A0A5K4F953_SCHMA Loading...

SH2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F953, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 918 aa.

						>A0A5K4F953_SCHMA|A0A5K4F953
MSLSPAAQRYEEHVLATVSGRPYNKTGNQIFFNDHKNYVPHQNPVKKVNILPECQYDEKPIEIIKGYNYDEEENDSTNQQNEDLFNAELWREKFGAITRWRREVDDAMLAGETERLHSPETILRDNCVKEEFSRSPIPNQHEVTNYLKPTIVQVNSFQSNGLYSSVNNAETNYSTSSPFPTIQSYTHNKPLVSGKEAIGTKQHILYSSNNMKPNTCQIPTTKNMNVYDNVVPKCYQPTNHAVPSKVVINSSGVANDQTYQYDNNIRLEDSRQINSKYQPMWIKAPIPKLQCSRQRSNSGNAGVLQPGQQIENFTNIPNHYYYPSSNPVNLTPNNQGSIHHSYEPNIPLSNMNSSMNKYNNSTVKSFRNFLTPKLRRKTYELDRTESVRLKQDDHKPMNNSVEQHLGNNNSRSINERNNPLKKVVSSTSYTDALNLAVAANTALNEAFNQSITSTDSYQKTNSTSQNTPISFKQQKFKTTTSPINPGSSIITNERSPAELNLTPIDAVKMENKTNTCQWTKISKPYKNISLSPISSISQYNNGDKNSSVDKQMDKNKFKIDTTEQTLYSDNKSRSPKLLISEKSDDFTETNTDTRRIPGRLKSSLRHSVTLSPCRRKPDVTLEQCNSPYLQPSPLALSSGFVSAGSIVNTVEECNEKMNKDGFVETSSKVKPVPPPVGVHDYPIVTNLEKDLNKIDSLINDSLNIHLTDTTSQTKSNPSELFNNSIQKSNEQQQQQQSKPNKLLPLQTLPPCKLLLGRVASNEDICIETETPFSFNIAATDKEICITRVASVEDLKCQRQEHDPLKGNNDSNNNNSKSIKRNYKRIPISLRLTFGSESKLNQSIVHSNENYRAMYYVNIPQGSRTTELRRKTNPLKSHNPHHNHNTQNMIRYSLPCITYCEELPKPISLLPPLGIEKNR
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	47.6	Very low	68.3	Low	244 Å²	244	110.9 Å²	110.9	100%	1.202	59%	0.593	S	S	*	*				0	110.3	0	-76.8	173.2	145.7	0	0	107.1
2	S	66.6	Low	68.6	Low	121 Å²	121	110.5 Å²	110.5	85%	0.846	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-71.6	136.6	170.4	45.5	0	0	0	0	108.6
3	L	61.2	Low	68.4	Low	93 Å²	93	110.4 Å²	110.4	49%	0.487	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-56.6	148.4	168	-77.3	160	0	0	0	109	A7 Q8 E11	L3-A7 HydrophobicContact CB-CB 4.39Å; L3-A7 HydrophobicContact CD2-CB 3.92Å; L3-Q8 HydrophobicContact CB-CB 4.41Å; L3-E11 WeakPolarHBondContact CD1-OE2 3.3Å
4	S	77.9	Confident	68.1	Low	66 Å²	66	106.9 Å²	106.9	46%	0.462	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-62.3	149.6	168.5	78	0	0	0	0	109	A6 A7 Q8	S4-A6 PolarHBondContact O-N 3.34Å; S4-A6 VanDerWaalsContact O-N 3.08Å; S4-A7 PolarHBondContact O-N 3.36Å; S4-A7 PolarHBondContact OG-N 3.3Å; S4-Q8 PolarHBondContact O-N 3.37Å
5	P	77.1	Confident	67.7	Low	92 Å²	92	107.1 Å²	107.1	60%	0.597	57%	0.565	S	S	*	*	H	α-helix	trans	-54.7	-29.5	176.9	-27.8	35.3	0	0	0	113.5	R9	P5-R9 WeakPolarHBondContact O-CB 3.23Å; P5-R9 WeakPolarHBondContact O-CG 3.2Å; P5-R9 PolarHBondContact O-N 3.41Å; P5-R9 VanDerWaalsContact O-N 3.08Å
6	A	67.8	Low	66.7	Low	61 Å²	61	101.8 Å²	101.8	50%	0.504	54%	0.541	S	S	.	.	H	α-helix	trans	-71.6	-43.6	176	0	0	0	0	0	112.2	S4 Q8 R9 Y10	S4-A6 PolarHBondContact O-N 3.34Å; S4-A6 VanDerWaalsContact O-N 3.08Å; A6-Q8 VanDerWaalsContact C-N 3.34Å; A6-R9 PolarHBondContact O-N 2.99Å; A6-Y10 PolarHBondContact O-N 3.01Å
7	A	69.2	Low	65.9	Low	38 Å²	38	101.4 Å²	101.4	31%	0.314	54%	0.543	S	S	.	.	H	α-helix	trans	-66.5	-37.8	177.1	0	0	0	0	0	111.7	L3 S4 Y10 E11	L3-A7 HydrophobicContact CB-CB 4.39Å; L3-A7 HydrophobicContact CD2-CB 3.92Å; S4-A7 PolarHBondContact O-N 3.36Å; S4-A7 PolarHBondContact OG-N 3.3Å; A7-Y10 PolarHBondContact O-N 3.32Å; A7-E11 PolarHBondContact O-N 3.18Å
8	Q	72.2	Confident	65.2	Low	103 Å²	103	102.5 Å²	102.5	48%	0.481	55%	0.554	S	S	.	*	H	α-helix	trans	-65.4	-40.8	175.5	-159.9	171	8.7	0	0	111.5	L3 S4 A6 E11 E12	L3-Q8 HydrophobicContact CB-CB 4.41Å; S4-Q8 PolarHBondContact O-N 3.37Å; A6-Q8 VanDerWaalsContact C-N 3.34Å; Q8-E11 PolarHBondContact O-N 3.27Å; Q8-E12 WeakPolarHBondContact O-CG 3.46Å; Q8-E12 PolarHBondContact O-N 3.3Å
9	R	73.7	Confident	64.7	Low	127 Å²	127	100.8 Å²	100.8	48%	0.479	55%	0.551	S	S	.	*	H	α-helix	trans	-65.7	-36.6	173.3	-80.1	-168.2	-95.7	167.7	-3.1	113.2	P5 A6 E12 H13 E103	P5-R9 WeakPolarHBondContact O-CB 3.23Å; P5-R9 WeakPolarHBondContact O-CG 3.2Å; P5-R9 PolarHBondContact O-N 3.41Å; P5-R9 VanDerWaalsContact O-N 3.08Å; A6-R9 PolarHBondContact O-N 2.99Å; R9-E12 PolarHBondContact O-N 3.06Å; R9-H13 WeakPolarHBondContact O-CB 3.43Å; R9-H13 PolarHBondContact O-N 3.27Å; R9-E103 IonicContact CZ-OE1 3.56Å; R9-E103 IonicContact NH1-OE1 2.66Å; R9-E103 PolarHBondContact NH1-OE1 3.19Å; R9-E103 IonicContact NH2-OE1 3.95Å
10	Y	68.6	Low	63.7	Low	174 Å²	174	99.1 Å²	99.1	68%	0.682	56%	0.558	S	S	*	*	H	α-helix	trans	-63.3	-44.4	172.9	-178.3	-97.8	0	0	0	111.4	A6 A7 H13 V14	A6-Y10 PolarHBondContact O-N 3.01Å; A7-Y10 PolarHBondContact O-N 3.32Å; Y10-H13 PolarHBondContact O-N 3.18Å; Y10-V14 HydrophobicContact CD1-CG2 4.11Å; Y10-V14 HydrophobicContact CE1-CG2 3.7Å; Y10-V14 HydrophobicContact CE2-CG2 4.27Å; Y10-V14 WeakPolarHBondContact O-CG2 3.19Å; Y10-V14 PolarHBondContact O-N 3.49Å
11	E	69.9	Low	62.6	Low	101 Å²	101	103.7 Å²	103.7	47%	0.472	57%	0.566	S	S	.	*	H	α-helix	trans	-61.7	-44.5	176.6	-169.6	174.7	-164.6	0	0	111.7	L3 A7 Q8 H13 V14 L15	L3-E11 WeakPolarHBondContact CD1-OE2 3.3Å; A7-E11 PolarHBondContact O-N 3.18Å; Q8-E11 PolarHBondContact O-N 3.27Å; E11-H13 PolarHBondContact O-N 3.16Å; E11-V14 PolarHBondContact O-N 3.08Å; E11-L15 HydrophobicContact CG-CD1 4.19Å; E11-L15 WeakPolarHBondContact O-CB 3.23Å; E11-L15 VanDerWaalsContact O-CG 3.26Å; E11-L15 WeakPolarHBondContact O-CG 3.27Å; E11-L15 PolarHBondContact O-N 2.89Å
12	E	71.7	Confident	62.4	Low	106 Å²	106	97.8 Å²	97.8	50%	0.495	55%	0.546	S	S	.	.	H	α-helix	trans	-60.4	-43	173.7	-75.5	-177.6	174.6	0	0	112.1	Q8 R9 L15 A16	Q8-E12 WeakPolarHBondContact O-CG 3.46Å; Q8-E12 PolarHBondContact O-N 3.3Å; R9-E12 PolarHBondContact O-N 3.06Å; E12-L15 PolarHBondContact O-N 3.29Å; E12-A16 WeakPolarHBondContact O-CB 3.15Å; E12-A16 PolarHBondContact O-N 3.22Å
13	H	66.2	Low	60.8	Low	109 Å²	109	98.6 Å²	98.6	51%	0.505	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-44.3	178.1	-168.9	-25.8	0	0	0	111.4	R9 Y10 E11 L15 A16 T17	R9-H13 WeakPolarHBondContact O-CB 3.43Å; R9-H13 PolarHBondContact O-N 3.27Å; Y10-H13 PolarHBondContact O-N 3.18Å; E11-H13 PolarHBondContact O-N 3.16Å; H13-L15 VanDerWaalsContact C-N 3.33Å; H13-L15 PolarHBondContact O-N 3.04Å; H13-A16 PolarHBondContact O-N 2.91Å; H13-T17 PolarHBondContact CE1-OG1 2.95Å; H13-T17 PolarHBondContact ND1-OG1 3.24Å; H13-T17 VanDerWaalsContact ND1-OG1 3.09Å; H13-T17 PolarHBondContact O-N 3.2Å; H13-T17 PolarHBondContact O-OG1 3.22Å
14	V	64.2	Low	59.9	Low	61 Å²	61	101.5 Å²	101.5	37%	0.37	55%	0.548	S	S	.	.	H	α-helix	trans	-61.6	-43.9	177.4	172.5	0	0	0	0	110.3	Y10 E11 T17 V18	Y10-V14 HydrophobicContact CD1-CG2 4.11Å; Y10-V14 HydrophobicContact CE1-CG2 3.7Å; Y10-V14 HydrophobicContact CE2-CG2 4.27Å; Y10-V14 WeakPolarHBondContact O-CG2 3.19Å; Y10-V14 PolarHBondContact O-N 3.49Å; E11-V14 PolarHBondContact O-N 3.08Å; V14-T17 PolarHBondContact O-N 3.3Å; V14-V18 HydrophobicContact CG1-CG2 4.46Å; V14-V18 WeakPolarHBondContact O-CB 3.25Å; V14-V18 WeakPolarHBondContact O-CG2 3.49Å; V14-V18 PolarHBondContact O-N 3.33Å
15	L	61.3	Low	58.1	Low	110 Å²	110	107.5 Å²	107.5	58%	0.576	57%	0.565	S	S	*	*	H	α-helix	trans	-65.5	-38.5	177.2	-69.7	170.8	0	0	0	112.7	E11 E12 H13 S19	E11-L15 HydrophobicContact CG-CD1 4.19Å; E11-L15 WeakPolarHBondContact O-CB 3.23Å; E11-L15 VanDerWaalsContact O-CG 3.26Å; E11-L15 WeakPolarHBondContact O-CG 3.27Å; E11-L15 PolarHBondContact O-N 2.89Å; E12-L15 PolarHBondContact O-N 3.29Å; H13-L15 VanDerWaalsContact C-N 3.33Å; H13-L15 PolarHBondContact O-N 3.04Å; L15-S19 VanDerWaalsContact O-CB 3.31Å; L15-S19 WeakPolarHBondContact O-CB 3.24Å; L15-S19 PolarHBondContact O-N 3.43Å; L15-S19 PolarHBondContact O-OG 3.47Å; L15-S19 VanDerWaalsContact O-OG 3.05Å
16	A	51.3	Low	56.2	Low	22 Å²	22	109.9 Å²	109.9	18%	0.182	58%	0.578	C	S	.	*	H	α-helix	trans	-64.9	-47.9	176.7	0	0	0	0	0	111.5	E12 H13 V18 S19 G20 Y23	E12-A16 WeakPolarHBondContact O-CB 3.15Å; E12-A16 PolarHBondContact O-N 3.22Å; H13-A16 PolarHBondContact O-N 2.91Å; A16-V18 VanDerWaalsContact C-N 3.34Å; A16-V18 PolarHBondContact O-N 3.23Å; A16-S19 PolarHBondContact O-N 3.13Å; A16-S19 PolarHBondContact O-OG 3Å; A16-S19 VanDerWaalsContact O-OG 3.1Å; A16-G20 PolarHBondContact O-N 2.84Å; A16-Y23 HydrophobicContact CB-CD2 4.31Å
