A11 PolarHBondContact O-N 3.27Å
10	N	26.4	Very low	27.1	Very low	115 Å²	115	135.6 Å²	135.6	62%	0.615	72%	0.723	S	S	*	*			trans	-91.6	75.2	167.7	-165.4	-8.3	0	0	0	109.7	I8 D12	I8-N10 PolarHBondContact O-N 3.45Å; N10-D12 PolarHBondContact O-N 3.12Å
11	A	27	Very low	27.3	Very low	59 Å²	59	136.3 Å²	136.3	49%	0.488	72%	0.716	S	S	.	*	G	3₁₀ helix	trans	-67.3	-23.1	-173.5	0	0	0	0	0	113.6	Y9 A13 Y14	Y9-A11 PolarHBondContact O-N 3.27Å; A11-A13 PolarHBondContact O-N 3.06Å; A11-Y14 PolarHBondContact O-N 2.77Å
12	D	26.4	Very low	27.1	Very low	114 Å²	114	128.3 Å²	128.3	61%	0.61	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-68.7	-20.6	-175.9	-59.8	-33.9	0	0	0	112.8	N10 Y14 Q15	N10-D12 PolarHBondContact O-N 3.12Å; D12-Y14 PolarHBondContact O-N 2.84Å; D12-Y14 VanDerWaalsContact O-N 3.16Å; D12-Q15 PolarHBondContact O-N 2.88Å
13	A	28.6	Very low	27.3	Very low	76 Å²	76	127.2 Å²	127.2	63%	0.628	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-63.9	-16.6	175.1	0	0	0	0	0	114.1	A11	A11-A13 PolarHBondContact O-N 3.06Å
14	Y	26.9	Very low	27.8	Very low	187 Å²	187	123.9 Å²	123.9	73%	0.733	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-93.5	-6.2	177.8	-88.1	-88.2	0	0	0	114.5	A11 D12 A16	A11-Y14 PolarHBondContact O-N 2.77Å; D12-Y14 PolarHBondContact O-N 2.84Å; D12-Y14 VanDerWaalsContact O-N 3.16Å; Y14-A16 PolarHBondContact O-N 2.92Å
15	Q	26.8	Very low	28	Very low	159 Å²	159	121.8 Å²	121.8	74%	0.743	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	1.9	-178.3	-62.6	-171.1	20.9	0	0	114.3	D12	D12-Q15 PolarHBondContact O-N 2.88Å
16	A	26.5	Very low	28.4	Very low	86 Å²	86	117.1 Å²	117.1	71%	0.711	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	13.4	-177.4	0	0	0	0	0	114.6	Y14 P18	Y14-A16 PolarHBondContact O-N 2.92Å; A16-P18 WeakPolarHBondContact O-CD 3.44Å
17	L	27.9	Very low	28.9	Very low	112 Å²	112	117.1 Å²	117.1	59%	0.586	60%	0.604	S	S	*	*	S	Bend	trans	-63.9	122.9	165.3	-92.4	166.7	0	0	0	108.9	I19 W21	L17-I19 PolarHBondContact O-N 3.11Å; L17-W21 HydrophobicContact CD2-CE3 4.06Å; L17-W21 HydrophobicContact CD2-CZ3 4.35Å
18	P	26.8	Very low	29.2	Very low	58 Å²	58	114.3 Å²	114.3	38%	0.377	59%	0.592	S	S	.	*			trans	-61.6	125.8	-178.6	-23.1	33.6	0	0	0	110.7	A16 H20 W21	A16-P18 WeakPolarHBondContact O-CD 3.44Å; P18-H20 HydrophobicContact CB-CB 4.14Å; P18-H20 PolarHBondContact O-N 3.05Å; P18-H20 VanDerWaalsContact O-N 3.13Å; P18-W21 HydrophobicContact CB-CG 4.42Å; P18-W21 HydrophobicContact CG-CD2 4.31Å; P18-W21 HydrophobicContact CG-CG 4.46Å; P18-W21 WeakPolarHBondContact O-CB 3.01Å; P18-W21 PolarHBondContact O-N 2.73Å
19	I	30.9	Very low	29.8	Very low	139 Å²	139	115.2 Å²	115.2	71%	0.713	59%	0.587	S	S	*	*	H	α-helix	trans	-54.1	-33.6	170.8	-64.3	173.2	0	0	0	109.8	L17 W21 A22 Q23	L17-I19 PolarHBondContact O-N 3.11Å; I19-W21 VanDerWaalsContact C-N 3.32Å; I19-W21 PolarHBondContact O-N 3.49Å; I19-A22 PolarHBondContact O-N 2.88Å; I19-A22 VanDerWaalsContact O-N 3.17Å; I19-Q23 WeakPolarHBondContact O-CB 3.46Å; I19-Q23 PolarHBondContact O-N 3.41Å
20	H	31	Very low	30.4	Very low	118 Å²	118	108.5 Å²	108.5	55%	0.546	56%	0.562	S	S	.	*	H	α-helix	trans	-50.2	-42.6	170.2	-160.3	-78.5	0	0	0	114	P18 Q23 E24	P18-H20 HydrophobicContact CB-CB 4.14Å; P18-H20 PolarHBondContact O-N 3.05Å; P18-H20 VanDerWaalsContact O-N 3.13Å; H20-Q23 CarbonylContact O-C 3.57Å; H20-Q23 WeakPolarHBondContact O-CB 3.34Å; H20-Q23 PolarHBondContact O-N 3.11Å; H20-E24 VanDerWaalsContact CE1-CD 3.42Å; H20-E24 IonicContact CE1-OE1 3.51Å; H20-E24 IonicContact CE1-OE2 2.67Å; H20-E24 PolarHBondContact CE1-OE2 3.48Å; H20-E24 IonicContact CG-OE2 2.72Å; H20-E24 VanDerWaalsContact ND1-CD 3.26Å; H20-E24 IonicContact ND1-OE1 3.15Å; H20-E24 IonicContact ND1-OE2 2.79Å; H20-E24 PolarHBondContact ND1-OE2 2.96Å; H20-E24 WeakPolarHBondContact O-CG 3.43Å; H20-E24 PolarHBondContact O-N 3.03Å
21	W	31.3	Very low	31.2	Very low	151 Å²	151	106.8 Å²	106.8	57%	0.572	55%	0.551	S	S	*	*	H	α-helix	trans	-70.2	-38.1	178.9	-84.4	-3.1	0	0	0	112.4	L17 P18 I19 Q23 W25	L17-W21 HydrophobicContact CD2-CE3 4.06Å; L17-W21 HydrophobicContact CD2-CZ3 4.35Å; P18-W21 HydrophobicContact CB-CG 4.42Å; P18-W21 HydrophobicContact CG-CD2 4.31Å; P18-W21 HydrophobicContact CG-CG 4.46Å; P18-W21 WeakPolarHBondContact O-CB 3.01Å; P18-W21 PolarHBondContact O-N 2.73Å; I19-W21 VanDerWaalsContact C-N 3.32Å; I19-W21 PolarHBondContact O-N 3.49Å; W21-Q23 VanDerWaalsContact C-N 3.25Å; W21-Q23 PolarHBondContact O-N 3.42Å; W21-W25 VanDerWaalsContact O-CB 3.3Å; W21-W25 WeakPolarHBondContact O-CB 3.3Å; W21-W25 VanDerWaalsContact O-CD1 3.31Å; W21-W25 PolarHBondContact O-N 3.49Å
22	A	27.3	Very low	32	Very low	73 Å²	73	109.2 Å²	109.2	60%	0.603	55%	0.551	S	S	*	*	H	α-helix	trans	-64.2	-35.5	171.9	0	0	0	0	0	111.2	I19 G26	I19-A22 PolarHBondContact O-N 2.88Å; I19-A22 VanDerWaalsContact O-N 3.17Å; A22-G26 PolarHBondContact O-N 3.37Å
23	Q	30.5	Very low	32.5	Very low	136 Å²	136	105.7 Å²	105.7	64%	0.636	54%	0.538	S	S	*	.	H	α-helix	trans	-70	-44.8	177.5	-141.8	165.8	0.3	0	0	112.1	I19 H20 W21 S27	I19-Q23 WeakPolarHBondContact O-CB 3.46Å; I19-Q23 PolarHBondContact O-N 3.41Å; H20-Q23 CarbonylContact O-C 3.57Å; H20-Q23 WeakPolarHBondContact O-CB 3.34Å; H20-Q23 PolarHBondContact O-N 3.11Å; W21-Q23 VanDerWaalsContact C-N 3.25Å; W21-Q23 PolarHBondContact O-N 3.42Å; Q23-S27 VanDerWaalsContact O-CB 3.25Å; Q23-S27 WeakPolarHBondContact O-CB 3.29Å; Q23-S27 PolarHBondContact O-N 3.34Å
24	E	33.1	Very low	33.1	Very low	83 Å²	83	106.2 Å²	106.2	39%	0.388	53%	0.526	S	S	.	.	H	α-helix	trans	-66.1	-45.3	174.7	-76.7	176.9	111.3	0	0	112.5	H20 S27 M28	H20-E24 VanDerWaalsContact CE1-CD 3.42Å; H20-E24 IonicContact CE1-OE1 3.51Å; H20-E24 IonicContact CE1-OE2 2.67Å; H20-E24 PolarHBondContact CE1-OE2 3.48Å; H20-E24 IonicContact CG-OE2 2.72Å; H20-E24 VanDerWaalsContact ND1-CD 3.26Å; H20-E24 IonicContact ND1-OE1 3.15Å; H20-E24 IonicContact ND1-OE2 2.79Å; H20-E24 PolarHBondContact ND1-OE2 2.96Å; H20-E24 WeakPolarHBondContact O-CG 3.43Å; H20-E24 PolarHBondContact O-N 3.03Å; E24-S27 PolarHBondContact O-N 3.49Å; E24-M28 HydrophobicContact CB-CE 4.22Å; E24-M28 WeakPolarHBondContact O-CB 3.46Å; E24-M28 PolarHBondContact O-N 2.89Å
25	W	33.7	Very low	33.8	Very low	160 Å²	160	103.5 Å²	103.5	61%	0.606	52%	0.52	S	S	*	.	H	α-helix	trans	-66.8	-37.3	176.7	-84.4	56.7	0	0	0	112.1	W21 R29	W21-W25 VanDerWaalsContact O-CB 3.3Å; W21-W25 WeakPolarHBondContact O-CB 3.3Å; W21-W25 VanDerWaalsContact O-CD1 3.31Å; W21-W25 PolarHBondContact O-N 3.49Å; W25-R29 WeakPolarHBondContact O-CB 3.24Å; W25-R29 WeakPolarHBondContact O-CG 3.42Å; W25-R29 PolarHBondContact O-N 3.47Å; W25-R29 VanDerWaalsContact O-N 3.11Å
26	G	31.2	Very low	34.3	Very low	20 Å²	20	101.5 Å²	101.5	21%	0.206	51%	0.511	C	S	.	.	H	α-helix	trans	-61.6	-48.8	171.3	0	0	0	0	0	111.5	A22 R29 F30	A22-G26 PolarHBondContact O-N 3.37Å; G26-R29 PolarHBondContact O-N 2.83Å; G26-F30 VanDerWaalsContact O-CB 3.27Å; G26-F30 WeakPolarHBondContact O-CB 3.5Å; G26-F30 PolarHBondContact O-N 2.7Å
27	S	35.3	Very low	34.7	Very low	69 Å²	69	102.4 Å²	102.4	48%	0.483	51%	0.507	S	S	.	.	H	α-helix	trans	-65.6	-45.2	-179.1	-165.3	0	0	0	0	112.9	Q23 E24 R29 F30 E31	Q23-S27 VanDerWaalsContact O-CB 3.25Å; Q23-S27 WeakPolarHBondContact O-CB 3.29Å; Q23-S27 PolarHBondContact O-N 3.34Å; E24-S27 PolarHBondContact O-N 3.49Å; S27-R29 VanDerWaalsContact C-N 3.35Å; S27-R29 PolarHBondContact O-N 2.63Å; S27-F30 PolarHBondContact O-N 2.78Å; S27-E31 PolarHBondContact O-N 3.35Å
28	M	34.1	Very low	35.2	Very low	121 Å²	121	104.1 Å²	104.1	60%	0.596	51%	0.514	S	S	*	.	H	α-helix	trans	-62	-39.8	175.2	-79.8	-173.6	-84.8	0	0	112.5	E24 H32	E24-M28 HydrophobicContact CB-CE 4.22Å; E24-M28 WeakPolarHBondContact O-CB 3.46Å; E24-M28 PolarHBondContact O-N 2.89Å; M28-H32 WeakPolarHBondContact O-CB 3.13Å; M28-H32 PolarHBondContact O-N 2.8Å; M28-H32 VanDerWaalsContact O-N 3.09Å
29	R	39.9	Very low	35.7	Very low	160 Å²	160	105.4 Å²	105.4	60%	0.604	53%	0.53	S	S	*	.	H	α-helix	trans	-72.8	-31.9	174.8	-72.8	-174.9	178.2	-135.9	-0.3	112.6	W25 G26 S27 A33	W25-R29 WeakPolarHBondContact O-CB 3.24Å; W25-R29 WeakPolarHBondContact O-CG 3.42Å; W25-R29 PolarHBondContact O-N 3.47Å; W25-R29 VanDerWaalsContact O-N 3.11Å; G26-R29 PolarHBondContact O-N 2.83Å; S27-R29 VanDerWaalsContact C-N 3.35Å; S27-R29 PolarHBondContact O-N 2.63Å; R29-A33 WeakPolarHBondContact O-CB 3.26Å; R29-A33 PolarHBondContact O-N 2.83Å
30	F	37.8	Very low	35.8	Very low	82 Å²	82	102.3 Å²	102.3	36%	0.36	52%	0.52	S	S	.	.	H	α-helix	trans	-66.1	-49.3	175	-179.1	-96.1	0	0	0	111.3	G26 S27 A33 K34	G26-F30 VanDerWaalsContact O-CB 3.27Å; G26-F30 WeakPolarHBondContact O-CB 3.5Å; G26-F30 PolarHBondContact O-N 2.7Å; S27-F30 PolarHBondContact O-N 2.78Å; F30-A33 PolarHBondContact O-N 2.84Å; F30-K34 HydrophobicContact CD1-CD 4.45Å; F30-K34 HydrophobicContact CE1-CD 3.85Å; F30-K34 HydrophobicContact CZ-CD 4.45Å; F30-K34 WeakPolarHBondContact O-CB 3.15Å; F30-K34 PolarHBondContact O-N 3.37Å
31	E	43.4	Very low	35.6	Very low	80 Å²	80	99.4 Å²	99.4	37%	0.374	52%	0.521	S	S	.	.	H	α-helix	trans	-65.1	-41.6	177.2	-73.3	-60.1	140.4	0	0	112.1	S27 A33 K34 E35	S27-E31 PolarHBondContact O-N 3.35Å; E31-A33 PolarHBondContact O-N 3.22Å; E31-K34 CarbonylContact O-C 3.4Å; E31-K34 WeakPolarHBondContact O-CB 3.42Å; E31-K34 PolarHBondContact O-N 3.03Å; E31-K34 IonicContact OE1-NZ 2.7Å; E31-K34 PolarHBondContact OE1-NZ 3.26Å; E31-K34 IonicContact OE2-NZ 2.63Å; E31-K34 PolarHBondContact OE2-NZ 3.45Å; E31-E35 WeakPolarHBondContact O-CG 3.44Å; E31-E35 PolarHBondContact O-N 2.83Å
32	H	42.7	Very low	35.7	Very low	109 Å²	109	97.9 Å²	97.9	51%	0.505	54%	0.541	S	S	.	.	H	α-helix	trans	-65.2	-37.3	174.7	-173.1	-82.7	0	0	0	112.9	M28 Q36	M28-H32 WeakPolarHBondContact O-CB 3.13Å; M28-H32 PolarHBondContact O-N 2.8Å; M28-H32 VanDerWaalsContact O-N 3.09Å; H32-Q36 PolarHBondContact CE1-NE2 3.27Å; H32-Q36 VanDerWaalsContact CE1-NE2 3.35Å; H32-Q36 WeakPolarHBondContact O-CG 3.3Å; H32-Q36 PolarHBondContact O-N 3.23Å
33	A	36.6	Very low	35.9	Very low	40 Å²	40	98 Å²	98	33%	0.331	55%	0.549	S	S	.	.	H	α-helix	trans	-69.6	-36	173.5	0	0	0	0	0	112	R29 F30 E31 Q36 V37	R29-A33 WeakPolarHBondContact O-CB 3.26Å; R29-A33 PolarHBondContact O-N 2.83Å; F30-A33 PolarHBondContact O-N 2.84Å; E31-A33 PolarHBondContact O-N 3.22Å; A33-Q36 PolarHBondContact O-N 3.34Å; A33-V37 WeakPolarHBondContact O-CB 3.35Å; A33-V37 VanDerWaalsContact O-CG2 3.3Å; A33-V37 WeakPolarHBondContact O-CG2 3.27Å; A33-V37 PolarHBondContact O-N 3.34Å
34	K	40.9	Very low	36.1	Very low	87 Å²	87	94.9 Å²	94.9	38%	0.378	54%	0.543	S	S	.	.	H	α-helix	trans	-67.7	-41.6	175.1	171.7	171.7	158.6	-116	0	111.5	F30 E31 V37 M38	F30-K34 HydrophobicContact CD1-CD 4.45Å; F30-K34 HydrophobicContact CE1-CD 3.85Å; F30-K34 HydrophobicContact CZ-CD 4.45Å; F30-K34 WeakPolarHBondContact O-CB 3.15Å; F30-K34 PolarHBondContact O-N 3.37Å; E31-K34 CarbonylContact O-C 3.4Å; E31-K34 WeakPolarHBondContact O-CB 3.42Å; E31-K34 PolarHBondContact O-N 3.03Å; E31-K34 IonicContact OE1-NZ 2.7Å; E31-K34 PolarHBondContact OE1-NZ 3.26Å; E31-K34 IonicContact OE2-NZ 2.63Å; E31-K34 PolarHBondContact OE2-NZ 3.45Å; K34-V37 PolarHBondContact O-N 3.33Å; K34-M38 HydrophobicContact CG-CG 4.46Å; K34-M38 VanDerWaalsContact O-CB 3.29Å; K34-M38 WeakPolarHBondContact O-CB 3.49Å; K34-M38 WeakPolarHBondContact O-CG 3.42Å; K34-M38 PolarHBondContact O-N 3.15Å
35	E	41.7	Very low	35.9	Very low	131 Å²	131	100.1 Å²	100.1	61%	0.612	57%	0.567	S	S	*	*	H	α-helix	trans	-60.2	-44.5	169.3	-76	-170.8	141.2	0	0	111.2	E31 M38 A39	E31-E35 WeakPolarHBondContact O-CG 3.44Å; E31-E35 PolarHBondContact O-N 2.83Å; E35-M38 PolarHBondContact O-N 2.92Å; E35-A39 VanDerWaalsContact O-CB 3.24Å; E35-A39 WeakPolarHBondContact O-CB 3.33Å; E35-A39 PolarHBondContact O-N 3.32Å
36	Q	37.6	Very low	35.8	Very low	116 Å²	116	96.9 Å²	96.9	54%	0.542	57%	0.566	S	S	.	*	H	α-helix	trans	-64.6	-39	175.5	-75.2	-172.5	-15.9	0	0	113.2	H32 A33 A39 C40	H32-Q36 PolarHBondContact CE1-NE2 3.27Å; H32-Q36 VanDerWaalsContact CE1-NE2 3.35Å; H32-Q36 WeakPolarHBondContact O-CG 3.3Å; H32-Q36 PolarHBondContact O-N 3.23Å; A33-Q36 PolarHBondContact O-N 3.34Å; Q36-A39 PolarHBondContact O-N 3.15Å; Q36-C40 VanDerWaalsContact O-CB 3.26Å; Q36-C40 WeakPolarHBondContact O-CB 3.42Å; Q36-C40 PolarHBondContact O-N 3.35Å; Q36-C40 PolarHBondContact O-SG 3.45Å; Q36-C40 VanDerWaalsContact O-SG 3.37Å
37	V	34.6	Very low	35.9	Very low	105 Å²	105	101.2 Å²	101.2	64%	0.636	59%	0.585	S	S	*	*	H	α-helix	trans	-70.8	-32.9	175.9	168.4	0	0	0	0	112	A33 K34	A33-V37 WeakPolarHBondContact O-CB 3.35Å; A33-V37 VanDerWaalsContact O-CG2 3.3Å; A33-V37 WeakPolarHBondContact O-CG2 3.27Å; A33-V37 PolarHBondContact O-N 3.34Å; K34-V37 PolarHBondContact O-N 3.33Å
38	M	38.3	Very low	35.6	Very low	148 Å²	148	104.5 Å²	104.5	73%	0.729	60%	0.597	S	S	*	*	H	α-helix	trans	-74.6	-33.7	174.4	-66.2	-97.7	-75.3	0	0	112.1	K34 E35	K34-M38 HydrophobicContact CG-CG 4.46Å; K34-M38 VanDerWaalsContact O-CB 3.29Å; K34-M38 WeakPolarHBondContact O-CB 3.49Å; K34-M38 WeakPolarHBondContact O-CG 3.42Å; K34-M38 PolarHBondContact O-N 3.15Å; E35-M38 PolarHBondContact O-N 2.92Å
39	A	38.5	Very low	35.5	Very low	86 Å²	86	103.6 Å²	103.6	71%	0.711	60%	0.598	S	S	*	*	H	α-helix	trans	-74.5	-33.6	174.2	0	0	0	0	0	112.6	E35 Q36 G41	E35-A39 VanDerWaalsContact O-CB 3.24Å; E35-A39 WeakPolarHBondContact O-CB 3.33Å; E35-A39 PolarHBondContact O-N 3.32Å; Q36-A39 PolarHBondContact O-N 3.15Å; A39-G41 PolarHBondContact O-N 3.28Å
40	C	32.1	Very low	35.1	Very low	74 Å²	74	98.6 Å²	98.6	50%	0.5	59%	0.587	S	S	.	*	S	Bend	trans	-73.7	63	167.1	-75.3	0	0	0	0	111	Q36 A42	Q36-C40 VanDerWaalsContact O-CB 3.26Å; Q36-C40 WeakPolarHBondContact O-CB 3.42Å; Q36-C40 PolarHBondContact O-N 3.35Å; Q36-C40 PolarHBondContact O-SG 3.45Å; Q36-C40 VanDerWaalsContact O-SG 3.37Å; C40-A42 PolarHBondContact O-N 3.02Å
41	G	28.2	Very low	34.7	Very low	56 Å²	56	97.7 Å²	97.7	58%	0.577	59%	0.591	S	S	*	*			trans	-55.8	109.4	-167.9	0	0	0	0	0	114.9	A39 G43	A39-G41 PolarHBondContact O-N 3.28Å; G41-G43 PolarHBondContact O-N 2.85Å
42	A	32.5	Very low	34.1	Very low	119 Å²	119	103.4 Å²	103.4	98%	0.983	61%	0.61	S	S	*	*	S	Bend	trans	54.7	-2	155.2	0	0	0	0	0	120.1	C40	C40-A42 PolarHBondContact O-N 3.02Å
43	G	30.9	Very low	33.4	Very low	75 Å²	75	105.3 Å²	105.3	77%	0.773	62%	0.617	S	S	*	*	S	Bend	trans	-133	-13.5	-171.6	0	0	0	0	0	116.8	G41	G41-G43 PolarHBondContact O-N 2.85Å
44	S	34.2	Very low	33.1	Very low	72 Å²	72	106 Å²	106	50%	0.503	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-100	116.4	179.5	40.3	0	0	0	0	111.4
45	Q	29.5	Very low	32.6	Very low	193 Å²	193	103.1 Å²	103.1	90%	0.902	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-65.8	130	169.3	-84.5	-161	-59.1	0	0	110.1
46	P	32.6	Very low	32.1	Very low	91 Å²	91	100.9 Å²	100.9	59%	0.591	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-70.5	136.5	169.8	29.6	-33.3	0	0	0	110
47	D	32.5	Very low	31.8	Very low	111 Å²	111	97.9 Å²	97.9	59%	0.594	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-57	144.8	179.7	-170.5	8.9	0	0	0	111.6	T49 S50 S51	D47-T49 PolarHBondContact O-N 3.28Å; D47-T49 PolarHBondContact OD2-OG1 3.45Å; D47-S50 WeakPolarHBondContact O-CA 3.25Å; D47-S50 WeakPolarHBondContact O-CB 3.41Å; D47-S50 PolarHBondContact O-N 3.16Å; D47-S51 PolarHBondContact O-N 3.09Å; D47-S51 VanDerWaalsContact O-N 3.11Å
48	L	29.9	Very low	31.6	Very low	139 Å²	139	98.1 Å²	98.1	73%	0.728	59%	0.586	S	S	*	*	H	α-helix	trans	-61.8	-22	-170.2	-80.3	161.3	0	0	0	113.3	R52	L48-R52 PolarHBondContact O-N 3.35Å
49	T	30.2	Very low	31.3	Very low	101 Å²	101	99 Å²	99	62%	0.62	59%	0.588	S	S	*	*	H	α-helix	trans	-69.3	-41.9	171.3	51.8	0	0	0	0	112.4	D47	D47-T49 PolarHBondContact O-N 3.28Å; D47-T49 PolarHBondContact OD2-OG1 3.45Å
50	S	32	Very low	31	Very low	55 Å²	55	101.7 Å²	101.7	39%	0.385	59%	0.59	S	S	.	*	H	α-helix	trans	-68.4	-39.9	175	-173.5	0	0	0	0	111.6	D47 R52 F53 C54	D47-S50 WeakPolarHBondContact O-CA 3.25Å; D47-S50 WeakPolarHBondContact O-CB 3.41Å; D47-S50 PolarHBondContact O-N 3.16Å; S50-R52 PolarHBondContact O-N 3.28Å; S50-F53 PolarHBondContact O-N 2.83Å; S50-F53 VanDerWaalsContact O-N 3.15Å; S50-C54 PolarHBondContact O-N 2.89Å; S50-C54 PolarHBondContact O-SG 3.11Å
51	S	30.3	Very low	31	Very low	64 Å²	64	100.7 Å²	100.7	45%	0.448	58%	0.584	S	S	.	*	H	α-helix	trans	-55.3	-44.9	177.7	179.4	0	0	0	0	113	D47 F53 C54 G55	D47-S51 PolarHBondContact O-N 3.09Å; D47-S51 VanDerWaalsContact O-N 3.11Å; S51-F53 PolarHBondContact O-N 3.45Å; S51-C54 PolarHBondContact O-N 3.19Å; S51-G55 PolarHBondContact O-N 3.38Å
52	R	29.3	Very low	31.1	Very low	200 Å²	200	104 Å²	104	76%	0.755	59%	0.588	S	S	*	*	H	α-helix	trans	-65.8	-37.7	177.8	-70.4	-171.7	178.4	-157.7	-0.5	113	L48 S50 G55 I56	L48-R52 PolarHBondContact O-N 3.35Å; S50-R52 PolarHBondContact O-N 3.28Å; R52-G55 PolarHBondContact O-N 2.87Å; R52-I56 WeakPolarHBondContact O-CG1 3.47Å; R52-I56 PolarHBondContact O-N 2.9Å
53	F	28.3	Very low	30.9	Very low	149 Å²	149	101.8 Å²	101.8	65%	0.654	58%	0.576	S	S	*	*	H	α-helix	trans	-67.7	-39.5	175.2	-120.7	-89.3	0	0	0	111.8	S50 S51 I56 I57	S50-F53 PolarHBondContact O-N 2.83Å; S50-F53 VanDerWaalsContact O-N 3.15Å; S51-F53 PolarHBondContact O-N 3.45Å; F53-I56 PolarHBondContact O-N 2.87Å; F53-I57 HydrophobicContact CD1-CD1 4.43Å; F53-I57 WeakPolarHBondContact O-CG1 3.39Å; F53-I57 PolarHBondContact O-N 3.46Å; F53-I57 VanDerWaalsContact O-N 3.16Å
54	C	30.6	Very low	30.9	Very low	55 Å²	55	102.6 Å²	102.6	37%	0.372	57%	0.57	S	S	.	*	H	α-helix	trans	-63.9	-41.6	174.9	-66.4	0	0	0	0	112.4	S50 S51 I56 I57 Q58	S50-C54 PolarHBondContact O-N 2.89Å; S50-C54 PolarHBondContact O-SG 3.11Å; S51-C54 PolarHBondContact O-N 3.19Å; C54-I56 PolarHBondContact O-N 2.81Å; C54-I57 PolarHBondContact O-N 3.42Å; C54-Q58 WeakPolarHBondContact O-CG 3.49Å; C54-Q58 PolarHBondContact O-N 3.23Å
55	G	30.2	Very low	30.7	Very low	26 Å²	26	106 Å²	106	27%	0.268	59%	0.587	S	S	.	*	H	α-helix	trans	-62.7	-38.4	177.8	0	0	0	0	0	113.5	S51 R52 Q58 H59	S51-G55 PolarHBondContact O-N 3.38Å; R52-G55 PolarHBondContact O-N 2.87Å; G55-Q58 PolarHBondContact O-N 2.95Å; G55-H59 PolarHBondContact O-CD2 2.93Å; G55-H59 PolarHBondContact O-N 2.96Å; G55-H59 VanDerWaalsContact O-N 3.11Å
56	I	31.3	Very low	30.6	Very low	84 Å²	84	98.7 Å²	98.7	43%	0.431	56%	0.564	S	S	.	*	H	α-helix	trans	-66.3	-41.2	174.8	-66	166.6	0	0	0	110.7	R52 F53 C54 H59 L60	R52-I56 WeakPolarHBondContact O-CG1 3.47Å; R52-I56 PolarHBondContact O-N 2.9Å; F53-I56 PolarHBondContact O-N 2.87Å; C54-I56 PolarHBondContact O-N 2.81Å; I56-H59 PolarHBondContact O-N 3.21Å; I56-L60 HydrophobicContact CG2-CD1 4.24Å; I56-L60 WeakPolarHBondContact O-CG 3.41Å; I56-L60 PolarHBondContact O-N 2.85Å
57	I	31.3	Very low	30.5	Very low	53 Å²	53	99.6 Å²	99.6	27%	0.272	57%	0.568	S	S	.	*	H	α-helix	trans	-68	-40.2	176.4	-67.3	170.9	0	0	0	111.2	F53 C54 H59 L60 S61	F53-I57 HydrophobicContact CD1-CD1 4.43Å; F53-I57 WeakPolarHBondContact O-CG1 3.39Å; F53-I57 PolarHBondContact O-N 3.46Å; F53-I57 VanDerWaalsContact O-N 3.16Å; C54-I57 PolarHBondContact O-N 3.42Å; I57-H59 VanDerWaalsContact C-N 3.32Å; I57-H59 PolarHBondContact O-N 3Å; I57-L60 CarbonylContact O-C 3.47Å; I57-L60 PolarHBondContact O-N 3.39Å; I57-S61 PolarHBondContact O-N 2.84Å; I57-S61 PolarHBondContact O-OG 2.97Å
58	Q	31.5	Very low	30.4	Very low	109 Å²	109	101 Å²	101	51%	0.509	58%	0.576	S	S	.	*	H	α-helix	trans	-58.8	-41.2	174.4	-79.1	-178.3	-38.3	0	0	112.3	C54 G55 L60 S61 L62	C54-Q58 WeakPolarHBondContact O-CG 3.49Å; C54-Q58 PolarHBondContact O-N 3.23Å; G55-Q58 PolarHBondContact O-N 2.95Å; Q58-L60 PolarHBondContact O-N 2.89Å; Q58-S61 PolarHBondContact O-N 3.37Å; Q58-L62 VanDerWaalsContact O-CB 3.3Å; Q58-L62 WeakPolarHBondContact O-CB 3.32Å; Q58-L62 WeakPolarHBondContact O-CG 3.42Å; Q58-L62 PolarHBondContact O-N 3.24Å
59	H	32.1	Very low	30.5	Very low	167 Å²	167	99.6 Å²	99.6	77%	0.773	57%	0.573	S	S	*	*	H	α-helix	trans	-69.6	-15.7	175	-90.4	-73.5	0	0	0	114.7	G55 I56 I57	G55-H59 PolarHBondContact O-CD2 2.93Å; G55-H59 PolarHBondContact O-N 2.96Å; G55-H59 VanDerWaalsContact O-N 3.11Å; I56-H59 PolarHBondContact O-N 3.21Å; I57-H59 VanDerWaalsContact C-N 3.32Å; I57-H59 PolarHBondContact O-N 3Å
60	L	31	Very low	30.5	Very low	142 Å²	142	101.1 Å²	101.1	74%	0.743	58%	0.577	S	S	*	*	H	α-helix	trans	-96.9	-27.3	174.5	-68.6	168.1	0	0	0	112.8	I56 I57 Q58	I56-L60 HydrophobicContact CG2-CD1 4.24Å; I56-L60 WeakPolarHBondContact O-CG 3.41Å; I56-L60 PolarHBondContact O-N 2.85Å; I57-L60 CarbonylContact O-C 3.47Å; I57-L60 PolarHBondContact O-N 3.39Å; Q58-L60 PolarHBondContact O-N 2.89Å
61	S	31.9	Very low	30.5	Very low	54 Å²	54	108.3 Å²	108.3	38%	0.378	60%	0.601	S	S	.	*	H	α-helix	trans	-87	-30	176.9	-61.8	0	0	0	0	113.4	I57 Q58 G63	I57-S61 PolarHBondContact O-N 2.84Å; I57-S61 PolarHBondContact O-OG 2.97Å; Q58-S61 PolarHBondContact O-N 3.37Å; S61-G63 PolarHBondContact O-N 3.36Å; S61-G63 VanDerWaalsContact O-N 3.15Å
62	L	31.3	Very low	30.7	Very low	126 Å²	126	110.4 Å²	110.4	66%	0.66	62%	0.616	S	S	*	*	S	Bend	trans	-77.8	96.4	169.9	-71.9	167.3	0	0	0	109	Q58 S64	Q58-L62 VanDerWaalsContact O-CB 3.3Å; Q58-L62 WeakPolarHBondContact O-CB 3.32Å; Q58-L62 WeakPolarHBondContact O-CG 3.42Å; Q58-L62 PolarHBondContact O-N 3.24Å; L62-S64 PolarHBondContact O-N 2.82Å
63	G	28.5	Very low	30.9	Very low	72 Å²	72	106.4 Å²	106.4	74%	0.742	61%	0.613	S	S	*	*			trans	-66	65.9	175.8	0	0	0	0	0	113.4	S61 T65	S61-G63 PolarHBondContact O-N 3.36Å; S61-G63 VanDerWaalsContact O-N 3.15Å; G63-T65 PolarHBondContact O-N 3.45Å
64	S	30	Very low	31.2	Very low	92 Å²	92	102.1 Å²	102.1	64%	0.643	60%	0.601	S	S	*	*			trans	-67.5	97.1	177.7	170.8	0	0	0	0	110.3	L62 G66	L62-S64 PolarHBondContact O-N 2.82Å; S64-G66 PolarHBondContact O-N 3.18Å; S64-G66 VanDerWaalsContact O-N 3.12Å
65	T	29.8	Very low	31.7	Very low	142 Å²	142	102.4 Å²	102.4	87%	0.871	60%	0.603	S	S	*	*			trans	-71.4	5.8	175.1	47.6	0	0	0	0	114.2	G63 T67	G63-T65 PolarHBondContact O-N 3.45Å; T65-T67 PolarHBondContact O-N 3.04Å
66	G	28.7	Very low	31.9	Very low	40 Å²	40	108.9 Å²	108.9	41%	0.412	62%	0.624	S	S	.	*			trans	-74.6	115.7	172	0	0	0	0	0	111.9	S64 D68	S64-G66 PolarHBondContact O-N 3.18Å; S64-G66 VanDerWaalsContact O-N 3.12Å; G66-D68 VanDerWaalsContact C-N 3.27Å; G66-D68 PolarHBondContact O-N 2.92Å
67	T	28.7	Very low	32.2	Very low	110 Å²	110	112.2 Å²	112.2	68%	0.675	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-11.1	-172.6	42.5	0	0	0	0	115.6	T65	T65-T67 PolarHBondContact O-N 3.04Å
68	D	31.7	Very low	32.9	Very low	140 Å²	140	112.4 Å²	112.4	75%	0.749	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	-0.2	-151.2	-58.1	-18.6	0	0	0	115.2	G66	G66-D68 VanDerWaalsContact C-N 3.27Å; G66-D68 PolarHBondContact O-N 2.92Å
69	T	32	Very low	33.2	Very low	111 Å²	111	110.3 Å²	110.3	68%	0.681	64%	0.636	S	S	*	*			trans	-113.9	1.7	-177.8	51.9	0	0	0	0	114.9	K71	T69-K71 PolarHBondContact O-N 3.42Å
70	L	29.3	Very low	33.5	Very low	133 Å²	133	106.3 Å²	106.3	70%	0.696	62%	0.619	S	S	*	*			trans	-76.3	53.8	-177.1	-68.2	172.1	0	0	0	114.2	V73	L70-V73 HydrophobicContact CD2-CG2 4.28Å
71	K	32.1	Very low	34.1	Very low	206 Å²	206	101.8 Å²	101.8	90%	0.896	60%	0.603	S	S	*	*	S	Bend	trans	-116.6	2.7	178.6	-78.2	-174.3	176.3	174.9	0	115.7	T69	T69-K71 PolarHBondContact O-N 3.42Å
72	S	34.9	Very low	34.8	Very low	108 Å²	108	104.3 Å²	104.3	76%	0.755	61%	0.608	S	S	*	*			trans	-146.8	26.1	-176	67.6	0	0	0	0	115.2	P74	S72-P74 WeakPolarHBondContact O-CD 3.37Å
73	V	33.4	Very low	35.1	Very low	115 Å²	115	100.8 Å²	100.8	70%	0.697	60%	0.597	S	S	*	*			trans	-85.1	115.6	171.1	-176.4	0	0	0	0	108.3	L70	L70-V73 HydrophobicContact CD2-CG2 4.28Å
74	P	35	Very low	35.6	Very low	60 Å²	60	102.3 Å²	102.3	39%	0.39	59%	0.586	S	S	.	*			trans	-65.4	143.5	174.9	27.7	-33.8	0	0	0	110.2	S72 L79	S72-P74 WeakPolarHBondContact O-CD 3.37Å; P74-L79 HydrophobicContact CB-CG 4.44Å; P74-L79 HydrophobicContact CG-CD1 4.41Å; P74-L79 HydrophobicContact CG-CD2 4.08Å; P74-L79 HydrophobicContact CG-CG 4.06Å
75	S	40.2	Very low	36.6	Very low	60 Å²	60	102.6 Å²	102.6	42%	0.42	58%	0.581	S	S	.	*			trans	-62.6	157.2	176.3	69.8	0	0	0	0	111.1	E77 S78 L79	S75-E77 PolarHBondContact O-N 2.71Å; S75-S78 WeakPolarHBondContact O-CA 3.39Å; S75-S78 VanDerWaalsContact O-CB 3.32Å; S75-S78 WeakPolarHBondContact O-CB 3.43Å; S75-S78 PolarHBondContact O-N 3.46Å; S75-S78 PolarHBondContact OG-N 2.88Å; S75-S78 VanDerWaalsContact OG-N 3.1Å; S75-L79 PolarHBondContact O-N 3.4Å
76	F	34.6	Very low	37.3	Very low	163 Å²	163	100.2 Å²	100.2	72%	0.715	56%	0.562	S	S	*	*	H	α-helix	trans	-55.3	-35.7	174.2	-175.8	-112.2	0	0	0	112	L79 I80	F76-L79 PolarHBondContact O-N 3.49Å; F76-I80 HydrophobicContact CD1-CD1 3.84Å; F76-I80 HydrophobicContact CE1-CD1 3.5Å; F76-I80 HydrophobicContact CZ-CD1 3.89Å; F76-I80 WeakPolarHBondContact O-CG1 3.32Å; F76-I80 PolarHBondContact O-N 3.23Å
77	E	38.8	Very low	37.6	Very low	154 Å²	154	103.9 Å²	103.9	72%	0.72	57%	0.571	S	S	*	*	H	α-helix	trans	-65.2	-40.7	173.1	-57.1	170.6	131	0	0	112.2	S75 I80 A81	S75-E77 PolarHBondContact O-N 2.71Å; E77-I80 PolarHBondContact O-N 3.42Å; E77-A81 WeakPolarHBondContact O-CB 3.33Å; E77-A81 PolarHBondContact O-N 3.32Å
78	S	45	Very low	38	Very low	56 Å²	56	105 Å²	105	39%	0.392	57%	0.567	S	S	.	*	H	α-helix	trans	-64.7	-38	174.7	-172.2	0	0	0	0	112	S75 A81 E82	S75-S78 WeakPolarHBondContact O-CA 3.39Å; S75-S78 VanDerWaalsContact O-CB 3.32Å; S75-S78 WeakPolarHBondContact O-CB 3.43Å; S75-S78 PolarHBondContact O-N 3.46Å; S75-S78 PolarHBondContact OG-N 2.88Å; S75-S78 VanDerWaalsContact OG-N 3.1Å; S78-A81 PolarHBondContact O-N 3.45Å; S78-E82 WeakPolarHBondContact O-CB 3.3Å; S78-E82 PolarHBondContact O-N 3.1Å
79	L	39.1	Very low	38.3	Very low	65 Å²	65	102 Å²	102	34%	0.34	56%	0.556	S	S	.	*	H	α-helix	trans	-67.6	-39.4	175.2	-74.9	163.5	0	0	0	111.9	P74 S75 F76 A83	P74-L79 HydrophobicContact CB-CG 4.44Å; P74-L79 HydrophobicContact CG-CD1 4.41Å; P74-L79 HydrophobicContact CG-CD2 4.08Å; P74-L79 HydrophobicContact CG-CG 4.06Å; S75-L79 PolarHBondContact O-N 3.4Å; F76-L79 PolarHBondContact O-N 3.49Å; L79-A83 WeakPolarHBondContact O-CB 3.38Å; L79-A83 PolarHBondContact O-N 3.26Å
80	I	37.9	Very low	38.7	Very low	83 Å²	83	104.6 Å²	104.6	43%	0.426	56%	0.558	S	S	.	*	H	α-helix	trans	-65.6	-41.9	172.5	-71.1	170.6	0	0	0	111	F76 E77 A83 M84	F76-I80 HydrophobicContact CD1-CD1 3.84Å; F76-I80 HydrophobicContact CE1-CD1 3.5Å; F76-I80 HydrophobicContact CZ-CD1 3.89Å; F76-I80 WeakPolarHBondContact O-CG1 3.32Å; F76-I80 PolarHBondContact O-N 3.23Å; E77-I80 PolarHBondContact O-N 3.42Å; I80-A83 PolarHBondContact O-N 3.5Å; I80-M84 HydrophobicContact CG2-CG 4.44Å; I80-M84 WeakPolarHBondContact O-CB 3.44Å; I80-M84 VanDerWaalsContact O-CG 3.24Å; I80-M84 WeakPolarHBondContact O-CG 3.47Å; I80-M84 PolarHBondContact O-N 3.29Å
81	A	44.2	Very low	39.1	Very low	48 Å²	48	102.5 Å²	102.5	40%	0.397	56%	0.555	S	S	.	*	H	α-helix	trans	-65.3	-40.1	177	0	0	0	0	0	112.2	E77 S78 M84 N85	E77-A81 WeakPolarHBondContact O-CB 3.33Å; E77-A81 PolarHBondContact O-N 3.32Å; S78-A81 PolarHBondContact O-N 3.45Å; A81-M84 PolarHBondContact O-N 3.31Å; A81-N85 WeakPolarHBondContact O-CB 3.5Å; A81-N85 VanDerWaalsContact O-CG 3.29Å; A81-N85 PolarHBondContact O-N 2.76Å; A81-N85 PolarHBondContact O-ND2 2.88Å
82	E	45.2	Very low	38.9	Very low	107 Å²	107	101.7 Å²	101.7	50%	0.5	55%	0.552	S	S	.	*	H	α-helix	trans	-64.8	-45.6	174.4	-171.3	177.4	176.5	0	0	111.3	S78 M84 N85 L86	S78-E82 WeakPolarHBondContact O-CB 3.3Å; S78-E82 PolarHBondContact O-N 3.1Å; E82-M84 PolarHBondContact O-N 3.39Å; E82-N85 CarbonylContact O-C 3.59Å; E82-N85 PolarHBondContact O-N 2.81Å; E82-L86 PolarHBondContact O-N 3.13Å
83	A	37.2	Very low	38.7	Very low	52 Å²	52	101.4 Å²	101.4	43%	0.43	55%	0.55	S	S	.	.	H	α-helix	trans	-60.4	-44.1	175.2	0	0	0	0	0	112.3	L79 I80 N85 L86 I87	L79-A83 WeakPolarHBondContact O-CB 3.38Å; L79-A83 PolarHBondContact O-N 3.26Å; I80-A83 PolarHBondContact O-N 3.5Å; A83-N85 VanDerWaalsContact C-N 3.33Å; A83-N85 PolarHBondContact O-N 2.91Å; A83-L86 PolarHBondContact O-N 3.17Å; A83-I87 WeakPolarHBondContact O-CG1 3.24Å; A83-I87 PolarHBondContact O-N 3.33Å
84	M	39.7	Very low	38.6	Very low	103 Å²	103	105.5 Å²	105.5	51%	0.507	56%	0.561	S	S	.	*	H	α-helix	trans	-61.3	-38.9	174.2	-76.4	-76.7	171.3	0	0	112.3	I80 A81 E82 I87 K88	I80-M84 HydrophobicContact CG2-CG 4.44Å; I80-M84 WeakPolarHBondContact O-CB 3.44Å; I80-M84 VanDerWaalsContact O-CG 3.24Å; I80-M84 WeakPolarHBondContact O-CG 3.47Å; I80-M84 PolarHBondContact O-N 3.29Å; A81-M84 PolarHBondContact O-N 3.31Å; E82-M84 PolarHBondContact O-N 3.39Å; M84-I87 PolarHBondContact O-N 2.91Å; M84-K88 VanDerWaalsContact O-CG 3.32Å; M84-K88 WeakPolarHBondContact O-CG 3.38Å; M84-K88 PolarHBondContact O-N 3.33Å
85	N	50.7	Low	38.4	Very low	99 Å²	99	107.6 Å²	107.6	53%	0.529	58%	0.577	S	S	.	*	H	α-helix	trans	-72.7	-32.4	175.6	-74.7	-20.8	0	0	0	112.6	A81 E82 A83 I87 K88 S89	A81-N85 WeakPolarHBondContact O-CB 3.5Å; A81-N85 VanDerWaalsContact O-CG 3.29Å; A81-N85 PolarHBondContact O-N 2.76Å; A81-N85 PolarHBondContact O-ND2 2.88Å; E82-N85 CarbonylContact O-C 3.59Å; E82-N85 PolarHBondContact O-N 2.81Å; A83-N85 VanDerWaalsContact C-N 3.33Å; A83-N85 PolarHBondContact O-N 2.91Å; N85-I87 VanDerWaalsContact C-N 3.33Å; N85-K88 PolarHBondContact O-N 3.32Å; N85-S89 VanDerWaalsContact O-CB 3.32Å; N85-S89 WeakPolarHBondContact O-CB 3.36Å; N85-S89 PolarHBondContact O-N 3.47Å; N85-S89 PolarHBondContact O-OG 3Å
86	L	44.2	Very low	37.7	Very low	92 Å²	92	111.4 Å²	111.4	48%	0.482	60%	0.598	S	S	.	*	H	α-helix	trans	-64.7	-38.4	172.5	-123.4	79.7	0	0	0	111.9	E82 A83 S89 K90	E82-L86 PolarHBondContact O-N 3.13Å; A83-L86 PolarHBondContact O-N 3.17Å; L86-S89 WeakPolarHBondContact CA-OG 3.36Å; L86-S89 PolarHBondContact O-OG 3.01Å; L86-K90 WeakPolarHBondContact O-CG 3.32Å; L86-K90 PolarHBondContact O-N 3.22Å
87	I	35.8	Very low	37.7	Very low	117 Å²	117	109.1 Å²	109.1	60%	0.6	60%	0.603	S	S	*	*	H	α-helix	trans	-65.7	-50.1	174.3	-67.4	163.7	0	0	0	109.8	A83 M84 N85 S89 K90 S91	A83-I87 WeakPolarHBondContact O-CG1 3.24Å; A83-I87 PolarHBondContact O-N 3.33Å; M84-I87 PolarHBondContact O-N 2.91Å; N85-I87 VanDerWaalsContact C-N 3.33Å; I87-S89 PolarHBondContact O-N 3.3Å; I87-K90 PolarHBondContact O-N 3.01Å; I87-S91 PolarHBondContact O-N 3.16Å; I87-S91 PolarHBondContact O-OG 3.05Å
88	K	38.1	Very low	37.1	Very low	134 Å²	134	110.9 Å²	110.9	58%	0.583	61%	0.611	S	S	*	*	H	α-helix	trans	-64.5	-32.8	-179.9	-72.4	173.1	-179.5	-179.9	0	114.5	M84 N85 S91	M84-K88 VanDerWaalsContact O-CG 3.32Å; M84-K88 WeakPolarHBondContact O-CG 3.38Å; M84-K88 PolarHBondContact O-N 3.33Å; N85-K88 PolarHBondContact O-N 3.32Å; K88-S91 PolarHBondContact O-OG 3.38Å
89	S	37.7	Very low	36.4	Very low	76 Å²	76	116.6 Å²	116.6	53%	0.531	63%	0.631	S	S	.	*	H	α-helix	trans	-78.3	-26.7	178.3	51.3	0	0	0	0	113.2	N85 L86 I87	N85-S89 VanDerWaalsContact O-CB 3.32Å; N85-S89 WeakPolarHBondContact O-CB 3.36Å; N85-S89 PolarHBondContact O-N 3.47Å; N85-S89 PolarHBondContact O-OG 3Å; L86-S89 WeakPolarHBondContact CA-OG 3.36Å; L86-S89 PolarHBondContact O-OG 3.01Å; I87-S89 PolarHBondContact O-N 3.3Å
90	K	39.4	Very low	35.8	Very low	166 Å²	166	120.4 Å²	120.4	72%	0.722	65%	0.652	S	S	*	*	H	α-helix	trans	-80.2	-19	173.4	-76.5	-173.2	173.5	-173.4	0	114.2	L86 I87 F92	L86-K90 WeakPolarHBondContact O-CG 3.32Å; L86-K90 PolarHBondContact O-N 3.22Å; I87-K90 PolarHBondContact O-N 3.01Å; K90-F92 VanDerWaalsContact C-N 3.32Å
91	S	37.4	Very low	35.5	Very low	89 Å²	89	124.3 Å²	124.3	62%	0.622	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	7.1	177.5	53.6	0	0	0	0	114.7	I87 K88	I87-S91 PolarHBondContact O-N 3.16Å; I87-S91 PolarHBondContact O-OG 3.05Å; K88-S91 PolarHBondContact O-OG 3.38Å
92	F	29.3	Very low	34.7	Very low	189 Å²	189	131.4 Å²	131.4	83%	0.829	69%	0.694	S	S	*	*	S	Bend	trans	-129.5	43	-172.8	-132.6	-88.6	0	0	0	114.3	K90	K90-F92 VanDerWaalsContact C-N 3.32Å
93	S	30.2	Very low	33.8	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	71%	0.709	S	S	*	*			trans	-145.4	65	177.2	64.6	0	0	0	0	112.9
94	Q	30.5	Very low	33.2	Very low	200 Å²	200	138.1 Å²	138.1	94%	0.935	73%	0.725	S	S	*	*			trans	-126.5	101	167.8	-156.5	169.6	21.3	0	0	109.7	T96	Q94-T96 PolarHBondContact O-N 2.7Å
95	S	31.4	Very low	32.6	Very low	104 Å²	104	139.8 Å²	139.8	73%	0.727	74%	0.74	S	S	*	*			trans	-82.2	115.3	-172.6	52.3	0	0	0	0	112.5	S97	S95-S97 PolarHBondContact O-N 3.24Å
96	T	26.5	Very low	31.5	Very low	141 Å²	141	139.4 Å²	139.4	87%	0.865	74%	0.743	S	S	*	*			trans	18.7	97.8	144.6	54.4	0	0	0	0	118.1	Q94	Q94-T96 PolarHBondContact O-N 2.7Å
97	S	33.8	Very low	30.7	Very low	115 Å²	115	144.5 Å²	144.5	80%	0.804	76%	0.764	S	S	*	*			trans	-153.5	91.7	146.2	64.2	0	0	0	0	110.2	S95	S95-S97 PolarHBondContact O-N 3.24Å
98	E	26.6	Very low	30.3	Very low	190 Å²	190	144.5 Å²	144.5	89%	0.888	77%	0.765	S	S	*	*			trans	-74.4	121.7	168.2	-62.7	-179.5	120.9	0	0	109.8
99	Q	28.7	Very low	29.9	Very low	176 Å²	176	140.8 Å²	140.8	82%	0.822	76%	0.755	S	S	*	*			trans	172.3	149.1	137.1	-96	164.9	36.5	0	0	110.8
100	N	27.5	Very low	29.5	Very low	145 Å²	145	148.3 Å²	148.3	78%	0.775	77%	0.772	S	S	*	*			trans	51.3	101	171.1	-63.6	-35.8	0	0	0	117.1
101	I	31.3	Very low	29	Very low	166 Å²	166	147.3 Å²	147.3	85%	0.851	77%	0.77	S	S	*	*				-161.3	120.5	97.4	-89.3	146.4	0	0	0	108.1
102	K	26.6	Very low	28.6	Very low	197 Å²	197	149 Å²	149	86%	0.857	77%	0.768	S	S	*	*			trans	-91.7	127.1	154.7	-68.5	175.7	178.8	175.3	0	106
103	E	26.7	Very low	28.6	Very low	175 Å²	175	147.6 Å²	147.6	82%	0.818	76%	0.762	S	S	*	*			trans	167.8	162.7	135.2	-94.1	-175.8	134.1	0	0	112.5
104	V	26.1	Very low	28.4	Very low	125 Å²	125	148.4 Å²	148.4	76%	0.758	76%	0.758	S	S	*	*			trans	51.2	81.8	171.5	-156.4	0	0	0	0	117.5	P106	V104-P106 HydrophobicContact CG1-CG 4.33Å
105	V	25.5	Very low	28.2	Very low	138 Å²	138	143 Å²	143	84%	0.836	74%	0.738	S	S	*	*			trans	-101.7	112.6	150.8	177.1	0	0	0	0	108.5	Q107	V105-Q107 PolarHBondContact O-N 3.35Å
106	P	27.8	Very low	28	Very low	90 Å²	90	142.6 Å²	142.6	58%	0.584	74%	0.735	S	S	*	*			trans	-69.5	122.6	174.4	-18.8	32.6	0	0	0	111.2	V104 I108	V104-P106 HydrophobicContact CG1-CG 4.33Å; P106-I108 HydrophobicContact CB-CG1 4.34Å; P106-I108 PolarHBondContact O-N 2.79Å
107	Q	27.1	Very low	27.9	Very low	199 Å²	199	142.4 Å²	142.4	93%	0.93	72%	0.723	S	S	*	*			trans	-74.5	72.6	168.6	-74.9	-171.6	-31.1	0	0	110.8	V105 S109	V105-Q107 PolarHBondContact O-N 3.35Å; Q107-S109 PolarHBondContact O-N 2.89Å
108	I	29	Very low	27.5	Very low	118 Å²	118	146.9 Å²	146.9	61%	0.605	72%	0.722	S	S	*	*			trans	-67.7	126.9	165.4	-62.8	176	0	0	0	107.4	P106	P106-I108 HydrophobicContact CB-CG1 4.34Å; P106-I108 PolarHBondContact O-N 2.79Å
109	S	29.1	Very low	27.3	Very low	56 Å²	56	142.8 Å²	142.8	39%	0.392	71%	0.714	S	S	.	*			trans	-68.7	155.7	-168.4	80.8	0	0	0	0	111.9	Q107 E111	Q107-S109 PolarHBondContact O-N 2.89Å; S109-E111 PolarHBondContact O-N 3.16Å
110	R	29.5	Very low	27.2	Very low	233 Å²	233	140.6 Å²	140.6	88%	0.879	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-6.6	-179	-146.6	174.9	-168.8	166.2	3.5	113.3
111	E	27.9	Very low	27.2	Very low	146 Å²	146	137.5 Å²	137.5	68%	0.682	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-33.6	-171.7	-62.1	177.9	125.7	0	0	112.7	S109 K113 L114 T115	S109-E111 PolarHBondContact O-N 3.16Å; E111-K113 VanDerWaalsContact C-N 3.3Å; E111-K113 PolarHBondContact O-N 2.96Å; E111-L114 PolarHBondContact O-N 3Å; E111-T115 PolarHBondContact O-N 3.11Å
112	E	29.9	Very low	27	Very low	123 Å²	123	135.7 Å²	135.7	58%	0.575	69%	0.686	S	S	*	*	H	α-helix	trans	-66.4	-30.2	178.8	-70.8	-171.9	123.7	0	0	113.1	L114 T115	E112-L114 PolarHBondContact O-N 2.85Å; E112-T115 PolarHBondContact O-N 3.15Å; E112-T115 PolarHBondContact O-OG1 3.25Å; E112-T115 VanDerWaalsContact O-OG1 3.05Å
113	K	29.2	Very low	27.2	Very low	160 Å²	160	129.1 Å²	129.1	70%	0.696	66%	0.659	S	S	*	*	H	α-helix	trans	-69.3	-13.8	172.9	-70.7	-167.6	175.4	-173.1	0	113.7	E111	E111-K113 VanDerWaalsContact C-N 3.3Å; E111-K113 PolarHBondContact O-N 2.96Å
114	L	26.6	Very low	27.8	Very low	120 Å²	120	127.1 Å²	127.1	63%	0.628	65%	0.648	S	S	*	*	H	α-helix	trans	-101.5	-15.9	179.5	-74.8	166.5	0	0	0	113.6	E111 E112	E111-L114 PolarHBondContact O-N 3Å; E112-L114 PolarHBondContact O-N 2.85Å
115	T	25.7	Very low	28.4	Very low	86 Å²	86	123.8 Å²	123.8	53%	0.528	63%	0.626	S	S	.	*	H	α-helix	trans	-81.6	-30.3	175.1	49.2	0	0	0	0	112.6	E111 E112 F117 R118	E111-T115 PolarHBondContact O-N 3.11Å; E112-T115 PolarHBondContact O-N 3.15Å; E112-T115 PolarHBondContact O-OG1 3.25Å; E112-T115 VanDerWaalsContact O-OG1 3.05Å; T115-F117 PolarHBondContact O-N 3.06Å; T115-F117 VanDerWaalsContact O-N 3.09Å; T115-R118 WeakPolarHBondContact O-CB 3.4Å; T115-R118 PolarHBondContact O-N 2.98Å
116	S	26.2	Very low	29.3	Very low	95 Å²	95	120 Å²	120	66%	0.664	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-21.9	177	-167.9	0	0	0	0	114.8
117	F	25.9	Very low	30.1	Very low	138 Å²	138	119.5 Å²	119.5	61%	0.605	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	7.4	-178.8	-77.4	-86.9	0	0	0	114.8	T115	T115-F117 PolarHBondContact O-N 3.06Å; T115-F117 VanDerWaalsContact O-N 3.09Å
118	R	23.7	Very low	30.9	Very low	209 Å²	209	111 Å²	111	79%	0.789	55%	0.548	S	S	*	.			trans	-93.7	13.8	-168.4	-70	-169.4	168.6	-153.9	-4.5	116.5	T115	T115-R118 WeakPolarHBondContact O-CB 3.4Å; T115-R118 PolarHBondContact O-N 2.98Å
119	S	23.7	Very low	31.4	Very low	103 Å²	103	112.6 Å²	112.6	72%	0.72	55%	0.546	S	S	*	.			trans	-134	51.9	-173.8	50.7	0	0	0	0	114.1
120	F	26	Very low	32	Very low	130 Å²	130	112.5 Å²	112.5	57%	0.57	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-69.6	130.5	167.8	-77.3	-83.3	0	0	0	111.1
121	P	28.4	Very low	32.6	Very low	81 Å²	81	106.8 Å²	106.8	53%	0.526	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-69.9	139.7	177.7	28.5	-34	0	0	0	111.1	M123 P198	P121-M123 PolarHBondContact O-N 2.77Å; P121-P198 HydrophobicContact CG-CG 4.09Å
122	V	26.5	Very low	33.5	Very low	127 Å²	127	101 Å²	101	77%	0.77	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-46.9	116.7	-172.9	178.6	0	0	0	0	112.8
123	M	30	Very low	34.1	Very low	59 Å²	59	98.7 Å²	98.7	29%	0.291	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-58.1	139.1	169.5	-68.5	171.5	-74.3	0	0	110.3	P121 I178	P121-M123 PolarHBondContact O-N 2.77Å; M123-I178 HydrophobicContact CE-CB 4.37Å; M123-I178 HydrophobicContact CE-CG1 3.72Å; M123-I178 HydrophobicContact SD-CG1 4.09Å; M123-I178 HydrophobicContact SD-CG2 4.38Å
124	K	40	Very low	34.7	Very low	134 Å²	134	95.4 Å²	95.4	58%	0.583	49%	0.486	S	S	*	.			trans	-124.5	99.8	176	-70.4	-175.4	179.3	176.4	0	110.6
125	L	39.6	Very low	35.8	Very low	55 Å²	55	96.1 Å²	96.1	29%	0.288	48%	0.484	S	S	.	.			trans	-73.9	122	163.2	-174	69.8	0	0	0	108.5	L181 W193	L125-L181 HydrophobicContact CD2-CD2 4.42Å; L125-W193 HydrophobicContact CD1-CB 4.49Å; L125-W193 HydrophobicContact CD1-CE3 4.28Å; L125-W193 HydrophobicContact CD2-CE3 3.85Å; L125-W193 HydrophobicContact CD2-CZ3 3.94Å; L125-W193 HydrophobicContact CG-CE3 4.02Å; L125-W193 HydrophobicContact CG-CZ3 4.42Å
126	H	42.9	Very low	37.1	Very low	59 Å²	59	93.4 Å²	93.4	27%	0.273	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121	174.4	-80.3	-99.7	0	0	0	110.7	F128 W139 L194	H126-F128 HydrophobicContact CB-CD2 4.09Å; H126-F128 HydrophobicContact CB-CE2 3.42Å; H126-F128 VanDerWaalsContact CB-CE2 3.42Å; H126-F128 HydrophobicContact CB-CZ 4.06Å; H126-W139 HydrophobicContact CB-CH2 4.45Å; H126-W139 HydrophobicContact CB-CZ2 4.17Å; H126-W139 AromaticContact CD2-CE2 3.52Å; H126-W139 AromaticContact CD2-CZ2 3.19Å; H126-W139 WeakPolarHBondContact CD2-CZ2 3.15Å; H126-W139 AromaticContact CD2-NE1 3.57Å; H126-W139 AromaticContact CE1-NE1 3.41Å; H126-W139 PolarHBondContact CE1-NE1 3.31Å; H126-W139 AromaticContact CG-CE2 3.76Å; H126-W139 AromaticContact CG-CZ2 3.72Å; H126-W139 AromaticContact CG-NE1 3.8Å; H126-W139 AromaticContact ND1-NE1 3.71Å; H126-W139 AromaticContact NE2-CE2 3.76Å; H126-W139 AromaticContact NE2-CZ2 3.76Å; H126-W139 AromaticContact NE2-NE1 3.29Å; H126-W139 PolarHBondContact NE2-NE1 3.21Å; H126-L194 PolarHBondContact N-O 3.3Å; H126-L194 PolarHBondContact O-N 2.85Å
127	K	45.4	Very low	38	Very low	78 Å²	78	90.4 Å²	90.4	34%	0.339	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	115.7	173.5	-168.8	179	-166.3	175.3	0	109.2	F191 W193	K127-F191 HydrophobicContact CD-CD1 4.1Å; K127-F191 HydrophobicContact CD-CE1 4.15Å; K127-F191 HydrophobicContact CD-CG 4.5Å; K127-F191 VanDerWaalsContact CE-CD1 3.45Å; K127-F191 VanDerWaalsContact CE-CG 3.49Å; K127-F191 HydrophobicContact CG-CD1 3.8Å; K127-F191 HydrophobicContact CG-CE1 4.25Å; K127-F191 HydrophobicContact CG-CG 4.31Å; K127-W193 HydrophobicContact CB-CE3 3.98Å; K127-W193 HydrophobicContact CB-CH2 4.17Å; K127-W193 HydrophobicContact CB-CZ3 3.56Å; K127-W193 HydrophobicContact CD-CH2 3.41Å; K127-W193 VanDerWaalsContact CD-CH2 3.41Å; K127-W193 HydrophobicContact CD-CZ2 4.18Å; K127-W193 HydrophobicContact CD-CZ3 3.73Å; K127-W193 VanDerWaalsContact CE-CH2 3.42Å; K127-W193 HydrophobicContact CG-CE3 4.05Å; K127-W193 HydrophobicContact CG-CH2 3.64Å; K127-W193 HydrophobicContact CG-CZ2 4.27Å; K127-W193 HydrophobicContact CG-CZ3 3.54Å