17	T	54.4	Low	54.3	Low	95 Å²	95	109.9 Å²	109.9	58%	0.583	58%	0.584	S	S	*	*	H	α-helix	trans	-61.3	-42	178.2	-52.6	0	0	0	0	111.5	H13 V14 G20	H13-T17 PolarHBondContact CE1-OG1 2.95Å; H13-T17 PolarHBondContact ND1-OG1 3.24Å; H13-T17 VanDerWaalsContact ND1-OG1 3.09Å; H13-T17 PolarHBondContact O-N 3.2Å; H13-T17 PolarHBondContact O-OG1 3.22Å; V14-T17 PolarHBondContact O-N 3.3Å; T17-G20 PolarHBondContact O-N 3.34Å
18	V	53.4	Low	52.4	Low	122 Å²	122	115.1 Å²	115.1	74%	0.739	61%	0.607	S	S	*	*	H	α-helix	trans	-70.3	-33.8	179.2	175.2	0	0	0	0	111.9	V14 A16 G20	V14-V18 HydrophobicContact CG1-CG2 4.46Å; V14-V18 WeakPolarHBondContact O-CB 3.25Å; V14-V18 WeakPolarHBondContact O-CG2 3.49Å; V14-V18 PolarHBondContact O-N 3.33Å; A16-V18 VanDerWaalsContact C-N 3.34Å; A16-V18 PolarHBondContact O-N 3.23Å; V18-G20 VanDerWaalsContact C-N 3.3Å; V18-G20 PolarHBondContact O-N 3.33Å
19	S	55.3	Low	50.2	Low	71 Å²	71	118.3 Å²	118.3	50%	0.497	62%	0.622	S	S	.	*	H	α-helix	trans	-80.9	-7.5	-179.9	69.1	0	0	0	0	114.3	L15 A16 R21	L15-S19 VanDerWaalsContact O-CB 3.31Å; L15-S19 WeakPolarHBondContact O-CB 3.24Å; L15-S19 PolarHBondContact O-N 3.43Å; L15-S19 PolarHBondContact O-OG 3.47Å; L15-S19 VanDerWaalsContact O-OG 3.05Å; A16-S19 PolarHBondContact O-N 3.13Å; A16-S19 PolarHBondContact O-OG 3Å; A16-S19 VanDerWaalsContact O-OG 3.1Å; S19-R21 PolarHBondContact O-N 2.91Å; S19-R21 VanDerWaalsContact O-N 3.11Å
20	G	44.9	Very low	48	Very low	66 Å²	66	118 Å²	118	68%	0.68	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	61.5	15.1	-176.8	0	0	0	0	0	113.5	A16 T17 V18	A16-G20 PolarHBondContact O-N 2.84Å; T17-G20 PolarHBondContact O-N 3.34Å; V18-G20 VanDerWaalsContact C-N 3.3Å; V18-G20 PolarHBondContact O-N 3.33Å
21	R	39.6	Very low	46.1	Very low	196 Å²	196	117.2 Å²	117.2	74%	0.74	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-83.9	127.8	177.1	-73.8	-165.7	178.4	-143	2.2	109.5	S19 Y23	S19-R21 PolarHBondContact O-N 2.91Å; S19-R21 VanDerWaalsContact O-N 3.11Å; R21-Y23 PolarHBondContact O-N 3.1Å
22	P	44.2	Very low	44.2	Very low	119 Å²	119	120.5 Å²	120.5	77%	0.773	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-60.6	138.7	169.5	24.2	-30.4	0	0	0	109.8	N24	P22-N24 PolarHBondContact O-N 3.24Å
23	Y	33.8	Very low	42	Very low	139 Å²	139	121.3 Å²	121.3	55%	0.545	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-57	120.5	-178.6	-141.4	-94	0	0	0	109.8	A16 R21 K25	A16-Y23 HydrophobicContact CB-CD2 4.31Å; R21-Y23 PolarHBondContact O-N 3.1Å; Y23-K25 PolarHBondContact O-N 3.14Å
24	N	40.3	Very low	40.3	Very low	154 Å²	154	122.6 Å²	122.6	82%	0.824	66%	0.66	S	S	*	*			trans	-69.7	96.2	170.9	-94.3	-19.8	0	0	0	108	P22 T26	P22-N24 PolarHBondContact O-N 3.24Å; N24-T26 PolarHBondContact O-N 2.83Å
25	K	40.4	Very low	38.6	Very low	192 Å²	192	127.7 Å²	127.7	84%	0.835	68%	0.68	S	S	*	*			trans	-56.9	110.5	164.8	-83	178.4	177	172.6	0	108.1	Y23 G27	Y23-K25 PolarHBondContact O-N 3.14Å; K25-G27 PolarHBondContact O-N 2.9Å
26	T	37.2	Very low	37.2	Very low	141 Å²	141	131.2 Å²	131.2	87%	0.865	69%	0.69	S	S	*	*	S	Bend	trans	-62.3	114.1	160.5	41.9	0	0	0	0	108.5	N24	N24-T26 PolarHBondContact O-N 2.83Å
27	G	28.2	Very low	36.3	Very low	61 Å²	61	137.6 Å²	137.6	63%	0.629	72%	0.721	S	S	*	*	S	Bend	trans	70.2	87.9	160.6	0	0	0	0	0	115.6	K25	K25-G27 PolarHBondContact O-N 2.9Å
28	N	28.8	Very low	35	Very low	148 Å²	148	143.6 Å²	143.6	79%	0.791	74%	0.735	S	S	*	*			trans	179.2	94.1	130.4	-85.3	-17.1	0	0	0	107.1	I30	N28-I30 VanDerWaalsContact C-N 3.29Å; N28-I30 HydrophobicContact CB-CG1 4.49Å; N28-I30 PolarHBondContact O-N 3.39Å
29	Q	26.7	Very low	34	Very low	171 Å²	171	142.9 Å²	142.9	80%	0.799	73%	0.73	S	S	*	*			trans	-64.4	92.6	165.9	-76	178	9.5	0	0	107.7	F31	Q29-F31 HydrophobicContact CB-CD2 4.5Å; Q29-F31 HydrophobicContact CB-CE2 4.17Å
30	I	27.4	Very low	32.9	Very low	121 Å²	121	144.6 Å²	144.6	62%	0.621	74%	0.74	S	S	*	*			trans	-91.8	102.9	164.2	-57.6	179	0	0	0	105.5	N28 F32	N28-I30 VanDerWaalsContact C-N 3.29Å; N28-I30 HydrophobicContact CB-CG1 4.49Å; N28-I30 PolarHBondContact O-N 3.39Å; I30-F32 HydrophobicContact CB-CE2 4.27Å; I30-F32 HydrophobicContact CG2-CD2 4.17Å; I30-F32 HydrophobicContact CG2-CE2 3.76Å; I30-F32 HydrophobicContact CG2-CZ 4.09Å; I30-F32 PolarHBondContact O-N 2.97Å; I30-F32 VanDerWaalsContact O-N 3.13Å
31	F	28.2	Very low	32.1	Very low	157 Å²	157	149.5 Å²	149.5	69%	0.689	75%	0.745	S	S	*	*			trans	-62.9	105.2	170.3	-72.6	-94.2	0	0	0	108.5	Q29 N33	Q29-F31 HydrophobicContact CB-CD2 4.5Å; Q29-F31 HydrophobicContact CB-CE2 4.17Å; F31-N33 PolarHBondContact O-N 3.02Å
32	F	30.1	Very low	31.5	Very low	169 Å²	169	148.5 Å²	148.5	74%	0.741	75%	0.749	S	S	*	*			trans	-85.4	92	161.7	-75.4	-82.6	0	0	0	107.7	I30 D34	I30-F32 HydrophobicContact CB-CE2 4.27Å; I30-F32 HydrophobicContact CG2-CD2 4.17Å; I30-F32 HydrophobicContact CG2-CE2 3.76Å; I30-F32 HydrophobicContact CG2-CZ 4.09Å; I30-F32 PolarHBondContact O-N 2.97Å; I30-F32 VanDerWaalsContact O-N 3.13Å; F32-D34 PolarHBondContact O-N 2.93Å
33	N	25	Very low	30.7	Very low	124 Å²	124	149.7 Å²	149.7	66%	0.663	75%	0.749	S	S	*	*			trans	-74.3	72.7	166.3	-82.5	-9.4	0	0	0	109.1	F31 H35	F31-N33 PolarHBondContact O-N 3.02Å; N33-H35 PolarHBondContact O-N 2.82Å
34	D	31.7	Very low	30.6	Very low	136 Å²	136	148.2 Å²	148.2	73%	0.727	76%	0.756	S	S	*	*			trans	-91.2	88.6	167.2	-81.7	-22.5	0	0	0	109.4	F32 K36	F32-D34 PolarHBondContact O-N 2.93Å; D34-K36 VanDerWaalsContact C-N 3.34Å; D34-K36 PolarHBondContact O-N 2.84Å
35	H	27.3	Very low	30	Very low	168 Å²	168	147.4 Å²	147.4	78%	0.778	76%	0.756	S	S	*	*			trans	-59.9	92.7	161.7	-69.1	-44.2	0	0	0	109.8	N33	N33-H35 PolarHBondContact O-N 2.82Å
36	K	34	Very low	29.5	Very low	183 Å²	183	147.2 Å²	147.2	80%	0.796	76%	0.755	S	S	*	*			trans	-120.7	101.2	158.2	-71.8	-166.4	179.5	-178.8	0	109.3	D34 Y38	D34-K36 VanDerWaalsContact C-N 3.34Å; D34-K36 PolarHBondContact O-N 2.84Å; K36-Y38 PolarHBondContact O-N 2.91Å
37	N	31.2	Very low	29	Very low	156 Å²	156	149.5 Å²	149.5	83%	0.834	75%	0.753	S	S	*	*			trans	-48.4	99.2	168.7	-70.3	-39.1	0	0	0	110.1	V39	N37-V39 PolarHBondContact O-N 3.37Å
38	Y	28.3	Very low	28.9	Very low	222 Å²	222	152.8 Å²	152.8	87%	0.871	76%	0.761	S	S	*	*			trans	-78.2	97.1	165.1	-108.9	-92.8	0	0	0	107.7	K36	K36-Y38 PolarHBondContact O-N 2.91Å
39	V	31.9	Very low	28.9	Very low	106 Å²	106	152.3 Å²	152.3	64%	0.642	76%	0.758	S	S	*	*			trans	-70.3	122.9	166.9	177.3	0	0	0	0	107.5	N37 H41	N37-V39 PolarHBondContact O-N 3.37Å; V39-H41 PolarHBondContact O-N 3.27Å; V39-H41 VanDerWaalsContact O-N 3.1Å
40	P	31.6	Very low	28.9	Very low	108 Å²	108	152.1 Å²	152.1	70%	0.701	76%	0.761	S	S	*	*			trans	-77.2	99.4	-175.5	29.7	-31.7	0	0	0	109.8	Q42	P40-Q42 VanDerWaalsContact C-N 3.32Å; P40-Q42 PolarHBondContact O-N 3.1Å
41	H	28.1	Very low	28.9	Very low	168 Å²	168	153.6 Å²	153.6	78%	0.778	77%	0.769	S	S	*	*			trans	-71.6	93.2	164.1	-85.8	-71.6	0	0	0	109	V39 N43	V39-H41 PolarHBondContact O-N 3.27Å; V39-H41 VanDerWaalsContact O-N 3.1Å; H41-N43 PolarHBondContact O-N 2.99Å
42	Q	27.6	Very low	28.8	Very low	175 Å²	175	150.8 Å²	150.8	82%	0.818	77%	0.767	S	S	*	*			trans	-62.6	96	162.6	-71.1	-177.8	-3.6	0	0	108.3	P40 P44	P40-Q42 VanDerWaalsContact C-N 3.32Å; P40-Q42 PolarHBondContact O-N 3.1Å; Q42-P44 VanDerWaalsContact O-CD 3.3Å; Q42-P44 WeakPolarHBondContact O-CD 3.38Å
43	N	26.3	Very low	28.6	Very low	145 Å²	145	152.2 Å²	152.2	78%	0.775	78%	0.776	S	S	*	*			trans	-79.3	114.8	163.4	-93.5	-22.7	0	0	0	108.3	H41 V45	H41-N43 PolarHBondContact O-N 2.99Å; N43-V45 PolarHBondContact O-N 2.97Å
44	P	31.9	Very low	28.7	Very low	108 Å²	108	150.7 Å²	150.7	70%	0.701	77%	0.774	S	S	*	*			trans	-67	120.6	178.5	26.4	-31.7	0	0	0	109.3	Q42 K46	Q42-P44 VanDerWaalsContact O-CD 3.3Å; Q42-P44 WeakPolarHBondContact O-CD 3.38Å; P44-K46 PolarHBondContact O-N 2.82Å
45	V	27.1	Very low	28.4	Very low	136 Å²	136	153.5 Å²	153.5	82%	0.824	78%	0.783	S	S	*	*			trans	-57.5	98.6	172.7	179.6	0	0	0	0	108.4	N43 K47	N43-V45 PolarHBondContact O-N 2.97Å; V45-K47 PolarHBondContact O-N 2.94Å