128	F	43.4	Very low	39.2	Very low	22 Å²	22	85.9 Å²	85.9	10%	0.096	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.6	174.2	-67.8	-85	0	0	0	110.4	H126 K135 W136 W139 T192 L194	H126-F128 HydrophobicContact CB-CD2 4.09Å; H126-F128 HydrophobicContact CB-CE2 3.42Å; H126-F128 VanDerWaalsContact CB-CE2 3.42Å; H126-F128 HydrophobicContact CB-CZ 4.06Å; F128-K135 HydrophobicContact CD1-CB 4.46Å; F128-K135 HydrophobicContact CE1-CB 4.27Å; F128-W136 HydrophobicContact CB-CB 4.05Å; F128-W136 HydrophobicContact CD1-CB 3.56Å; F128-W136 HydrophobicContact CD2-CB 3.55Å; F128-W136 HydrophobicContact CE1-CB 3.77Å; F128-W136 HydrophobicContact CE2-CB 3.76Å; F128-W136 HydrophobicContact CG-CB 3.44Å; F128-W136 VanDerWaalsContact CG-CB 3.44Å; F128-W136 HydrophobicContact CG-CG 4.45Å; F128-W136 HydrophobicContact CZ-CB 3.86Å; F128-W139 HydrophobicContact CE2-CD2 4.23Å; F128-W139 HydrophobicContact CE2-CE3 4.15Å; F128-W139 HydrophobicContact CZ-CB 3.91Å; F128-W139 HydrophobicContact CZ-CD2 4.07Å; F128-W139 HydrophobicContact CZ-CE3 4.36Å; F128-W139 AromaticContact CZ-CG 3.88Å; F128-W139 HydrophobicContact CZ-CG 3.88Å; F128-T192 PolarHBondContact N-O 2.83Å; F128-T192 PolarHBondContact O-N 3.2Å; F128-L194 HydrophobicContact CD2-CD1 3.86Å; F128-L194 HydrophobicContact CD2-CG 4.26Å; F128-L194 HydrophobicContact CE2-CB 4.39Å; F128-L194 HydrophobicContact CE2-CD1 3.72Å; F128-L194 HydrophobicContact CE2-CG 4.38Å
129	R	39.8	Very low	40.9	Very low	151 Å²	151	78 Å²	78	57%	0.57	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	146.3	165.9	-78.9	-170.8	-179.9	174.1	-0.9	109.2	D131 T132 F191	R129-D131 VanDerWaalsContact CD-OD2 3.3Å; R129-D131 WeakPolarHBondContact CD-OD2 3.47Å; R129-D131 PolarHBondContact O-N 3.41Å; R129-T132 HydrophobicContact CB-CG2 4.22Å; R129-T132 PolarHBondContact N-OG1 2.97Å; R129-T132 PolarHBondContact O-N 2.92Å; R129-T132 PolarHBondContact O-OG1 3.44Å; R129-F191 HydrophobicContact CG-CD1 4.25Å; R129-F191 HydrophobicContact CG-CE1 3.71Å
130	K	42.5	Very low	42.4	Very low	54 Å²	54	73.2 Å²	73.2	24%	0.235	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-49.7	-46.8	173.5	-169.2	179.2	-179.3	-174	0	111.3	T132 E133 D190 I246	K130-T132 PolarHBondContact O-N 2.57Å; K130-E133 VanDerWaalsContact O-CG 3.22Å; K130-E133 WeakPolarHBondContact O-CG 3.35Å; K130-D190 WeakPolarHBondContact CB-O 3.23Å; K130-D190 PolarHBondContact N-O 2.98Å; K130-I246 VanDerWaalsContact NZ-CD1 3.28Å
131	D	40.6	Very low	43.7	Very low	113 Å²	113	72.2 Å²	72.2	60%	0.604	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-65.2	10.9	175.1	43.1	-73.7	0	0	0	116	R129	R129-D131 VanDerWaalsContact CD-OD2 3.3Å; R129-D131 WeakPolarHBondContact CD-OD2 3.47Å; R129-D131 PolarHBondContact O-N 3.41Å
132	T	47.8	Very low	45.3	Very low	23 Å²	23	76.2 Å²	76.2	14%	0.141	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-123	34.6	177	63.1	0	0	0	0	114.5	R129 K130 S134 K135 W136	R129-T132 HydrophobicContact CB-CG2 4.22Å; R129-T132 PolarHBondContact N-OG1 2.97Å; R129-T132 PolarHBondContact O-N 2.92Å; R129-T132 PolarHBondContact O-OG1 3.44Å; K130-T132 PolarHBondContact O-N 2.57Å; T132-S134 VanDerWaalsContact C-N 3.34Å; T132-S134 PolarHBondContact O-N 3.36Å; T132-K135 HydrophobicContact CG2-CD 4.15Å; T132-K135 WeakPolarHBondContact O-CB 3.44Å; T132-K135 PolarHBondContact O-N 3.24Å; T132-W136 PolarHBondContact O-N 3.38Å
133	E	42.4	Very low	46.6	Very low	75 Å²	75	71.4 Å²	71.4	35%	0.35	34%	0.341	S	S	.	.	H	α-helix	trans	-46.2	-51.8	-175.3	-56.7	-172.8	150.9	0	0	113.6	K130 K135 W136 I137	K130-E133 VanDerWaalsContact O-CG 3.22Å; K130-E133 WeakPolarHBondContact O-CG 3.35Å; E133-K135 PolarHBondContact O-N 2.99Å; E133-W136 VanDerWaalsContact CA-CD1 3.49Å; E133-W136 VanDerWaalsContact O-CD1 3.28Å; E133-W136 PolarHBondContact O-N 2.96Å; E133-I137 WeakPolarHBondContact O-CG1 3.33Å; E133-I137 PolarHBondContact O-N 3.26Å
134	S	42.6	Very low	47.5	Very low	91 Å²	91	72 Å²	72	64%	0.636	35%	0.349	S	S	*	.	H	α-helix	trans	-61.6	-25.3	178.6	58.6	0	0	0	0	114.4	T132 A138	T132-S134 VanDerWaalsContact C-N 3.34Å; T132-S134 PolarHBondContact O-N 3.36Å; S134-A138 WeakPolarHBondContact O-CB 3.46Å; S134-A138 PolarHBondContact O-N 2.9Å
135	K	49.5	Very low	47.7	Very low	136 Å²	136	75.2 Å²	75.2	59%	0.591	36%	0.358	S	S	*	.	H	α-helix	trans	-80.6	-34.2	-179.6	-59.9	-173.3	-173.3	168	0	112.4	F128 T132 E133 W139	F128-K135 HydrophobicContact CD1-CB 4.46Å; F128-K135 HydrophobicContact CE1-CB 4.27Å; T132-K135 HydrophobicContact CG2-CD 4.15Å; T132-K135 WeakPolarHBondContact O-CB 3.44Å; T132-K135 PolarHBondContact O-N 3.24Å; E133-K135 PolarHBondContact O-N 2.99Å; K135-W139 VanDerWaalsContact O-CB 3.31Å; K135-W139 WeakPolarHBondContact O-CB 3.26Å; K135-W139 PolarHBondContact O-N 2.9Å; K135-W139 VanDerWaalsContact O-N 3.15Å
136	W	51.6	Low	47.4	Very low	29 Å²	29	75.6 Å²	75.6	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-81.5	-37.4	-179.6	78.6	-108.2	0	0	0	111.8	F128 T132 E133 W139 L140 L194 L230	F128-W136 HydrophobicContact CB-CB 4.05Å; F128-W136 HydrophobicContact CD1-CB 3.56Å; F128-W136 HydrophobicContact CD2-CB 3.55Å; F128-W136 HydrophobicContact CE1-CB 3.77Å; F128-W136 HydrophobicContact CE2-CB 3.76Å; F128-W136 HydrophobicContact CG-CB 3.44Å; F128-W136 VanDerWaalsContact CG-CB 3.44Å; F128-W136 HydrophobicContact CG-CG 4.45Å; F128-W136 HydrophobicContact CZ-CB 3.86Å; T132-W136 PolarHBondContact O-N 3.38Å; E133-W136 VanDerWaalsContact CA-CD1 3.49Å; E133-W136 VanDerWaalsContact O-CD1 3.28Å; E133-W136 PolarHBondContact O-N 2.96Å; W136-W139 PolarHBondContact O-N 3.26Å; W136-L140 HydrophobicContact CZ3-CD2 4.14Å; W136-L140 WeakPolarHBondContact O-CB 3.4Å; W136-L140 PolarHBondContact O-N 3.49Å; W136-L194 HydrophobicContact CB-CD1 3.91Å; W136-L194 HydrophobicContact CD2-CD1 4.28Å; W136-L194 HydrophobicContact CE3-CD1 3.76Å; W136-L194 HydrophobicContact CG-CD1 4.4Å; W136-L230 HydrophobicContact CH2-CD1 3.5Å; W136-L230 VanDerWaalsContact CH2-CD1 3.5Å; W136-L230 HydrophobicContact CH2-CD2 3.68Å; W136-L230 HydrophobicContact CH2-CG 4.19Å; W136-L230 HydrophobicContact CZ2-CD2 4.31Å; W136-L230 HydrophobicContact CZ3-CD1 3.79Å
137	I	44.8	Very low	47.1	Very low	32 Å²	32	76.6 Å²	76.6	16%	0.164	37%	0.366	C	S	.	.	H	α-helix	trans	-63.3	-48	171.4	-62.1	170.9	0	0	0	110	E133 W139 L140 H141	E133-I137 WeakPolarHBondContact O-CG1 3.33Å; E133-I137 PolarHBondContact O-N 3.26Å; I137-W139 PolarHBondContact O-N 3.46Å; I137-W139 VanDerWaalsContact O-N 3.15Å; I137-L140 WeakPolarHBondContact O-CB 3.33Å; I137-L140 PolarHBondContact O-N 3.21Å; I137-H141 PolarHBondContact O-CD2 3.25Å; I137-H141 PolarHBondContact O-N 3.34Å
138	A	51.9	Low	46.6	Very low	42 Å²	42	75.8 Å²	75.8	35%	0.347	36%	0.363	S	S	.	.	H	α-helix	trans	-68.1	-11.4	175.9	0	0	0	0	0	114.6	S134 K142	S134-A138 WeakPolarHBondContact O-CB 3.46Å; S134-A138 PolarHBondContact O-N 2.9Å; A138-K142 WeakPolarHBondContact O-CD 3.34Å; A138-K142 VanDerWaalsContact O-CE 3.23Å; A138-K142 WeakPolarHBondContact O-CE 3.43Å; A138-K142 VanDerWaalsContact O-CG 3.31Å; A138-K142 WeakPolarHBondContact O-CG 3.09Å
139	W	59.6	Low	46.3	Very low	44 Å²	44	74.8 Å²	74.8	17%	0.167	36%	0.359	C	S	.	.	H	α-helix	trans	-88.2	-39.9	168.2	174.3	92.7	0	0	0	111	H126 F128 K135 W136 I137 H141 K142 L143 L149 L194 A196	H126-W139 HydrophobicContact CB-CH2 4.45Å; H126-W139 HydrophobicContact CB-CZ2 4.17Å; H126-W139 AromaticContact CD2-CE2 3.52Å; H126-W139 AromaticContact CD2-CZ2 3.19Å; H126-W139 WeakPolarHBondContact CD2-CZ2 3.15Å; H126-W139 AromaticContact CD2-NE1 3.57Å; H126-W139 AromaticContact CE1-NE1 3.41Å; H126-W139 PolarHBondContact CE1-NE1 3.31Å; H126-W139 AromaticContact CG-CE2 3.76Å; H126-W139 AromaticContact CG-CZ2 3.72Å; H126-W139 AromaticContact CG-NE1 3.8Å; H126-W139 AromaticContact ND1-NE1 3.71Å; H126-W139 AromaticContact NE2-CE2 3.76Å; H126-W139 AromaticContact NE2-CZ2 3.76Å; H126-W139 AromaticContact NE2-NE1 3.29Å; H126-W139 PolarHBondContact NE2-NE1 3.21Å; F128-W139 HydrophobicContact CE2-CD2 4.23Å; F128-W139 HydrophobicContact CE2-CE3 4.15Å; F128-W139 HydrophobicContact CZ-CB 3.91Å; F128-W139 HydrophobicContact CZ-CD2 4.07Å; F128-W139 HydrophobicContact CZ-CE3 4.36Å; F128-W139 AromaticContact CZ-CG 3.88Å; F128-W139 HydrophobicContact CZ-CG 3.88Å; K135-W139 VanDerWaalsContact O-CB 3.31Å; K135-W139 WeakPolarHBondContact O-CB 3.26Å; K135-W139 PolarHBondContact O-N 2.9Å; K135-W139 VanDerWaalsContact O-N 3.15Å; W136-W139 PolarHBondContact O-N 3.26Å; I137-W139 PolarHBondContact O-N 3.46Å; I137-W139 VanDerWaalsContact O-N 3.15Å; W139-H141 PolarHBondContact O-N 3.24Å; W139-K142 WeakPolarHBondContact O-CA 3.39Å; W139-K142 WeakPolarHBondContact O-CB 3.09Å; W139-K142 PolarHBondContact O-N 3.35Å; W139-L143 HydrophobicContact CE3-CD1 4.35Å; W139-L143 HydrophobicContact CH2-CD1 3.79Å; W139-L143 HydrophobicContact CH2-CD2 4.06Å; W139-L143 HydrophobicContact CH2-CG 4.28Å; W139-L143 HydrophobicContact CZ2-CD1 4.41Å; W139-L143 HydrophobicContact CZ2-CD2 3.84Å; W139-L143 HydrophobicContact CZ2-CG 4.44Å; W139-L143 HydrophobicContact CZ3-CD1 3.75Å; W139-L143 HydrophobicContact CZ3-CG 4.3Å; W139-L143 PolarHBondContact O-N 2.89Å; W139-L149 HydrophobicContact CH2-CD1 4.12Å; W139-L149 HydrophobicContact CZ3-CD1 3.81Å; W139-L194 HydrophobicContact CE3-CB 4.44Å; W139-L194 HydrophobicContact CE3-CD1 3.72Å; W139-L194 HydrophobicContact CH2-CB 4.01Å; W139-L194 HydrophobicContact CZ3-CB 3.62Å; W139-L194 HydrophobicContact CZ3-CD1 3.62Å; W139-L194 HydrophobicContact CZ3-CG 4.19Å; W139-A196 HydrophobicContact CH2-CB 4.45Å
140	L	55.3	Low	46.3	Very low	3 Å²	3	68.8 Å²	68.8	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-58.5	-44.8	175.5	-179.9	62.3	0	0	0	112.4	W136 I137 K142 L143 L149 L227 L230	W136-L140 HydrophobicContact CZ3-CD2 4.14Å; W136-L140 WeakPolarHBondContact O-CB 3.4Å; W136-L140 PolarHBondContact O-N 3.49Å; I137-L140 WeakPolarHBondContact O-CB 3.33Å; I137-L140 PolarHBondContact O-N 3.21Å; L140-K142 PolarHBondContact O-N 3.29Å; L140-L143 HydrophobicContact CD1-CD1 4.25Å; L140-L143 PolarHBondContact O-N 3.16Å; L140-L149 HydrophobicContact CD1-CD1 4.25Å; L140-L149 HydrophobicContact CD1-CD2 3.56Å; L140-L149 HydrophobicContact CD1-CG 4.47Å; L140-L227 HydrophobicContact CD2-CD2 3.78Å; L140-L227 HydrophobicContact CD2-CG 4.38Å; L140-L227 HydrophobicContact CG-CD2 4.46Å; L140-L230 HydrophobicContact CD2-CD1 4.31Å
141	H	54	Low	46.2	Very low	108 Å²	108	66.6 Å²	66.6	50%	0.5	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.7	174	-67.3	-76.1	0	0	0	113.6	I137 W139	I137-H141 PolarHBondContact O-CD2 3.25Å; I137-H141 PolarHBondContact O-N 3.34Å; W139-H141 PolarHBondContact O-N 3.24Å
142	K	60.4	Low	46.3	Very low	165 Å²	165	61.3 Å²	61.3	72%	0.717	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-7.5	177.6	-68.1	173.6	-171.7	167.7	0	113.4	A138 W139 L140 P144	A138-K142 WeakPolarHBondContact O-CD 3.34Å; A138-K142 VanDerWaalsContact O-CE 3.23Å; A138-K142 WeakPolarHBondContact O-CE 3.43Å; A138-K142 VanDerWaalsContact O-CG 3.31Å; A138-K142 WeakPolarHBondContact O-CG 3.09Å; W139-K142 WeakPolarHBondContact O-CA 3.39Å; W139-K142 WeakPolarHBondContact O-CB 3.09Å; W139-K142 PolarHBondContact O-N 3.35Å; L140-K142 PolarHBondContact O-N 3.29Å; K142-P144 WeakPolarHBondContact O-CD 3.4Å
143	L	54.6	Low	45.7	Very low	26 Å²	26	62.9 Å²	62.9	14%	0.136	31%	0.311	C	S	.	.	S	Bend	trans	-72	129	171.1	-67.4	-177.6	0	0	0	110.3	W139 L140 L149 A196 K223	W139-L143 HydrophobicContact CE3-CD1 4.35Å; W139-L143 HydrophobicContact CH2-CD1 3.79Å; W139-L143 HydrophobicContact CH2-CD2 4.06Å; W139-L143 HydrophobicContact CH2-CG 4.28Å; W139-L143 HydrophobicContact CZ2-CD1 4.41Å; W139-L143 HydrophobicContact CZ2-CD2 3.84Å; W139-L143 HydrophobicContact CZ2-CG 4.44Å; W139-L143 HydrophobicContact CZ3-CD1 3.75Å; W139-L143 HydrophobicContact CZ3-CG 4.3Å; W139-L143 PolarHBondContact O-N 2.89Å; L140-L143 HydrophobicContact CD1-CD1 4.25Å; L140-L143 PolarHBondContact O-N 3.16Å; L143-L149 HydrophobicContact CD1-CD1 3.68Å; L143-A196 HydrophobicContact CD1-CB 4.42Å; L143-K223 PolarHBondContact O-NZ 2.91Å
144	P	47.9	Very low	45.5	Very low	71 Å²	71	62.4 Å²	62.4	46%	0.461	31%	0.311	S	S	.	.			trans	-54.9	165.8	168.5	-26.6	36	0	0	0	113.3	K142 S146 Y147 K223	K142-P144 WeakPolarHBondContact O-CD 3.4Å; P144-S146 PolarHBondContact O-N 3.14Å; P144-Y147 HydrophobicContact CB-CD2 3.98Å; P144-Y147 HydrophobicContact CB-CE2 3.93Å; P144-Y147 HydrophobicContact CG-CD2 4.21Å; P144-Y147 HydrophobicContact CG-CE2 3.78Å; P144-K223 PolarHBondContact O-NZ 3.33Å
145	R	44.6	Very low	45.3	Very low	203 Å²	203	59 Å²	59	77%	0.766	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	1	-179.9	-61.8	-175.4	-179.7	142.2	-2.3	114.9	D206	R145-D206 WeakPolarHBondContact CA-OD1 3.48Å; R145-D206 WeakPolarHBondContact CG-OD2 3.41Å
146	S	34.4	Very low	44.9	Very low	62 Å²	62	55.9 Å²	55.9	43%	0.434	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	22.7	-174.6	50.5	0	0	0	0	113.3	P144 P198 S199	P144-S146 PolarHBondContact O-N 3.14Å; S146-P198 WeakPolarHBondContact O-CA 3.47Å; S146-S199 PolarHBondContact O-N 3.01Å; S146-S199 PolarHBondContact O-OG 2.85Å
147	Y	35.5	Very low	44.3	Very low	80 Å²	80	59.4 Å²	59.4	31%	0.314	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	118.1	179.3	-71.3	-93.9	0	0	0	110.2	P144 A196 S197	P144-Y147 HydrophobicContact CB-CD2 3.98Å; P144-Y147 HydrophobicContact CB-CE2 3.93Å; P144-Y147 HydrophobicContact CG-CD2 4.21Å; P144-Y147 HydrophobicContact CG-CE2 3.78Å; Y147-A196 HydrophobicContact CD1-CB 4.08Å; Y147-S197 CarbonylContact C-O 3.55Å; Y147-S197 WeakPolarHBondContact CA-O 3.45Å
148	F	34.9	Very low	44.1	Very low	61 Å²	61	65.3 Å²	65.3	27%	0.268	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	137.1	152.7	-63.5	-52.6	0	0	0	108.2	A196 S197 V207	F148-A196 CarbonylContact O-C 3.59Å; F148-A196 VanDerWaalsContact O-CA 3.22Å; F148-A196 WeakPolarHBondContact O-CA 3.4Å; F148-S197 PolarHBondContact N-O 3.24Å; F148-S197 PolarHBondContact O-N 3.08Å; F148-V207 WeakPolarHBondContact CA-O 3.43Å; F148-V207 HydrophobicContact CD1-CB 4.09Å; F148-V207 HydrophobicContact CE1-CB 4.08Å
149	L	37.5	Very low	43.6	Very low	2 Å²	2	66 Å²	66	1%	0.01	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	145.7	168	-174.2	88.4	0	0	0	108.5	W139 L140 L143 V151 L194 Y195 A196 V208 A209	W139-L149 HydrophobicContact CH2-CD1 4.12Å; W139-L149 HydrophobicContact CZ3-CD1 3.81Å; L140-L149 HydrophobicContact CD1-CD1 4.25Å; L140-L149 HydrophobicContact CD1-CD2 3.56Å; L140-L149 HydrophobicContact CD1-CG 4.47Å; L143-L149 HydrophobicContact CD1-CD1 3.68Å; L149-V151 HydrophobicContact CD2-CG2 3.6Å; L149-V151 HydrophobicContact CG-CG2 4.34Å; L149-L194 HydrophobicContact CD1-CB 4.4Å; L149-L194 HydrophobicContact CD1-CD2 4.3Å; L149-L194 HydrophobicContact CD2-CD2 4.09Å; L149-L194 HydrophobicContact CG-CD2 4.4Å; L149-Y195 CarbonylContact C-O 3.54Å; L149-Y195 WeakPolarHBondContact CA-O 3.35Å; L149-Y195 WeakPolarHBondContact CD1-O 3.36Å; L149-A196 HydrophobicContact CD1-CB 4.41Å; L149-V208 HydrophobicContact CB-CB 4.31Å; L149-V208 HydrophobicContact CB-CG1 3.8Å; L149-V208 HydrophobicContact CB-CG2 3.89Å; L149-V208 HydrophobicContact CD2-CG1 3.71Å; L149-V208 HydrophobicContact CD2-CG2 4.46Å; L149-V208 HydrophobicContact CG-CG1 4.23Å; L149-A209 PolarHBondContact O-N 2.8Å; L149-A209 VanDerWaalsContact O-O 3.12Å
150	V	40.3	Very low	42.8	Very low	24 Å²	24	64.4 Å²	64.4	15%	0.145	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	110.1	163.7	-173.1	0	0	0	0	108	L152 Y195 A209 L218	V150-L152 HydrophobicContact CG1-CD2 3.57Å; V150-L152 HydrophobicContact CG1-CG 4.08Å; V150-Y195 HydrophobicContact CB-CD1 3.64Å; V150-Y195 HydrophobicContact CB-CE1 4.44Å; V150-Y195 HydrophobicContact CB-CG 4.27Å; V150-Y195 HydrophobicContact CG2-CD1 3.41Å; V150-Y195 VanDerWaalsContact CG2-CD1 3.41Å; V150-Y195 HydrophobicContact CG2-CE1 3.73Å; V150-Y195 HydrophobicContact CG2-CG 4.42Å; V150-Y195 PolarHBondContact N-O 3.25Å; V150-Y195 PolarHBondContact O-N 3.11Å; V150-A209 VanDerWaalsContact CA-O 3.25Å; V150-A209 WeakPolarHBondContact CA-O 3.45Å; V150-A209 HydrophobicContact CB-CB 4.49Å; V150-A209 HydrophobicContact CG1-CB 4.33Å; V150-A209 HydrophobicContact CG2-CB 4.08Å; V150-L218 HydrophobicContact CG1-CD1 4.46Å
151	V	41.2	Very low	42.1	Very low	9 Å²	9	66.4 Å²	66.4	6%	0.055	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	122.4	171.2	-167.2	0	0	0	0	109.3	L149 V153 T192 L194 V208 A209 W210 L211 L226	L149-V151 HydrophobicContact CD2-CG2 3.6Å; L149-V151 HydrophobicContact CG-CG2 4.34Å; V151-V153 HydrophobicContact CG1-CG2 3.66Å; V151-T192 HydrophobicContact CG1-CG2 4Å; V151-L194 HydrophobicContact CB-CD2 3.97Å; V151-L194 HydrophobicContact CG1-CD2 3.72Å; V151-L194 HydrophobicContact CG2-CD2 3.64Å; V151-V208 HydrophobicContact CG2-CG1 4.45Å; V151-A209 PolarHBondContact N-O 3.39Å; V151-W210 HydrophobicContact CB-CB 3.82Å; V151-W210 HydrophobicContact CG2-CB 4.02Å; V151-W210 CarbonylContact O-C 3.56Å; V151-W210 WeakPolarHBondContact O-CA 3.43Å; V151-L211 PolarHBondContact O-N 2.86Å; V151-L226 HydrophobicContact CG2-CD2 3.93Å
152	L	41.5	Very low	41.4	Very low	2 Å²	2	65.6 Å²	65.6	1%	0.01	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	90.2	171.1	-41.8	164.6	0	0	0	107.5	V150 M155 V160 V163 W193 L211	V150-L152 HydrophobicContact CG1-CD2 3.57Å; V150-L152 HydrophobicContact CG1-CG 4.08Å; L152-M155 HydrophobicContact CB-CB 4.31Å; L152-M155 HydrophobicContact CB-CG 4.23Å; L152-M155 HydrophobicContact CD2-CE 4.36Å; L152-V160 HydrophobicContact CD1-CB 4.32Å; L152-V160 HydrophobicContact CD1-CG1 3.79Å; L152-V160 HydrophobicContact CD1-CG2 3.98Å; L152-V163 HydrophobicContact CD2-CG1 4.19Å; L152-W193 HydrophobicContact CB-CB 4.03Å; L152-W193 PolarHBondContact N-O 2.91Å; L152-W193 WeakPolarHBondContact O-CB 3.49Å; L152-W193 PolarHBondContact O-N 3.27Å; L152-L211 HydrophobicContact CD2-CB 3.82Å; L152-L211 HydrophobicContact CD2-CD1 4.01Å
153	V	36.3	Very low	40.4	Very low	56 Å²	56	58.5 Å²	58.5	34%	0.339	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	130.7	177.4	-173.7	0	0	0	0	108.7	V151 M155 T192 S213	V151-V153 HydrophobicContact CG1-CG2 3.66Å; V153-M155 VanDerWaalsContact O-CG 3.32Å; V153-M155 WeakPolarHBondContact O-CG 3.45Å; V153-M155 PolarHBondContact O-N 2.81Å; V153-T192 HydrophobicContact CG2-CG2 4.12Å; V153-S213 WeakPolarHBondContact O-CB 3.49Å
154	N	37.1	Very low	39.8	Very low	64 Å²	64	59 Å²	59	34%	0.342	31%	0.31	S	S	.	.	S	Bend	trans	45.3	62.9	170.4	-167.7	18.6	0	0	0	114.3	D189 F191 S213	N154-D189 PolarHBondContact OD1-O 3.46Å; N154-F191 WeakPolarHBondContact CA-O 3.31Å; N154-F191 PolarHBondContact N-O 3.46Å; N154-S213 WeakPolarHBondContact O-CB 3.4Å
155	M	37.8	Very low	39.4	Very low	20 Å²	20	59.4 Å²	59.4	10%	0.099	32%	0.315	C	S	.	.			trans	-126.4	133.7	-174.3	-77.2	-93.5	-77.4	0	0	110.9	L152 V153 V159 V160 V163 L211	L152-M155 HydrophobicContact CB-CB 4.31Å; L152-M155 HydrophobicContact CB-CG 4.23Å; L152-M155 HydrophobicContact CD2-CE 4.36Å; V153-M155 VanDerWaalsContact O-CG 3.32Å; V153-M155 WeakPolarHBondContact O-CG 3.45Å; V153-M155 PolarHBondContact O-N 2.81Å; M155-V159 HydrophobicContact CE-CB 3.78Å; M155-V159 HydrophobicContact CE-CG1 3.4Å; M155-V159 HydrophobicContact SD-CB 3.99Å; M155-V159 HydrophobicContact SD-CG1 3.76Å; M155-V160 HydrophobicContact CB-CG2 3.92Å; M155-V163 HydrophobicContact CE-CG2 4.02Å; M155-L211 HydrophobicContact CE-CD1 3.7Å; M155-L211 HydrophobicContact CE-CD2 3.47Å; M155-L211 VanDerWaalsContact CE-CD2 3.47Å; M155-L211 HydrophobicContact CE-CG 4.13Å; M155-L211 HydrophobicContact CG-CD2 4.5Å; M155-L211 HydrophobicContact SD-CD2 3.6Å
156	S	41.3	Very low	38.9	Very low	71 Å²	71	53.8 Å²	53.8	50%	0.497	31%	0.307	S	S	.	.			trans	-76.4	152.8	173.7	72.7	0	0	0	0	111.4	Q158 V159 V160	S156-Q158 PolarHBondContact O-N 2.81Å; S156-Q158 VanDerWaalsContact O-N 3.13Å; S156-V159 PolarHBondContact O-N 3.36Å; S156-V160 PolarHBondContact O-N 3.14Å
157	E	40.2	Very low	38.9	Very low	102 Å²	102	53.7 Å²	53.7	48%	0.477	31%	0.309	S	S	.	.	H	α-helix	trans	-50.6	-39.6	-176.2	-177.7	-179	-173.6	0	0	113.7	V159 V160 S161 L181 L184	E157-V159 VanDerWaalsContact C-N 3.33Å; E157-V159 PolarHBondContact O-N 3.03Å; E157-V160 PolarHBondContact O-N 2.85Å; E157-S161 WeakPolarHBondContact O-CB 3.36Å; E157-S161 PolarHBondContact O-N 3.28Å; E157-L181 HydrophobicContact CG-CD1 4.1Å; E157-L184 HydrophobicContact CB-CD1 3.84Å; E157-L184 VanDerWaalsContact CD-CD1 3.42Å; E157-L184 HydrophobicContact CG-CD1 3.63Å
158	Q	41	Very low	38.6	Very low	156 Å²	156	52.8 Å²	52.8	73%	0.729	32%	0.324	S	S	*	.	H	α-helix	trans	-61.4	-40.3	178.6	-66.4	-178	-6.2	0	0	112.3	S156 T162	S156-Q158 PolarHBondContact O-N 2.81Å; S156-Q158 VanDerWaalsContact O-N 3.13Å; Q158-T162 WeakPolarHBondContact O-CB 3.41Å; Q158-T162 PolarHBondContact O-N 2.78Å; Q158-T162 PolarHBondContact O-OG1 2.79Å
159	V	40.8	Very low	38.6	Very low	56 Å²	56	54.8 Å²	54.8	34%	0.339	34%	0.335	S	S	.	.	H	α-helix	trans	-76.5	-38.6	178.4	-160.9	0	0	0	0	110.1	M155 S156 E157 S161 T162 V163	M155-V159 HydrophobicContact CE-CB 3.78Å; M155-V159 HydrophobicContact CE-CG1 3.4Å; M155-V159 HydrophobicContact SD-CB 3.99Å; M155-V159 HydrophobicContact SD-CG1 3.76Å; S156-V159 PolarHBondContact O-N 3.36Å; E157-V159 VanDerWaalsContact C-N 3.33Å; E157-V159 PolarHBondContact O-N 3.03Å; V159-S161 PolarHBondContact O-N 2.78Å; V159-T162 PolarHBondContact O-N 3.31Å; V159-V163 HydrophobicContact CG1-CG2 4.23Å; V159-V163 WeakPolarHBondContact O-CB 3.2Å; V159-V163 WeakPolarHBondContact O-CG2 3.36Å; V159-V163 PolarHBondContact O-N 3.25Å
160	V	43.1	Very low	38.2	Very low	12 Å²	12	61.7 Å²	61.7	7%	0.073	37%	0.367	C	S	.	.	H	α-helix	trans	-56.4	-49.7	172.8	175.4	0	0	0	0	111.1	L152 M155 S156 E157 V163 L164	L152-V160 HydrophobicContact CD1-CB 4.32Å; L152-V160 HydrophobicContact CD1-CG1 3.79Å; L152-V160 HydrophobicContact CD1-CG2 3.98Å; M155-V160 HydrophobicContact CB-CG2 3.92Å; S156-V160 PolarHBondContact O-N 3.14Å; E157-V160 PolarHBondContact O-N 2.85Å; V160-V163 PolarHBondContact O-N 2.79Å; V160-L164 HydrophobicContact CG1-CD1 3.99Å; V160-L164 WeakPolarHBondContact O-CG 3.31Å; V160-L164 PolarHBondContact O-N 2.97Å
161	S	40.4	Very low	37.7	Very low	44 Å²	44	67.9 Å²	67.9	31%	0.308	39%	0.394	S	S	.	.	H	α-helix	trans	-63.6	-41.7	178.5	-176.8	0	0	0	0	112.4	E157 V159 S165	E157-S161 WeakPolarHBondContact O-CB 3.36Å; E157-S161 PolarHBondContact O-N 3.28Å; V159-S161 PolarHBondContact O-N 2.78Å; S161-S165 WeakPolarHBondContact O-CB 3.24Å; S161-S165 PolarHBondContact O-N 3.19Å; S161-S165 PolarHBondContact O-OG 2.91Å
162	T	39.7	Very low	37	Very low	91 Å²	91	72.3 Å²	72.3	56%	0.558	42%	0.421	S	S	*	.	H	α-helix	trans	-63.1	-42.5	175.2	-59.6	0	0	0	0	111.6	Q158 V159 S165 S166	Q158-T162 WeakPolarHBondContact O-CB 3.41Å; Q158-T162 PolarHBondContact O-N 2.78Å; Q158-T162 PolarHBondContact O-OG1 2.79Å; V159-T162 PolarHBondContact O-N 3.31Å; T162-S165 PolarHBondContact O-N 2.85Å; T162-S166 WeakPolarHBondContact O-CB 3.1Å; T162-S166 PolarHBondContact O-N 3.21Å; T162-S166 PolarHBondContact O-OG 2.68Å
163	V	39.1	Very low	36.3	Very low	16 Å²	16	74.5 Å²	74.5	10%	0.097	44%	0.436	C	S	.	.	H	α-helix	trans	-66.1	-48.3	-180	167.7	0	0	0	0	111.1	L152 M155 V159 V160 S165 S166 A167 L211	L152-V163 HydrophobicContact CD2-CG1 4.19Å; M155-V163 HydrophobicContact CE-CG2 4.02Å; V159-V163 HydrophobicContact CG1-CG2 4.23Å; V159-V163 WeakPolarHBondContact O-CB 3.2Å; V159-V163 WeakPolarHBondContact O-CG2 3.36Å; V159-V163 PolarHBondContact O-N 3.25Å; V160-V163 PolarHBondContact O-N 2.79Å; V163-S165 VanDerWaalsContact C-N 3.29Å; V163-S165 PolarHBondContact O-N 3.35Å; V163-S166 WeakPolarHBondContact CA-OG 3.14Å; V163-S166 PolarHBondContact O-N 2.84Å; V163-S166 VanDerWaalsContact O-N 3.09Å; V163-S166 PolarHBondContact O-OG 3.41Å; V163-A167 PolarHBondContact O-N 3.5Å; V163-L211 HydrophobicContact CB-CD1 4.14Å; V163-L211 HydrophobicContact CG1-CD1 3.69Å; V163-L211 HydrophobicContact CG2-CD1 3.35Å
164	L	42.2	Very low	35.8	Very low	36 Å²	36	77.6 Å²	77.6	19%	0.188	45%	0.447	C	S	.	.	H	α-helix	trans	-58.5	-41.3	174.8	-69.4	170.7	0	0	0	111.6	V160 A167 Y195	V160-L164 HydrophobicContact CG1-CD1 3.99Å; V160-L164 WeakPolarHBondContact O-CG 3.31Å; V160-L164 PolarHBondContact O-N 2.97Å; L164-A167 PolarHBondContact O-N 3.29Å; L164-Y195 HydrophobicContact CD2-CD2 4.16Å; L164-Y195 HydrophobicContact CD2-CE2 3.96Å
165	S	38.9	Very low	35.3	Very low	80 Å²	80	77.2 Å²	77.2	56%	0.559	45%	0.448	S	S	*	.	H	α-helix	trans	-66.6	-34.2	175.1	-56.1	0	0	0	0	113	S161 T162 V163	S161-S165 WeakPolarHBondContact O-CB 3.24Å; S161-S165 PolarHBondContact O-N 3.19Å; S161-S165 PolarHBondContact O-OG 2.91Å; T162-S165 PolarHBondContact O-N 2.85Å; V163-S165 VanDerWaalsContact C-N 3.29Å; V163-S165 PolarHBondContact O-N 3.35Å
166	S	34.3	Very low	34.8	Very low	86 Å²	86	82.5 Å²	82.5	60%	0.601	48%	0.477	S	S	*	.	H	α-helix	trans	-78.2	-18.8	179.8	73.8	0	0	0	0	114.1	T162 V163 G168	T162-S166 WeakPolarHBondContact O-CB 3.1Å; T162-S166 PolarHBondContact O-N 3.21Å; T162-S166 PolarHBondContact O-OG 2.68Å; V163-S166 WeakPolarHBondContact CA-OG 3.14Å; V163-S166 PolarHBondContact O-N 2.84Å; V163-S166 VanDerWaalsContact O-N 3.09Å; V163-S166 PolarHBondContact O-OG 3.41Å; S166-G168 PolarHBondContact O-N 3.13Å; S166-G168 VanDerWaalsContact O-N 3.07Å
167	A	34.5	Very low	34.1	Very low	59 Å²	59	84.2 Å²	84.2	49%	0.488	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	8.3	-174	0	0	0	0	0	114.7	V163 L164 H169	V163-A167 PolarHBondContact O-N 3.5Å; L164-A167 PolarHBondContact O-N 3.29Å; A167-H169 VanDerWaalsContact C-N 3.28Å; A167-H169 PolarHBondContact O-N 3.09Å
168	G	29.1	Very low	33.5	Very low	61 Å²	61	81.2 Å²	81.2	63%	0.629	47%	0.467	S	S	*	.	S	Bend	trans	76.6	1.8	172.2	0	0	0	0	0	116.1	S166 E170	S166-G168 PolarHBondContact O-N 3.13Å; S166-G168 VanDerWaalsContact O-N 3.07Å; G168-E170 PolarHBondContact O-N 3.21Å
169	H	35.2	Very low	32.7	Very low	104 Å²	104	75.3 Å²	75.3	48%	0.481	44%	0.44	S	S	.	.			trans	-75.3	56.7	174	-94.9	-67.2	0	0	0	112.3	A167 Q171	A167-H169 VanDerWaalsContact C-N 3.28Å; A167-H169 PolarHBondContact O-N 3.09Å; H169-Q171 PolarHBondContact O-N 2.67Å
170	E	29.1	Very low	32	Very low	147 Å²	147	80.3 Å²	80.3	69%	0.687	47%	0.465	S	S	*	.			trans	-71	16.4	177.8	-73.2	-164.5	157.4	0	0	114.3	G168	G168-E170 PolarHBondContact O-N 3.21Å
171	Q	28.7	Very low	31.4	Very low	154 Å²	154	81.3 Å²	81.3	72%	0.72	47%	0.47	S	S	*	.	S	Bend	trans	-134.9	137.8	177.6	-64	-167.9	13.1	0	0	113.3	H169 C173	H169-Q171 PolarHBondContact O-N 2.67Å; Q171-C173 PolarHBondContact O-N 2.79Å
172	T	26.8	Very low	30.7	Very low	102 Å²	102	88.7 Å²	88.7	63%	0.626	50%	0.5	S	S	*	.	S	Bend	trans	69.4	3.5	169.2	66.3	0	0	0	0	119.6
173	C	26	Very low	30.1	Very low	48 Å²	48	92.8 Å²	92.8	32%	0.324	51%	0.512	S	S	.	.			trans	-130.7	111.3	172.4	-57.8	0	0	0	0	111.8	Q171 I178	Q171-C173 PolarHBondContact O-N 2.79Å; C173-I178 HydrophobicContact CB-CD1 3.69Å; C173-I178 HydrophobicContact CB-CG1 3.75Å
174	Q	26	Very low	29.7	Very low	121 Å²	121	93.8 Å²	93.8	57%	0.565	52%	0.517	S	S	*	.			trans	-61.4	154.4	154.9	-62.1	-85.1	-53	0	0	108.2	N176 D177 I178	Q174-N176 HydrophobicContact CB-CB 4.39Å; Q174-N176 PolarHBondContact O-N 3.33Å; Q174-D177 HydrophobicContact CB-CB 4.21Å; Q174-D177 WeakPolarHBondContact CB-OD2 3.12Å; Q174-D177 WeakPolarHBondContact CG-OD2 3.37Å; Q174-D177 PolarHBondContact N-OD2 2.95Å; Q174-D177 PolarHBondContact O-N 2.97Å; Q174-I178 PolarHBondContact O-N 3.18Å
175	P	26.8	Very low	29	Very low	56 Å²	56	98.2 Å²	98.2	36%	0.364	54%	0.541	S	S	.	.	H	α-helix	trans	-48.5	-51.4	161.8	-25.9	35.2	0	0	0	109.6	D177 I178 L179	P175-D177 PolarHBondContact O-N 3.19Å; P175-I178 PolarHBondContact O-N 3.37Å; P175-L179 HydrophobicContact CB-CD1 3.94Å; P175-L179 WeakPolarHBondContact O-CB 3.42Å; P175-L179 VanDerWaalsContact O-CD1 3.25Å; P175-L179 WeakPolarHBondContact O-CD1 3.26Å; P175-L179 WeakPolarHBondContact O-CG 3.45Å; P175-L179 PolarHBondContact O-N 3.15Å
176	N	26.8	Very low	28.6	Very low	131 Å²	131	100.3 Å²	100.3	70%	0.701	55%	0.553	S	S	*	*	H	α-helix	trans	-60.3	-16.5	-180	-55.7	-0.2	0	0	0	115.1	Q174	Q174-N176 HydrophobicContact CB-CB 4.39Å; Q174-N176 PolarHBondContact O-N 3.33Å
177	D	27.1	Very low	28.2	Very low	107 Å²	107	99.8 Å²	99.8	57%	0.572	56%	0.561	S	S	*	*	H	α-helix	trans	-87.5	-22	175.8	-59.5	-35.5	0	0	0	112.5	Q174 P175	Q174-D177 HydrophobicContact CB-CB 4.21Å; Q174-D177 WeakPolarHBondContact CB-OD2 3.12Å; Q174-D177 WeakPolarHBondContact CG-OD2 3.37Å; Q174-D177 PolarHBondContact N-OD2 2.95Å; Q174-D177 PolarHBondContact O-N 2.97Å; P175-D177 PolarHBondContact O-N 3.19Å
178	I	27.7	Very low	28.1	Very low	39 Å²	39	98.7 Å²	98.7	20%	0.2	56%	0.555	C	S	.	*	H	α-helix	trans	-87.3	-15.4	174.9	-53.9	155.8	0	0	0	110.2	M123 C173 Q174 P175	M123-I178 HydrophobicContact CE-CB 4.37Å; M123-I178 HydrophobicContact CE-CG1 3.72Å; M123-I178 HydrophobicContact SD-CG1 4.09Å; M123-I178 HydrophobicContact SD-CG2 4.38Å; C173-I178 HydrophobicContact CB-CD1 3.69Å; C173-I178 HydrophobicContact CB-CG1 3.75Å; Q174-I178 PolarHBondContact O-N 3.18Å; P175-I178 PolarHBondContact O-N 3.37Å
179	L	25.3	Very low	28.5	Very low	31 Å²	31	101.6 Å²	101.6	16%	0.162	56%	0.556	C	S	.	*			trans	-131.6	88.9	-149.5	-65	179.2	0	0	0	113.6	P175 L181	P175-L179 HydrophobicContact CB-CD1 3.94Å; P175-L179 WeakPolarHBondContact O-CB 3.42Å; P175-L179 VanDerWaalsContact O-CD1 3.25Å; P175-L179 WeakPolarHBondContact O-CD1 3.26Å; P175-L179 WeakPolarHBondContact O-CG 3.45Å; P175-L179 PolarHBondContact O-N 3.15Å; L179-L181 HydrophobicContact CB-CB 4.17Å; L179-L181 HydrophobicContact CB-CD1 4.05Å; L179-L181 HydrophobicContact CB-CG 3.64Å; L179-L181 HydrophobicContact CD1-CD1 3.67Å; L179-L181 HydrophobicContact CD1-CG 4.24Å; L179-L181 HydrophobicContact CD2-CD1 3.69Å; L179-L181 HydrophobicContact CD2-CD2 4.02Å; L179-L181 HydrophobicContact CD2-CG 3.65Å; L179-L181 HydrophobicContact CG-CD1 3.91Å; L179-L181 HydrophobicContact CG-CG 3.93Å; L179-L181 PolarHBondContact O-N 3.19Å
180	D	24.7	Very low	28.6	Very low	162 Å²	162	98.9 Å²	98.9	87%	0.866	55%	0.545	S	S	*	.			trans	-66.9	38.3	152.1	-105.1	-25.4	0	0	0	111.1	E182	D180-E182 PolarHBondContact O-N 3.15Å
181	L	30.5	Very low	28.7	Very low	32 Å²	32	94 Å²	94	17%	0.168	52%	0.522	C	S	.	.	G	3₁₀ helix	trans	-76.2	-1.3	-177.8	-67.8	-171.5	0	0	0	113.5	L125 E157 L179 Q183 L184	L125-L181 HydrophobicContact CD2-CD2 4.42Å; E157-L181 HydrophobicContact CG-CD1 4.1Å; L179-L181 HydrophobicContact CB-CB 4.17Å; L179-L181 HydrophobicContact CB-CD1 4.05Å; L179-L181 HydrophobicContact CB-CG 3.64Å; L179-L181 HydrophobicContact CD1-CD1 3.67Å; L179-L181 HydrophobicContact CD1-CG 4.24Å; L179-L181 HydrophobicContact CD2-CD1 3.69Å; L179-L181 HydrophobicContact CD2-CD2 4.02Å; L179-L181 HydrophobicContact CD2-CG 3.65Å; L179-L181 HydrophobicContact CG-CD1 3.91Å; L179-L181 HydrophobicContact CG-CG 3.93Å; L179-L181 PolarHBondContact O-N 3.19Å; L181-Q183 PolarHBondContact O-N 3.05Å; L181-L184 HydrophobicContact CB-CD1 4.01Å; L181-L184 HydrophobicContact CB-CG 3.84Å; L181-L184 HydrophobicContact CD1-CD1 3.73Å; L181-L184 HydrophobicContact CD1-CG 4.34Å; L181-L184 HydrophobicContact CD2-CD1 3.78Å; L181-L184 HydrophobicContact CD2-CD2 3.78Å; L181-L184 HydrophobicContact CD2-CG 3.57Å; L181-L184 HydrophobicContact CG-CD1 4Å; L181-L184 HydrophobicContact CG-CG 4.05Å; L181-L184 WeakPolarHBondContact O-CB 3.23Å; L181-L184 PolarHBondContact O-N 3.07Å
182	E	26.3	Very low	29.3	Very low	200 Å²	200	87.5 Å²	87.5	94%	0.935	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-62.5	-4.2	167.8	-65.3	-161.2	141.9	0	0	112.9	D180	D180-E182 PolarHBondContact O-N 3.15Å
183	Q	27.4	Very low	30.1	Very low	176 Å²	176	84 Å²	84	82%	0.822	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-112.3	23	166	-59.7	-170.8	32.5	0	0	114.2	L181 D185	L181-Q183 PolarHBondContact O-N 3.05Å; Q183-D185 PolarHBondContact O-N 3.24Å
184	L	30.2	Very low	30.7	Very low	37 Å²	37	81.7 Å²	81.7	19%	0.194	45%	0.452	C	S	.	.			trans	-70	95.4	162.9	-79.8	-167.6	0	0	0	110.9	E157 L181 P186 W193	E157-L184 HydrophobicContact CB-CD1 3.84Å; E157-L184 VanDerWaalsContact CD-CD1 3.42Å; E157-L184 HydrophobicContact CG-CD1 3.63Å; L181-L184 HydrophobicContact CB-CD1 4.01Å; L181-L184 HydrophobicContact CB-CG 3.84Å; L181-L184 HydrophobicContact CD1-CD1 3.73Å; L181-L184 HydrophobicContact CD1-CG 4.34Å; L181-L184 HydrophobicContact CD2-CD1 3.78Å; L181-L184 HydrophobicContact CD2-CD2 3.78Å; L181-L184 HydrophobicContact CD2-CG 3.57Å; L181-L184 HydrophobicContact CG-CD1 4Å; L181-L184 HydrophobicContact CG-CG 4.05Å; L181-L184 WeakPolarHBondContact O-CB 3.23Å; L181-L184 PolarHBondContact O-N 3.07Å; L184-P186 WeakPolarHBondContact O-CD 3.18Å; L184-P186 VanDerWaalsContact O-N 3.12Å; L184-W193 HydrophobicContact CD2-CH2 3.31Å; L184-W193 HydrophobicContact CD2-CZ2 3.71Å; L184-W193 HydrophobicContact CD2-CZ3 4.38Å
185	D	27.9	Very low	31.4	Very low	129 Å²	129	77 Å²	77	69%	0.69	43%	0.43	S	S	*	.			trans	-58.1	108.6	163.5	-157.6	2.2	0	0	0	109.3	Q183 G187	Q183-D185 PolarHBondContact O-N 3.24Å; D185-G187 PolarHBondContact O-N 2.97Å
186	P	29.4	Very low	31.8	Very low	125 Å²	125	74.7 Å²	74.7	81%	0.812	42%	0.415	S	S	*	.	S	Bend	trans	-88.7	36.7	-156.8	36.6	-37.9	0	0	0	113.2	L184	L184-P186 WeakPolarHBondContact O-CD 3.18Å; L184-P186 VanDerWaalsContact O-N 3.12Å
187	G	25.9	Very low	32.2	Very low	75 Å²	75	69 Å²	69	77%	0.773	39%	0.385	S	S	*	.			trans	-158.9	61.5	-167.6	0	0	0	0	0	114.9	D185	D185-G187 PolarHBondContact O-N 2.97Å
188	G	33.6	Very low	32.6	Very low	35 Å²	35	65.8 Å²	65.8	36%	0.361	37%	0.37	S	S	.	.			trans	-164.1	114.2	171.5	0	0	0	0	0	114.5	D190 F191	G188-D190 PolarHBondContact O-N 3.13Å; G188-D190 VanDerWaalsContact O-N 3.08Å; G188-F191 WeakPolarHBondContact O-CD2 3.09Å
189	D	37.7	Very low	32.9	Very low	122 Å²	122	65.5 Å²	65.5	65%	0.652	37%	0.372	S	S	*	.	S	Bend	trans	-76.2	17.1	176.6	-45.6	-56.2	0	0	0	113.3	N154	N154-D189 PolarHBondContact OD1-O 3.46Å
190	D	36.5	Very low	33.2	Very low	47 Å²	47	69.3 Å²	69.3	25%	0.251	40%	0.396	S	S	.	.			trans	-112.4	23.7	-167.3	-67.6	-55.9	0	0	0	113.2	K130 G188 K250	K130-D190 WeakPolarHBondContact CB-O 3.23Å; K130-D190 PolarHBondContact N-O 2.98Å; G188-D190 PolarHBondContact O-N 3.13Å; G188-D190 VanDerWaalsContact O-N 3.08Å; D190-K250 IonicContact OD1-NZ 2.68Å; D190-K250 PolarHBondContact OD1-NZ 2.85Å; D190-K250 IonicContact OD2-NZ 2.98Å; D190-K250 PolarHBondContact OD2-NZ 2.94Å
191	F	32.4	Very low	33.6	Very low	46 Å²	46	63.6 Å²	63.6	20%	0.202	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139	-177.2	-65.5	-68.1	0	0	0	114.2	K127 R129 N154 G188	K127-F191 HydrophobicContact CD-CD1 4.1Å; K127-F191 HydrophobicContact CD-CE1 4.15Å; K127-F191 HydrophobicContact CD-CG 4.5Å; K127-F191 VanDerWaalsContact CE-CD1 3.45Å; K127-F191 VanDerWaalsContact CE-CG 3.49Å; K127-F191 HydrophobicContact CG-CD1 3.8Å; K127-F191 HydrophobicContact CG-CE1 4.25Å; K127-F191 HydrophobicContact CG-CG 4.31Å; R129-F191 HydrophobicContact CG-CD1 4.25Å; R129-F191 HydrophobicContact CG-CE1 3.71Å; N154-F191 WeakPolarHBondContact CA-O 3.31Å; N154-F191 PolarHBondContact N-O 3.46Å; G188-F191 WeakPolarHBondContact O-CD2 3.09Å
192	T	40.7	Very low	33.7	Very low	17 Å²	17	69.7 Å²	69.7	10%	0.104	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.3	163	-63.4	0	0	0	0	108.8	F128 V151 V153	F128-T192 PolarHBondContact N-O 2.83Å; F128-T192 PolarHBondContact O-N 3.2Å; V151-T192 HydrophobicContact CG1-CG2 4Å; V153-T192 HydrophobicContact CG2-CG2 4.12Å
193	W	42.7	Very low	34.2	Very low	27 Å²	27	67.2 Å²	67.2	10%	0.102	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	136.1	173.8	-56.2	98.5	0	0	0	110.2	L125 K127 L152 L184	L125-W193 HydrophobicContact CD1-CB 4.49Å; L125-W193 HydrophobicContact CD1-CE3 4.28Å; L125-W193 HydrophobicContact CD2-CE3 3.85Å; L125-W193 HydrophobicContact CD2-CZ3 3.94Å; L125-W193 HydrophobicContact CG-CE3 4.02Å; L125-W193 HydrophobicContact CG-CZ3 4.42Å; K127-W193 HydrophobicContact CB-CE3 3.98Å; K127-W193 HydrophobicContact CB-CH2 4.17Å; K127-W193 HydrophobicContact CB-CZ3 3.56Å; K127-W193 HydrophobicContact CD-CH2 3.41Å; K127-W193 VanDerWaalsContact CD-CH2 3.41Å; K127-W193 HydrophobicContact CD-CZ2 4.18Å; K127-W193 HydrophobicContact CD-CZ3 3.73Å; K127-W193 VanDerWaalsContact CE-CH2 3.42Å; K127-W193 HydrophobicContact CG-CE3 4.05Å; K127-W193 HydrophobicContact CG-CH2 3.64Å; K127-W193 HydrophobicContact CG-CZ2 4.27Å; K127-W193 HydrophobicContact CG-CZ3 3.54Å; L152-W193 HydrophobicContact CB-CB 4.03Å; L152-W193 PolarHBondContact N-O 2.91Å; L152-W193 WeakPolarHBondContact O-CB 3.49Å; L152-W193 PolarHBondContact O-N 3.27Å; L184-W193 HydrophobicContact CD2-CH2 3.31Å; L184-W193 HydrophobicContact CD2-CZ2 3.71Å; L184-W193 HydrophobicContact CD2-CZ3 4.38Å
194	L	39.7	Very low	34.6	Very low	0 Å²	0	61.8 Å²	61.8	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	109	168.7	-68	178.3	0	0	0	108.9	H126 F128 W136 W139 L149 V151	H126-L194 PolarHBondContact N-O 3.3Å; H126-L194 PolarHBondContact O-N 2.85Å; F128-L194 HydrophobicContact CD2-CD1 3.86Å; F128-L194 HydrophobicContact CD2-CG 4.26Å; F128-L194 HydrophobicContact CE2-CB 4.39Å; F128-L194 HydrophobicContact CE2-CD1 3.72Å; F128-L194 HydrophobicContact CE2-CG 4.38Å; W136-L194 HydrophobicContact CB-CD1 3.91Å; W136-L194 HydrophobicContact CD2-CD1 4.28Å; W136-L194 HydrophobicContact CE3-CD1 3.76Å; W136-L194 HydrophobicContact CG-CD1 4.4Å; W139-L194 HydrophobicContact CE3-CB 4.44Å; W139-L194 HydrophobicContact CE3-CD1 3.72Å; W139-L194 HydrophobicContact CH2-CB 4.01Å; W139-L194 HydrophobicContact CZ3-CB 3.62Å; W139-L194 HydrophobicContact CZ3-CD1 3.62Å; W139-L194 HydrophobicContact CZ3-CG 4.19Å; L149-L194 HydrophobicContact CD1-CB 4.4Å; L149-L194 HydrophobicContact CD1-CD2 4.3Å; L149-L194 HydrophobicContact CD2-CD2 4.09Å; L149-L194 HydrophobicContact CG-CD2 4.4Å; V151-L194 HydrophobicContact CB-CD2 3.97Å; V151-L194 HydrophobicContact CG1-CD2 3.72Å; V151-L194 HydrophobicContact CG2-CD2 3.64Å
195	Y	40	Very low	34.9	Very low	23 Å²	23	62.3 Å²	62.3	9%	0.09	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	146.3	168.6	163.5	-80.6	0	0	0	108.7	L149 V150 L164	L149-Y195 CarbonylContact C-O 3.54Å; L149-Y195 WeakPolarHBondContact CA-O 3.35Å; L149-Y195 WeakPolarHBondContact CD1-O 3.36Å; V150-Y195 HydrophobicContact CB-CD1 3.64Å; V150-Y195 HydrophobicContact CB-CE1 4.44Å; V150-Y195 HydrophobicContact CB-CG 4.27Å; V150-Y195 HydrophobicContact CG2-CD1 3.41Å; V150-Y195 VanDerWaalsContact CG2-CD1 3.41Å; V150-Y195 HydrophobicContact CG2-CE1 3.73Å; V150-Y195 HydrophobicContact CG2-CG 4.42Å; V150-Y195 PolarHBondContact N-O 3.25Å; V150-Y195 PolarHBondContact O-N 3.11Å; L164-Y195 HydrophobicContact CD2-CD2 4.16Å; L164-Y195 HydrophobicContact CD2-CE2 3.96Å
196	A	36.5	Very low	35.9	Very low	7 Å²	7	58 Å²	58	6%	0.058	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	130	173.3	0	0	0	0	0	110.6	W139 L143 Y147 F148 L149	W139-A196 HydrophobicContact CH2-CB 4.45Å; L143-A196 HydrophobicContact CD1-CB 4.42Å; Y147-A196 HydrophobicContact CD1-CB 4.08Å; F148-A196 CarbonylContact O-C 3.59Å; F148-A196 VanDerWaalsContact O-CA 3.22Å; F148-A196 WeakPolarHBondContact O-CA 3.4Å; L149-A196 HydrophobicContact CD1-CB 4.41Å
197	S	34.2	Very low	36.3	Very low	11 Å²	11	54 Å²	54	8%	0.077	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.9	178.5	-175.2	0	0	0	0	110.3	Y147 F148 S199	Y147-S197 CarbonylContact C-O 3.55Å; Y147-S197 WeakPolarHBondContact CA-O 3.45Å; F148-S197 PolarHBondContact N-O 3.24Å; F148-S197 PolarHBondContact O-N 3.08Å; S197-S199 PolarHBondContact O-N 3.31Å
198	P	34.5	Very low	37.2	Very low	40 Å²	40	50.5 Å²	50.5	26%	0.26	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	131.8	173.8	-23.1	34.1	0	0	0	111.6	P121 S146 V200	P121-P198 HydrophobicContact CG-CG 4.09Å; S146-P198 WeakPolarHBondContact O-CA 3.47Å; P198-V200 PolarHBondContact O-N 3.19Å
199	S	36	Very low	37.5	Very low	34 Å²	34	49.2 Å²	49.2	24%	0.238	30%	0.296	C	S	.	.			trans	-75.7	111	-173.6	61.7	0	0	0	0	112.3	S146 S197 S201	S146-S199 PolarHBondContact O-N 3.01Å; S146-S199 PolarHBondContact O-OG 2.85Å; S197-S199 PolarHBondContact O-N 3.31Å; S199-S201 PolarHBondContact O-N 3.16Å
200	V	31.6	Very low	37.7	Very low	110 Å²	110	46 Å²	46	67%	0.667	27%	0.274	S	S	*	.			trans	-70.8	-6.6	176	-163.6	0	0	0	0	112.5	P198 N202	P198-V200 PolarHBondContact O-N 3.19Å; V200-N202 PolarHBondContact O-N 3Å
201	S	32	Very low	37.9	Very low	43 Å²	43	43.8 Å²	43.8	30%	0.301	26%	0.263	S	S	.	.			trans	-86.7	108.1	-179.8	54.5	0	0	0	0	112.7	S199 N203	S199-S201 PolarHBondContact O-N 3.16Å; S201-N203 PolarHBondContact O-N 2.89Å
202	N	33.4	Very low	38.1	Very low	160 Å²	160	46.9 Å²	46.9	86%	0.856	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-5.8	174.9	-69.4	-4.8	0	0	0	115.2	V200 G204	V200-N202 PolarHBondContact O-N 3Å; N202-G204 VanDerWaalsContact C-N 3.32Å; N202-G204 PolarHBondContact O-N 3.24Å
203	N	36	Very low	37.9	Very low	148 Å²	148	48.7 Å²	48.7	79%	0.791	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	4.3	-174.2	-67.3	9.4	0	0	0	114.4	S201 A205	S201-N203 PolarHBondContact O-N 2.89Å; N203-A205 PolarHBondContact O-N 2.81Å
204	G	34.9	Very low	37.5	Very low	62 Å²	62	54.5 Å²	54.5	64%	0.639	31%	0.314	S	S	*	.			trans	65.1	6.6	173.6	0	0	0	0	0	116.3	N202 D206	N202-G204 VanDerWaalsContact C-N 3.32Å; N202-G204 PolarHBondContact O-N 3.24Å; G204-D206 PolarHBondContact O-N 3Å
205	A	37.1	Very low	37.2	Very low	47 Å²	47	57.9 Å²	57.9	39%	0.388	34%	0.338	S	S	.	.			trans	-73.9	110.5	178.4	0	0	0	0	0	110.3	N203 V207	N203-A205 PolarHBondContact O-N 2.81Å; A205-V207 HydrophobicContact CB-CG2 4.02Å; A205-V207 PolarHBondContact O-N 2.82Å
206	D	48.6	Very low	37	Very low	38 Å²	38	58.7 Å²	58.7	20%	0.203	35%	0.353	C	S	.	.			trans	-58	81	166	-95.9	-64.1	0	0	0	109.4	R145 G204 T222 K223	R145-D206 WeakPolarHBondContact CA-OD1 3.48Å; R145-D206 WeakPolarHBondContact CG-OD2 3.41Å; G204-D206 PolarHBondContact O-N 3Å; D206-T222 CarbonylContact O-C 3.5Å; D206-T222 WeakPolarHBondContact O-CA 3.4Å; D206-K223 HydrophobicContact CB-CB 3.72Å; D206-K223 HydrophobicContact CB-CD 4.31Å; D206-K223 PolarHBondContact O-N 3.45Å; D206-K223 WeakPolarHBondContact OD1-CD 3.25Å; D206-K223 IonicContact OD1-NZ 3.79Å