46	K	30.6	Very low	28.6	Very low	188 Å²	188	155.6 Å²	155.6	82%	0.817	79%	0.785	S	S	*	*			trans	-65.1	106.7	169.2	-78.9	-178.7	177.9	175.7	0	107.6	P44 V48	P44-K46 PolarHBondContact O-N 2.82Å; K46-V48 PolarHBondContact O-N 3.24Å
47	K	26.6	Very low	28.6	Very low	190 Å²	190	154.1 Å²	154.1	83%	0.826	79%	0.786	S	S	*	*			trans	-54.8	109.1	169.7	-79.1	177.2	174.6	177	0	108.6	V45 N49	V45-K47 PolarHBondContact O-N 2.94Å; K47-N49 PolarHBondContact O-N 3.24Å
48	V	26.3	Very low	28.4	Very low	130 Å²	130	156.1 Å²	156.1	79%	0.788	79%	0.79	S	S	*	*			trans	-72.8	109	169.6	178.2	0	0	0	0	106.9	K46 I50	K46-V48 PolarHBondContact O-N 3.24Å; V48-I50 PolarHBondContact O-N 3.12Å
49	N	28.8	Very low	28.6	Very low	137 Å²	137	154.1 Å²	154.1	73%	0.733	79%	0.786	S	S	*	*			trans	-65.8	115.9	172.3	-79.9	-23.8	0	0	0	108.7	K47 L51	K47-N49 PolarHBondContact O-N 3.24Å; N49-L51 PolarHBondContact O-N 2.98Å; N49-L51 VanDerWaalsContact O-N 3.12Å
50	I	26.1	Very low	28.5	Very low	168 Å²	168	155.1 Å²	155.1	86%	0.862	80%	0.795	S	S	*	*			trans	-74.9	96.2	170.8	-56.5	166.7	0	0	0	106.1	V48	V48-I50 PolarHBondContact O-N 3.12Å
51	L	27.6	Very low	28.3	Very low	151 Å²	151	157.6 Å²	157.6	79%	0.791	80%	0.801	S	S	*	*			trans	-80.8	142.5	172.1	-96.9	152.6	0	0	0	110	N49	N49-L51 PolarHBondContact O-N 2.98Å; N49-L51 VanDerWaalsContact O-N 3.12Å
52	P	27.3	Very low	28.3	Very low	98 Å²	98	157.5 Å²	157.5	64%	0.636	80%	0.8	S	S	*	*			trans	-74	132.2	-168.5	-11.3	26.9	0	0	0	113	C54	P52-C54 PolarHBondContact O-N 3Å; P52-C54 PolarHBondContact O-SG 3.39Å; P52-C54 VanDerWaalsContact O-SG 3.33Å
53	E	25.4	Very low	28.3	Very low	200 Å²	200	156.5 Å²	156.5	94%	0.935	80%	0.799	S	S	*	*			trans	8.5	78.5	141	-149.4	163.7	-149.7	0	0	115.6
54	C	26.9	Very low	28.5	Very low	92 Å²	92	156.6 Å²	156.6	62%	0.622	80%	0.798	S	S	*	*			trans	-90.1	116.5	168.8	-69.1	0	0	0	0	109.1	P52 Y56	P52-C54 PolarHBondContact O-N 3Å; P52-C54 PolarHBondContact O-SG 3.39Å; P52-C54 VanDerWaalsContact O-SG 3.33Å; C54-Y56 HydrophobicContact CB-CE2 4.25Å; C54-Y56 VanDerWaalsContact O-CD2 3.23Å; C54-Y56 WeakPolarHBondContact O-CD2 3.27Å; C54-Y56 PolarHBondContact O-N 3.24Å
55	Q	26.6	Very low	28.3	Very low	194 Å²	194	161 Å²	161	91%	0.907	81%	0.806	S	S	*	*			trans	-50.7	114.8	163.3	-94.8	165.6	-40.8	0	0	109.7
56	Y	30.7	Very low	28.4	Very low	213 Å²	213	156.9 Å²	156.9	84%	0.835	79%	0.791	S	S	*	*			trans	-96.7	108.8	169.9	-80.4	-84.2	0	0	0	109	C54	C54-Y56 HydrophobicContact CB-CE2 4.25Å; C54-Y56 VanDerWaalsContact O-CD2 3.23Å; C54-Y56 WeakPolarHBondContact O-CD2 3.27Å; C54-Y56 PolarHBondContact O-N 3.24Å
57	D	33.3	Very low	28.5	Very low	151 Å²	151	158.9 Å²	158.9	81%	0.807	80%	0.795	S	S	*	*			trans	-61.2	134.9	168.3	-78.3	-41.3	0	0	0	110.8	K59	D57-K59 PolarHBondContact O-N 3.26Å
58	E	28.2	Very low	28.6	Very low	199 Å²	199	156.8 Å²	156.8	93%	0.93	79%	0.793	S	S	*	*			trans	-58.9	93.7	173.8	-72.3	178	143	0	0	110.9
59	K	32.6	Very low	28.8	Very low	179 Å²	179	160.5 Å²	160.5	78%	0.778	80%	0.795	S	S	*	*			trans	-121.1	129.3	155.7	-73.2	-173.1	-178.5	178.2	0	109.8	D57 I61	D57-K59 PolarHBondContact O-N 3.26Å; K59-I61 PolarHBondContact O-N 3.02Å
60	P	28.7	Very low	29.3	Very low	128 Å²	128	161.5 Å²	161.5	83%	0.831	80%	0.8	S	S	*	*			trans	-65.4	117.9	-173.8	25.4	-32.3	0	0	0	110	E62	P60-E62 PolarHBondContact O-N 3Å
61	I	27.3	Very low	29.8	Very low	160 Å²	160	162.2 Å²	162.2	82%	0.821	80%	0.8	S	S	*	*			trans	-72.2	111.7	179.4	-61.7	171.2	0	0	0	108.1	K59 I63	K59-I61 PolarHBondContact O-N 3.02Å; I61-I63 PolarHBondContact O-N 2.88Å
62	E	28.3	Very low	30.5	Very low	165 Å²	165	163.5 Å²	163.5	77%	0.771	80%	0.801	S	S	*	*			trans	-59.9	131.1	167.3	-71.4	-177.8	161.8	0	0	109.7	P60 I64	P60-E62 PolarHBondContact O-N 3Å; E62-I64 VanDerWaalsContact C-N 3.32Å; E62-I64 PolarHBondContact O-N 2.99Å
63	I	27.8	Very low	31.1	Very low	154 Å²	154	167.9 Å²	167.9	79%	0.79	81%	0.813	S	S	*	*			trans	-73.2	85.8	-176.3	-59.1	160.8	0	0	0	108.3	I61 K65	I61-I63 PolarHBondContact O-N 2.88Å; I63-K65 HydrophobicContact CG2-CG 4.27Å; I63-K65 PolarHBondContact O-N 3.19Å
64	I	30.8	Very low	31.6	Very low	148 Å²	148	165.4 Å²	165.4	76%	0.759	81%	0.806	S	S	*	*			trans	-81.7	103.4	167.9	-57	178.5	0	0	0	107.4	E62 G66	E62-I64 VanDerWaalsContact C-N 3.32Å; E62-I64 PolarHBondContact O-N 2.99Å; I64-G66 PolarHBondContact O-N 2.91Å
65	K	28.3	Very low	32.3	Very low	200 Å²	200	167.9 Å²	167.9	87%	0.87	81%	0.814	S	S	*	*			trans	-70.4	107	169.2	-64.5	177.8	179.5	177.9	0	108.4	I63	I63-K65 HydrophobicContact CG2-CG 4.27Å; I63-K65 PolarHBondContact O-N 3.19Å
66	G	27.7	Very low	33.1	Very low	49 Å²	49	162.8 Å²	162.8	51%	0.505	80%	0.8	S	S	.	*			trans	-176.7	145.6	171.3	0	0	0	0	0	112.3	I64	I64-G66 PolarHBondContact O-N 2.91Å
67	Y	32.5	Very low	33.8	Very low	230 Å²	230	157.8 Å²	157.8	90%	0.902	79%	0.791	S	S	*	*			trans	79.3	85.2	178.6	-42.2	-66.3	0	0	0	113.1
68	N	30.1	Very low	34.3	Very low	147 Å²	147	156.3 Å²	156.3	79%	0.786	78%	0.783	S	S	*	*				67.6	112.6	72.8	-147	14	0	0	0	112.5	D70	N68-D70 PolarHBondContact O-N 3.05Å
69	Y	30.2	Very low	35.2	Very low	208 Å²	208	154.6 Å²	154.6	82%	0.816	78%	0.775	S	S	*	*			trans	-23.9	112.8	176.2	-77.5	-101.9	0	0	0	115.5
70	D	38.2	Very low	35.9	Very low	158 Å²	158	154.1 Å²	154.1	85%	0.845	78%	0.776	S	S	*	*			trans	-82.2	111.7	146.5	-72.8	-39.6	0	0	0	106.4	N68 E72	N68-D70 PolarHBondContact O-N 3.05Å; D70-E72 PolarHBondContact O-N 3.06Å
71	E	37.9	Very low	36.8	Very low	183 Å²	183	152.8 Å²	152.8	86%	0.855	76%	0.762	S	S	*	*			trans	-56.6	104.6	169.6	-65.5	-175	156	0	0	108.1	E73	E71-E73 PolarHBondContact O-N 2.87Å
72	E	41.8	Very low	37.9	Very low	177 Å²	177	151.7 Å²	151.7	83%	0.827	75%	0.753	S	S	*	*			trans	-63.6	107.1	164.4	-76.2	-166.2	169.2	0	0	107.1	D70 N74	D70-E72 PolarHBondContact O-N 3.06Å; E72-N74 PolarHBondContact O-N 2.88Å
73	E	39.7	Very low	39.1	Very low	191 Å²	191	149.7 Å²	149.7	89%	0.893	75%	0.748	S	S	*	*			trans	-43.3	108.5	171.7	-122.4	176.5	167.4	0	0	109.2	E71 D75	E71-E73 PolarHBondContact O-N 2.87Å; E73-D75 PolarHBondContact O-N 2.95Å
74	N	36.9	Very low	40.4	Very low	147 Å²	147	148.1 Å²	148.1	79%	0.786	74%	0.74	S	S	*	*			trans	-69.2	97.1	179.1	-75.8	-73	0	0	0	109.2	E72 S76	E72-N74 PolarHBondContact O-N 2.88Å; N74-S76 PolarHBondContact O-N 2.74Å; N74-S76 PolarHBondContact O-OG 3.32Å
75	D	40	Very low	41.6	Very low	145 Å²	145	148.4 Å²	148.4	78%	0.775	74%	0.736	S	S	*	*			trans	-68.1	63	165.6	-119.9	-3.4	0	0	0	109.7	E73 T77	E73-D75 PolarHBondContact O-N 2.95Å; D75-T77 VanDerWaalsContact C-N 3.29Å; D75-T77 PolarHBondContact O-N 2.74Å
76	S	43.7	Very low	43.5	Very low	87 Å²	87	142.3 Å²	142.3	61%	0.608	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	2.3	-173.1	52.3	0	0	0	0	113.5	N74	N74-S76 PolarHBondContact O-N 2.74Å; N74-S76 PolarHBondContact O-OG 3.32Å
77	T	45.1	Very low	45.5	Very low	107 Å²	107	142.1 Å²	142.1	66%	0.656	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-11.2	-175.6	39	0	0	0	0	114.7	D75	D75-T77 VanDerWaalsContact C-N 3.29Å; D75-T77 PolarHBondContact O-N 2.74Å
78	N	45	Very low	47.5	Very low	120 Å²	120	136.1 Å²	136.1	64%	0.642	69%	0.687	S	S	*	*	S	Bend	trans	-96.4	-12.8	-177.8	-88.6	-29	0	0	0	116.2
79	Q	46	Very low	49.8	Very low	164 Å²	164	132.8 Å²	132.8	77%	0.766	67%	0.668	S	S	*	*	H	α-helix	trans	-81.9	-27.2	-175.7	-93	171.3	-0.7	0	0	114.9	N81 E82	Q79-N81 VanDerWaalsContact C-N 3.3Å; Q79-N81 PolarHBondContact O-N 2.92Å; Q79-E82 PolarHBondContact O-N 3.05Å
80	Q	48	Very low	52.1	Low	168 Å²	168	129.9 Å²	129.9	79%	0.785	66%	0.656	S	S	*	*	H	α-helix	trans	-69.2	-27.4	179	-80.7	-172.2	-21.6	0	0	113.4
81	N	47.4	Very low	53.9	Low	100 Å²	100	129.8 Å²	129.8	54%	0.535	64%	0.644	S	S	.	*	H	α-helix	trans	-74.6	-31.1	-179.6	-75	-28.1	0	0	0	112.7	Q79 L84 F85	Q79-N81 VanDerWaalsContact C-N 3.3Å; Q79-N81 PolarHBondContact O-N 2.92Å; N81-L84 PolarHBondContact O-N 2.92Å; N81-F85 PolarHBondContact O-N 3.33Å