207	V	39.3	Very low	36.8	Very low	42 Å²	42	60.6 Å²	60.6	26%	0.255	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	134.3	177.6	175.9	0	0	0	0	110.3	F148 A205 F220 E221	F148-V207 WeakPolarHBondContact CA-O 3.43Å; F148-V207 HydrophobicContact CD1-CB 4.09Å; F148-V207 HydrophobicContact CE1-CB 4.08Å; A205-V207 HydrophobicContact CB-CG2 4.02Å; A205-V207 PolarHBondContact O-N 2.82Å; V207-F220 HydrophobicContact CG1-CD1 4.48Å; V207-E221 CarbonylContact C-O 3.6Å; V207-E221 WeakPolarHBondContact CA-O 3.49Å
208	V	42.8	Very low	37.1	Very low	1 Å²	1	63.1 Å²	63.1	1%	0.006	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.9	177.8	174.1	0	0	0	0	109	L149 V151 E221 K223 L226	L149-V208 HydrophobicContact CB-CB 4.31Å; L149-V208 HydrophobicContact CB-CG1 3.8Å; L149-V208 HydrophobicContact CB-CG2 3.89Å; L149-V208 HydrophobicContact CD2-CG1 3.71Å; L149-V208 HydrophobicContact CD2-CG2 4.46Å; L149-V208 HydrophobicContact CG-CG1 4.23Å; V151-V208 HydrophobicContact CG2-CG1 4.45Å; V208-E221 PolarHBondContact N-O 3.09Å; V208-E221 PolarHBondContact O-N 2.85Å; V208-K223 HydrophobicContact CG2-CB 3.72Å; V208-K223 HydrophobicContact CG2-CG 4.16Å; V208-L226 HydrophobicContact CB-CD2 4.34Å; V208-L226 HydrophobicContact CG1-CD2 3.45Å; V208-L226 VanDerWaalsContact CG1-CD2 3.45Å
209	A	41.6	Very low	37.3	Very low	8 Å²	8	62.7 Å²	62.7	7%	0.066	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	148.2	162.7	0	0	0	0	0	110	L149 V150 V151 L218 S219 F220	L149-A209 PolarHBondContact O-N 2.8Å; L149-A209 VanDerWaalsContact O-O 3.12Å; V150-A209 VanDerWaalsContact CA-O 3.25Å; V150-A209 WeakPolarHBondContact CA-O 3.45Å; V150-A209 HydrophobicContact CB-CB 4.49Å; V150-A209 HydrophobicContact CG1-CB 4.33Å; V150-A209 HydrophobicContact CG2-CB 4.08Å; V151-A209 PolarHBondContact N-O 3.39Å; A209-L218 HydrophobicContact CB-CD1 3.99Å; A209-S219 CarbonylContact C-O 3.5Å; A209-S219 VanDerWaalsContact CA-O 3.26Å; A209-S219 WeakPolarHBondContact CA-O 3.4Å; A209-F220 HydrophobicContact CB-CD1 3.89Å; A209-F220 HydrophobicContact CB-CE1 3.9Å
210	W	42.2	Very low	37.7	Very low	55 Å²	55	68 Å²	68	21%	0.208	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	152	170.2	70.2	-77.3	0	0	0	109.5	V151 R212 S219 E221 L226	V151-W210 HydrophobicContact CB-CB 3.82Å; V151-W210 HydrophobicContact CG2-CB 4.02Å; V151-W210 CarbonylContact O-C 3.56Å; V151-W210 WeakPolarHBondContact O-CA 3.43Å; W210-R212 HydrophobicContact CE3-CG 3.94Å; W210-R212 HydrophobicContact CH2-CG 3.54Å; W210-R212 HydrophobicContact CZ2-CG 4.38Å; W210-R212 HydrophobicContact CZ3-CG 3.29Å; W210-S219 PolarHBondContact N-O 2.84Å; W210-S219 PolarHBondContact O-N 3.29Å; W210-E221 PolarHBondContact NE1-OE1 3.43Å; W210-L226 HydrophobicContact CD2-CD1 4.47Å; W210-L226 HydrophobicContact CG-CD1 4.2Å
211	L	39.3	Very low	38.5	Very low	1 Å²	1	64.1 Å²	64.1	1%	0.005	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	122.5	-171.9	-159.5	160.1	0	0	0	110.5	V151 L152 M155 V163 G216 L218	V151-L211 PolarHBondContact O-N 2.86Å; L152-L211 HydrophobicContact CD2-CB 3.82Å; L152-L211 HydrophobicContact CD2-CD1 4.01Å; M155-L211 HydrophobicContact CE-CD1 3.7Å; M155-L211 HydrophobicContact CE-CD2 3.47Å; M155-L211 VanDerWaalsContact CE-CD2 3.47Å; M155-L211 HydrophobicContact CE-CG 4.13Å; M155-L211 HydrophobicContact CG-CD2 4.5Å; M155-L211 HydrophobicContact SD-CD2 3.6Å; V163-L211 HydrophobicContact CB-CD1 4.14Å; V163-L211 HydrophobicContact CG1-CD1 3.69Å; V163-L211 HydrophobicContact CG2-CD1 3.35Å; L211-G216 VanDerWaalsContact CD2-C 3.48Å; L211-L218 HydrophobicContact CB-CD1 4.4Å; L211-L218 HydrophobicContact CD1-CB 4.4Å; L211-L218 HydrophobicContact CD1-CD1 4.18Å
212	R	36.5	Very low	39.3	Very low	111 Å²	111	65.3 Å²	65.3	42%	0.419	38%	0.376	S	S	.	.			trans	-78.8	117.9	-179.5	-68.9	-178.6	74.4	152.8	2.5	110.5	W210 E214 S215 G216 S217	W210-R212 HydrophobicContact CE3-CG 3.94Å; W210-R212 HydrophobicContact CH2-CG 3.54Å; W210-R212 HydrophobicContact CZ2-CG 4.38Å; W210-R212 HydrophobicContact CZ3-CG 3.29Å; R212-E214 IonicContact NH2-OE2 4Å; R212-E214 PolarHBondContact O-N 3.31Å; R212-S215 VanDerWaalsContact CB-OG 3.3Å; R212-S215 WeakPolarHBondContact CB-OG 3.45Å; R212-S215 PolarHBondContact O-N 3.21Å; R212-G216 WeakPolarHBondContact O-CA 3.31Å; R212-G216 PolarHBondContact O-N 3.43Å; R212-S217 PolarHBondContact N-O 3.23Å
213	S	37.2	Very low	40.2	Very low	55 Å²	55	58.7 Å²	58.7	39%	0.385	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-34.6	176.5	49.6	0	0	0	0	113.9	V153 N154	V153-S213 WeakPolarHBondContact O-CB 3.49Å; N154-S213 WeakPolarHBondContact O-CB 3.4Å
214	E	33.3	Very low	41	Very low	148 Å²	148	60.7 Å²	60.7	69%	0.692	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-29.9	-175.7	-57.1	176.6	133.1	0	0	113.9	R212	R212-E214 IonicContact NH2-OE2 4Å; R212-E214 PolarHBondContact O-N 3.31Å
215	S	34.1	Very low	42	Very low	71 Å²	71	59.2 Å²	59.2	50%	0.497	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-8.8	-170.2	53.4	0	0	0	0	113.8	R212 S217	R212-S215 VanDerWaalsContact CB-OG 3.3Å; R212-S215 WeakPolarHBondContact CB-OG 3.45Å; R212-S215 PolarHBondContact O-N 3.21Å; S215-S217 PolarHBondContact O-N 2.79Å; S215-S217 VanDerWaalsContact O-N 3.1Å; S215-S217 WeakPolarHBondContact OG-CB 3.37Å; S215-S217 PolarHBondContact OG-N 2.73Å; S215-S217 PolarHBondContact OG-OG 3.44Å
216	G	35	Very low	42.8	Very low	40 Å²	40	57.4 Å²	57.4	41%	0.412	30%	0.3	S	S	.	.			trans	64.3	5.1	-169.5	0	0	0	0	0	114	L211 R212 L218	L211-G216 VanDerWaalsContact CD2-C 3.48Å; R212-G216 WeakPolarHBondContact O-CA 3.31Å; R212-G216 PolarHBondContact O-N 3.43Å; G216-L218 PolarHBondContact O-N 3.1Å
217	S	33.2	Very low	43.1	Very low	47 Å²	47	56.8 Å²	56.8	33%	0.329	30%	0.296	S	S	.	.			trans	-81	111.3	-166	63.7	0	0	0	0	111.9	R212 S215 S219	R212-S217 PolarHBondContact N-O 3.23Å; S215-S217 PolarHBondContact O-N 2.79Å; S215-S217 VanDerWaalsContact O-N 3.1Å; S215-S217 WeakPolarHBondContact OG-CB 3.37Å; S215-S217 PolarHBondContact OG-N 2.73Å; S215-S217 PolarHBondContact OG-OG 3.44Å; S217-S219 PolarHBondContact O-N 3.38Å; S217-S219 PolarHBondContact O-OG 3.41Å
218	L	39.7	Very low	43.8	Very low	64 Å²	64	58.8 Å²	58.8	34%	0.335	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	118	167.8	-170.5	70.7	0	0	0	109.1	V150 A209 L211 G216 F220	V150-L218 HydrophobicContact CG1-CD1 4.46Å; A209-L218 HydrophobicContact CB-CD1 3.99Å; L211-L218 HydrophobicContact CB-CD1 4.4Å; L211-L218 HydrophobicContact CD1-CB 4.4Å; L211-L218 HydrophobicContact CD1-CD1 4.18Å; G216-L218 PolarHBondContact O-N 3.1Å; L218-F220 HydrophobicContact CD2-CE1 4.4Å; L218-F220 HydrophobicContact CD2-CE2 3.84Å; L218-F220 HydrophobicContact CD2-CZ 3.51Å; L218-F220 HydrophobicContact CG-CE2 4.02Å; L218-F220 HydrophobicContact CG-CZ 4Å
219	S	39.1	Very low	44.3	Very low	32 Å²	32	63 Å²	63	22%	0.224	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.3	-179.4	-54.7	0	0	0	0	108.8	A209 W210 S217	A209-S219 CarbonylContact C-O 3.5Å; A209-S219 VanDerWaalsContact CA-O 3.26Å; A209-S219 WeakPolarHBondContact CA-O 3.4Å; W210-S219 PolarHBondContact N-O 2.84Å; W210-S219 PolarHBondContact O-N 3.29Å; S217-S219 PolarHBondContact O-N 3.38Å; S217-S219 PolarHBondContact O-OG 3.41Å
220	F	45	Very low	44.6	Very low	146 Å²	146	64.1 Å²	64.1	64%	0.64	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.2	-180	-63.7	-91	0	0	0	110	V207 A209 L218	V207-F220 HydrophobicContact CG1-CD1 4.48Å; A209-F220 HydrophobicContact CB-CD1 3.89Å; A209-F220 HydrophobicContact CB-CE1 3.9Å; L218-F220 HydrophobicContact CD2-CE1 4.4Å; L218-F220 HydrophobicContact CD2-CE2 3.84Å; L218-F220 HydrophobicContact CD2-CZ 3.51Å; L218-F220 HydrophobicContact CG-CE2 4.02Å; L218-F220 HydrophobicContact CG-CZ 4Å
221	E	48.2	Very low	44.8	Very low	28 Å²	28	66.4 Å²	66.4	13%	0.131	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	173.9	-178.5	-59.3	-163.5	178.9	0	0	110.4	V207 V208 W210 S225 K229	V207-E221 CarbonylContact C-O 3.6Å; V207-E221 WeakPolarHBondContact CA-O 3.49Å; V208-E221 PolarHBondContact N-O 3.09Å; V208-E221 PolarHBondContact O-N 2.85Å; W210-E221 PolarHBondContact NE1-OE1 3.43Å; E221-S225 PolarHBondContact OE2-OG 2.86Å; E221-K229 IonicContact OE1-NZ 2.83Å; E221-K229 PolarHBondContact OE1-NZ 3.43Å; E221-K229 WeakPolarHBondContact OE2-CD 3.31Å; E221-K229 IonicContact OE2-NZ 3.83Å; E221-K229 PolarHBondContact OE2-NZ 2.77Å
222	T	49.3	Very low	44.9	Very low	68 Å²	68	69 Å²	69	42%	0.417	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	152.9	163	61.5	0	0	0	0	110.1	D206 R224 S225 L226	D206-T222 CarbonylContact O-C 3.5Å; D206-T222 WeakPolarHBondContact O-CA 3.4Å; T222-R224 PolarHBondContact O-N 2.93Å; T222-R224 VanDerWaalsContact O-N 3.15Å; T222-S225 PolarHBondContact O-N 3.22Å; T222-S225 VanDerWaalsContact O-N 3.11Å; T222-S225 WeakPolarHBondContact OG1-CB 3.3Å; T222-S225 PolarHBondContact OG1-N 3.4Å; T222-L226 PolarHBondContact O-N 3.18Å
223	K	51	Low	44.9	Very low	21 Å²	21	66.9 Å²	66.9	9%	0.091	36%	0.356	C	S	.	.	H	α-helix	trans	-53.8	-33.1	172	-170.8	178.5	-179.5	174.8	0	111.6	L143 P144 D206 V208 L227	L143-K223 PolarHBondContact O-NZ 2.91Å; P144-K223 PolarHBondContact O-NZ 3.33Å; D206-K223 HydrophobicContact CB-CB 3.72Å; D206-K223 HydrophobicContact CB-CD 4.31Å; D206-K223 PolarHBondContact O-N 3.45Å; D206-K223 WeakPolarHBondContact OD1-CD 3.25Å; D206-K223 IonicContact OD1-NZ 3.79Å; V208-K223 HydrophobicContact CG2-CB 3.72Å; V208-K223 HydrophobicContact CG2-CG 4.16Å; K223-L227 HydrophobicContact CG-CD1 4.34Å; K223-L227 WeakPolarHBondContact O-CB 3.4Å; K223-L227 VanDerWaalsContact O-CG 3.24Å; K223-L227 WeakPolarHBondContact O-CG 3.32Å; K223-L227 PolarHBondContact O-N 3.2Å
224	R	53.6	Low	44.8	Very low	190 Å²	190	70.4 Å²	70.4	72%	0.717	37%	0.367	S	S	*	.	H	α-helix	trans	-67.1	-57.5	173	-158.7	177.3	-166	160.2	4.4	111.2	T222 L226 L227 D228	T222-R224 PolarHBondContact O-N 2.93Å; T222-R224 VanDerWaalsContact O-N 3.15Å; R224-L226 PolarHBondContact O-N 3.28Å; R224-L226 VanDerWaalsContact O-N 3.16Å; R224-L227 CarbonylContact O-C 3.53Å; R224-L227 WeakPolarHBondContact O-CA 3.38Å; R224-L227 WeakPolarHBondContact O-CB 3.16Å; R224-L227 PolarHBondContact O-N 3.24Å; R224-D228 VanDerWaalsContact C-OD2 3.31Å; R224-D228 PolarHBondContact O-N 3.27Å; R224-D228 VanDerWaalsContact O-OD2 3.08Å
225	S	55.4	Low	44.6	Very low	30 Å²	30	67.3 Å²	67.3	21%	0.21	37%	0.367	C	S	.	.	H	α-helix	trans	-51.4	-42.2	175.1	164.6	0	0	0	0	112.5	E221 T222 K229	E221-S225 PolarHBondContact OE2-OG 2.86Å; T222-S225 PolarHBondContact O-N 3.22Å; T222-S225 VanDerWaalsContact O-N 3.11Å; T222-S225 WeakPolarHBondContact OG1-CB 3.3Å; T222-S225 PolarHBondContact OG1-N 3.4Å; S225-K229 VanDerWaalsContact O-CB 3.26Å; S225-K229 WeakPolarHBondContact O-CB 3.41Å; S225-K229 WeakPolarHBondContact O-CD 3.37Å; S225-K229 WeakPolarHBondContact O-CG 3.47Å; S225-K229 PolarHBondContact O-N 3.4Å; S225-K229 PolarHBondContact OG-NZ 3.4Å
226	L	54.6	Low	44.4	Very low	10 Å²	10	69.5 Å²	69.5	5%	0.052	37%	0.369	C	S	.	.	H	α-helix	trans	-68.6	-42.8	177.7	-173.1	69.9	0	0	0	111.5	V151 V208 W210 T222 R224 K229 L230	V151-L226 HydrophobicContact CG2-CD2 3.93Å; V208-L226 HydrophobicContact CB-CD2 4.34Å; V208-L226 HydrophobicContact CG1-CD2 3.45Å; V208-L226 VanDerWaalsContact CG1-CD2 3.45Å; W210-L226 HydrophobicContact CD2-CD1 4.47Å; W210-L226 HydrophobicContact CG-CD1 4.2Å; T222-L226 PolarHBondContact O-N 3.18Å; R224-L226 PolarHBondContact O-N 3.28Å; R224-L226 VanDerWaalsContact O-N 3.16Å; L226-K229 PolarHBondContact O-N 2.88Å; L226-L230 HydrophobicContact CD1-CD1 4.42Å; L226-L230 HydrophobicContact CD1-CG 4.34Å; L226-L230 HydrophobicContact CD2-CD1 4.2Å; L226-L230 HydrophobicContact CG-CD1 3.81Å; L226-L230 HydrophobicContact CG-CG 4.18Å; L226-L230 VanDerWaalsContact O-CB 3.31Å; L226-L230 WeakPolarHBondContact O-CB 3.47Å; L226-L230 WeakPolarHBondContact O-CG 3.47Å; L226-L230 PolarHBondContact O-N 3.04Å
227	L	53.9	Low	44	Very low	25 Å²	25	75.7 Å²	75.7	13%	0.131	39%	0.387	C	S	.	.	H	α-helix	trans	-60.4	-49	173.5	-78.1	168.1	0	0	0	111.2	L140 K223 R224 K229 L230 E231	L140-L227 HydrophobicContact CD2-CD2 3.78Å; L140-L227 HydrophobicContact CD2-CG 4.38Å; L140-L227 HydrophobicContact CG-CD2 4.46Å; K223-L227 HydrophobicContact CG-CD1 4.34Å; K223-L227 WeakPolarHBondContact O-CB 3.4Å; K223-L227 VanDerWaalsContact O-CG 3.24Å; K223-L227 WeakPolarHBondContact O-CG 3.32Å; K223-L227 PolarHBondContact O-N 3.2Å; R224-L227 CarbonylContact O-C 3.53Å; R224-L227 WeakPolarHBondContact O-CA 3.38Å; R224-L227 WeakPolarHBondContact O-CB 3.16Å; R224-L227 PolarHBondContact O-N 3.24Å; L227-K229 VanDerWaalsContact C-N 3.26Å; L227-K229 PolarHBondContact O-N 3.29Å; L227-L230 PolarHBondContact O-N 3.41Å; L227-E231 WeakPolarHBondContact O-CB 3.22Å; L227-E231 WeakPolarHBondContact O-CG 3.42Å; L227-E231 PolarHBondContact O-N 2.93Å
228	D	55.7	Low	43.8	Very low	83 Å²	83	76.5 Å²	76.5	44%	0.444	39%	0.392	S	S	.	.	H	α-helix	trans	-58	-39.1	177.6	-51.8	-32.8	0	0	0	111.2	R224 S232	R224-D228 VanDerWaalsContact C-OD2 3.31Å; R224-D228 PolarHBondContact O-N 3.27Å; R224-D228 VanDerWaalsContact O-OD2 3.08Å; D228-S232 WeakPolarHBondContact O-CB 3.49Å; D228-S232 PolarHBondContact O-N 3.39Å; D228-S232 PolarHBondContact O-OG 2.91Å
229	K	52.4	Low	43.3	Very low	89 Å²	89	77 Å²	77	39%	0.387	39%	0.392	S	S	.	.	H	α-helix	trans	-71.6	-35.5	173.5	-81.3	161.5	177.6	164.2	0	113.5	E221 S225 L226 L227 S232 L233	E221-K229 IonicContact OE1-NZ 2.83Å; E221-K229 PolarHBondContact OE1-NZ 3.43Å; E221-K229 WeakPolarHBondContact OE2-CD 3.31Å; E221-K229 IonicContact OE2-NZ 3.83Å; E221-K229 PolarHBondContact OE2-NZ 2.77Å; S225-K229 VanDerWaalsContact O-CB 3.26Å; S225-K229 WeakPolarHBondContact O-CB 3.41Å; S225-K229 WeakPolarHBondContact O-CD 3.37Å; S225-K229 WeakPolarHBondContact O-CG 3.47Å; S225-K229 PolarHBondContact O-N 3.4Å; S225-K229 PolarHBondContact OG-NZ 3.4Å; L226-K229 PolarHBondContact O-N 2.88Å; L227-K229 VanDerWaalsContact C-N 3.26Å; L227-K229 PolarHBondContact O-N 3.29Å; K229-S232 WeakPolarHBondContact CA-OG 3.22Å; K229-S232 PolarHBondContact O-OG 2.84Å; K229-L233 WeakPolarHBondContact O-CB 3.47Å; K229-L233 WeakPolarHBondContact O-CD1 3.45Å; K229-L233 WeakPolarHBondContact O-CG 3.32Å; K229-L233 PolarHBondContact O-N 2.96Å
230	L	48.3	Very low	42.8	Very low	33 Å²	33	77.3 Å²	77.3	17%	0.173	40%	0.396	C	S	.	.	H	α-helix	trans	-72.2	-41.4	177.3	-73.9	168.8	0	0	0	111.3	W136 L140 L226 L227 L233 Q234	W136-L230 HydrophobicContact CH2-CD1 3.5Å; W136-L230 VanDerWaalsContact CH2-CD1 3.5Å; W136-L230 HydrophobicContact CH2-CD2 3.68Å; W136-L230 HydrophobicContact CH2-CG 4.19Å; W136-L230 HydrophobicContact CZ2-CD2 4.31Å; W136-L230 HydrophobicContact CZ3-CD1 3.79Å; L140-L230 HydrophobicContact CD2-CD1 4.31Å; L226-L230 HydrophobicContact CD1-CD1 4.42Å; L226-L230 HydrophobicContact CD1-CG 4.34Å; L226-L230 HydrophobicContact CD2-CD1 4.2Å; L226-L230 HydrophobicContact CG-CD1 3.81Å; L226-L230 HydrophobicContact CG-CG 4.18Å; L226-L230 VanDerWaalsContact O-CB 3.31Å; L226-L230 WeakPolarHBondContact O-CB 3.47Å; L226-L230 WeakPolarHBondContact O-CG 3.47Å; L226-L230 PolarHBondContact O-N 3.04Å; L227-L230 PolarHBondContact O-N 3.41Å; L230-L233 PolarHBondContact O-N 3.29Å; L230-Q234 WeakPolarHBondContact O-CB 3.47Å; L230-Q234 PolarHBondContact O-N 3.19Å
231	E	47	Very low	42	Very low	102 Å²	102	74.1 Å²	74.1	48%	0.477	39%	0.392	S	S	.	.	H	α-helix	trans	-65.9	-41.8	174.8	-70.1	176.7	-162.5	0	0	111	L227 Q234 A235	L227-E231 WeakPolarHBondContact O-CB 3.22Å; L227-E231 WeakPolarHBondContact O-CG 3.42Å; L227-E231 PolarHBondContact O-N 2.93Å; E231-Q234 WeakPolarHBondContact O-CA 3.19Å; E231-Q234 VanDerWaalsContact O-CB 3.23Å; E231-Q234 WeakPolarHBondContact O-CB 3.4Å; E231-Q234 PolarHBondContact O-N 2.95Å; E231-Q234 VanDerWaalsContact O-N 3.16Å; E231-A235 PolarHBondContact O-N 3.18Å
232	S	40.9	Very low	41.1	Very low	57 Å²	57	77 Å²	77	40%	0.399	41%	0.407	S	S	.	.	H	α-helix	trans	-71.5	-30.1	172.9	55	0	0	0	0	113.9	D228 K229 Q234 A235 H236	D228-S232 WeakPolarHBondContact O-CB 3.49Å; D228-S232 PolarHBondContact O-N 3.39Å; D228-S232 PolarHBondContact O-OG 2.91Å; K229-S232 WeakPolarHBondContact CA-OG 3.22Å; K229-S232 PolarHBondContact O-OG 2.84Å; S232-Q234 VanDerWaalsContact C-N 3.3Å; S232-A235 PolarHBondContact O-N 2.9Å; S232-H236 PolarHBondContact O-CD2 3.38Å; S232-H236 PolarHBondContact O-N 3.26Å; S232-H236 VanDerWaalsContact O-N 3.08Å
233	L	35.2	Very low	40.2	Very low	65 Å²	65	78 Å²	78	34%	0.34	41%	0.407	S	S	.	.	H	α-helix	trans	-66.6	-32.4	166.7	-78	166	0	0	0	111.9	K229 L230 A235 H236 F239	K229-L233 WeakPolarHBondContact O-CB 3.47Å; K229-L233 WeakPolarHBondContact O-CD1 3.45Å; K229-L233 WeakPolarHBondContact O-CG 3.32Å; K229-L233 PolarHBondContact O-N 2.96Å; L230-L233 PolarHBondContact O-N 3.29Å; L233-A235 VanDerWaalsContact C-N 3.3Å; L233-H236 PolarHBondContact O-N 2.76Å; L233-F239 HydrophobicContact CB-CD2 3.99Å; L233-F239 HydrophobicContact CB-CE2 4.29Å; L233-F239 HydrophobicContact CD1-CE2 4.39Å; L233-F239 HydrophobicContact CD2-CD2 4.17Å
234	Q	36.7	Very low	39.2	Very low	129 Å²	129	81.5 Å²	81.5	60%	0.603	43%	0.426	S	S	*	.	H	α-helix	trans	-67.3	-31	171.9	-133.2	172.3	13.1	0	0	112.1	L230 E231 S232	L230-Q234 WeakPolarHBondContact O-CB 3.47Å; L230-Q234 PolarHBondContact O-N 3.19Å; E231-Q234 WeakPolarHBondContact O-CA 3.19Å; E231-Q234 VanDerWaalsContact O-CB 3.23Å; E231-Q234 WeakPolarHBondContact O-CB 3.4Å; E231-Q234 PolarHBondContact O-N 2.95Å; E231-Q234 VanDerWaalsContact O-N 3.16Å; S232-Q234 VanDerWaalsContact C-N 3.3Å
235	A	29.4	Very low	38.1	Very low	84 Å²	84	74.5 Å²	74.5	69%	0.694	41%	0.414	S	S	*	.	H	α-helix	trans	-79.6	-16.1	172.6	0	0	0	0	0	114	E231 S232 L233	E231-A235 PolarHBondContact O-N 3.18Å; S232-A235 PolarHBondContact O-N 2.9Å; L233-A235 VanDerWaalsContact C-N 3.3Å
236	H	28.7	Very low	37.1	Very low	116 Å²	116	75.8 Å²	75.8	54%	0.537	42%	0.417	S	S	.	.			trans	-99.2	121.8	-175.5	-99	-87	0	0	0	113.5	S232 L233 S238 F239	S232-H236 PolarHBondContact O-CD2 3.38Å; S232-H236 PolarHBondContact O-N 3.26Å; S232-H236 VanDerWaalsContact O-N 3.08Å; L233-H236 PolarHBondContact O-N 2.76Å; H236-S238 PolarHBondContact O-N 3.39Å; H236-F239 PolarHBondContact O-N 3.09Å
237	H	27.8	Very low	36.1	Very low	171 Å²	171	80 Å²	80	79%	0.792	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-20.4	168	-104.9	-78.6	0	0	0	114.6	F239 A240 S241	H237-F239 PolarHBondContact O-N 3.07Å; H237-A240 WeakPolarHBondContact O-CB 3.45Å; H237-A240 PolarHBondContact O-N 3.45Å; H237-A240 VanDerWaalsContact O-N 3.13Å; H237-S241 PolarHBondContact O-N 3.04Å; H237-S241 VanDerWaalsContact O-N 3.14Å
238	S	27.2	Very low	35.2	Very low	64 Å²	64	83 Å²	83	45%	0.448	46%	0.456	S	S	.	.	H	α-helix	trans	-51.8	-34.5	171.7	-46.8	0	0	0	0	113.6	H236 S241 M242	H236-S238 PolarHBondContact O-N 3.39Å; S238-S241 VanDerWaalsContact O-CB 3.31Å; S238-S241 WeakPolarHBondContact O-CB 3.14Å; S238-S241 PolarHBondContact O-N 2.9Å; S238-S241 VanDerWaalsContact O-N 3.16Å; S238-M242 PolarHBondContact O-N 2.82Å
239	F	31.1	Very low	34.1	Very low	75 Å²	75	81 Å²	81	33%	0.329	46%	0.455	S	S	.	.	H	α-helix	trans	-69.2	-40.3	177.9	-136.2	-95.7	0	0	0	111.8	L233 H236 H237 S241 M242 Q243	L233-F239 HydrophobicContact CB-CD2 3.99Å; L233-F239 HydrophobicContact CB-CE2 4.29Å; L233-F239 HydrophobicContact CD1-CE2 4.39Å; L233-F239 HydrophobicContact CD2-CD2 4.17Å; H236-F239 PolarHBondContact O-N 3.09Å; H237-F239 PolarHBondContact O-N 3.07Å; F239-S241 PolarHBondContact O-N 3.44Å; F239-M242 HydrophobicContact CD2-CE 3.37Å; F239-M242 HydrophobicContact CE2-CE 3.52Å; F239-M242 HydrophobicContact CG-CE 3.93Å; F239-M242 HydrophobicContact CZ-CE 4.2Å; F239-M242 PolarHBondContact O-N 3.43Å; F239-M242 VanDerWaalsContact O-N 3.11Å; F239-Q243 PolarHBondContact O-N 3.25Å
240	A	27.7	Very low	33.3	Very low	37 Å²	37	81.4 Å²	81.4	31%	0.306	46%	0.457	S	S	.	.	H	α-helix	trans	-62.9	-28.3	170.7	0	0	0	0	0	112.1	H237 Q243 N244	H237-A240 WeakPolarHBondContact O-CB 3.45Å; H237-A240 PolarHBondContact O-N 3.45Å; H237-A240 VanDerWaalsContact O-N 3.13Å; A240-Q243 WeakPolarHBondContact O-CB 3.34Å; A240-Q243 PolarHBondContact O-N 2.89Å; A240-N244 WeakPolarHBondContact O-CB 3.47Å; A240-N244 PolarHBondContact O-N 3.36Å; A240-N244 PolarHBondContact O-ND2 3.01Å
241	S	28.3	Very low	32.8	Very low	80 Å²	80	86.3 Å²	86.3	56%	0.559	48%	0.479	S	S	*	.	H	α-helix	trans	-68.5	-37.3	172.2	-161.6	0	0	0	0	112.8	H237 S238 F239 Q243 G245	H237-S241 PolarHBondContact O-N 3.04Å; H237-S241 VanDerWaalsContact O-N 3.14Å; S238-S241 VanDerWaalsContact O-CB 3.31Å; S238-S241 WeakPolarHBondContact O-CB 3.14Å; S238-S241 PolarHBondContact O-N 2.9Å; S238-S241 VanDerWaalsContact O-N 3.16Å; F239-S241 PolarHBondContact O-N 3.44Å; S241-Q243 VanDerWaalsContact C-N 3.32Å; S241-G245 PolarHBondContact O-N 3.28Å
242	M	29	Very low	32.3	Very low	89 Å²	89	90.5 Å²	90.5	44%	0.438	50%	0.496	S	S	.	.	H	α-helix	trans	-68.2	-32.1	170.7	-71.3	-172.4	-72	0	0	112.1	S238 F239 I246	S238-M242 PolarHBondContact O-N 2.82Å; F239-M242 HydrophobicContact CD2-CE 3.37Å; F239-M242 HydrophobicContact CE2-CE 3.52Å; F239-M242 HydrophobicContact CG-CE 3.93Å; F239-M242 HydrophobicContact CZ-CE 4.2Å; F239-M242 PolarHBondContact O-N 3.43Å; F239-M242 VanDerWaalsContact O-N 3.11Å; M242-I246 WeakPolarHBondContact O-CG1 3.41Å; M242-I246 PolarHBondContact O-N 2.97Å
243	Q	30.2	Very low	32.1	Very low	89 Å²	89	91.8 Å²	91.8	42%	0.416	51%	0.51	S	S	.	.	H	α-helix	trans	-66.7	-49.1	173.4	-166.6	165	-7.9	0	0	111.3	F239 A240 S241 G245 I246 E247	F239-Q243 PolarHBondContact O-N 3.25Å; A240-Q243 WeakPolarHBondContact O-CB 3.34Å; A240-Q243 PolarHBondContact O-N 2.89Å; S241-Q243 VanDerWaalsContact C-N 3.32Å; Q243-G245 VanDerWaalsContact C-N 3.33Å; Q243-G245 PolarHBondContact O-N 2.81Å; Q243-I246 PolarHBondContact O-N 2.93Å; Q243-E247 PolarHBondContact O-N 3.12Å
244	N	29.6	Very low	32.1	Very low	93 Å²	93	96.8 Å²	96.8	50%	0.497	53%	0.532	S	S	.	.	H	α-helix	trans	-63.6	-33.7	175.6	-68.3	-12.5	0	0	0	112.9	A240 I246 E247 T248	A240-N244 WeakPolarHBondContact O-CB 3.47Å; A240-N244 PolarHBondContact O-N 3.36Å; A240-N244 PolarHBondContact O-ND2 3.01Å; N244-I246 PolarHBondContact O-N 3.14Å; N244-E247 PolarHBondContact O-N 3Å; N244-T248 WeakPolarHBondContact O-CB 3.28Å; N244-T248 WeakPolarHBondContact O-CG2 3.29Å; N244-T248 PolarHBondContact O-N 3.36Å; N244-T248 PolarHBondContact O-OG1 2.92Å
245	G	31.4	Very low	31.8	Very low	44 Å²	44	97.7 Å²	97.7	45%	0.454	54%	0.541	S	S	.	.	H	α-helix	trans	-62.4	-31.5	171.8	0	0	0	0	0	113.2	S241 Q243 T248 G249	S241-G245 PolarHBondContact O-N 3.28Å; Q243-G245 VanDerWaalsContact C-N 3.33Å; Q243-G245 PolarHBondContact O-N 2.81Å; G245-T248 WeakPolarHBondContact CA-OG1 3.3Å; G245-T248 PolarHBondContact O-OG1 2.83Å; G245-G249 PolarHBondContact O-N 3.14Å
246	I	35	Very low	31.7	Very low	57 Å²	57	96.8 Å²	96.8	29%	0.292	54%	0.54	S	S	.	.	H	α-helix	trans	-86.1	-33.3	178	-71.6	166.3	0	0	0	111.4	K130 M242 Q243 N244 G249 K250	K130-I246 VanDerWaalsContact NZ-CD1 3.28Å; M242-I246 WeakPolarHBondContact O-CG1 3.41Å; M242-I246 PolarHBondContact O-N 2.97Å; Q243-I246 PolarHBondContact O-N 2.93Å; N244-I246 PolarHBondContact O-N 3.14Å; I246-G249 PolarHBondContact O-N 3.29Å; I246-K250 HydrophobicContact CG2-CD 4.39Å; I246-K250 WeakPolarHBondContact O-CG 3.47Å; I246-K250 PolarHBondContact O-N 2.72Å
247	E	33.2	Very low	31.5	Very low	99 Å²	99	98.8 Å²	98.8	46%	0.463	56%	0.555	S	S	.	*	H	α-helix	trans	-69	-40.1	171.4	-69.8	-167.3	-176.9	0	0	112.7	Q243 N244 G249 K250 Q251	Q243-E247 PolarHBondContact O-N 3.12Å; N244-E247 PolarHBondContact O-N 3Å; E247-G249 VanDerWaalsContact C-N 3.25Å; E247-G249 PolarHBondContact O-N 3.37Å; E247-K250 PolarHBondContact O-N 2.91Å; E247-K250 VanDerWaalsContact O-N 3.14Å; E247-Q251 WeakPolarHBondContact O-CG 3.33Å; E247-Q251 PolarHBondContact O-N 2.99Å
248	T	34.1	Very low	31.4	Very low	86 Å²	86	98.3 Å²	98.3	53%	0.528	56%	0.557	S	S	.	*	H	α-helix	trans	-66.1	-28.1	171.7	50.5	0	0	0	0	112.5	N244 G245 K252	N244-T248 WeakPolarHBondContact O-CB 3.28Å; N244-T248 WeakPolarHBondContact O-CG2 3.29Å; N244-T248 PolarHBondContact O-N 3.36Å; N244-T248 PolarHBondContact O-OG1 2.92Å; G245-T248 WeakPolarHBondContact CA-OG1 3.3Å; G245-T248 PolarHBondContact O-OG1 2.83Å; T248-K252 WeakPolarHBondContact O-CB 3.47Å; T248-K252 PolarHBondContact O-N 3.49Å
249	G	33.9	Very low	31.1	Very low	42 Å²	42	105 Å²	105	43%	0.433	58%	0.578	S	S	.	*	H	α-helix	trans	-63.8	-49.2	165.8	0	0	0	0	0	112.8	G245 I246 E247 K252	G245-G249 PolarHBondContact O-N 3.14Å; I246-G249 PolarHBondContact O-N 3.29Å; E247-G249 VanDerWaalsContact C-N 3.25Å; E247-G249 PolarHBondContact O-N 3.37Å; G249-K252 PolarHBondContact O-N 2.97Å
250	K	35	Very low	30.7	Very low	97 Å²	97	110.8 Å²	110.8	42%	0.422	60%	0.598	S	S	.	*	H	α-helix	trans	-69.7	-34.9	-178.5	-71.5	176.7	177.8	-178.6	0	113.1	D190 I246 E247 A253	D190-K250 IonicContact OD1-NZ 2.68Å; D190-K250 PolarHBondContact OD1-NZ 2.85Å; D190-K250 IonicContact OD2-NZ 2.98Å; D190-K250 PolarHBondContact OD2-NZ 2.94Å; I246-K250 HydrophobicContact CG2-CD 4.39Å; I246-K250 WeakPolarHBondContact O-CG 3.47Å; I246-K250 PolarHBondContact O-N 2.72Å; E247-K250 PolarHBondContact O-N 2.91Å; E247-K250 VanDerWaalsContact O-N 3.14Å; K250-A253 PolarHBondContact O-N 3.39Å
251	Q	37.2	Very low	30.4	Very low	137 Å²	137	114.7 Å²	114.7	64%	0.64	62%	0.618	S	S	*	*	H	α-helix	trans	-67.7	-34.9	173.5	-71.8	-175.1	10.5	0	0	112.9	E247 A253 Q254	E247-Q251 WeakPolarHBondContact O-CG 3.33Å; E247-Q251 PolarHBondContact O-N 2.99Å; Q251-A253 PolarHBondContact O-N 3.33Å; Q251-A253 VanDerWaalsContact O-N 3.09Å; Q251-Q254 PolarHBondContact O-N 2.72Å
252	K	37.3	Very low	30.2	Very low	189 Å²	189	117.7 Å²	117.7	82%	0.822	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-11.9	175.7	-111	178.5	178.3	174.7	0	114.5	T248 G249	T248-K252 WeakPolarHBondContact O-CB 3.47Å; T248-K252 PolarHBondContact O-N 3.49Å; G249-K252 PolarHBondContact O-N 2.97Å
253	A	36.5	Very low	29.8	Very low	85 Å²	85	118.4 Å²	118.4	70%	0.702	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-4.5	-179.4	0	0	0	0	0	114.5	K250 Q251	K250-A253 PolarHBondContact O-N 3.39Å; Q251-A253 PolarHBondContact O-N 3.33Å; Q251-A253 VanDerWaalsContact O-N 3.09Å
254	Q	35.8	Very low	29.4	Very low	170 Å²	170	118.4 Å²	118.4	79%	0.794	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.4	-25.1	-171.9	-73.6	-165.5	-21.1	0	0	116.7	Q251	Q251-Q254 PolarHBondContact O-N 2.72Å
255	N	30.2	Very low	29.2	Very low	147 Å²	147	120.9 Å²	120.9	79%	0.786	67%	0.671	S	S	*	*			trans	-118.9	114.3	178	-76.6	-34.2	0	0	0	112
256	G	27.4	Very low	28.9	Very low	66 Å²	66	122 Å²	122	68%	0.68	68%	0.682	S	S	*	*			trans	-74	157.8	153.1	0	0	0	0	0	110.6
257	D	24.3	Very low	28.4	Very low	158 Å²	158	125.4 Å²	125.4	85%	0.845	71%	0.71	S	S	*	*	S	Bend	trans	49.4	74	161.6	-56.3	-23.4	0	0	0	118.1
258	L	25.2	Very low	28.1	Very low	161 Å²	161	129 Å²	129	84%	0.843	73%	0.727	S	S	*	*				-168	131.4	101	-127.7	70.9	0	0	0	113.5
259	F	21.7	Very low	28	Very low	204 Å²	204	133.5 Å²	133.5	90%	0.895	74%	0.741	S	S	*	*			trans	-82.1	121.3	160.1	-84.4	-98.5	0	0	0	109.7
260	R	22.5	Very low	27.6	Very low	196 Å²	196	139 Å²	139	74%	0.74	76%	0.756	S	S	*	*			trans	-142	93.2	153.9	-154.7	175.8	-153.1	-161.5	1.8	111.9	H262	R260-H262 PolarHBondContact NE-NE2 2.94Å; R260-H262 PolarHBondContact O-N 3.02Å
261	V	21.4	Very low	27.3	Very low	120 Å²	120	139.7 Å²	139.7	73%	0.727	77%	0.77	S	S	*	*			trans	-67.2	114.4	165.1	178.1	0	0	0	0	108.1
262	H	23.5	Very low	26.9	Very low	142 Å²	142	138 Å²	138	66%	0.657	77%	0.774	S	S	*	*			trans	-128.2	126.5	163.9	-84.8	7.3	0	0	0	108.5	R260	R260-H262 PolarHBondContact NE-NE2 2.94Å; R260-H262 PolarHBondContact O-N 3.02Å
263	S	21	Very low	26.3	Very low	104 Å²	104	136 Å²	136	73%	0.727	77%	0.767	S	S	*	*			trans	-108.4	141.4	-176	-55	0	0	0	0	110.7
264	A	21.3	Very low	25.8	Very low	89 Å²	89	137.7 Å²	137.7	74%	0.736	77%	0.771	S	S	*	*			trans	70	158.6	159.2	0	0	0	0	0	120
265	T	25.4	Very low	25.3	Very low	146 Å²	146	137.2 Å²	137.2	90%	0.896	77%	0.773	S	S	*	*			trans	78.5	140.3	168.2	70.1	0	0	0	0	118.6
266	G	25.1	Very low	25	Very low	68 Å²	68	138.5 Å²	138.5	70%	0.701	77%	0.767	S	S	*	*			trans	92.3	121.2	-172.4	0	0	0	0	0	112.5
267	C	24.7	Very low	25	Very low	128 Å²	128	142.4 Å²	142.4	87%	0.865	78%	0.777	S	S	*	*			cis	60.5	118.1	32.3	-56.3	0	0	0	0	112.3
268	E	26.3	Very low	25.2	Very low	175 Å²	175	140.8 Å²	140.8	82%	0.818	76%	0.764	S	S	*	*			cis	-140.5	177.3	-6.8	-63.7	173.2	95.8	0	0	106.8
269	Q	31.7	Very low	25.5	Very low	180 Å²	180	140 Å²	140	84%	0.841	76%	0.756	S	S	*	*			cis	-157	158.5	36.9	-65.8	174.7	-28.9	0	0	111.4
270	Q	25.7	Very low	25.8	Very low	158 Å²	158	137.4 Å²	137.4	74%	0.738	75%	0.745	S	S	*	*			trans	-92	-173.1	172.2	-123.1	-165.7	-13	0	0	110.9
271	P	28.8	Very low	26.1	Very low	110 Å²	110	135.7 Å²	135.7	71%	0.714	74%	0.743	S	S	*	*			cis	-130.4	-171.7	23.3	39.8	-17.7	0	0	0	113.9
272	S	29.8	Very low	26.6	Very low	103 Å²	103	136 Å²	136	72%	0.72	74%	0.74	S	S	*	*			cis	-152.1	155.4	15.8	-32.4	0	0	0	0	112.3
273	E	24.3	Very low	26.7	Very low	146 Å²	146	133.7 Å²	133.7	68%	0.682	75%	0.746	S	S	*	*			trans	-87.7	169.6	174.7	-69	-172.3	136.7	0	0	114.3
274	P	25.2	Very low	27.1	Very low	120 Å²	120	137.6 Å²	137.6	78%	0.779	75%	0.753	S	S	*	*				-139.9	156.4	110	38.3	-27.7	0	0	0	113.7
275	L	25.3	Very low	27.4	Very low	160 Å²	160	140.2 Å²	140.2	84%	0.838	75%	0.754	S	S	*	*			cis	-163.4	152.3	-20.6	-134.3	149.7	0	0	0	107.2
276	R	24.1	Very low	27.7	Very low	175 Å²	175	141 Å²	141	66%	0.66	75%	0.747	S	S	*	*			trans	-77.5	157.9	-176.7	-70.2	-174.7	-175.7	160.9	2.3	114.9	E278	R276-E278 HydrophobicContact CB-CG 4.06Å; R276-E278 WeakPolarHBondContact CD-OE1 3.45Å; R276-E278 IonicContact CZ-OE1 2.77Å; R276-E278 IonicContact NH1-OE1 3.59Å; R276-E278 PolarHBondContact NH1-OE1 2.85Å
277	V	27.8	Very low	27.9	Very low	147 Å²	147	142 Å²	142	89%	0.891	74%	0.744	S	S	*	*			trans	-109.7	123.8	143	175	0	0	0	0	106.6
278	E	27.8	Very low	27.9	Very low	124 Å²	124	142.9 Å²	142.9	58%	0.579	74%	0.74	S	S	*	*			trans	-89.6	-176.5	174.4	-49.8	-159.3	127.2	0	0	108.4	R276	R276-E278 HydrophobicContact CB-CG 4.06Å; R276-E278 WeakPolarHBondContact CD-OE1 3.45Å; R276-E278 IonicContact CZ-OE1 2.77Å; R276-E278 IonicContact NH1-OE1 3.59Å; R276-E278 PolarHBondContact NH1-OE1 2.85Å
279	E	31.2	Very low	27.9	Very low	144 Å²	144	141.3 Å²	141.3	67%	0.673	74%	0.736	S	S	*	*			cis	-173.7	172.4	36.4	-148.1	177.2	-174.2	0	0	110.8
280	F	28.7	Very low	27.7	Very low	150 Å²	150	141.5 Å²	141.5	66%	0.658	74%	0.735	S	S	*	*			trans	58.3	103.3	162.1	-70.4	-67.5	0	0	0	122.2
281	K	29.8	Very low	27.6	Very low	160 Å²	160	141.4 Å²	141.4	70%	0.696	74%	0.739	S	S	*	*				79.1	155.1	123.5	-72.5	179.9	162.1	-122.9	0	121.7
282	D	30	Very low	27.6	Very low	127 Å²	127	142.8 Å²	142.8	68%	0.679	75%	0.745	S	S	*	*			cis	-144.1	155	-16	-120.1	-26.1	0	0	0	108.2
283	A	26.8	Very low	27.3	Very low	93 Å²	93	145.8 Å²	145.8	77%	0.769	75%	0.753	S	S	*	*			trans	-102	117.8	173.3	0	0	0	0	0	110.3
284	Q	30.1	Very low	27.4	Very low	187 Å²	187	142.7 Å²	142.7	87%	0.874	76%	0.76	S	S	*	*			trans	-154.5	140.8	154.3	-138.8	149.9	0.1	0	0	113.9
285	D	27.6	Very low	27.3	Very low	143 Å²	143	145.2 Å²	145.2	77%	0.765	77%	0.766	S	S	*	*			trans	-62.2	179.1	161.2	-74	-76.2	0	0	0	111.9
286	H	30.6	Very low	27.5	Very low	162 Å²	162	143.4 Å²	143.4	75%	0.75	77%	0.766	S	S	*	*			trans	98.6	92.7	167.9	-58.6	-72.8	0	0	0	117.1
287	S	28.7	Very low	27.5	Very low	90 Å²	90	140.5 Å²	140.5	63%	0.629	77%	0.773	S	S	*	*				57.2	120.3	122	64.8	0	0	0	0	119.8
288	D	25.4	Very low	27.5	Very low	147 Å²	147	139.6 Å²	139.6	79%	0.786	77%	0.77	S	S	*	*				72.7	125.4	127.5	-65.1	-32.4	0	0	0	120.6
289	L	26.1	Very low	27.4	Very low	142 Å²	142	141 Å²	141	74%	0.743	78%	0.781	S	S	*	*			trans	91.1	138	144.2	-65.8	157.7	0	0	0	121.4
290	F	27.4	Very low	27.4	Very low	184 Å²	184	140.4 Å²	140.4	81%	0.807	79%	0.787	S	S	*	*			trans	77.5	127.9	157.6	-62.2	-58.1	0	0	0	122.6
291	L	23.9	Very low	27.4	Very low	156 Å²	156	139.9 Å²	139.9	82%	0.817	79%	0.791	S	S	*	*			trans	-56.4	158.4	156.6	-70	59.6	0	0	0	111.3
292	V	27.8	Very low	27.4	Very low	139 Å²	139	137.7 Å²	137.7	84%	0.842	80%	0.795	S	S	*	*				-179.8	152.9	109.9	148.6	0	0	0	0	110.6
293	N	23.7	Very low	27.1	Very low	166 Å²	166	137.9 Å²	137.9	89%	0.888	80%	0.802	S	S	*	*			trans	-69.7	148.2	-177.9	-56.1	-41.9	0	0	0	113.4
294	G	26.4	Very low	27.3	Very low	81 Å²	81	139 Å²	139	84%	0.835	80%	0.801	S	S	*	*			trans	-154	110.2	173.3	0	0	0	0	0	113.9
295	L	24.5	Very low	27	Very low	173 Å²	173	135.8 Å²	135.8	91%	0.906	79%	0.794	S	S	*	*			trans	-70.4	152.1	-177.6	-61.7	158.4	0	0	0	113.9
296	S	28.7	Very low	27.3	Very low	121 Å²	121	140.7 Å²	140.7	85%	0.846	80%	0.802	S	S	*	*			trans	-177.6	145.4	131.2	-82.9	0	0	0	0	113.3
297	S	23.8	Very low	27	Very low	115 Å²	115	139.5 Å²	139.5	80%	0.804	80%	0.801	S	S	*	*			trans	-156	151.3	175.3	-50.5	0	0	0	0	111.5
298	P	29.4	Very low	27	Very low	128 Å²	128	142.3 Å²	142.3	83%	0.831	81%	0.808	S	S	*	*			trans	-111.3	119.5	155.1	33.5	-22.6	0	0	0	109.8
299	L	25.4	Very low	27.1	Very low	154 Å²	154	142.6 Å²	142.6	81%	0.806	81%	0.808	S	S	*	*			cis	80.9	87.8	44	-164.3	134.5	0	0	0	114.3
300	V	31.1	Very low	26.9	Very low	130 Å²	130	140.5 Å²	140.5	79%	0.788	81%	0.812	S	S	*	*			trans	-147.5	121.8	146.7	-174.6	0	0	0	0	109.9
301	N	28.2	Very low	27	Very low	140 Å²	140	136.1 Å²	136.1	75%	0.749	81%	0.809	S	S	*	*			trans	11	146.3	147.5	-52.8	-15.6	0	0	0	120.5
302	S	30.5	Very low	27.3	Very low	113 Å²	113	137.7 Å²	137.7	79%	0.79	81%	0.809	S	S	*	*			cis	-164.6	153.1	5.1	37.6	0	0	0	0	114
303	T	23.8	Very low	27.4	Very low	132 Å²	132	137.9 Å²	137.9	81%	0.81	81%	0.806	S	S	*	*			trans	-74.7	174.6	167.9	22.5	0	0	0	0	112.7
304	P	30.2	Very low	27.7	Very low	117 Å²	117	136 Å²	136	76%	0.76	80%	0.8	S	S	*	*			cis	-146.7	176.8	33.6	43.6	-22.2	0	0	0	120.6
305	T	25	Very low	27.7	Very low	118 Å²	118	142.5 Å²	142.5	72%	0.724	80%	0.801	S	S	*	*			trans	-57.8	158.1	175.8	52.9	0	0	0	0	117.1
306	R	31.8	Very low	27.9	Very low	246 Å²	246	138.6 Å²	138.6	93%	0.928	79%	0.788	S	S	*	*			trans	-145.5	129.4	140.8	-137.6	172.5	-167.5	156.5	3.9	112.3
307	N	25.4	Very low	28	Very low	137 Å²	137	140.7 Å²	140.7	73%	0.733	78%	0.784	S	S	*	*			trans	-79.2	163.3	169.8	-61.9	-49.3	0	0	0	110.5
308	L	27.9	Very low	28.1	Very low	149 Å²	149	140.5 Å²	140.5	78%	0.78	78%	0.783	S	S	*	*				164.3	138.6	110	-86.1	170.8	0	0	0	114.9
309	I	27.9	Very low	28.1	Very low	154 Å²	154	140.7 Å²	140.7	79%	0.79	78%	0.784	S	S	*	*			trans	73.3	144	145.6	-65.5	162.6	0	0	0	119.2
310	A	23	Very low	28.2	Very low	98 Å²	98	139.1 Å²	139.1	81%	0.81	79%	0.786	S	S	*	*			trans	-129.3	140.3	172.7	0	0	0	0	0	112
311	A	29.2	Very low	28	Very low	91 Å²	91	138.6 Å²	138.6	75%	0.752	79%	0.788	S	S	*	*			trans	-153.7	131.7	161.2	0	0	0	0	0	106.3
312	K	29	Very low	28.2	Very low	190 Å²	190	137.8 Å²	137.8	83%	0.826	79%	0.793	S	S	*	*			cis	89.8	137.7	43.1	-163.8	180	-176.5	-177.3	0	111.9
313	N	31.2	Very low	28	Very low	143 Å²	143	141.1 Å²	141.1	77%	0.765	80%	0.797	S	S	*	*			trans	84.4	133	-170.4	-52.3	-13	0	0	0	113
314	V	30.2	Very low	28.2	Very low	125 Å²	125	141.6 Å²	141.6	76%	0.758	80%	0.8	S	S	*	*			cis	119.4	112.5	10.9	162.3	0	0	0	0	110.2
315	Y	26.3	Very low	28	Very low	219 Å²	219	141.4 Å²	141.4	86%	0.859	80%	0.801	S	S	*	*			trans	34.1	123.3	156.7	-74.9	-101.3	0	0	0	120
316	S	28.2	Very low	28.1	Very low	91 Å²	91	141.2 Å²	141.2	64%	0.636	80%	0.804	S	S	*	*				179.9	165.9	85	-136.2	0	0	0	0	114.1
317	E	30.3	Very low	27.8	Very low	164 Å²	164	133.4 Å²	133.4	77%	0.766	79%	0.792	S	S	*	*			trans	56.5	107.7	150.8	-76.3	144.7	-120.4	0	0	123.5
318	S	26.5	Very low	27.9	Very low	112 Å²	112	134.6 Å²	134.6	78%	0.783	80%	0.799	S	S	*	*				62.5	129.7	117.8	-54.5	0	0	0	0	121.7
319	P	28.7	Very low	27.9	Very low	131 Å²	131	134.1 Å²	134.1	85%	0.851	80%	0.801	S	S	*	*			trans	-91.8	164.8	-174.2	37.9	-37.3	0	0	0	114.8
320	S	28.3	Very low	27.8	Very low	122 Å²	122	133 Å²	133	85%	0.853	81%	0.807	S	S	*	*			trans	-137.4	154.3	156.6	64.5	0	0	0	0	111
321	S	26.6	Very low	28	Very low	119 Å²	119	131.5 Å²	131.5	83%	0.832	80%	0.801	S	S	*	*			trans	-88.7	142.6	-169.5	52.9	0	0	0	0	113.9
322	S	31.7	Very low	27.9	Very low	122 Å²	122	135.5 Å²	135.5	85%	0.853	81%	0.809	S	S	*	*			trans	-152.9	149.6	146.7	44.5	0	0	0	0	110.6
323	E	27.5	Very low	27.9	Very low	184 Å²	184	130 Å²	130	86%	0.86	80%	0.795	S	S	*	*			trans	-93.6	150.9	-173.6	-58.7	156.1	107.6	0	0	111.1
324	T	27.8	Very low	27.9	Very low	142 Å²	142	129.3 Å²	129.3	87%	0.871	80%	0.801	S	S	*	*				176.8	134.5	122.3	26.8	0	0	0	0	114.4
325	S	25	Very low	27.8	Very low	112 Å²	112	127 Å²	127	78%	0.783	79%	0.785	S	S	*	*			trans	43.4	108.4	140.2	178.7	0	0	0	0	121.3
326	S	26.7	Very low	28.1	Very low	114 Å²	114	123 Å²	123	80%	0.797	78%	0.777	S	S	*	*				-170.5	135.1	113.7	41.9	0	0	0	0	114.6
327	A	25.9	Very low	28.4	Very low	82 Å²	82	125.2 Å²	125.2	68%	0.678	78%	0.776	S	S	*	*			trans	54.4	121.4	154.9	0	0	0	0	0	122.4
328	D	28.1	Very low	28.5	Very low	163 Å²	163	120.9 Å²	120.9	87%	0.872	76%	0.758	S	S	*	*			trans	64.4	75.9	134.5	-53.1	-10.9	0	0	0	120.3
329	V	26.9	Very low	28.8	Very low	138 Å²	138	120.3 Å²	120.3	84%	0.836	75%	0.749	S	S	*	*			trans	-128	117.4	159.1	177.1	0	0	0	0	110.4
330	S	26.4	Very low	29	Very low	130 Å²	130	120.1 Å²	120.1	91%	0.909	74%	0.737	S	S	*	*			trans	-168.5	136	160.4	-84.7	0	0	0	0	110.6
331	G	26.7	Very low	29.5	Very low	67 Å²	67	119.2 Å²	119.2	69%	0.691	72%	0.722	S	S	*	*			cis	-169.9	-158.7	-0.4	0	0	0	0	0	113
332	L	28.9	Very low	29.9	Very low	175 Å²	175	119.9 Å²	119.9	92%	0.916	72%	0.716	S	S	*	*	S	Bend	trans	83	67.6	-171.6	-54.2	-175.4	0	0	0	116.6
333	S	27.9	Very low	29.9	Very low	74 Å²	74	118.1 Å²	118.1	52%	0.517	71%	0.708	S	S	.	*			trans	60.9	97.6	148.1	-149.3	0	0	0	0	120.1	N335 D338	S333-N335 WeakPolarHBondContact OG-CB 3.45Å; S333-N335 PolarHBondContact OG-N 3.31Å; S333-D338 WeakPolarHBondContact CB-OD2 3.35Å; S333-D338 PolarHBondContact OG-OD2 3.34Å
334	S	32	Very low	30.2	Very low	130 Å²	130	113 Å²	113	91%	0.909	69%	0.693	S	S	*	*			trans	-83.5	16.1	154.1	52.3	0	0	0	0	113.2	L336	S334-L336 PolarHBondContact O-N 3.19Å
335	N	28.2	Very low	30.7	Very low	75 Å²	75	110.3 Å²	110.3	40%	0.401	67%	0.672	S	S	.	*			trans	-78.7	113.6	-171	-165.7	-7.1	0	0	0	111.5	S333 K337 D338	S333-N335 WeakPolarHBondContact OG-CB 3.45Å; S333-N335 PolarHBondContact OG-N 3.31Å; N335-K337 PolarHBondContact O-N 3.25Å; N335-K337 WeakPolarHBondContact OD1-CB 3.45Å; N335-K337 WeakPolarHBondContact OD1-CG 3.48Å; N335-K337 PolarHBondContact OD1-N 3.26Å; N335-D338 PolarHBondContact O-N 3.3Å
336	L	31.6	Very low	31.5	Very low	135 Å²	135	111.2 Å²	111.2	71%	0.707	66%	0.664	S	S	*	*	H	α-helix	trans	-50.9	-25.7	174.6	-88.6	159.5	0	0	0	113.6	S334 D338 V339 Q340	S334-L336 PolarHBondContact O-N 3.19Å; L336-D338 VanDerWaalsContact C-N 3.33Å; L336-D338 PolarHBondContact O-N 3.04Å; L336-V339 PolarHBondContact O-N 3.18Å; L336-Q340 WeakPolarHBondContact O-CB 3.34Å; L336-Q340 WeakPolarHBondContact O-CG 3.33Å; L336-Q340 PolarHBondContact O-N 3.05Å
337	K	34.5	Very low	32.1	Very low	138 Å²	138	111.9 Å²	111.9	60%	0.6	66%	0.655	S	S	*	*	H	α-helix	trans	-64.9	-31.4	177.1	-63.8	179.1	-180	-178.9	0	113.7	N335 Q340 L341	N335-K337 PolarHBondContact O-N 3.25Å; N335-K337 WeakPolarHBondContact OD1-CB 3.45Å; N335-K337 WeakPolarHBondContact OD1-CG 3.48Å; N335-K337 PolarHBondContact OD1-N 3.26Å; K337-Q340 PolarHBondContact O-N 3.27Å; K337-L341 PolarHBondContact O-N 3.31Å
338	D	33.5	Very low	33.1	Very low	74 Å²	74	113.3 Å²	113.3	40%	0.396	65%	0.651	S	S	.	*	H	α-helix	trans	-76.7	-34.7	179.1	-61.7	-34.3	0	0	0	111	S333 N335 L336 L341 L342	S333-D338 WeakPolarHBondContact CB-OD2 3.35Å; S333-D338 PolarHBondContact OG-OD2 3.34Å; N335-D338 PolarHBondContact O-N 3.3Å; L336-D338 VanDerWaalsContact C-N 3.33Å; L336-D338 PolarHBondContact O-N 3.04Å; D338-L341 WeakPolarHBondContact O-CB 3.49Å; D338-L341 PolarHBondContact O-N 2.97Å; D338-L342 PolarHBondContact O-N 3.31Å
339	V	32.8	Very low	33.9	Very low	99 Å²	99	109.6 Å²	109.6	60%	0.6	63%	0.631	S	S	*	*	H	α-helix	trans	-67.8	-39.9	170.3	-176	0	0	0	0	110.8	L336 L341 L342 A343	L336-V339 PolarHBondContact O-N 3.18Å; V339-L341 VanDerWaalsContact C-N 3.33Å; V339-L341 PolarHBondContact O-N 3.09Å; V339-L342 PolarHBondContact O-N 3.34Å; V339-A343 WeakPolarHBondContact O-CB 3.47Å; V339-A343 PolarHBondContact O-N 3.48Å
340	Q	33	Very low	34.6	Very low	128 Å²	128	107.6 Å²	107.6	60%	0.598	62%	0.615	S	S	*	*	H	α-helix	trans	-63.9	-35	172.1	-75.9	177.5	-44.9	0	0	112.6	L336 K337 A343 S344	L336-Q340 WeakPolarHBondContact O-CB 3.34Å; L336-Q340 WeakPolarHBondContact O-CG 3.33Å; L336-Q340 PolarHBondContact O-N 3.05Å; K337-Q340 PolarHBondContact O-N 3.27Å; Q340-A343 CarbonylContact O-C 3.59Å; Q340-A343 PolarHBondContact O-N 2.73Å; Q340-S344 WeakPolarHBondContact O-CB 3.32Å; Q340-S344 PolarHBondContact O-N 2.84Å
341	L	38.7	Very low	35.2	Very low	103 Å²	103	108.2 Å²	108.2	54%	0.539	60%	0.597	S	S	.	*	H	α-helix	trans	-62.3	-44	174.4	-101.3	160.6	0	0	0	111.8	K337 D338 V339 S344	K337-L341 PolarHBondContact O-N 3.31Å; D338-L341 WeakPolarHBondContact O-CB 3.49Å; D338-L341 PolarHBondContact O-N 2.97Å; V339-L341 VanDerWaalsContact C-N 3.33Å; V339-L341 PolarHBondContact O-N 3.09Å; L341-S344 PolarHBondContact O-N 2.85Å; L341-S344 PolarHBondContact O-OG 3.36Å
342	L	33.3	Very low	36.3	Very low	133 Å²	133	111 Å²	111	70%	0.696	59%	0.593	S	S	*	*	H	α-helix	trans	-66.9	-35.5	173.8	-71.5	169.6	0	0	0	112.4	D338 V339 S344 I345	D338-L342 PolarHBondContact O-N 3.31Å; V339-L342 PolarHBondContact O-N 3.34Å; L342-S344 VanDerWaalsContact C-N 3.25Å; L342-S344 PolarHBondContact O-N 3.02Å; L342-I345 HydrophobicContact CD2-CD1 4.47Å
343	A	32.2	Very low	36.8	Very low	84 Å²	84	106.4 Å²	106.4	69%	0.694	57%	0.574	S	S	*	*	H	α-helix	trans	-74.8	-9.1	173.9	0	0	0	0	0	114.3	V339 Q340	V339-A343 WeakPolarHBondContact O-CB 3.47Å; V339-A343 PolarHBondContact O-N 3.48Å; Q340-A343 CarbonylContact O-C 3.59Å; Q340-A343 PolarHBondContact O-N 2.73Å