82	E	49.8	Very low	56.2	Low	138 Å²	138	127.2 Å²	127.2	65%	0.645	63%	0.632	S	S	*	*	H	α-helix	trans	-70.6	-37.9	179.3	-71	-138.6	172.5	0	0	112.8	Q79 L84 F85 N86	Q79-E82 PolarHBondContact O-N 3.05Å; E82-L84 VanDerWaalsContact C-N 3.31Å; E82-L84 PolarHBondContact O-N 3.02Å; E82-F85 PolarHBondContact O-N 2.98Å; E82-N86 WeakPolarHBondContact O-CB 3.07Å; E82-N86 PolarHBondContact O-N 2.92Å; E82-N86 PolarHBondContact O-ND2 3.44Å
83	D	53.8	Low	58.3	Low	123 Å²	123	124 Å²	124	66%	0.658	62%	0.616	S	S	*	*	H	α-helix	trans	-64.9	-37.2	176.4	-82.2	-15.8	0	0	0	111.5	N86 A87	D83-N86 PolarHBondContact O-N 2.72Å; D83-A87 PolarHBondContact O-N 3.01Å; D83-A87 VanDerWaalsContact O-N 3.1Å
84	L	55.8	Low	60.2	Low	120 Å²	120	121 Å²	121	63%	0.628	60%	0.599	S	S	*	*	H	α-helix	trans	-69.7	-42.4	176.6	-153.7	77.1	0	0	0	111.8	N81 E82 N86 A87 E88	N81-L84 PolarHBondContact O-N 2.92Å; E82-L84 VanDerWaalsContact C-N 3.31Å; E82-L84 PolarHBondContact O-N 3.02Å; L84-N86 VanDerWaalsContact C-N 3.29Å; L84-N86 PolarHBondContact O-N 3.04Å; L84-A87 PolarHBondContact O-N 3.04Å; L84-E88 PolarHBondContact O-N 2.8Å
85	F	56.9	Low	62.6	Low	155 Å²	155	115.1 Å²	115.1	68%	0.68	57%	0.574	S	S	*	*	H	α-helix	trans	-60.5	-39.2	174.3	-113.3	-86.4	0	0	0	111.9	N81 E82 E88 L89	N81-F85 PolarHBondContact O-N 3.33Å; E82-F85 PolarHBondContact O-N 2.98Å; F85-E88 PolarHBondContact O-N 3.03Å; F85-L89 PolarHBondContact O-N 3.18Å; F85-L89 VanDerWaalsContact O-N 3.1Å
86	N	67.8	Low	64.6	Low	72 Å²	72	110.4 Å²	110.4	39%	0.385	56%	0.555	S	S	.	*	H	α-helix	trans	-65.7	-40.9	176.4	-86.5	-41	0	0	0	112.1	E82 D83 L84 E88 L89 W90	E82-N86 WeakPolarHBondContact O-CB 3.07Å; E82-N86 PolarHBondContact O-N 2.92Å; E82-N86 PolarHBondContact O-ND2 3.44Å; D83-N86 PolarHBondContact O-N 2.72Å; L84-N86 VanDerWaalsContact C-N 3.29Å; L84-N86 PolarHBondContact O-N 3.04Å; N86-E88 VanDerWaalsContact C-N 3.33Å; N86-E88 PolarHBondContact O-N 3.23Å; N86-L89 PolarHBondContact O-N 3.45Å; N86-W90 PolarHBondContact O-N 2.81Å
87	A	68.2	Low	66.4	Low	44 Å²	44	111.2 Å²	111.2	36%	0.364	55%	0.552	S	S	.	*	H	α-helix	trans	-62.3	-40.1	178	0	0	0	0	0	112.2	D83 L84 W90 R91	D83-A87 PolarHBondContact O-N 3.01Å; D83-A87 VanDerWaalsContact O-N 3.1Å; L84-A87 PolarHBondContact O-N 3.04Å; A87-W90 PolarHBondContact O-N 2.99Å; A87-R91 WeakPolarHBondContact O-CG 3.43Å; A87-R91 PolarHBondContact O-N 3.3Å
88	E	75.8	Confident	68	Low	104 Å²	104	110 Å²	110	49%	0.486	54%	0.544	S	S	.	.	H	α-helix	trans	-63.5	-45.7	174.5	-93.6	176.1	-171	0	0	112.9	L84 F85 N86 W90 R91 E92	L84-E88 PolarHBondContact O-N 2.8Å; F85-E88 PolarHBondContact O-N 3.03Å; N86-E88 VanDerWaalsContact C-N 3.33Å; N86-E88 PolarHBondContact O-N 3.23Å; E88-W90 VanDerWaalsContact C-N 3.31Å; E88-W90 PolarHBondContact O-N 3.01Å; E88-R91 PolarHBondContact O-N 3.22Å; E88-R91 IonicContact OE1-NH2 3.38Å; E88-R91 PolarHBondContact OE1-NH2 3.14Å; E88-E92 PolarHBondContact O-N 3.22Å
89	L	77.7	Confident	70.1	Confident	77 Å²	77	111.8 Å²	111.8	40%	0.403	54%	0.542	S	S	.	.	H	α-helix	trans	-60.6	-41	177.3	-174.5	66	0	0	0	111.8	F85 N86 E92 K93	F85-L89 PolarHBondContact O-N 3.18Å; F85-L89 VanDerWaalsContact O-N 3.1Å; N86-L89 PolarHBondContact O-N 3.45Å; L89-E92 PolarHBondContact O-N 2.86Å; L89-K93 WeakPolarHBondContact O-CG 3.12Å; L89-K93 PolarHBondContact O-N 2.74Å
90	W	79	Confident	71.9	Confident	148 Å²	148	112.2 Å²	112.2	56%	0.561	54%	0.537	S	S	*	.	H	α-helix	trans	-66.7	-42.1	175.8	-79.3	111.4	0	0	0	112.3	N86 A87 E88 E92 K93 F94	N86-W90 PolarHBondContact O-N 2.81Å; A87-W90 PolarHBondContact O-N 2.99Å; E88-W90 VanDerWaalsContact C-N 3.31Å; E88-W90 PolarHBondContact O-N 3.01Å; W90-E92 VanDerWaalsContact C-N 3.31Å; W90-E92 PolarHBondContact O-N 3.11Å; W90-K93 PolarHBondContact O-N 2.76Å; W90-F94 HydrophobicContact CB-CD2 4.5Å; W90-F94 HydrophobicContact CE3-CD2 4.45Å; W90-F94 AromaticContact CE3-CE2 3.87Å; W90-F94 HydrophobicContact CE3-CE2 3.87Å; W90-F94 HydrophobicContact CE3-CZ 4.47Å; W90-F94 WeakPolarHBondContact O-CD2 3.22Å; W90-F94 PolarHBondContact O-N 2.86Å
91	R	76	Confident	73.5	Confident	155 Å²	155	112.5 Å²	112.5	59%	0.585	53%	0.531	S	S	*	.	H	α-helix	trans	-59.6	-41.6	174.2	-72.8	-165.4	-49.1	-96.7	11.9	111.8	A87 E88 G95	A87-R91 WeakPolarHBondContact O-CG 3.43Å; A87-R91 PolarHBondContact O-N 3.3Å; E88-R91 PolarHBondContact O-N 3.22Å; E88-R91 IonicContact OE1-NH2 3.38Å; E88-R91 PolarHBondContact OE1-NH2 3.14Å; R91-G95 PolarHBondContact O-N 2.83Å
92	E	85.3	Confident	75	Confident	130 Å²	130	115.6 Å²	115.6	61%	0.607	54%	0.535	S	S	*	.	H	α-helix	trans	-62.5	-45.8	176.3	-174.3	177.9	-164.4	0	0	111.6	E88 L89 W90 G95 A96	E88-E92 PolarHBondContact O-N 3.22Å; L89-E92 PolarHBondContact O-N 2.86Å; W90-E92 VanDerWaalsContact C-N 3.31Å; W90-E92 PolarHBondContact O-N 3.11Å; E92-G95 PolarHBondContact O-N 3.03Å; E92-A96 PolarHBondContact O-N 3.31Å
93	K	86.8	Confident	76.7	Confident	110 Å²	110	113.4 Å²	113.4	48%	0.478	52%	0.524	S	S	.	.	H	α-helix	trans	-62.9	-46.4	178.2	-73.7	-176.4	-179.6	-153.9	0	112.5	L89 W90 G95 A96 I97	L89-K93 WeakPolarHBondContact O-CG 3.12Å; L89-K93 PolarHBondContact O-N 2.74Å; W90-K93 PolarHBondContact O-N 2.76Å; K93-G95 VanDerWaalsContact C-N 3.34Å; K93-G95 PolarHBondContact O-N 3.04Å; K93-A96 PolarHBondContact O-N 3.29Å; K93-I97 WeakPolarHBondContact O-CG1 3.43Å; K93-I97 PolarHBondContact O-N 2.89Å; K93-I97 VanDerWaalsContact O-N 3.09Å
94	F	79.7	Confident	77.6	Confident	126 Å²	126	110 Å²	110	55%	0.553	51%	0.508	S	S	*	.	H	α-helix	trans	-62.9	-42.2	175.9	-79.7	-66.3	0	0	0	111.5	W90 A96 I97 T98	W90-F94 HydrophobicContact CB-CD2 4.5Å; W90-F94 HydrophobicContact CE3-CD2 4.45Å; W90-F94 AromaticContact CE3-CE2 3.87Å; W90-F94 HydrophobicContact CE3-CE2 3.87Å; W90-F94 HydrophobicContact CE3-CZ 4.47Å; W90-F94 WeakPolarHBondContact O-CD2 3.22Å; W90-F94 PolarHBondContact O-N 2.86Å; F94-A96 VanDerWaalsContact C-N 3.31Å; F94-A96 PolarHBondContact O-N 3.1Å; F94-I97 PolarHBondContact O-N 2.82Å; F94-T98 PolarHBondContact O-N 3.1Å; F94-T98 PolarHBondContact O-OG1 3.27Å; F94-T98 VanDerWaalsContact O-OG1 3.06Å
95	G	86.4	Confident	78.7	Confident	25 Å²	25	107.4 Å²	107.4	26%	0.258	50%	0.495	S	S	.	.	H	α-helix	trans	-61.5	-36.5	175	0	0	0	0	0	113.4	R91 E92 K93 R99	R91-G95 PolarHBondContact O-N 2.83Å; E92-G95 PolarHBondContact O-N 3.03Å; K93-G95 VanDerWaalsContact C-N 3.34Å; K93-G95 PolarHBondContact O-N 3.04Å; G95-R99 WeakPolarHBondContact O-CG 3Å; G95-R99 PolarHBondContact O-N 3.07Å
96	A	82.2	Confident	79.9	Confident	46 Å²	46	104.4 Å²	104.4	38%	0.38	49%	0.486	S	S	.	.	H	α-helix	trans	-64.9	-43.7	174.1	0	0	0	0	0	112.2	E92 K93 F94 R99 W100	E92-A96 PolarHBondContact O-N 3.31Å; K93-A96 PolarHBondContact O-N 3.29Å; F94-A96 VanDerWaalsContact C-N 3.31Å; F94-A96 PolarHBondContact O-N 3.1Å; A96-R99 PolarHBondContact O-N 3.18Å; A96-W100 WeakPolarHBondContact O-CB 2.98Å; A96-W100 PolarHBondContact O-N 2.85Å
97	I	82.3	Confident	80.1	Confident	103 Å²	103	103.6 Å²	103.6	53%	0.528	49%	0.489	S	S	.	.	H	α-helix	trans	-62.9	-44.2	177.2	-65.3	165.8	0	0	0	110.9	K93 F94 R99 W100 R101	K93-I97 WeakPolarHBondContact O-CG1 3.43Å; K93-I97 PolarHBondContact O-N 2.89Å; K93-I97 VanDerWaalsContact O-N 3.09Å; F94-I97 PolarHBondContact O-N 2.82Å; I97-R99 PolarHBondContact O-N 2.98Å; I97-W100 PolarHBondContact O-N 2.81Å; I97-R101 PolarHBondContact O-N 3.37Å
98	T	79.1	Confident	80.1	Confident	82 Å²	82	107 Å²	107	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-39.3	178	-50.9	0	0	0	0	112.2	F94 R102	F94-T98 PolarHBondContact O-N 3.1Å; F94-T98 PolarHBondContact O-OG1 3.27Å; F94-T98 VanDerWaalsContact O-OG1 3.06Å; T98-R102 PolarHBondContact O-N 2.98Å; T98-R102 VanDerWaalsContact O-N 3.12Å
99	R	88.1	Confident	79.8	Confident	157 Å²	157	107.2 Å²	107.2	59%	0.592	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-44.3	174.2	-76.5	-174.8	-67.9	-120.6	-0.5	111.9	G95 A96 I97 R101 R102 E103	G95-R99 WeakPolarHBondContact O-CG 3Å; G95-R99 PolarHBondContact O-N 3.07Å; A96-R99 PolarHBondContact O-N 3.18Å; I97-R99 PolarHBondContact O-N 2.98Å; R99-R101 PolarHBondContact O-N 2.98Å; R99-R102 PolarHBondContact O-N 3.25Å; R99-E103 WeakPolarHBondContact O-CB 3.4Å; R99-E103 PolarHBondContact O-N 3.36Å