344	S	34.3	Very low	37.5	Very low	77 Å²	77	107 Å²	107	54%	0.538	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.5	-9.5	179.2	74.7	0	0	0	0	114.2	Q340 L341 L342 Q346	Q340-S344 WeakPolarHBondContact O-CB 3.32Å; Q340-S344 PolarHBondContact O-N 2.84Å; L341-S344 PolarHBondContact O-N 2.85Å; L341-S344 PolarHBondContact O-OG 3.36Å; L342-S344 VanDerWaalsContact C-N 3.25Å; L342-S344 PolarHBondContact O-N 3.02Å; S344-Q346 PolarHBondContact O-N 2.74Å
345	I	38.5	Very low	38.1	Very low	86 Å²	86	106.4 Å²	106.4	44%	0.441	55%	0.554	S	S	.	*	S	Bend	trans	-69.2	117.2	174.2	-57.4	174.5	0	0	0	107.8	L342 D349 L350	L342-I345 HydrophobicContact CD2-CD1 4.47Å; I345-D349 HydrophobicContact CG2-CB 4.08Å; I345-L350 HydrophobicContact CG2-CB 4.36Å; I345-L350 HydrophobicContact CG2-CD1 4.36Å; I345-L350 HydrophobicContact CG2-CG 4.48Å
346	Q	42.5	Very low	38.8	Very low	130 Å²	130	107.6 Å²	107.6	61%	0.607	56%	0.56	S	S	*	*			trans	-69.3	149.6	179.8	-64	-171.4	-9.9	0	0	110.4	S344 D348 D349 L350	S344-Q346 PolarHBondContact O-N 2.74Å; Q346-D348 PolarHBondContact O-N 2.97Å; Q346-D348 VanDerWaalsContact O-N 3.13Å; Q346-D349 PolarHBondContact O-N 2.97Å; Q346-D349 VanDerWaalsContact O-N 3.09Å; Q346-L350 PolarHBondContact O-N 3.02Å
347	E	39.2	Very low	39	Very low	129 Å²	129	105.9 Å²	105.9	60%	0.603	55%	0.551	S	S	*	*	H	α-helix	trans	-58.1	-30.8	178.7	-158.4	-171.8	131.1	0	0	111	L350 R351	E347-L350 PolarHBondContact O-N 3.5Å; E347-R351 WeakPolarHBondContact O-CB 3.47Å; E347-R351 WeakPolarHBondContact O-CD 3.44Å; E347-R351 WeakPolarHBondContact O-CG 3.41Å; E347-R351 PolarHBondContact O-N 2.95Å; E347-R351 IonicContact OE1-CZ 3.33Å; E347-R351 IonicContact OE1-NE 3.99Å; E347-R351 PolarHBondContact OE1-NE 2.97Å; E347-R351 IonicContact OE1-NH2 2.76Å; E347-R351 PolarHBondContact OE1-NH2 3.36Å
348	D	45.9	Very low	39.1	Very low	111 Å²	111	105.2 Å²	105.2	59%	0.594	55%	0.549	S	S	*	.	H	α-helix	trans	-70.3	-38.3	176.6	-65.1	-48.4	0	0	0	113.8	Q346 L350 R351 Q352	Q346-D348 PolarHBondContact O-N 2.97Å; Q346-D348 VanDerWaalsContact O-N 3.13Å; D348-L350 VanDerWaalsContact C-N 3.29Å; D348-L350 PolarHBondContact O-N 3.45Å; D348-R351 PolarHBondContact O-N 3.49Å; D348-Q352 VanDerWaalsContact O-CB 3.29Å; D348-Q352 WeakPolarHBondContact O-CB 3.11Å; D348-Q352 PolarHBondContact O-N 3.25Å
349	D	45.6	Very low	39.1	Very low	85 Å²	85	106.5 Å²	106.5	46%	0.455	56%	0.555	S	S	.	*	H	α-helix	trans	-61	-42.7	171.7	-74.3	-50.9	0	0	0	110.8	I345 Q346 Q352 C353	I345-D349 HydrophobicContact CG2-CB 4.08Å; Q346-D349 PolarHBondContact O-N 2.97Å; Q346-D349 VanDerWaalsContact O-N 3.09Å; D349-Q352 PolarHBondContact O-N 3.02Å; D349-C353 PolarHBondContact O-N 2.99Å; D349-C353 PolarHBondContact O-SG 3.36Å
350	L	41.3	Very low	39.2	Very low	97 Å²	97	105.1 Å²	105.1	51%	0.508	55%	0.549	S	S	.	.	H	α-helix	trans	-69.8	-40.6	-178.7	-139.3	163.8	0	0	0	110.8	I345 Q346 E347 D348 L354	I345-L350 HydrophobicContact CG2-CB 4.36Å; I345-L350 HydrophobicContact CG2-CD1 4.36Å; I345-L350 HydrophobicContact CG2-CG 4.48Å; Q346-L350 PolarHBondContact O-N 3.02Å; E347-L350 PolarHBondContact O-N 3.5Å; D348-L350 VanDerWaalsContact C-N 3.29Å; D348-L350 PolarHBondContact O-N 3.45Å; L350-L354 HydrophobicContact CD2-CD1 4.3Å; L350-L354 PolarHBondContact O-N 3.33Å; L350-L354 VanDerWaalsContact O-N 3.09Å
351	R	39.7	Very low	39.2	Very low	142 Å²	142	108.8 Å²	108.8	54%	0.536	56%	0.558	S	S	.	*	H	α-helix	trans	-61.6	-43.4	169.7	-76.6	164	174.5	-100.6	0.3	111.8	E347 D348 L354 E355	E347-R351 WeakPolarHBondContact O-CB 3.47Å; E347-R351 WeakPolarHBondContact O-CD 3.44Å; E347-R351 WeakPolarHBondContact O-CG 3.41Å; E347-R351 PolarHBondContact O-N 2.95Å; E347-R351 IonicContact OE1-CZ 3.33Å; E347-R351 IonicContact OE1-NE 3.99Å; E347-R351 PolarHBondContact OE1-NE 2.97Å; E347-R351 IonicContact OE1-NH2 2.76Å; E347-R351 PolarHBondContact OE1-NH2 3.36Å; D348-R351 PolarHBondContact O-N 3.49Å; R351-L354 CarbonylContact O-C 3.52Å; R351-L354 WeakPolarHBondContact O-CA 3.25Å; R351-L354 WeakPolarHBondContact O-CB 3.01Å; R351-L354 PolarHBondContact O-N 3.29Å; R351-L354 VanDerWaalsContact O-N 3.14Å; R351-E355 WeakPolarHBondContact O-CG 3.37Å; R351-E355 PolarHBondContact O-N 3.41Å
352	Q	49.7	Very low	38.9	Very low	127 Å²	127	113.7 Å²	113.7	59%	0.593	57%	0.569	S	S	*	*	H	α-helix	trans	-71.9	-32.2	-178.5	-166.1	160.2	31.7	0	0	112.2	D348 D349 E355 N356	D348-Q352 VanDerWaalsContact O-CB 3.29Å; D348-Q352 WeakPolarHBondContact O-CB 3.11Å; D348-Q352 PolarHBondContact O-N 3.25Å; D349-Q352 PolarHBondContact O-N 3.02Å; Q352-E355 PolarHBondContact O-N 2.85Å; Q352-N356 WeakPolarHBondContact O-CB 3.33Å; Q352-N356 PolarHBondContact O-N 3.09Å; Q352-N356 PolarHBondContact O-ND2 3.34Å
353	C	38.6	Very low	38.8	Very low	78 Å²	78	118.2 Å²	118.2	53%	0.527	58%	0.577	S	S	.	*	H	α-helix	trans	-60.5	-44.7	165.7	-70.4	0	0	0	0	111.7	D349 N356 L357	D349-C353 PolarHBondContact O-N 2.99Å; D349-C353 PolarHBondContact O-SG 3.36Å; C353-N356 PolarHBondContact O-N 2.68Å; C353-L357 PolarHBondContact O-N 3.08Å
354	L	43.2	Very low	38.7	Very low	86 Å²	86	118.2 Å²	118.2	45%	0.45	58%	0.577	S	S	.	*	H	α-helix	trans	-65.5	-33.8	176.3	-99.4	157.2	0	0	0	113.8	L350 R351 K358	L350-L354 HydrophobicContact CD2-CD1 4.3Å; L350-L354 PolarHBondContact O-N 3.33Å; L350-L354 VanDerWaalsContact O-N 3.09Å; R351-L354 CarbonylContact O-C 3.52Å; R351-L354 WeakPolarHBondContact O-CA 3.25Å; R351-L354 WeakPolarHBondContact O-CB 3.01Å; R351-L354 PolarHBondContact O-N 3.29Å; R351-L354 VanDerWaalsContact O-N 3.14Å; L354-K358 VanDerWaalsContact O-CG 3.28Å; L354-K358 WeakPolarHBondContact O-CG 3.36Å; L354-K358 PolarHBondContact O-N 3.13Å; L354-K358 VanDerWaalsContact O-N 3.12Å
355	E	44.1	Very low	38.4	Very low	117 Å²	117	119.9 Å²	119.9	55%	0.547	58%	0.584	S	S	.	*	H	α-helix	trans	-67.7	-46.1	172.4	-70.5	-101.1	111.6	0	0	111.1	R351 Q352 L357 K358 L359	R351-E355 WeakPolarHBondContact O-CG 3.37Å; R351-E355 PolarHBondContact O-N 3.41Å; Q352-E355 PolarHBondContact O-N 2.85Å; E355-L357 VanDerWaalsContact C-N 3.29Å; E355-L357 PolarHBondContact O-N 2.97Å; E355-K358 WeakPolarHBondContact O-CA 3.21Å; E355-K358 WeakPolarHBondContact O-CB 3.19Å; E355-K358 PolarHBondContact O-N 3.46Å; E355-L359 WeakPolarHBondContact O-CG 3.16Å; E355-L359 PolarHBondContact O-N 2.96Å
356	N	41.9	Very low	37.9	Very low	101 Å²	101	122.1 Å²	122.1	54%	0.54	60%	0.602	S	S	.	*	H	α-helix	trans	-60.7	-37.7	176	-74.3	-46.8	0	0	0	112.2	Q352 C353 K358 L359 S360	Q352-N356 WeakPolarHBondContact O-CB 3.33Å; Q352-N356 PolarHBondContact O-N 3.09Å; Q352-N356 PolarHBondContact O-ND2 3.34Å; C353-N356 PolarHBondContact O-N 2.68Å; N356-K358 VanDerWaalsContact C-N 3.33Å; N356-K358 PolarHBondContact O-N 3Å; N356-L359 PolarHBondContact O-N 3.43Å; N356-S360 PolarHBondContact O-N 2.89Å
357	L	36.6	Very low	37.2	Very low	98 Å²	98	121.4 Å²	121.4	51%	0.513	61%	0.608	S	S	.	*	H	α-helix	trans	-68.4	-23.7	171.4	-86.7	158.2	0	0	0	114.2	C353 E355 S360	C353-L357 PolarHBondContact O-N 3.08Å; E355-L357 VanDerWaalsContact C-N 3.29Å; E355-L357 PolarHBondContact O-N 2.97Å; L357-S360 PolarHBondContact O-OG 3.03Å
358	K	37.3	Very low	36.6	Very low	125 Å²	125	123 Å²	123	54%	0.543	62%	0.621	S	S	.	*	H	α-helix	trans	-81.4	-30.2	171.5	-72	164.6	-174.3	172	0	112.4	L354 E355 N356 R361	L354-K358 VanDerWaalsContact O-CG 3.28Å; L354-K358 WeakPolarHBondContact O-CG 3.36Å; L354-K358 PolarHBondContact O-N 3.13Å; L354-K358 VanDerWaalsContact O-N 3.12Å; E355-K358 WeakPolarHBondContact O-CA 3.21Å; E355-K358 WeakPolarHBondContact O-CB 3.19Å; E355-K358 PolarHBondContact O-N 3.46Å; N356-K358 VanDerWaalsContact C-N 3.33Å; N356-K358 PolarHBondContact O-N 3Å; K358-R361 PolarHBondContact O-N 3.33Å
359	L	33.6	Very low	35.7	Very low	100 Å²	100	123.4 Å²	123.4	52%	0.524	63%	0.632	S	S	.	*	H	α-helix	trans	-70.2	-30.5	-179.5	-72.9	171	0	0	0	113.1	E355 N356 R362 R363	E355-L359 WeakPolarHBondContact O-CG 3.16Å; E355-L359 PolarHBondContact O-N 2.96Å; N356-L359 PolarHBondContact O-N 3.43Å; L359-R362 PolarHBondContact O-N 3.06Å; L359-R363 PolarHBondContact O-N 3.12Å
360	S	34.4	Very low	34.9	Very low	70 Å²	70	123.9 Å²	123.9	49%	0.49	65%	0.648	S	S	.	*	H	α-helix	trans	-59.6	-47.5	173.7	61.6	0	0	0	0	111.8	N356 L357 R362 R363	N356-S360 PolarHBondContact O-N 2.89Å; L357-S360 PolarHBondContact O-OG 3.03Å; S360-R362 PolarHBondContact O-N 3.48Å; S360-R362 VanDerWaalsContact O-N 3.12Å; S360-R363 PolarHBondContact O-N 3.24Å
361	R	32.7	Very low	34.2	Very low	205 Å²	205	126 Å²	126	77%	0.774	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-17.5	177.7	-71.8	-170	175.7	-164.6	-1.3	114.3	K358	K358-R361 PolarHBondContact O-N 3.33Å
362	R	31.6	Very low	33.6	Very low	207 Å²	207	124.9 Å²	124.9	78%	0.781	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	4.4	175.6	-73.6	-169.7	172.5	-168.9	-1.5	114.8	L359 S360	L359-R362 PolarHBondContact O-N 3.06Å; S360-R362 PolarHBondContact O-N 3.48Å; S360-R362 VanDerWaalsContact O-N 3.12Å
363	R	31.2	Very low	32.5	Very low	227 Å²	227	125.6 Å²	125.6	86%	0.857	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-0.6	172.5	-77.2	-171.5	170.1	-168	-1.8	114.6	L359 S360	L359-R363 PolarHBondContact O-N 3.12Å; S360-R363 PolarHBondContact O-N 3.24Å
364	A	30.3	Very low	32	Very low	84 Å²	84	128.4 Å²	128.4	69%	0.694	70%	0.697	S	S	*	*			trans	-83.4	-8.7	174	0	0	0	0	0	114	V366	A364-V366 PolarHBondContact O-N 3.39Å
365	T	27.9	Very low	31.2	Very low	113 Å²	113	130.1 Å²	130.1	69%	0.693	72%	0.716	S	S	*	*			trans	-76.1	100.6	171.5	46.2	0	0	0	0	110.4
366	V	29.2	Very low	30.7	Very low	133 Å²	133	136.4 Å²	136.4	81%	0.806	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-63.9	141.6	168.9	178.1	0	0	0	0	109.4	A364	A364-V366 PolarHBondContact O-N 3.39Å
367	P	28.1	Very low	30	Very low	115 Å²	115	136.5 Å²	136.5	75%	0.747	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-72.6	164.7	-171.2	-18.4	33.1	0	0	0	115.1
368	D	26	Very low	29.7	Very low	163 Å²	163	137.6 Å²	137.6	87%	0.872	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-50.7	135	176.6	-68.1	-75	0	0	0	114.6
369	S	27.2	Very low	29.3	Very low	118 Å²	118	140.3 Å²	140.3	83%	0.825	77%	0.768	S	S	*	*			trans	-163	150.7	157.7	-83.4	0	0	0	0	111.4
370	A	27.5	Very low	29.2	Very low	96 Å²	96	142.9 Å²	142.9	79%	0.793	78%	0.782	S	S	*	*			trans	62	71.4	174.1	0	0	0	0	0	116.4	T372	A370-T372 PolarHBondContact O-N 3.24Å
371	T	26.5	Very low	29.1	Very low	140 Å²	140	147.6 Å²	147.6	86%	0.859	80%	0.801	S	S	*	*			trans	-52.7	126.6	151.4	39.2	0	0	0	0	111.5
372	T	27.1	Very low	29	Very low	120 Å²	120	141.3 Å²	141.3	74%	0.736	79%	0.793	S	S	*	*			trans	-160	133.9	144.6	0.6	0	0	0	0	112.6	A370	A370-T372 PolarHBondContact O-N 3.24Å
373	N	26.9	Very low	29.1	Very low	141 Å²	141	141 Å²	141	75%	0.754	80%	0.797	S	S	*	*			trans	71.4	97.5	153.2	-59.7	-16.8	0	0	0	121.4
374	V	28.4	Very low	29.1	Very low	138 Å²	138	141.5 Å²	141.5	84%	0.836	80%	0.799	S	S	*	*			trans	71.7	95.3	133.2	-168.1	0	0	0	0	118.6
375	S	27.8	Very low	29.1	Very low	121 Å²	121	142.7 Å²	142.7	85%	0.846	80%	0.803	S	S	*	*			trans	-145	60.1	148.3	58.5	0	0	0	0	112.2	S377	S375-S377 PolarHBondContact O-N 2.99Å
376	R	32.4	Very low	29.5	Very low	250 Å²	250	142.3 Å²	142.3	94%	0.943	80%	0.802	S	S	*	*			trans	-74	106.1	160.5	-98.4	-170.7	174.9	-179.1	-1.4	108.7
377	S	27	Very low	29.8	Very low	102 Å²	102	146.2 Å²	146.2	71%	0.713	80%	0.802	S	S	*	*			trans	-68	166.8	155.6	70.3	0	0	0	0	109.3	S375	S375-S377 PolarHBondContact O-N 2.99Å
378	P	30.8	Very low	30	Very low	121 Å²	121	146.3 Å²	146.3	79%	0.786	80%	0.797	S	S	*	*				-130.8	163.4	67.1	38.2	-25.7	0	0	0	114.7
379	F	29.1	Very low	30.3	Very low	183 Å²	183	143.5 Å²	143.5	80%	0.803	79%	0.79	S	S	*	*			trans	-72.2	149.2	157.7	-98.1	-116.4	0	0	0	110.1
380	L	31.9	Very low	30.6	Very low	154 Å²	154	144.4 Å²	144.4	81%	0.806	79%	0.791	S	S	*	*			trans	30.3	108.9	150	-60.2	172.8	0	0	0	118.6
381	D	30.9	Very low	30.7	Very low	169 Å²	169	144.4 Å²	144.4	90%	0.904	79%	0.791	S	S	*	*				-142.5	153.6	115.9	-152	-16.9	0	0	0	109.8
382	A	31.1	Very low	31.1	Very low	73 Å²	73	146.1 Å²	146.1	60%	0.603	79%	0.792	S	S	*	*			trans	-151	104.7	-167	0	0	0	0	0	114
383	K	33.2	Very low	31.3	Very low	199 Å²	199	147.2 Å²	147.2	87%	0.865	79%	0.794	S	S	*	*			trans	-165.8	145.2	149.3	-110.7	147.9	-169.5	169.5	0	114.9
384	R	32.6	Very low	31.6	Very low	238 Å²	238	147 Å²	147	90%	0.898	79%	0.793	S	S	*	*			trans	67	106.8	158.5	-66.5	-180	173.9	175.6	-2.6	118.9
385	S	29.4	Very low	31.6	Very low	110 Å²	110	144.9 Å²	144.9	77%	0.769	78%	0.784	S	S	*	*			trans	-81	-177.1	142.8	69.9	0	0	0	0	109.7
386	P	37.4	Very low	31.6	Very low	105 Å²	105	145 Å²	145	68%	0.682	78%	0.78	S	S	*	*			cis	-135.1	-178.1	-4	41.8	-25.3	0	0	0	115.7
387	R	33.6	Very low	31.5	Very low	214 Å²	214	138 Å²	138	81%	0.808	77%	0.77	S	S	*	*			trans	86.9	141.5	144.8	-94.9	-172.7	155.1	159.2	2.8	122.3
388	D	33.3	Very low	31.6	Very low	118 Å²	118	141.7 Å²	141.7	63%	0.631	77%	0.773	S	S	*	*			trans	64.6	91.4	143.4	-53.7	-17.3	0	0	0	121.3
389	S	31.4	Very low	31.6	Very low	103 Å²	103	144.2 Å²	144.2	72%	0.72	77%	0.774	S	S	*	*				83.7	138.1	118.5	-61.8	0	0	0	0	122.1
390	T	33.5	Very low	31.8	Very low	138 Å²	138	143.2 Å²	143.2	85%	0.847	78%	0.776	S	S	*	*			trans	69.1	133.7	159.2	47.8	0	0	0	0	120.5
391	A	30.6	Very low	31.8	Very low	96 Å²	96	141.2 Å²	141.2	79%	0.793	77%	0.771	S	S	*	*			trans	53.1	99.5	151.9	0	0	0	0	0	119	D393	A391-D393 PolarHBondContact O-N 3.05Å
392	I	34.2	Very low	31.8	Very low	175 Å²	175	142.5 Å²	142.5	90%	0.897	77%	0.769	S	S	*	*			trans	-21.7	114	149.2	-55.1	161.4	0	0	0	113
393	D	33	Very low	31.6	Very low	144 Å²	144	147.8 Å²	147.8	77%	0.77	79%	0.786	S	S	*	*			trans	-154.7	176.7	154.2	-135.1	-38	0	0	0	113.4	A391	A391-D393 PolarHBondContact O-N 3.05Å
394	N	31.3	Very low	31.4	Very low	135 Å²	135	142.2 Å²	142.2	72%	0.722	79%	0.786	S	S	*	*			trans	-93.9	166.3	-149.3	-77.1	-86.3	0	0	0	117.3
395	S	29.1	Very low	31.1	Very low	95 Å²	95	134.1 Å²	134.1	66%	0.664	78%	0.776	S	S	*	*			trans	84.7	109.2	133.3	62.2	0	0	0	0	123.2
396	T	28.5	Very low	31.1	Very low	122 Å²	122	140 Å²	140	75%	0.748	78%	0.781	S	S	*	*				77.2	139.7	123.8	61.2	0	0	0	0	123.6
397	S	29.1	Very low	30.6	Very low	105 Å²	105	143.9 Å²	143.9	73%	0.734	79%	0.79	S	S	*	*			trans	77.7	150.1	150.5	87	0	0	0	0	116.8
398	K	30.3	Very low	30.3	Very low	178 Å²	178	138 Å²	138	77%	0.774	79%	0.787	S	S	*	*			cis	-161.6	176.1	-7.1	-129	173.5	-172.5	-180	0	110.8
399	E	30.8	Very low	30	Very low	175 Å²	175	137.7 Å²	137.7	82%	0.818	79%	0.794	S	S	*	*			trans	77.4	147.7	153.8	-77.7	165.1	-163.8	0	0	121.8
400	I	31.8	Very low	29.7	Very low	162 Å²	162	137.2 Å²	137.2	83%	0.831	80%	0.796	S	S	*	*			trans	-127.5	140.2	-174.8	-53.8	160.3	0	0	0	106.7
401	P	32.3	Very low	29.5	Very low	111 Å²	111	136.4 Å²	136.4	72%	0.721	79%	0.794	S	S	*	*			trans	-145.9	122.3	140.9	30.4	-11.4	0	0	0	117.2
402	K	31.7	Very low	29.2	Very low	196 Å²	196	137.3 Å²	137.3	85%	0.852	79%	0.793	S	S	*	*				62.9	114.7	124.5	-61.8	175.4	-178.6	175.6	0	121.6
403	L	25.7	Very low	29	Very low	184 Å²	184	136.1 Å²	136.1	96%	0.963	79%	0.788	S	S	*	*			trans	-9.3	136.3	139.9	-70.2	159.2	0	0	0	119.2
404	G	29.1	Very low	28.7	Very low	83 Å²	83	136.9 Å²	136.9	86%	0.856	79%	0.792	S	S	*	*			trans	-178.9	143.8	151.9	0	0	0	0	0	110.9
405	G	26.1	Very low	28.4	Very low	67 Å²	67	133.3 Å²	133.3	69%	0.691	79%	0.787	S	S	*	*			cis	137.5	70.6	-6.4	0	0	0	0	0	114.7
406	R	31.1	Very low	28.5	Very low	233 Å²	233	138.9 Å²	138.9	88%	0.879	80%	0.8	S	S	*	*			trans	-178	125.1	159.5	-90.6	133.6	-157.7	-99.2	3.1	107.1
407	H	25.7	Very low	28.5	Very low	187 Å²	187	141 Å²	141	87%	0.866	81%	0.806	S	S	*	*				81.8	140.6	59.5	-78.9	-66.1	0	0	0	114.8
408	A	27.3	Very low	28.7	Very low	90 Å²	90	146.2 Å²	146.2	74%	0.744	81%	0.809	S	S	*	*			trans	99.8	108.2	158.6	0	0	0	0	0	119.3
409	S	27.9	Very low	28.7	Very low	112 Å²	112	146.3 Å²	146.3	78%	0.783	81%	0.809	S	S	*	*			trans	54.8	124.4	136.5	56.5	0	0	0	0	121.6
410	A	25.2	Very low	28.9	Very low	93 Å²	93	145.6 Å²	145.6	77%	0.769	81%	0.806	S	S	*	*			trans	-67.6	171.1	151.6	0	0	0	0	0	111.7
411	P	29.4	Very low	28.7	Very low	122 Å²	122	143 Å²	143	79%	0.792	80%	0.802	S	S	*	*			trans	-131.6	145.2	136.5	36.8	-27.8	0	0	0	113.2
412	C	23.2	Very low	28.7	Very low	114 Å²	114	141.6 Å²	141.6	77%	0.77	80%	0.8	S	S	*	*			trans	-79.4	151.1	153.3	-55.4	0	0	0	0	109.2
413	N	29.9	Very low	28.7	Very low	150 Å²	150	140.3 Å²	140.3	80%	0.802	80%	0.803	S	S	*	*			trans	171	126.3	143.7	-83.9	-13.6	0	0	0	106
414	D	27.1	Very low	29	Very low	161 Å²	161	135.5 Å²	135.5	86%	0.861	80%	0.798	S	S	*	*				76.1	138.7	51.7	-152.6	5.6	0	0	0	112.6
415	G	25.4	Very low	29.1	Very low	59 Å²	59	136.6 Å²	136.6	61%	0.608	79%	0.792	S	S	*	*			trans	-89.2	165.9	-132.7	0	0	0	0	0	118.3
416	F	31.1	Very low	29.6	Very low	213 Å²	213	142.4 Å²	142.4	93%	0.934	80%	0.798	S	S	*	*			trans	-132.6	101.3	164.4	-97	-79.3	0	0	0	112.7
417	L	29.1	Very low	29.6	Very low	166 Å²	166	135.8 Å²	135.8	87%	0.869	79%	0.788	S	S	*	*			trans	-72.9	144.2	153.3	-73.3	164.2	0	0	0	109.3
418	R	31.6	Very low	30	Very low	214 Å²	214	137 Å²	137	81%	0.808	79%	0.791	S	S	*	*				150.1	100.1	126.6	-176.8	176.9	-68.2	-156.5	-0.2	114.8
419	K	30.7	Very low	30.1	Very low	180 Å²	180	139.9 Å²	139.9	78%	0.783	79%	0.794	S	S	*	*			trans	56.8	164.1	135.2	-61.5	-173.7	176.8	-175.1	0	121.4
420	H	35.1	Very low	30.5	Very low	160 Å²	160	141.7 Å²	141.7	74%	0.741	80%	0.8	S	S	*	*			trans	84.5	138.5	163.6	-48.3	-76.1	0	0	0	117.3
421	S	28.3	Very low	30.9	Very low	107 Å²	107	145.9 Å²	145.9	75%	0.748	80%	0.803	S	S	*	*			cis	-178.3	138.9	-36.6	-106.9	0	0	0	0	109.2
422	A	32.5	Very low	31.2	Very low	83 Å²	83	145.6 Å²	145.6	69%	0.686	80%	0.801	S	S	*	*			trans	64.6	131.1	154	0	0	0	0	0	121.7
423	N	31.4	Very low	31.9	Very low	169 Å²	169	147.3 Å²	147.3	90%	0.904	81%	0.809	S	S	*	*			trans	65.2	131.4	141.1	-57.1	-9.2	0	0	0	121.4
424	G	32	Very low	31.8	Very low	83 Å²	83	152.2 Å²	152.2	86%	0.856	82%	0.816	S	S	*	*			trans	170.7	72.3	170.1	0	0	0	0	0	115.2
425	S	31.8	Very low	32.1	Very low	106 Å²	106	149.7 Å²	149.7	74%	0.741	81%	0.811	S	S	*	*			trans	-82.7	141.8	-178.1	59.8	0	0	0	0	114.8
426	K	36.3	Very low	32.4	Very low	188 Å²	188	153.1 Å²	153.1	82%	0.817	82%	0.82	S	S	*	*			trans	150.2	112.8	143.8	-82.8	155.8	-174.4	179.2	0	109.3
427	S	30.4	Very low	32.3	Very low	94 Å²	94	148.8 Å²	148.8	66%	0.657	81%	0.814	S	S	*	*				71.5	115.2	61.1	77	0	0	0	0	114.9
428	F	33.7	Very low	32.5	Very low	213 Å²	213	146.8 Å²	146.8	93%	0.934	81%	0.811	S	S	*	*			trans	-168.1	151.2	134.4	-106.9	-67.9	0	0	0	111.8
429	N	31.1	Very low	32.4	Very low	150 Å²	150	142.3 Å²	142.3	80%	0.802	81%	0.812	S	S	*	*			trans	-91.1	154	-176.6	-65.9	-23.5	0	0	0	113
430	V	36.3	Very low	32.2	Very low	151 Å²	151	138 Å²	138	92%	0.915	81%	0.805	S	S	*	*			trans	-138.3	148.4	142	-177.2	0	0	0	0	108.2
431	E	33.2	Very low	32	Very low	180 Å²	180	135.5 Å²	135.5	84%	0.841	81%	0.811	S	S	*	*			trans	-84	165.9	-166.1	-86.8	-179.1	94.8	0	0	116.8
432	P	36.1	Very low	32	Very low	116 Å²	116	141 Å²	141	75%	0.753	82%	0.816	S	S	*	*			trans	-92.4	149.6	178.8	36.7	-34.4	0	0	0	114
433	T	37.7	Very low	31.7	Very low	150 Å²	150	144.6 Å²	144.6	92%	0.92	82%	0.823	S	S	*	*			trans	-127.4	153	167	49	0	0	0	0	112.4
434	R	28	Very low	31.6	Very low	254 Å²	254	141.3 Å²	141.3	96%	0.958	82%	0.819	S	S	*	*			trans	-127.7	115	-153.4	174.2	-164.9	-171.9	-169.5	5.9	112.1
435	S	32.4	Very low	31.5	Very low	108 Å²	108	142.5 Å²	142.5	76%	0.755	81%	0.809	S	S	*	*			trans	-154.7	105.9	171.2	58.3	0	0	0	0	115.1
436	T	32.7	Very low	31.4	Very low	131 Å²	131	143.3 Å²	143.3	80%	0.804	81%	0.812	S	S	*	*			trans	51.7	115.7	134.5	-32	0	0	0	0	121.4
437	P	28.1	Very low	31.1	Very low	122 Å²	122	143.6 Å²	143.6	79%	0.792	81%	0.813	S	S	*	*			trans	-96.4	149.8	167	36.8	-32.2	0	0	0	113.7
438	P	33.7	Very low	31	Very low	124 Å²	124	145.1 Å²	145.1	81%	0.805	82%	0.819	S	S	*	*			trans	-122.9	101.4	162.7	34.8	-21.3	0	0	0	114
439	S	28.7	Very low	30.6	Very low	119 Å²	119	140.1 Å²	140.1	83%	0.832	81%	0.809	S	S	*	*			trans	39.7	130.5	138.3	-151.2	0	0	0	0	123.6
440	S	27.1	Very low	30.4	Very low	91 Å²	91	138.8 Å²	138.8	64%	0.636	81%	0.807	S	S	*	*			trans	76.6	92	137.2	-177.7	0	0	0	0	121.2
441	A	30.8	Very low	30	Very low	106 Å²	106	141.8 Å²	141.8	88%	0.876	80%	0.803	S	S	*	*				-120	143.7	130	0	0	0	0	0	108.7
442	R	28.6	Very low	29.8	Very low	223 Å²	223	138.3 Å²	138.3	84%	0.842	80%	0.798	S	S	*	*			trans	-102.2	137.4	-161.7	-69.4	177.3	174.5	173.8	-3.8	114.6
443	L	26.3	Very low	29.5	Very low	159 Å²	159	142.3 Å²	142.3	83%	0.832	80%	0.804	S	S	*	*			trans	21.8	107.6	141.8	-67.9	164.4	0	0	0	117.9
444	A	29.6	Very low	29.1	Very low	100 Å²	100	147.2 Å²	147.2	83%	0.826	81%	0.806	S	S	*	*			trans	-125	66.3	162.9	0	0	0	0	0	110.9
445	V	29.6	Very low	29	Very low	107 Å²	107	138.4 Å²	138.4	65%	0.648	79%	0.794	S	S	*	*			trans	-81.9	127.5	169.9	178	0	0	0	0	108.9	K447	V445-K447 PolarHBondContact O-N 2.85Å
446	P	28.9	Very low	28.6	Very low	124 Å²	124	141.7 Å²	141.7	81%	0.805	80%	0.799	S	S	*	*			trans	-65.2	102.2	171	-18.3	31.8	0	0	0	109.9