100	W	84.2	Confident	79.3	Confident	174 Å²	174	106.3 Å²	106.3	66%	0.659	51%	0.507	S	S	*	.	H	α-helix	trans	-61.9	-43.8	178	-177.7	73.5	0	0	0	111.8	A96 I97 R102 E103 V104	A96-W100 WeakPolarHBondContact O-CB 2.98Å; A96-W100 PolarHBondContact O-N 2.85Å; I97-W100 PolarHBondContact O-N 2.81Å; W100-R102 PolarHBondContact O-N 3.25Å; W100-E103 PolarHBondContact O-N 3.08Å; W100-V104 HydrophobicContact CD2-CG2 4.05Å; W100-V104 HydrophobicContact CE3-CG2 4.46Å; W100-V104 HydrophobicContact CH2-CG2 4.29Å; W100-V104 HydrophobicContact CZ2-CG2 3.84Å; W100-V104 WeakPolarHBondContact O-CG2 3.42Å; W100-V104 PolarHBondContact O-N 3.19Å
101	R	82.3	Confident	77.9	Confident	174 Å²	174	101.7 Å²	101.7	66%	0.657	51%	0.505	S	S	*	.	H	α-helix	trans	-59.2	-47.4	175.7	-174.4	171.5	179.7	-174.6	0	111.8	I97 R99 E103 V104 D105	I97-R101 PolarHBondContact O-N 3.37Å; R99-R101 PolarHBondContact O-N 2.98Å; R101-E103 VanDerWaalsContact C-N 3.32Å; R101-E103 PolarHBondContact O-N 3.3Å; R101-V104 PolarHBondContact O-N 2.88Å; R101-D105 VanDerWaalsContact O-CG 3.24Å; R101-D105 PolarHBondContact O-N 3.41Å
102	R	77.5	Confident	76.7	Confident	164 Å²	164	102.2 Å²	102.2	62%	0.619	51%	0.514	S	S	*	.	H	α-helix	trans	-61	-41.3	176.7	-167	-176.6	-64.5	166.8	-1.4	111.9	T98 R99 W100 D105 D106	T98-R102 PolarHBondContact O-N 2.98Å; T98-R102 VanDerWaalsContact O-N 3.12Å; R99-R102 PolarHBondContact O-N 3.25Å; W100-R102 PolarHBondContact O-N 3.25Å; R102-D105 PolarHBondContact O-N 3.15Å; R102-D106 WeakPolarHBondContact O-CB 3.38Å; R102-D106 PolarHBondContact O-N 3.39Å
103	E	84.9	Confident	74.7	Confident	92 Å²	92	100.5 Å²	100.5	43%	0.43	51%	0.513	S	S	.	.	H	α-helix	trans	-67.6	-35.8	178.3	-173.6	171.4	-164	0	0	112.7	R9 R99 W100 R101 A107	R9-E103 IonicContact CZ-OE1 3.56Å; R9-E103 IonicContact NH1-OE1 2.66Å; R9-E103 PolarHBondContact NH1-OE1 3.19Å; R9-E103 IonicContact NH2-OE1 3.95Å; R99-E103 WeakPolarHBondContact O-CB 3.4Å; R99-E103 PolarHBondContact O-N 3.36Å; W100-E103 PolarHBondContact O-N 3.08Å; R101-E103 VanDerWaalsContact C-N 3.32Å; R101-E103 PolarHBondContact O-N 3.3Å; E103-A107 WeakPolarHBondContact O-CB 3.11Å; E103-A107 PolarHBondContact O-N 3.34Å
104	V	73.1	Confident	72.5	Confident	51 Å²	51	103.7 Å²	103.7	31%	0.309	53%	0.529	S	S	.	.	H	α-helix	trans	-66.1	-44.4	172.6	171	0	0	0	0	110.6	W100 R101 A107 M108	W100-V104 HydrophobicContact CD2-CG2 4.05Å; W100-V104 HydrophobicContact CE3-CG2 4.46Å; W100-V104 HydrophobicContact CH2-CG2 4.29Å; W100-V104 HydrophobicContact CZ2-CG2 3.84Å; W100-V104 WeakPolarHBondContact O-CG2 3.42Å; W100-V104 PolarHBondContact O-N 3.19Å; R101-V104 PolarHBondContact O-N 2.88Å; V104-A107 PolarHBondContact O-N 3.44Å; V104-M108 WeakPolarHBondContact O-CG 3.26Å; V104-M108 PolarHBondContact O-N 2.99Å
105	D	78.8	Confident	70.4	Confident	67 Å²	67	107.4 Å²	107.4	36%	0.358	54%	0.539	S	S	.	.	H	α-helix	trans	-62.7	-44.7	177.4	-65.7	-25.7	0	0	0	111	R101 R102 A107 M108 L109	R101-D105 VanDerWaalsContact O-CG 3.24Å; R101-D105 PolarHBondContact O-N 3.41Å; R102-D105 PolarHBondContact O-N 3.15Å; D105-A107 VanDerWaalsContact C-N 3.34Å; D105-A107 PolarHBondContact O-N 3.02Å; D105-M108 PolarHBondContact O-N 2.98Å; D105-L109 VanDerWaalsContact O-CG 3.32Å; D105-L109 WeakPolarHBondContact O-CG 3.28Å; D105-L109 PolarHBondContact O-N 3.01Å
106	D	82.5	Confident	68.1	Low	92 Å²	92	114.4 Å²	114.4	49%	0.492	57%	0.57	S	S	.	*	H	α-helix	trans	-62.9	-38.5	174.7	-70.6	-20.1	0	0	0	111.8	R102 L109 A110	R102-D106 WeakPolarHBondContact O-CB 3.38Å; R102-D106 PolarHBondContact O-N 3.39Å; D106-L109 PolarHBondContact O-N 3.16Å; D106-A110 VanDerWaalsContact O-CB 3.23Å; D106-A110 WeakPolarHBondContact O-CB 3.04Å; D106-A110 PolarHBondContact O-N 3.34Å
107	A	72.4	Confident	65.8	Low	54 Å²	54	119.8 Å²	119.8	45%	0.446	59%	0.587	S	S	.	*	H	α-helix	trans	-70.4	-34.9	177.1	0	0	0	0	0	112.5	E103 V104 D105 A110 G111	E103-A107 WeakPolarHBondContact O-CB 3.11Å; E103-A107 PolarHBondContact O-N 3.34Å; V104-A107 PolarHBondContact O-N 3.44Å; D105-A107 VanDerWaalsContact C-N 3.34Å; D105-A107 PolarHBondContact O-N 3.02Å; A107-A110 PolarHBondContact O-N 3.01Å; A107-G111 PolarHBondContact O-N 3.15Å
108	M	68.2	Low	63.3	Low	116 Å²	116	118.4 Å²	118.4	57%	0.571	59%	0.587	S	S	*	*	H	α-helix	trans	-66.3	-44	171.9	-72.2	-167.7	-48.5	0	0	110.7	V104 D105 A110 G111 E112	V104-M108 WeakPolarHBondContact O-CG 3.26Å; V104-M108 PolarHBondContact O-N 2.99Å; D105-M108 PolarHBondContact O-N 2.98Å; M108-A110 VanDerWaalsContact C-N 3.33Å; M108-A110 PolarHBondContact O-N 2.88Å; M108-G111 PolarHBondContact O-N 3.44Å; M108-E112 PolarHBondContact O-N 2.89Å
109	L	70.2	Confident	61.1	Low	108 Å²	108	120.3 Å²	120.3	57%	0.565	60%	0.6	S	S	*	*	H	α-helix	trans	-63.7	-37.6	175	-71.2	166.3	0	0	0	112.2	D105 D106 E112 T113	D105-L109 VanDerWaalsContact O-CG 3.32Å; D105-L109 WeakPolarHBondContact O-CG 3.28Å; D105-L109 PolarHBondContact O-N 3.01Å; D106-L109 PolarHBondContact O-N 3.16Å; L109-E112 PolarHBondContact O-N 3.28Å; L109-T113 PolarHBondContact O-N 3.21Å; L109-T113 PolarHBondContact O-OG1 2.84Å
110	A	65.4	Low	58.5	Low	59 Å²	59	121 Å²	121	49%	0.488	61%	0.61	S	S	.	*	H	α-helix	trans	-70.4	-36.2	174.6	0	0	0	0	0	112.4	D106 A107 M108 E112 T113	D106-A110 VanDerWaalsContact O-CB 3.23Å; D106-A110 WeakPolarHBondContact O-CB 3.04Å; D106-A110 PolarHBondContact O-N 3.34Å; A107-A110 PolarHBondContact O-N 3.01Å; M108-A110 VanDerWaalsContact C-N 3.33Å; M108-A110 PolarHBondContact O-N 2.88Å; A110-E112 VanDerWaalsContact C-N 3.29Å; A110-E112 PolarHBondContact O-N 2.93Å; A110-T113 WeakPolarHBondContact CA-OG1 3.38Å; A110-T113 CarbonylContact O-C 3.54Å; A110-T113 WeakPolarHBondContact O-CA 3.49Å; A110-T113 PolarHBondContact O-N 3.19Å; A110-T113 PolarHBondContact O-OG1 2.83Å; A110-T113 VanDerWaalsContact O-OG1 3.07Å
111	G	50.4	Low	56.1	Low	51 Å²	51	118.2 Å²	118.2	53%	0.526	61%	0.613	S	S	.	*	H	α-helix	trans	-65.8	-30.9	174.7	0	0	0	0	0	112.9	A107 M108 T113	A107-G111 PolarHBondContact O-N 3.15Å; M108-G111 PolarHBondContact O-N 3.44Å; G111-T113 PolarHBondContact O-N 3.15Å
112	E	50.6	Low	53.7	Low	165 Å²	165	117.5 Å²	117.5	77%	0.771	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-12.1	169.9	-72.1	-172.9	168.8	0	0	113.1	M108 L109 A110	M108-E112 PolarHBondContact O-N 2.89Å; L109-E112 PolarHBondContact O-N 3.28Å; A110-E112 VanDerWaalsContact C-N 3.29Å; A110-E112 PolarHBondContact O-N 2.93Å
113	T	43.5	Very low	51.4	Low	95 Å²	95	117.4 Å²	117.4	58%	0.583	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	38	174.7	24.4	0	0	0	0	113.2	L109 A110 G111 R115	L109-T113 PolarHBondContact O-N 3.21Å; L109-T113 PolarHBondContact O-OG1 2.84Å; A110-T113 WeakPolarHBondContact CA-OG1 3.38Å; A110-T113 CarbonylContact O-C 3.54Å; A110-T113 WeakPolarHBondContact O-CA 3.49Å; A110-T113 PolarHBondContact O-N 3.19Å; A110-T113 PolarHBondContact O-OG1 2.83Å; A110-T113 VanDerWaalsContact O-OG1 3.07Å; G111-T113 PolarHBondContact O-N 3.15Å; T113-R115 PolarHBondContact O-N 3.15Å
114	E	41.9	Very low	48.9	Very low	177 Å²	177	124 Å²	124	83%	0.827	65%	0.652	S	S	*	*			trans	-60	79.6	148	-80.6	-166.9	171.7	0	0	108.3	L116	E114-L116 VanDerWaalsContact C-N 3.3Å; E114-L116 PolarHBondContact O-N 3.19Å
115	R	35.1	Very low	46.9	Very low	203 Å²	203	128.8 Å²	128.8	77%	0.766	68%	0.676	S	S	*	*			trans	-52.9	103.9	159.3	-91.5	-176.8	171.5	173.7	-1.8	104.9	T113 H117	T113-R115 PolarHBondContact O-N 3.15Å; R115-H117 PolarHBondContact O-N 3.41Å
116	L	37	Very low	44.5	Very low	172 Å²	172	133.7 Å²	133.7	90%	0.901	70%	0.702	S	S	*	*			trans	-48.1	90.7	154.2	-76.8	158.6	0	0	0	107	E114 S118	E114-L116 VanDerWaalsContact C-N 3.3Å; E114-L116 PolarHBondContact O-N 3.19Å; L116-S118 PolarHBondContact O-N 2.91Å
117	H	34.6	Very low	41.7	Very low	160 Å²	160	134.5 Å²	134.5	74%	0.741	71%	0.714	S	S	*	*			trans	-66.2	89	159.9	-79.3	-66.6	0	0	0	105	R115	R115-H117 PolarHBondContact O-N 3.41Å
118	S	30.2	Very low	39.7	Very low	74 Å²	74	137.2 Å²	137.2	52%	0.517	73%	0.725	S	S	.	*			trans	-59.4	131.9	161.7	73.9	0	0	0	0	106.6	L116 E120	L116-S118 PolarHBondContact O-N 2.91Å; S118-E120 PolarHBondContact O-N 3.11Å
119	P	31.8	Very low	37.8	Very low	121 Å²	121	141.6 Å²	141.6	79%	0.786	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-70.2	14.7	-175.9	-18.7	31.2	0	0	0	115.4	T121	P119-T121 PolarHBondContact O-N 3.34Å
120	E	33.5	Very low	35.9	Very low	173 Å²	173	143.3 Å²	143.3	81%	0.808	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-88.5	4	-167.2	-84.6	-171.6	158.2	0	0	116	S118	S118-E120 PolarHBondContact O-N 3.11Å
121	T	34.6	Very low	34.1	Very low	115 Å²	115	149.2 Å²	149.2	71%	0.706	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-108.6	10.8	-178.8	47.4	0	0	0	0	116.4	P119 L123	P119-T121 PolarHBondContact O-N 3.34Å; T121-L123 PolarHBondContact O-N 3.5Å
122	I	32	Very low	33.1	Very low	158 Å²	158	155.1 Å²	155.1	81%	0.81	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-6.6	171.3	-60.4	178.2	0	0	0	112.3
123	L	29.8	Very low	31.8	Very low	163 Å²	163	152.6 Å²	152.6	85%	0.853	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	12.5	-174	-102.1	165.4	0	0	0	116.8	T121	T121-L123 PolarHBondContact O-N 3.5Å
124	R	30.7	Very low	31	Very low	229 Å²	229	159.2 Å²	159.2	86%	0.864	79%	0.789	S	S	*	*			trans	-140	45.1	176.7	-72.9	-155.4	178.9	175.2	2.8	115.9
125	D	31.5	Very low	30.5	Very low	153 Å²	153	155.5 Å²	155.5	82%	0.818	78%	0.783	S	S	*	*	S	Bend	trans	-103.7	3.6	164.5	-82.4	-14.4	0	0	0	114
126	N	28	Very low	30.1	Very low	169 Å²	169	151.7 Å²	151.7	90%	0.904	79%	0.785	S	S	*	*			trans	-115.6	63.7	174.6	-71.3	-14.8	0	0	0	111.2
127	C	24.9	Very low	29.8	Very low	110 Å²	110	150.2 Å²	150.2	74%	0.743	78%	0.776	S	S	*	*	S	Bend	trans	-149.3	99	161.4	-154.2	0	0	0	0	111.6
128	V	29.9	Very low	29.4	Very low	110 Å²	110	148.1 Å²	148.1	67%	0.667	78%	0.777	S	S	*	*			trans	62.4	107.9	143.5	-171.7	0	0	0	0	116.8	E130	V128-E130 HydrophobicContact CG1-CG 4.13Å; V128-E130 PolarHBondContact O-N 3.47Å
129	K	29.1	Very low	29.2	Very low	209 Å²	209	150.7 Å²	150.7	91%	0.909	79%	0.785	S	S	*	*			trans	-52.2	86.6	149.6	-69.8	174.2	175.3	178.6	0	109	E131	K129-E131 PolarHBondContact O-N 3.03Å
130	E	29.2	Very low	29.1	Very low	144 Å²	144	153.1 Å²	153.1	67%	0.673	79%	0.786	S	S	*	*			trans	-84.7	100.1	166	-112.8	178	-179.9	0	0	107.8	V128 F132	V128-E130 HydrophobicContact CG1-CG 4.13Å; V128-E130 PolarHBondContact O-N 3.47Å; E130-F132 HydrophobicContact CB-CD2 4.22Å; E130-F132 HydrophobicContact CB-CE2 4.45Å; E130-F132 HydrophobicContact CG-CE2 4.42Å; E130-F132 PolarHBondContact O-N 3.19Å
131	E	28	Very low	28.8	Very low	182 Å²	182	153.6 Å²	153.6	85%	0.85	79%	0.787	S	S	*	*			trans	-58.4	79.4	162.9	-75.8	176.5	132.6	0	0	109.6	K129 S133	K129-E131 PolarHBondContact O-N 3.03Å; E131-S133 PolarHBondContact O-N 3.15Å; E131-S133 PolarHBondContact O-OG 3.4Å
132	F	28.3	Very low	28.4	Very low	175 Å²	175	156.7 Å²	156.7	77%	0.768	79%	0.794	S	S	*	*			trans	-75.7	84.6	159.9	-92.4	-79.8	0	0	0	108.8	E130 R134	E130-F132 HydrophobicContact CB-CD2 4.22Å; E130-F132 HydrophobicContact CB-CE2 4.45Å; E130-F132 HydrophobicContact CG-CE2 4.42Å; E130-F132 PolarHBondContact O-N 3.19Å; F132-R134 PolarHBondContact O-N 3.1Å
133	S	25	Very low	28.4	Very low	112 Å²	112	153.6 Å²	153.6	78%	0.783	78%	0.782	S	S	*	*			trans	-55.1	81.6	159.2	35	0	0	0	0	109.6	E131	E131-S133 PolarHBondContact O-N 3.15Å; E131-S133 PolarHBondContact O-OG 3.4Å
134	R	27	Very low	28.4	Very low	234 Å²	234	151.9 Å²	151.9	88%	0.883	78%	0.779	S	S	*	*			trans	-101.5	103.2	164.8	-142.3	174.2	-156.7	-177.3	5.4	108.7	F132	F132-R134 PolarHBondContact O-N 3.1Å
135	S	29.6	Very low	28.4	Very low	99 Å²	99	147.4 Å²	147.4	69%	0.692	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-47.3	135.9	172.5	19.2	0	0	0	0	111.3	I137	S135-I137 PolarHBondContact O-N 3.01Å
136	P	28.4	Very low	28.2	Very low	124 Å²	124	150.7 Å²	150.7	81%	0.805	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-69.4	120.3	-177.2	26.3	-31.2	0	0	0	110	P138	P136-P138 WeakPolarHBondContact O-CD 3.49Å
137	I	28.8	Very low	28.2	Very low	140 Å²	140	150.7 Å²	150.7	72%	0.718	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-74.4	120.2	164.3	-63.2	173.1	0	0	0	106.6	S135 N139	S135-I137 PolarHBondContact O-N 3.01Å; I137-N139 PolarHBondContact O-N 3.35Å
138	P	27.2	Very low	28.2	Very low	117 Å²	117	154.3 Å²	154.3	76%	0.76	78%	0.777	S	S	*	*			trans	-80	105.1	178.6	31.3	-28.7	0	0	0	108	P136	P136-P138 WeakPolarHBondContact O-CD 3.49Å
139	N	26.3	Very low	28.1	Very low	128 Å²	128	154.7 Å²	154.7	68%	0.684	78%	0.782	S	S	*	*			trans	-131.4	101.4	167.6	-94.8	-30	0	0	0	110.3	I137	I137-N139 PolarHBondContact O-N 3.35Å
140	Q	29.4	Very low	28	Very low	171 Å²	171	150.5 Å²	150.5	80%	0.799	77%	0.774	S	S	*	*			trans	58.2	92.9	140.1	-51.7	-157.3	-6.4	0	0	115.9	E142	Q140-E142 VanDerWaalsContact C-N 3.33Å; Q140-E142 PolarHBondContact O-N 2.99Å
141	H	26.2	Very low	28	Very low	183 Å²	183	151.1 Å²	151.1	85%	0.847	78%	0.78	S	S	*	*			trans	-51.4	90.5	155.6	-78.6	-94.4	0	0	0	111.2	V143	H141-V143 VanDerWaalsContact C-N 3.29Å; H141-V143 HydrophobicContact CB-CG2 4.49Å; H141-V143 PolarHBondContact O-N 3.49Å
142	E	27.1	Very low	27.9	Very low	180 Å²	180	147.7 Å²	147.7	84%	0.841	77%	0.771	S	S	*	*			trans	-94.1	71.5	150	-82	-170.5	156.9	0	0	108	Q140 T144	Q140-E142 VanDerWaalsContact C-N 3.33Å; Q140-E142 PolarHBondContact O-N 2.99Å; E142-T144 PolarHBondContact O-N 3.22Å; E142-T144 VanDerWaalsContact O-N 3.14Å
143	V	31.3	Very low	27.8	Very low	94 Å²	94	147.3 Å²	147.3	57%	0.57	77%	0.772	S	S	*	*			trans	-72.7	104.2	161.9	-178.2	0	0	0	0	105.4	H141 N145	H141-V143 VanDerWaalsContact C-N 3.29Å; H141-V143 HydrophobicContact CB-CG2 4.49Å; H141-V143 PolarHBondContact O-N 3.49Å; V143-N145 PolarHBondContact O-N 2.99Å
144	T	30.4	Very low	27.8	Very low	126 Å²	126	147.9 Å²	147.9	77%	0.773	77%	0.77	S	S	*	*			trans	-58.9	90.7	167.5	6.2	0	0	0	0	107.3	E142 Y146	E142-T144 PolarHBondContact O-N 3.22Å; E142-T144 VanDerWaalsContact O-N 3.14Å; T144-Y146 PolarHBondContact O-N 2.84Å
145	N	30.7	Very low	27.6	Very low	135 Å²	135	142.7 Å²	142.7	72%	0.722	76%	0.76	S	S	*	*			trans	-63.9	106.3	174.7	-75.9	-42.3	0	0	0	107.6	V143 L147	V143-N145 PolarHBondContact O-N 2.99Å; N145-L147 PolarHBondContact O-N 3.32Å
146	Y	27.4	Very low	27.4	Very low	222 Å²	222	143.2 Å²	143.2	87%	0.871	76%	0.764	S	S	*	*			trans	-54.1	108.4	162.8	-76.3	-89.5	0	0	0	107.5	T144 K148	T144-Y146 PolarHBondContact O-N 2.84Å; Y146-K148 VanDerWaalsContact C-N 3.29Å; Y146-K148 PolarHBondContact O-N 3.22Å
147	L	27.1	Very low	27.3	Very low	169 Å²	169	147 Å²	147	89%	0.885	77%	0.768	S	S	*	*			trans	-61	95.7	172.2	-77.7	162.4	0	0	0	107.6	N145 P149	N145-L147 PolarHBondContact O-N 3.32Å; L147-P149 WeakPolarHBondContact O-CD 3.42Å
148	K	26.2	Very low	27	Very low	187 Å²	187	148.5 Å²	148.5	81%	0.813	77%	0.772	S	S	*	*			trans	-63.3	122.2	170.2	-153.5	175.1	-173.4	179.5	0	106.3	Y146 T150	Y146-K148 VanDerWaalsContact C-N 3.29Å; Y146-K148 PolarHBondContact O-N 3.22Å; K148-T150 PolarHBondContact O-N 2.97Å
149	P	26.9	Very low	26.9	Very low	118 Å²	118	147.5 Å²	147.5	77%	0.766	77%	0.768	S	S	*	*			trans	-61.2	109	-178.6	21	-29.7	0	0	0	109	L147 I151	L147-P149 WeakPolarHBondContact O-CD 3.42Å; P149-I151 PolarHBondContact O-N 2.93Å
150	T	28.6	Very low	26.9	Very low	121 Å²	121	148.7 Å²	148.7	74%	0.742	77%	0.774	S	S	*	*			trans	-66.8	113	171.6	-61	0	0	0	0	107.4	K148 V152	K148-T150 PolarHBondContact O-N 2.97Å; T150-V152 VanDerWaalsContact C-N 3.31Å; T150-V152 HydrophobicContact CG2-CG2 4.43Å; T150-V152 PolarHBondContact O-N 3.42Å
151	I	28.8	Very low	26.6	Very low	156 Å²	156	143.9 Å²	143.9	80%	0.8	77%	0.77	S	S	*	*			trans	-66	95.7	169.6	-61.3	168.4	0	0	0	106.1	P149 Q153	P149-I151 PolarHBondContact O-N 2.93Å; I151-Q153 PolarHBondContact O-N 3.08Å