447	K	31	Very low	28.3	Very low	193 Å²	193	140.1 Å²	140.1	84%	0.839	79%	0.794	S	S	*	*			trans	-72.9	129.9	177.4	-72	-174.4	176.6	-177.5	0	110.4	V445 C449	V445-K447 PolarHBondContact O-N 2.85Å; K447-C449 PolarHBondContact O-N 3.17Å
448	T	26.6	Very low	28.4	Very low	126 Å²	126	141.3 Å²	141.3	77%	0.773	80%	0.799	S	S	*	*			trans	-55.8	119.9	169.8	48.5	0	0	0	0	110.9	T450	T448-T450 PolarHBondContact O-N 3.22Å
449	C	27.2	Very low	28.2	Very low	109 Å²	109	143.6 Å²	143.6	74%	0.736	80%	0.798	S	S	*	*			trans	-88.9	82.4	-179.7	-161.1	0	0	0	0	111.3	K447 Y451	K447-C449 PolarHBondContact O-N 3.17Å; C449-Y451 PolarHBondContact O-N 3.03Å
450	T	25.8	Very low	28.5	Very low	122 Å²	122	142.9 Å²	142.9	75%	0.748	79%	0.79	S	S	*	*			trans	-77.1	105.9	171.9	51	0	0	0	0	110.7	T448	T448-T450 PolarHBondContact O-N 3.22Å
451	Y	28.6	Very low	28.7	Very low	214 Å²	214	150 Å²	150	84%	0.839	80%	0.803	S	S	*	*			trans	-103.3	113.2	168.8	-105.6	-91.1	0	0	0	111.8	C449	C449-Y451 PolarHBondContact O-N 3.03Å
452	S	29	Very low	28.7	Very low	106 Å²	106	155.7 Å²	155.7	74%	0.741	80%	0.804	S	S	*	*			trans	-93.9	138.8	175.8	-80.1	0	0	0	0	112.3
453	K	28.4	Very low	28.7	Very low	200 Å²	200	151 Å²	151	87%	0.87	80%	0.802	S	S	*	*			trans	28.2	106.6	149.5	-61.9	178.3	179.3	176.5	0	117.8
454	R	29.2	Very low	28.8	Very low	254 Å²	254	147 Å²	147	96%	0.958	80%	0.799	S	S	*	*			trans	-172.3	136.8	133	-107.7	165.9	-166.9	-178	5.1	113.5
455	G	26.1	Very low	28.9	Very low	69 Å²	69	150.8 Å²	150.8	71%	0.711	80%	0.804	S	S	*	*			trans	85.2	98.7	132	0	0	0	0	0	120.4
456	M	25.5	Very low	28.7	Very low	176 Å²	176	154.9 Å²	154.9	87%	0.867	82%	0.816	S	S	*	*				57.4	99.2	129.2	-60.1	-166.6	72.4	0	0	121.2
457	S	25.9	Very low	28.9	Very low	98 Å²	98	158.6 Å²	158.6	69%	0.685	82%	0.82	S	S	*	*				37.6	114.5	120.9	63.6	0	0	0	0	121.3
458	V	30.3	Very low	28.7	Very low	148 Å²	148	154.9 Å²	154.9	90%	0.897	82%	0.818	S	S	*	*				-142.2	137.7	125.9	-172.8	0	0	0	0	108.4
459	H	29.6	Very low	28.9	Very low	172 Å²	172	156.9 Å²	156.9	80%	0.796	82%	0.824	S	S	*	*			trans	-109.2	122.9	175.8	-162	-51.6	0	0	0	109.7
460	P	34.9	Very low	29.1	Very low	103 Å²	103	156.6 Å²	156.6	67%	0.669	82%	0.82	S	S	*	*			trans	-64.9	143	170	-19.2	32.5	0	0	0	110.7
461	R	30.2	Very low	29.1	Very low	240 Å²	240	157.1 Å²	157.1	91%	0.906	82%	0.818	S	S	*	*			trans	-82.7	128.9	-175.7	-60	173.6	-177.4	164.4	-0.7	111.2
462	Y	31.2	Very low	29.1	Very low	227 Å²	227	154.1 Å²	154.1	89%	0.89	82%	0.816	S	S	*	*			trans	-122.4	122.9	151.3	-89.4	-84.3	0	0	0	109.2
463	P	28.7	Very low	29.1	Very low	124 Å²	124	153.3 Å²	153.3	81%	0.805	81%	0.811	S	S	*	*			trans	-86.3	138.3	-175.8	32.9	-33.2	0	0	0	112.1
464	G	27.7	Very low	29	Very low	74 Å²	74	151 Å²	151	76%	0.763	81%	0.806	S	S	*	*	S	Bend	trans	96.3	65.8	157.1	0	0	0	0	0	117.4
465	L	32.1	Very low	29	Very low	180 Å²	180	145.1 Å²	145.1	94%	0.942	80%	0.798	S	S	*	*			trans	-164.7	54.7	146	-107.9	167.2	0	0	0	112
466	Q	26	Very low	29.2	Very low	193 Å²	193	153.4 Å²	153.4	90%	0.902	81%	0.808	S	S	*	*			trans	-111	98.4	174.6	-79.9	-170.5	-24.3	0	0	112
467	K	33.3	Very low	29.3	Very low	202 Å²	202	153.8 Å²	153.8	88%	0.878	81%	0.81	S	S	*	*			trans	-146.2	120.2	154	-71.7	-162.5	177.4	177.6	0	112.1
468	S	26.6	Very low	29.4	Very low	115 Å²	115	157.7 Å²	157.7	80%	0.804	82%	0.82	S	S	*	*			trans	50.9	98.4	157.8	57.8	0	0	0	0	119.6
469	L	30.5	Very low	29.4	Very low	169 Å²	169	160.2 Å²	160.2	89%	0.885	82%	0.822	S	S	*	*				-121.5	150.2	129.3	-84.3	174.6	0	0	0	109.4
470	P	30.6	Very low	29.4	Very low	103 Å²	103	156.8 Å²	156.8	67%	0.669	82%	0.823	S	S	*	*			trans	-73	149.3	-179.1	-15.7	31.6	0	0	0	112.8	L472	P470-L472 PolarHBondContact O-N 3.29Å
471	N	26.1	Very low	29.3	Very low	132 Å²	132	159.9 Å²	159.9	71%	0.706	83%	0.834	S	S	*	*			trans	-79	85.1	-178.7	-171.4	-9.1	0	0	0	111.6	S473	N471-S473 PolarHBondContact O-N 3.42Å; N471-S473 WeakPolarHBondContact OD1-CB 3.41Å; N471-S473 PolarHBondContact OD1-OG 3.01Å
472	L	30	Very low	29.4	Very low	152 Å²	152	154.6 Å²	154.6	80%	0.796	83%	0.833	S	S	*	*			trans	-78.5	45.5	179.9	-66.9	177.9	0	0	0	113.8	P470 I474	P470-L472 PolarHBondContact O-N 3.29Å; L472-I474 PolarHBondContact O-N 2.82Å
473	S	28.1	Very low	29.5	Very low	89 Å²	89	147 Å²	147	62%	0.622	82%	0.824	S	S	*	*			trans	-85.2	13.6	174.5	46.5	0	0	0	0	114	N471	N471-S473 PolarHBondContact O-N 3.42Å; N471-S473 WeakPolarHBondContact OD1-CB 3.41Å; N471-S473 PolarHBondContact OD1-OG 3.01Å
474	I	27.4	Very low	29.6	Very low	151 Å²	151	152.4 Å²	152.4	77%	0.774	83%	0.829	S	S	*	*			trans	-121.3	47.9	-169.8	-38.7	-178	0	0	0	112.2	L472	L472-I474 PolarHBondContact O-N 2.82Å
475	V	28.4	Very low	29.9	Very low	131 Å²	131	153.9 Å²	153.9	79%	0.794	83%	0.828	S	S	*	*	S	Bend	trans	-139.6	60.5	167.9	-164.4	0	0	0	0	111
476	R	29.2	Very low	29.8	Very low	242 Å²	242	155.1 Å²	155.1	91%	0.913	83%	0.825	S	S	*	*			trans	-156.2	32.4	167.8	-142.6	-176.9	-75.6	-165.1	-2.2	115.4
477	M	28.7	Very low	30.1	Very low	184 Å²	184	153.6 Å²	153.6	91%	0.906	82%	0.823	S	S	*	*	S	Bend	trans	-131.1	70.1	173.8	-70.2	-153.9	-53.8	0	0	112.4
478	M	28.1	Very low	30.1	Very low	181 Å²	181	149.1 Å²	149.1	89%	0.892	82%	0.815	S	S	*	*	S	Bend	trans	-172.3	175	153	-104	162.6	-167.2	0	0	108.3
479	E	30.9	Very low	30.6	Very low	201 Å²	201	151.6 Å²	151.6	94%	0.939	82%	0.819	S	S	*	*			trans	64.1	41.1	177.6	-53.4	-162.8	145.3	0	0	116.4
480	A	29.3	Very low	30.9	Very low	99 Å²	99	149 Å²	149	82%	0.818	81%	0.81	S	S	*	*			trans	-125.8	44.8	161.7	0	0	0	0	0	111.7
481	N	33.2	Very low	30.9	Very low	168 Å²	168	150.5 Å²	150.5	90%	0.898	81%	0.813	S	S	*	*			trans	-126.6	95	171.9	-133.8	23.7	0	0	0	109.7
482	S	32	Very low	31.2	Very low	129 Å²	129	153 Å²	153	90%	0.902	82%	0.82	S	S	*	*			trans	-74.6	146.3	172.9	-178.3	0	0	0	0	110.3
483	G	32.4	Very low	31.3	Very low	68 Å²	68	149.9 Å²	149.9	70%	0.701	82%	0.817	S	S	*	*			trans	145.4	92.5	163.1	0	0	0	0	0	117.8
484	R	30.4	Very low	31.5	Very low	237 Å²	237	149.5 Å²	149.5	89%	0.894	82%	0.818	S	S	*	*			trans	65.4	116.2	143.4	-101.2	179	175.7	170.7	-1.9	121.6
485	S	33.9	Very low	31.7	Very low	106 Å²	106	150.3 Å²	150.3	74%	0.741	82%	0.824	S	S	*	*			trans	46.8	108.3	133	58.8	0	0	0	0	119.8
486	K	31.1	Very low	32	Very low	206 Å²	206	147.3 Å²	147.3	90%	0.896	82%	0.82	S	S	*	*			trans	-74.7	129.3	146	-67.9	-179.6	178.2	179.9	0	109.6
487	N	31.3	Very low	32.1	Very low	160 Å²	160	142.3 Å²	142.3	86%	0.856	82%	0.817	S	S	*	*				-154.4	137.6	128.8	-104	-1.4	0	0	0	107.2
488	P	33.7	Very low	32.4	Very low	109 Å²	109	142 Å²	142	71%	0.708	82%	0.815	S	S	*	*			trans	-86.6	150.2	175.8	35.6	-32.8	0	0	0	110.9
489	D	37.6	Very low	32.6	Very low	166 Å²	166	138.6 Å²	138.6	89%	0.888	81%	0.809	S	S	*	*			trans	-155.8	161.5	143.2	-103	-39.1	0	0	0	109.8
490	T	36.4	Very low	33.2	Very low	115 Å²	115	134.4 Å²	134.4	71%	0.706	80%	0.799	S	S	*	*			trans	-110.1	147.2	-157.7	41.3	0	0	0	0	116.3
491	N	31.2	Very low	33.4	Very low	135 Å²	135	136.1 Å²	136.1	72%	0.722	79%	0.794	S	S	*	*			trans	73.2	152.3	147.6	-66.4	-3.2	0	0	0	120.7
492	E	32.6	Very low	33.5	Very low	184 Å²	184	135 Å²	135	86%	0.86	78%	0.784	S	S	*	*			trans	65.6	145.4	159.3	-70.7	165.1	-143.2	0	0	118.5
493	A	31.3	Very low	33.9	Very low	87 Å²	87	135.7 Å²	135.7	72%	0.719	78%	0.777	S	S	*	*			cis	-164.1	171.8	-20.1	0	0	0	0	0	111.1
494	A	33.4	Very low	34	Very low	80 Å²	80	138.6 Å²	138.6	66%	0.661	78%	0.776	S	S	*	*			trans	70.3	107.4	150.5	0	0	0	0	0	122.5
495	N	30.8	Very low	34.4	Very low	168 Å²	168	135 Å²	135	90%	0.898	77%	0.77	S	S	*	*				71	144.4	119.9	-55	-16.5	0	0	0	123.4
496	G	33.9	Very low	34.6	Very low	68 Å²	68	134 Å²	134	70%	0.701	76%	0.762	S	S	*	*			trans	104.3	89.1	168.7	0	0	0	0	0	113.3
497	T	32.2	Very low	34.8	Very low	137 Å²	137	128.4 Å²	128.4	84%	0.84	75%	0.749	S	S	*	*			cis	76.5	106.6	40.9	-42.5	0	0	0	0	114
498	M	35.7	Very low	34.9	Very low	179 Å²	179	127.5 Å²	127.5	88%	0.882	75%	0.75	S	S	*	*			trans	150.9	149.8	158.2	-86.3	-67.4	173.4	0	0	109.1
499	S	32.1	Very low	35	Very low	108 Å²	108	126.7 Å²	126.7	76%	0.755	75%	0.747	S	S	*	*			cis	-163.3	151.9	-48.9	-155.6	0	0	0	0	107.5
500	P	41.8	Very low	34.9	Very low	113 Å²	113	126.3 Å²	126.3	73%	0.734	74%	0.744	S	S	*	*			trans	-106.1	162.1	-167.8	39.7	-34.8	0	0	0	115.8
501	N	35.2	Very low	34.9	Very low	135 Å²	135	127 Å²	127	72%	0.722	74%	0.744	S	S	*	*			trans	176.6	157.9	152.2	-108.9	21.3	0	0	0	110.3
502	E	35.1	Very low	35.1	Very low	145 Å²	145	124.2 Å²	124.2	68%	0.678	73%	0.734	S	S	*	*			cis	-163.7	-175.4	-11.7	-144.7	170.1	-132.2	0	0	110.3
503	L	39.6	Very low	35.4	Very low	143 Å²	143	124.7 Å²	124.7	75%	0.749	73%	0.733	S	S	*	*			trans	73.4	119.7	171.6	-56.5	162.3	0	0	0	116.6
504	N	35.6	Very low	35.4	Very low	130 Å²	130	124.5 Å²	124.5	70%	0.695	74%	0.74	S	S	*	*				69.9	136.1	53.6	-66.8	-39.9	0	0	0	113.4
505	Q	38.3	Very low	35.2	Very low	162 Å²	162	124.4 Å²	124.4	76%	0.757	75%	0.747	S	S	*	*			cis	-162.8	-177.9	1.7	-130.1	-173.1	77.6	0	0	108.6
506	S	37	Very low	35.3	Very low	83 Å²	83	125.6 Å²	125.6	58%	0.58	75%	0.747	S	S	*	*			cis	-160.2	-167.4	3.5	-153	0	0	0	0	111.5
507	S	36.5	Very low	35.3	Very low	90 Å²	90	128 Å²	128	63%	0.629	75%	0.748	S	S	*	*			trans	57.3	107.3	157.1	52.6	0	0	0	0	119.4
508	T	33.4	Very low	35.2	Very low	140 Å²	140	126.8 Å²	126.8	86%	0.859	74%	0.742	S	S	*	*				72.7	144.8	64.8	70.1	0	0	0	0	114.2
509	S	35.5	Very low	35.5	Very low	93 Å²	93	123.4 Å²	123.4	65%	0.65	73%	0.734	S	S	*	*			cis	-161.7	151.1	21.7	57.1	0	0	0	0	114.2
510	L	35.2	Very low	35.5	Very low	157 Å²	157	128.4 Å²	128.4	82%	0.822	74%	0.742	S	S	*	*			trans	61	147	143.2	-66.7	166.1	0	0	0	119.1
511	D	37.5	Very low	35.2	Very low	131 Å²	131	129.9 Å²	129.9	70%	0.701	74%	0.742	S	S	*	*			cis	-157.5	-169.6	-14.9	-155.2	27.3	0	0	0	105.8
512	S	35	Very low	35.1	Very low	76 Å²	76	127.2 Å²	127.2	53%	0.531	74%	0.738	S	S	.	*			cis	-159.2	157.6	8.4	-155.8	0	0	0	0	113.2
513	K	37.7	Very low	34.8	Very low	193 Å²	193	130.1 Å²	130.1	84%	0.839	75%	0.749	S	S	*	*			trans	37.1	114.4	147.6	-71.8	168	-174.9	173.2	0	121.9
514	G	32.2	Very low	34.5	Very low	83 Å²	83	129.2 Å²	129.2	86%	0.856	75%	0.75	S	S	*	*				94.9	126.4	128.1	0	0	0	0	0	117.4
515	G	28.2	Very low	34.2	Very low	79 Å²	79	129.7 Å²	129.7	81%	0.814	76%	0.757	S	S	*	*			cis	118.8	83.8	-7.9	0	0	0	0	0	114.9
516	H	34.3	Very low	33.8	Very low	192 Å²	192	133 Å²	133	89%	0.889	76%	0.763	S	S	*	*			trans	-152.3	150.8	155.1	-148.3	-83.9	0	0	0	112.9
517	V	33.6	Very low	33.5	Very low	119 Å²	119	137.1 Å²	137.1	72%	0.721	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-99.8	150.2	-178.2	170	0	0	0	0	109.4
518	P	30.5	Very low	33	Very low	112 Å²	112	138.6 Å²	138.6	73%	0.727	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-82.5	150.5	-156.3	30.9	-37	0	0	0	115.3
519	P	41.5	Very low	32.9	Very low	107 Å²	107	137.4 Å²	137.4	70%	0.695	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-81.1	120.6	177.2	32.8	-34	0	0	0	112.3	I521	P519-I521 HydrophobicContact CB-CD1 4.21Å; P519-I521 HydrophobicContact CB-CG1 4.1Å; P519-I521 HydrophobicContact CG-CD1 4.41Å; P519-I521 PolarHBondContact O-N 2.86Å
520	K	32	Very low	32.6	Very low	214 Å²	214	144.4 Å²	144.4	93%	0.93	79%	0.79	S	S	*	*			trans	-68.5	113.3	161.8	-74.4	173.8	176.9	172.5	0	108.9
521	I	36.4	Very low	32.3	Very low	144 Å²	144	144.6 Å²	144.6	74%	0.738	79%	0.791	S	S	*	*			trans	-120.3	117.5	176.4	-59.9	-175.4	0	0	0	111.9	P519	P519-I521 HydrophobicContact CB-CD1 4.21Å; P519-I521 HydrophobicContact CB-CG1 4.1Å; P519-I521 HydrophobicContact CG-CD1 4.41Å; P519-I521 PolarHBondContact O-N 2.86Å
522	A	31.6	Very low	32	Very low	78 Å²	78	144 Å²	144	65%	0.645	79%	0.794	S	S	*	*			trans	16.1	126	160.3	0	0	0	0	0	120.8	T524	A522-T524 PolarHBondContact O-N 3.21Å
523	K	29.5	Very low	31.8	Very low	206 Å²	206	148.5 Å²	148.5	90%	0.896	81%	0.809	S	S	*	*			trans	-57.3	117.4	154.6	-64.6	174.9	178.5	177.1	0	109.8
524	T	33.1	Very low	31.6	Very low	125 Å²	125	145.2 Å²	145.2	77%	0.767	81%	0.808	S	S	*	*			trans	-101.6	93	171.1	37.1	0	0	0	0	111.1	A522 R526	A522-T524 PolarHBondContact O-N 3.21Å; T524-R526 PolarHBondContact O-N 3.23Å; T524-R526 VanDerWaalsContact O-N 3.13Å
525	T	29.7	Very low	31.6	Very low	140 Å²	140	147.6 Å²	147.6	86%	0.859	81%	0.805	S	S	*	*			trans	-64.5	107.8	177.6	-43	0	0	0	0	110.9
526	R	29.8	Very low	31.7	Very low	230 Å²	230	155.4 Å²	155.4	87%	0.868	81%	0.81	S	S	*	*			trans	-135.2	106	172.7	-76.5	-166.2	169.4	-162.9	-3	113	T524	T524-R526 PolarHBondContact O-N 3.23Å; T524-R526 VanDerWaalsContact O-N 3.13Å
527	Q	30.1	Very low	31.8	Very low	171 Å²	171	152.9 Å²	152.9	80%	0.799	81%	0.808	S	S	*	*			trans	35.7	119.3	147.9	-70.2	-69.9	-7	0	0	119.2	S529	Q527-S529 PolarHBondContact O-N 3.29Å; Q527-S529 VanDerWaalsContact O-N 3.09Å
528	P	27.1	Very low	31.4	Very low	121 Å²	121	150.9 Å²	150.9	79%	0.786	81%	0.812	S	S	*	*			trans	-72.4	103.7	175.1	30.7	-33.8	0	0	0	111.8	R530	P528-R530 VanDerWaalsContact C-N 3.34Å; P528-R530 PolarHBondContact O-N 2.97Å
529	S	31.3	Very low	31.5	Very low	115 Å²	115	153.1 Å²	153.1	80%	0.804	82%	0.816	S	S	*	*			trans	-72.9	81	176.1	39.4	0	0	0	0	112.5	Q527 L531	Q527-S529 PolarHBondContact O-N 3.29Å; Q527-S529 VanDerWaalsContact O-N 3.09Å; S529-L531 PolarHBondContact O-N 3.21Å
530	R	28.2	Very low	31.1	Very low	239 Å²	239	153.2 Å²	153.2	90%	0.902	82%	0.817	S	S	*	*			trans	18.7	94	160.4	-66	-176.1	176.9	-170.4	-1.4	115.8	P528	P528-R530 VanDerWaalsContact C-N 3.34Å; P528-R530 PolarHBondContact O-N 2.97Å
531	L	28.2	Very low	31.1	Very low	161 Å²	161	150.3 Å²	150.3	84%	0.843	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-62.4	147.6	163.1	-69	172.2	0	0	0	110.6	S529 M533	S529-L531 PolarHBondContact O-N 3.21Å; L531-M533 PolarHBondContact O-N 2.99Å
532	P	31.9	Very low	31	Very low	119 Å²	119	151 Å²	151	77%	0.773	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-61.3	134.9	171.2	-19.8	32.4	0	0	0	110.9
533	M	30.4	Very low	30.9	Very low	171 Å²	171	156 Å²	156	84%	0.842	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-67.4	132	173.1	-77	166.2	49.9	0	0	110.5	L531 V535	L531-M533 PolarHBondContact O-N 2.99Å; M533-V535 PolarHBondContact O-N 3.47Å
534	P	33.6	Very low	31	Very low	124 Å²	124	151.2 Å²	151.2	81%	0.805	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-62.6	123.9	164.8	-18.7	31.8	0	0	0	109.5	R536	P534-R536 PolarHBondContact O-N 3.2Å
535	V	33.6	Very low	30.8	Very low	133 Å²	133	150.2 Å²	150.2	81%	0.806	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-68.3	130.1	172.5	177.2	0	0	0	0	108.4	M533 T537	M533-V535 PolarHBondContact O-N 3.47Å; V535-T537 PolarHBondContact O-N 3.34Å
536	R	28.9	Very low	31	Very low	242 Å²	242	151.6 Å²	151.6	91%	0.913	81%	0.814	S	S	*	*			trans	-68.8	112.2	179.7	-72.9	177.8	171.7	176	-3.7	110.9	P534	P534-R536 PolarHBondContact O-N 3.2Å
537	T	36	Very low	31.3	Very low	140 Å²	140	151.1 Å²	151.1	86%	0.859	81%	0.812	S	S	*	*			trans	-114.9	129.8	147.5	45.9	0	0	0	0	107.4	V535	V535-T537 PolarHBondContact O-N 3.34Å
538	G	26.8	Very low	31.4	Very low	77 Å²	77	152.9 Å²	152.9	79%	0.794	82%	0.817	S	S	*	*			trans	-105.5	134.1	-159.2	0	0	0	0	0	114.6
539	I	32.6	Very low	31.6	Very low	158 Å²	158	154.9 Å²	154.9	81%	0.81	82%	0.821	S	S	*	*			trans	-132.1	132.1	158.1	-59.1	-178.3	0	0	0	106.3	L541	I539-L541 PolarHBondContact O-N 3.28Å
540	P	31.5	Very low	31.6	Very low	110 Å²	110	155 Å²	155	71%	0.714	82%	0.822	S	S	*	*			trans	-80.9	118.8	-162.5	29.5	-35.1	0	0	0	114	L542	P540-L542 PolarHBondContact O-N 3.39Å; P540-L542 VanDerWaalsContact O-N 3.17Å
541	L	31.8	Very low	32	Very low	152 Å²	152	148.9 Å²	148.9	80%	0.796	82%	0.816	S	S	*	*			trans	-76	95.7	163.1	-73.5	173.1	0	0	0	110.1	I539 K543	I539-L541 PolarHBondContact O-N 3.28Å; L541-K543 VanDerWaalsContact C-N 3.29Å; L541-K543 PolarHBondContact O-N 2.98Å
542	L	35.1	Very low	32.1	Very low	159 Å²	159	147.6 Å²	147.6	83%	0.832	81%	0.81	S	S	*	*			trans	-68.7	81.6	173.7	-76	174.5	0	0	0	111.9	P540 S544	P540-L542 PolarHBondContact O-N 3.39Å; P540-L542 VanDerWaalsContact O-N 3.17Å; L542-S544 PolarHBondContact O-N 3.39Å
543	K	30.6	Very low	32.2	Very low	183 Å²	183	148.9 Å²	148.9	80%	0.796	81%	0.81	S	S	*	*			trans	-83.9	76.1	166	-68.5	-173.7	177.4	-176.9	0	110.2	L541 S545	L541-K543 VanDerWaalsContact C-N 3.29Å; L541-K543 PolarHBondContact O-N 2.98Å; K543-S545 PolarHBondContact O-N 3.01Å
544	S	31.7	Very low	32.2	Very low	106 Å²	106	144 Å²	144	74%	0.741	80%	0.804	S	S	*	*			trans	-68.4	99	173	38.7	0	0	0	0	110.9	L542 L546	L542-S544 PolarHBondContact O-N 3.39Å; S544-L546 PolarHBondContact O-N 3.31Å
545	S	28.8	Very low	32.3	Very low	103 Å²	103	146.1 Å²	146.1	72%	0.72	81%	0.808	S	S	*	*			trans	-74.4	86.2	178.8	-174.3	0	0	0	0	111.5	K543 R547	K543-S545 PolarHBondContact O-N 3.01Å; S545-R547 PolarHBondContact O-N 2.68Å
546	L	33.8	Very low	32.4	Very low	170 Å²	170	144.9 Å²	144.9	89%	0.89	80%	0.803	S	S	*	*			trans	-73.9	105.3	164.6	-88.7	165.6	0	0	0	109.2	S544	S544-L546 PolarHBondContact O-N 3.31Å
547	R	35.4	Very low	32.5	Very low	220 Å²	220	139.3 Å²	139.3	83%	0.83	80%	0.797	S	S	*	*			trans	-69.3	145.1	179.8	-64	-178.1	179.6	-174.2	0	110.6	S545 N549	S545-R547 PolarHBondContact O-N 2.68Å; R547-N549 PolarHBondContact O-N 3.48Å
548	K	31.4	Very low	32.3	Very low	207 Å²	207	140.4 Å²	140.4	90%	0.9	80%	0.797	S	S	*	*			trans	-59	129.1	163.4	-62.7	179.2	178.6	-177.4	0	109.3
549	N	32.9	Very low	32.5	Very low	164 Å²	164	143.3 Å²	143.3	88%	0.877	80%	0.8	S	S	*	*			trans	-128.9	150.6	154.4	-96.1	-2.1	0	0	0	107.6	R547	R547-N549 PolarHBondContact O-N 3.48Å
550	S	29.5	Very low	32.5	Very low	117 Å²	117	143.3 Å²	143.3	82%	0.818	80%	0.8	S	S	*	*			trans	-137.1	111.1	-164.7	54	0	0	0	0	112.6
551	S	37.6	Very low	32.4	Very low	110 Å²	110	142.7 Å²	142.7	77%	0.769	80%	0.798	S	S	*	*			trans	-170.7	133.9	159.5	51.3	0	0	0	0	110.9
552	N	30.8	Very low	32.3	Very low	134 Å²	134	145 Å²	145	72%	0.717	80%	0.802	S	S	*	*				16.5	141.1	128.4	-69	54.4	0	0	0	118.8
553	D	33.8	Very low	32	Very low	146 Å²	146	144.3 Å²	144.3	78%	0.781	80%	0.799	S	S	*	*			cis	-156.8	156.9	6.5	-103.5	-34.8	0	0	0	113.2
554	G	31	Very low	32.1	Very low	70 Å²	70	140.9 Å²	140.9	72%	0.722	80%	0.798	S	S	*	*				85.9	35.5	129.5	0	0	0	0	0	122.5
555	L	34.4	Very low	32.2	Very low	168 Å²	168	148.4 Å²	148.4	88%	0.88	81%	0.81	S	S	*	*			trans	-135.1	148.8	160.4	-78.9	-179.8	0	0	0	112.8
556	P	37.1	Very low	32.2	Very low	107 Å²	107	150.8 Å²	150.8	70%	0.695	82%	0.815	S	S	*	*			trans	-76.6	154.4	-169.7	31.2	-36.2	0	0	0	113.5	L558	P556-L558 PolarHBondContact O-N 2.9Å
557	P	31.2	Very low	32.3	Very low	124 Å²	124	152.1 Å²	152.1	81%	0.805	82%	0.816	S	S	*	*			trans	-70.7	115.6	-179.9	29	-34.3	0	0	0	111.4	T559	P557-T559 PolarHBondContact O-N 3.09Å
558	L	31	Very low	31.9	Very low	163 Å²	163	144.9 Å²	144.9	85%	0.853	81%	0.81	S	S	*	*			trans	-60.6	117.7	168.7	-83.7	165.6	0	0	0	109.8	P556 I560	P556-L558 PolarHBondContact O-N 2.9Å; L558-I560 PolarHBondContact O-N 3.4Å
559	T	31.5	Very low	31.8	Very low	138 Å²	138	141.1 Å²	141.1	85%	0.847	81%	0.809	S	S	*	*			trans	-69.4	91.3	172.6	47.2	0	0	0	0	109.4	P557 S561	P557-T559 PolarHBondContact O-N 3.09Å; T559-S561 PolarHBondContact O-N 3.25Å
560	I	31.4	Very low	31.6	Very low	159 Å²	159	147 Å²	147	82%	0.815	83%	0.827	S	S	*	*			trans	-61.7	107.2	175	-59.9	177.7	0	0	0	108.3	L558 K562	L558-I560 PolarHBondContact O-N 3.4Å; I560-K562 PolarHBondContact O-N 3.32Å
561	S	29.3	Very low	31.7	Very low	96 Å²	96	148.5 Å²	148.5	67%	0.671	83%	0.827	S	S	*	*			trans	-61.3	125.5	177.5	48.9	0	0	0	0	110.4	T559 N563	T559-S561 PolarHBondContact O-N 3.25Å; S561-N563 PolarHBondContact O-N 3.13Å
562	K	30.9	Very low	31.4	Very low	202 Å²	202	150.5 Å²	150.5	88%	0.878	83%	0.83	S	S	*	*	S	Bend	trans	-66.3	95.7	165.4	-70.1	178.5	179.5	176	0	109	I560	I560-K562 PolarHBondContact O-N 3.32Å
563	N	29.2	Very low	31.4	Very low	144 Å²	144	151.4 Å²	151.4	77%	0.77	84%	0.837	S	S	*	*			trans	-173.6	164.2	153.7	-91.5	-23.3	0	0	0	109.2	S561	S561-N563 PolarHBondContact O-N 3.13Å
564	S	31.2	Very low	31.3	Very low	111 Å²	111	151.7 Å²	151.7	78%	0.776	84%	0.84	S	S	*	*			trans	46.9	90.2	176.1	58	0	0	0	0	116.7
565	W	33.5	Very low	31.3	Very low	263 Å²	263	156.8 Å²	156.8	100%	0.996	85%	0.847	S	S	*	*			trans	-106.5	102.3	142.6	-91.9	42.3	0	0	0	107.2
566	N	29.6	Very low	31.1	Very low	153 Å²	153	156.1 Å²	156.1	82%	0.818	85%	0.845	S	S	*	*			trans	-117.6	167	163.2	-106.9	3.1	0	0	0	107.1
567	E	35.5	Very low	30.6	Very low	198 Å²	198	159.6 Å²	159.6	93%	0.925	86%	0.856	S	S	*	*			trans	78.8	144.5	-179	-52.8	-178.7	178.9	0	0	117.2
568	G	27.9	Very low	30.6	Very low	68 Å²	68	162.3 Å²	162.3	70%	0.701	86%	0.86	S	S	*	*			trans	92.8	69.2	140.1	0	0	0	0	0	119.5
569	C	27.8	Very low	30.6	Very low	129 Å²	129	162.3 Å²	162.3	87%	0.872	86%	0.86	S	S	*	*			trans	46.3	131.8	140	-54.3	0	0	0	0	121.8
570	F	29.2	Very low	30.5	Very low	286 Å²	286	164.5 Å²	164.5	100%	1.254	86%	0.862	S	S	*	*			trans	-145.4	0	144.7	-117.6	-72.6	0	0	0	110.3

Retrieved 570 of 570 residues in 199.2 ms (Link to these results)

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