152	V	25.7	Very low	26.6	Very low	111 Å²	111	142.6 Å²	142.6	67%	0.673	77%	0.769	S	S	*	*			trans	-71.7	101.8	172.1	180	0	0	0	0	106.5	T150 V154	T150-V152 VanDerWaalsContact C-N 3.31Å; T150-V152 HydrophobicContact CG2-CG2 4.43Å; T150-V152 PolarHBondContact O-N 3.42Å; V152-V154 VanDerWaalsContact C-N 3.28Å; V152-V154 HydrophobicContact CG1-CG2 4.06Å; V152-V154 PolarHBondContact O-N 3.25Å
153	Q	24.9	Very low	26.5	Very low	166 Å²	166	143.8 Å²	143.8	78%	0.776	77%	0.767	S	S	*	*			trans	-60.8	93	164.4	-80.4	179	-41.1	0	0	107.9	I151 N155	I151-Q153 PolarHBondContact O-N 3.08Å; Q153-N155 PolarHBondContact O-N 3.26Å; Q153-N155 VanDerWaalsContact O-N 3.16Å
154	V	25.2	Very low	26.2	Very low	124 Å²	124	144.7 Å²	144.7	75%	0.752	78%	0.777	S	S	*	*			trans	-75.9	105.1	164.3	179.4	0	0	0	0	106.2	V152 S156	V152-V154 VanDerWaalsContact C-N 3.28Å; V152-V154 HydrophobicContact CG1-CG2 4.06Å; V152-V154 PolarHBondContact O-N 3.25Å; V154-S156 PolarHBondContact O-N 2.97Å
155	N	24.6	Very low	25.9	Very low	126 Å²	126	143.3 Å²	143.3	67%	0.674	77%	0.773	S	S	*	*			trans	-48.3	132.8	173.8	-82	-30.6	0	0	0	110.9	Q153 F157	Q153-N155 PolarHBondContact O-N 3.26Å; Q153-N155 VanDerWaalsContact O-N 3.16Å; N155-F157 PolarHBondContact O-N 3.05Å
156	S	24.2	Very low	25.7	Very low	110 Å²	110	143.8 Å²	143.8	77%	0.769	78%	0.78	S	S	*	*			trans	-50.4	101.3	167.5	33.3	0	0	0	0	111.1	V154 Q158	V154-S156 PolarHBondContact O-N 2.97Å; S156-Q158 PolarHBondContact O-N 3Å; S156-Q158 VanDerWaalsContact O-N 3.08Å
157	F	25.7	Very low	25.6	Very low	202 Å²	202	139.4 Å²	139.4	89%	0.886	77%	0.772	S	S	*	*			trans	-70.5	100.6	159.4	-88.2	-84.8	0	0	0	108.2	N155	N155-F157 PolarHBondContact O-N 3.05Å
158	Q	24.2	Very low	25.5	Very low	172 Å²	172	138.9 Å²	138.9	80%	0.804	77%	0.77	S	S	*	*			trans	-58.9	133.2	154.8	-68.7	173.1	-14.7	0	0	108.4	S156	S156-Q158 PolarHBondContact O-N 3Å; S156-Q158 VanDerWaalsContact O-N 3.08Å
159	S	24.1	Very low	25.4	Very low	96 Å²	96	134 Å²	134	67%	0.671	77%	0.765	S	S	*	*				153.6	137.8	115.2	61.7	0	0	0	0	111.9
160	N	26.2	Very low	25.2	Very low	154 Å²	154	137 Å²	137	82%	0.824	77%	0.768	S	S	*	*			trans	76.6	85.2	147.3	-56.1	-13	0	0	0	117.4
161	G	23.3	Very low	25.1	Very low	69 Å²	69	137.1 Å²	137.1	71%	0.711	77%	0.77	S	S	*	*				68.8	102.4	103.4	0	0	0	0	0	115.8
162	L	25.7	Very low	25	Very low	157 Å²	157	136.3 Å²	136.3	82%	0.822	77%	0.767	S	S	*	*				175.3	141.2	125.5	-90	155.4	0	0	0	107.7
163	Y	25.6	Very low	24.9	Very low	205 Å²	205	141.5 Å²	141.5	80%	0.804	78%	0.776	S	S	*	*			trans	89.6	80.1	173.4	-59.5	-79.3	0	0	0	118.4
164	S	24.4	Very low	24.9	Very low	112 Å²	112	139 Å²	139	78%	0.783	78%	0.777	S	S	*	*				42.3	99.4	126	-59.5	0	0	0	0	119.5
165	S	25.3	Very low	24.8	Very low	97 Å²	97	139.9 Å²	139.9	68%	0.678	78%	0.783	S	S	*	*				29.7	104.2	126.8	-166.8	0	0	0	0	117.3	N167	S165-N167 VanDerWaalsContact C-N 3.3Å; S165-N167 PolarHBondContact O-N 2.93Å
166	V	25.5	Very low	24.8	Very low	146 Å²	146	139 Å²	139	89%	0.885	79%	0.786	S	S	*	*			trans	-64.1	89.5	158.2	-172.4	0	0	0	0	108.2
167	N	26.1	Very low	24.8	Very low	130 Å²	130	137.9 Å²	137.9	70%	0.695	78%	0.779	S	S	*	*			trans	-137.6	97.1	161.4	-88.2	-19.7	0	0	0	106.1	S165	S165-N167 VanDerWaalsContact C-N 3.3Å; S165-N167 PolarHBondContact O-N 2.93Å
168	N	24.7	Very low	25	Very low	157 Å²	157	134.3 Å²	134.3	84%	0.84	78%	0.775	S	S	*	*			trans	-171.7	99.3	155.9	-88	-24.9	0	0	0	105.9
169	A	23.2	Very low	25.1	Very low	86 Å²	86	134.6 Å²	134.6	71%	0.711	77%	0.774	S	S	*	*				80.6	113.8	85.5	0	0	0	0	0	110.4	T171	A169-T171 PolarHBondContact O-N 3.14Å
170	E	23.8	Very low	25.3	Very low	179 Å²	179	135.4 Å²	135.4	84%	0.836	78%	0.778	S	S	*	*			trans	-41.4	120.6	179.8	-66.3	163.4	149.5	0	0	112.2	N172	E170-N172 VanDerWaalsContact C-N 3.33Å; E170-N172 PolarHBondContact O-N 2.91Å
171	T	26.5	Very low	25.3	Very low	125 Å²	125	134.3 Å²	134.3	77%	0.767	78%	0.776	S	S	*	*			trans	-72	89.8	175.2	-33	0	0	0	0	108.8	A169 Y173	A169-T171 PolarHBondContact O-N 3.14Å; T171-Y173 PolarHBondContact O-N 2.93Å
172	N	26.5	Very low	25.5	Very low	139 Å²	139	138.6 Å²	138.6	74%	0.743	78%	0.782	S	S	*	*			trans	-63.7	117.5	168	-76.1	-52	0	0	0	109.3	E170 S174	E170-N172 VanDerWaalsContact C-N 3.33Å; E170-N172 PolarHBondContact O-N 2.91Å; N172-S174 PolarHBondContact O-N 3.04Å
173	Y	24.1	Very low	25.5	Very low	219 Å²	219	138.2 Å²	138.2	86%	0.859	78%	0.776	S	S	*	*			trans	-68	98.1	172.1	-70.4	-85	0	0	0	109.9	T171 T175	T171-Y173 PolarHBondContact O-N 2.93Å; Y173-T175 PolarHBondContact O-N 2.78Å
174	S	23.7	Very low	25.3	Very low	115 Å²	115	133.8 Å²	133.8	80%	0.804	78%	0.775	S	S	*	*			trans	-79.2	107.5	167	-103.9	0	0	0	0	110	N172 S176	N172-S174 PolarHBondContact O-N 3.04Å; S174-S176 PolarHBondContact O-N 2.74Å
175	T	23.6	Very low	25.3	Very low	142 Å²	142	137.8 Å²	137.8	87%	0.871	77%	0.774	S	S	*	*			trans	-84.6	80.2	170.1	35.7	0	0	0	0	109.4	Y173	Y173-T175 PolarHBondContact O-N 2.78Å
176	S	24.5	Very low	25.2	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	78%	0.778	S	S	*	*			trans	-107	101.8	166.6	69	0	0	0	0	109.6	S174	S174-S176 PolarHBondContact O-N 2.74Å
177	S	24.3	Very low	25.2	Very low	87 Å²	87	140.6 Å²	140.6	61%	0.608	78%	0.775	S	S	*	*			trans	-86.9	135.2	162.9	99.9	0	0	0	0	108.7	F179	S177-F179 PolarHBondContact O-N 3.08Å
178	P	28.9	Very low	25.1	Very low	126 Å²	126	141.4 Å²	141.4	82%	0.818	78%	0.779	S	S	*	*			trans	-85.3	103	-175.1	31.7	-30.6	0	0	0	110.1
179	F	26.5	Very low	25.2	Very low	178 Å²	178	143.5 Å²	143.5	78%	0.781	78%	0.781	S	S	*	*			trans	-96.1	127.7	158.8	-80.1	-77.2	0	0	0	109.2	S177 T181	S177-F179 PolarHBondContact O-N 3.08Å; F179-T181 PolarHBondContact O-N 3.48Å
180	P	30	Very low	25.3	Very low	114 Å²	114	145.1 Å²	145.1	74%	0.74	78%	0.784	S	S	*	*			trans	-67.8	118.8	177.4	25.2	-30.4	0	0	0	110.2	I182	P180-I182 PolarHBondContact O-N 2.98Å
181	T	25.6	Very low	25.1	Very low	130 Å²	130	144.9 Å²	144.9	80%	0.798	79%	0.788	S	S	*	*			trans	-58.4	103.1	172.4	-52.6	0	0	0	0	109.9	F179 Q183	F179-T181 PolarHBondContact O-N 3.48Å; T181-Q183 PolarHBondContact O-N 3.16Å
182	I	26.2	Very low	25.1	Very low	160 Å²	160	145.3 Å²	145.3	82%	0.821	79%	0.79	S	S	*	*			trans	-71	109.5	168.9	-63.9	173.6	0	0	0	106.8	P180 S184	P180-I182 PolarHBondContact O-N 2.98Å; I182-S184 PolarHBondContact O-N 2.95Å
183	Q	25.9	Very low	24.9	Very low	149 Å²	149	143.8 Å²	143.8	70%	0.696	79%	0.79	S	S	*	*			trans	-60.8	121.3	176	-70.7	179.8	-8.6	0	0	110	T181 Y185	T181-Q183 PolarHBondContact O-N 3.16Å; Q183-Y185 PolarHBondContact O-N 2.82Å; Q183-Y185 VanDerWaalsContact O-N 3.08Å
184	S	23.2	Very low	25	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	79%	0.785	S	S	*	*			trans	-65.8	97.6	172.2	33.1	0	0	0	0	110.1	I182 T186	I182-S184 PolarHBondContact O-N 2.95Å; S184-T186 PolarHBondContact O-N 2.87Å; S184-T186 VanDerWaalsContact O-N 3.16Å
185	Y	23.3	Very low	25.1	Very low	196 Å²	196	140.5 Å²	140.5	77%	0.769	79%	0.787	S	S	*	*			trans	-70.9	105.9	164.1	-89.5	-91.1	0	0	0	109.2	Q183 H187	Q183-Y185 PolarHBondContact O-N 2.82Å; Q183-Y185 VanDerWaalsContact O-N 3.08Å; Y185-H187 PolarHBondContact O-N 2.83Å
186	T	23.9	Very low	25.1	Very low	125 Å²	125	142.2 Å²	142.2	77%	0.767	79%	0.785	S	S	*	*			trans	-65.5	89.3	166.1	43.9	0	0	0	0	109.5	S184	S184-T186 PolarHBondContact O-N 2.87Å; S184-T186 VanDerWaalsContact O-N 3.16Å
187	H	24.2	Very low	25.2	Very low	177 Å²	177	142 Å²	142	82%	0.819	79%	0.79	S	S	*	*			trans	-89.1	108	166.7	-112.5	-40.8	0	0	0	110	Y185 K189	Y185-H187 PolarHBondContact O-N 2.83Å; H187-K189 PolarHBondContact O-N 2.94Å
188	N	24.5	Very low	25.2	Very low	147 Å²	147	146 Å²	146	79%	0.786	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-54.5	126.5	174.7	-69.1	-34	0	0	0	111.1
189	K	26.8	Very low	24.9	Very low	201 Å²	201	142.9 Å²	142.9	87%	0.874	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-66.1	132.9	173.8	-74	177.6	176.2	176.9	0	110.4	H187 L191	H187-K189 PolarHBondContact O-N 2.94Å; K189-L191 PolarHBondContact O-N 2.97Å
190	P	25.1	Very low	24.9	Very low	119 Å²	119	140.8 Å²	140.8	77%	0.773	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71.8	118.9	163.9	-10.6	26.6	0	0	0	109.5	V192	P190-V192 PolarHBondContact O-N 3.08Å
191	L	20.8	Very low	24.5	Very low	175 Å²	175	145.3 Å²	145.3	92%	0.916	80%	0.804	S	S	*	*			trans	-74.1	100.8	169.5	-167.5	80.9	0	0	0	107.9	K189	K189-L191 PolarHBondContact O-N 2.97Å
192	V	25	Very low	24.5	Very low	133 Å²	133	146.9 Å²	146.9	81%	0.806	80%	0.802	S	S	*	*			trans	-117.7	102.5	166.9	-178.1	0	0	0	0	108.9	P190 G194	P190-V192 PolarHBondContact O-N 3.08Å; V192-G194 PolarHBondContact O-N 3.02Å
193	S	22.9	Very low	24.1	Very low	107 Å²	107	147.6 Å²	147.6	75%	0.748	80%	0.801	S	S	*	*			trans	-59.9	111.1	168.4	150.5	0	0	0	0	110.3
194	G	26	Very low	24.1	Very low	74 Å²	74	147.3 Å²	147.3	76%	0.763	80%	0.803	S	S	*	*			trans	-112.6	120.4	167.4	0	0	0	0	0	109.6	V192	V192-G194 PolarHBondContact O-N 3.02Å
195	K	25.7	Very low	24.1	Very low	192 Å²	192	147.6 Å²	147.6	84%	0.835	80%	0.795	S	S	*	*			trans	-67.3	151.8	-167.8	-69.8	177.2	172.8	-179.6	0	114.7
196	E	23.3	Very low	23.9	Very low	177 Å²	177	147.8 Å²	147.8	83%	0.827	80%	0.796	S	S	*	*			trans	-21.8	131.2	157.1	-64.9	165.4	145.8	0	0	116.5
197	A	27.5	Very low	23.9	Very low	104 Å²	104	146.3 Å²	146.3	86%	0.86	79%	0.791	S	S	*	*			trans	-143.7	100.1	146.8	0	0	0	0	0	108.4
198	I	23.6	Very low	23.7	Very low	169 Å²	169	142.8 Å²	142.8	87%	0.867	79%	0.786	S	S	*	*			trans	-76.9	127	168.7	-63.2	165.8	0	0	0	106.8
199	G	23.4	Very low	23.8	Very low	62 Å²	62	142.1 Å²	142.1	64%	0.639	78%	0.783	S	S	*	*			trans	-178.4	85.3	178.5	0	0	0	0	0	116.1
200	T	25.5	Very low	23.7	Very low	133 Å²	133	140 Å²	140	82%	0.816	78%	0.781	S	S	*	*			trans	62.8	109.9	144.7	28.4	0	0	0	0	120.8	Q202	T200-Q202 PolarHBondContact O-N 2.74Å
201	K	21.5	Very low	23.8	Very low	210 Å²	210	142.7 Å²	142.7	91%	0.913	79%	0.785	S	S	*	*			trans	-43	118.7	150.7	-66.7	170.5	175.9	176.1	0	111.1
202	Q	25.3	Very low	24	Very low	163 Å²	163	143.5 Å²	143.5	76%	0.762	78%	0.781	S	S	*	*			trans	-123.1	116.3	155.6	-71.8	-164.1	7.5	0	0	109.3	T200	T200-Q202 PolarHBondContact O-N 2.74Å
203	H	19.5	Very low	24	Very low	174 Å²	174	142.9 Å²	142.9	81%	0.806	78%	0.78	S	S	*	*			trans	-88	101.8	176.5	-161.8	-96.4	0	0	0	105.9
204	I	26.3	Very low	24.2	Very low	144 Å²	144	145.2 Å²	145.2	74%	0.738	78%	0.784	S	S	*	*			trans	-119.2	105.3	174.3	-58.1	179.8	0	0	0	108
205	L	21.6	Very low	24	Very low	118 Å²	118	147.7 Å²	147.7	62%	0.618	78%	0.784	S	S	*	*			trans	-87.6	138.7	170.8	-127	79	0	0	0	108.4
206	Y	19.2	Very low	23.9	Very low	199 Å²	199	144.5 Å²	144.5	78%	0.78	79%	0.785	S	S	*	*			trans	61.9	116.3	162.4	-70.7	-86.6	0	0	0	120.1
207	S	23.5	Very low	23.8	Very low	95 Å²	95	143.9 Å²	143.9	66%	0.664	78%	0.782	S	S	*	*				-153.8	115.2	123.7	-162.4	0	0	0	0	110.9	N209	S207-N209 PolarHBondContact O-N 3.3Å; S207-N209 PolarHBondContact OG-OD1 3.45Å
208	S	21.6	Very low	23.5	Very low	103 Å²	103	145.4 Å²	145.4	72%	0.72	78%	0.775	S	S	*	*			trans	-78.3	88.5	169.8	-60.1	0	0	0	0	109	N210	S208-N210 PolarHBondContact O-N 3.42Å
209	N	26.4	Very low	23.6	Very low	133 Å²	133	143.6 Å²	143.6	71%	0.711	77%	0.773	S	S	*	*			trans	-85.8	103.6	174	-72.3	-8.1	0	0	0	110	S207 M211	S207-N209 PolarHBondContact O-N 3.3Å; S207-N209 PolarHBondContact OG-OD1 3.45Å; N209-M211 PolarHBondContact O-N 2.93Å
210	N	24	Very low	23.5	Very low	155 Å²	155	146 Å²	146	83%	0.829	78%	0.776	S	S	*	*			trans	-50.6	109.7	159	-73.9	-56.3	0	0	0	110.2	S208	S208-N210 PolarHBondContact O-N 3.42Å
211	M	27.1	Very low	23.6	Very low	176 Å²	176	146.1 Å²	146.1	87%	0.867	78%	0.777	S	S	*	*			trans	-125.1	114.8	162.1	-83.6	-75.7	128.6	0	0	108.1	N209	N209-M211 PolarHBondContact O-N 2.93Å
212	K	24.2	Very low	23.9	Very low	192 Å²	192	145.9 Å²	145.9	84%	0.835	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-55.8	150.8	180	-92.4	172.6	170.8	174.7	0	111.5	N214	K212-N214 PolarHBondContact O-N 3.1Å
213	P	26.5	Very low	24	Very low	120 Å²	120	145.5 Å²	145.5	78%	0.779	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-65.4	119	179.8	26.4	-33.1	0	0	0	110.7	T215	P213-T215 PolarHBondContact O-N 3.39Å
214	N	26.6	Very low	24.4	Very low	156 Å²	156	145.6 Å²	145.6	83%	0.834	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-70.1	116.2	168.7	-80	-27	0	0	0	109.3	K212 C216	K212-N214 PolarHBondContact O-N 3.1Å; N214-C216 PolarHBondContact O-N 3.46Å
215	T	21.6	Very low	24.4	Very low	126 Å²	126	145.2 Å²	145.2	77%	0.773	78%	0.781	S	S	*	*			trans	-56.8	97.3	166.4	-55.4	0	0	0	0	110	P213 Q217	P213-T215 PolarHBondContact O-N 3.39Å; T215-Q217 HydrophobicContact CG2-CG 4.33Å
216	C	23	Very low	24.9	Very low	125 Å²	125	145.3 Å²	145.3	85%	0.845	79%	0.786	S	S	*	*			trans	-89.4	111	165.4	-82.7	0	0	0	0	109.2	N214	N214-C216 PolarHBondContact O-N 3.46Å
217	Q	21.5	Very low	25.3	Very low	164 Å²	164	145.1 Å²	145.1	77%	0.766	79%	0.786	S	S	*	*			trans	-75.9	131.9	172.8	-68.1	178.4	-5	0	0	110.8	T215	T215-Q217 HydrophobicContact CG2-CG 4.33Å
218	I	21.8	Very low	25.4	Very low	137 Å²	137	147.9 Å²	147.9	70%	0.703	79%	0.793	S	S	*	*			trans	32.4	121.2	139.1	-48.3	171.8	0	0	0	117.9	T220	I218-T220 HydrophobicContact CG2-CG2 3.95Å; I218-T220 VanDerWaalsContact CG2-N 3.26Å
219	P	24.6	Very low	25.8	Very low	130 Å²	130	149.1 Å²	149.1	84%	0.844	79%	0.792	S	S	*	*				-122.1	107.7	124.7	15.6	2.7	0	0	0	110.3
220	T	23	Very low	25.9	Very low	113 Å²	113	149.2 Å²	149.2	69%	0.693	80%	0.797	S	S	*	*			trans	-59	137	157.6	32.6	0	0	0	0	110.1	I218	I218-T220 HydrophobicContact CG2-CG2 3.95Å; I218-T220 VanDerWaalsContact CG2-N 3.26Å
221	T	26.2	Very low	26.1	Very low	135 Å²	135	147.6 Å²	147.6	83%	0.828	79%	0.792	S	S	*	*			trans	128.8	101.1	153.2	57.3	0	0	0	0	112.9
222	K	29.3	Very low	26.2	Very low	205 Å²	205	143.8 Å²	143.8	89%	0.891	78%	0.781	S	S	*	*				-170.6	113.4	129.4	-104.8	166.1	-175.2	-179.5	0	109.7	M224	K222-M224 PolarHBondContact O-N 3.19Å
223	N	26.5	Very low	26.3	Very low	156 Å²	156	143.2 Å²	143.2	83%	0.834	78%	0.778	S	S	*	*			trans	-42.6	115.9	165.7	-70.9	-42.8	0	0	0	110.7
224	M	27.7	Very low	26.4	Very low	175 Å²	175	142.5 Å²	142.5	86%	0.862	78%	0.775	S	S	*	*			trans	-120.3	103.9	150.8	-80.5	-143.6	129.1	0	0	107.3	K222 V226	K222-M224 PolarHBondContact O-N 3.19Å; M224-V226 PolarHBondContact O-N 3.24Å
225	N	27.7	Very low	26.3	Very low	136 Å²	136	145.1 Å²	145.1	73%	0.727	77%	0.774	S	S	*	*			trans	-55	98	170	-72.5	-21.9	0	0	0	108.7	Y227	N225-Y227 PolarHBondContact O-N 3.34Å
226	V	30.2	Very low	26.5	Very low	120 Å²	120	147 Å²	147	73%	0.727	77%	0.774	S	S	*	*			trans	-78.6	111.7	162	179.5	0	0	0	0	105.5	M224 D228	M224-V226 PolarHBondContact O-N 3.24Å; V226-D228 VanDerWaalsContact C-N 3.33Å; V226-D228 PolarHBondContact O-N 3.27Å
227	Y	27.6	Very low	26.7	Very low	195 Å²	195	146.1 Å²	146.1	77%	0.765	77%	0.768	S	S	*	*			trans	-62.3	92.9	174.4	-87.8	-97.9	0	0	0	109.5	N225 N229	N225-Y227 PolarHBondContact O-N 3.34Å; Y227-N229 PolarHBondContact O-N 2.74Å
228	D	26.5	Very low	26.9	Very low	154 Å²	154	143.4 Å²	143.4	82%	0.824	76%	0.762	S	S	*	*			trans	-70.2	77.4	163.7	-89.8	-27.9	0	0	0	109.4	V226	V226-D228 VanDerWaalsContact C-N 3.33Å; V226-D228 PolarHBondContact O-N 3.27Å
229	N	29.2	Very low	27.1	Very low	129 Å²	129	144 Å²	144	69%	0.69	77%	0.766	S	S	*	*			trans	-117.9	56.1	169.4	-82.9	-21.3	0	0	0	110.1	Y227	Y227-N229 PolarHBondContact O-N 2.74Å
230	V	28.7	Very low	27.3	Very low	135 Å²	135	145 Å²	145	82%	0.818	76%	0.76	S	S	*	*			trans	-129.8	82.5	157.9	-171.9	0	0	0	0	106.9	P232	V230-P232 WeakPolarHBondContact O-CD 3.39Å
231	V	27.9	Very low	27.5	Very low	121 Å²	121	143.9 Å²	143.9	73%	0.733	76%	0.762	S	S	*	*			trans	-53.1	113.8	169.2	176.2	0	0	0	0	106.9	K233	V231-K233 PolarHBondContact O-N 3.32Å
232	P	29.1	Very low	27.4	Very low	96 Å²	96	143.6 Å²	143.6	62%	0.623	76%	0.759	S	S	*	*			trans	-61.3	117.9	173.5	23.1	-27.8	0	0	0	106.1	V230 C234	V230-P232 WeakPolarHBondContact O-CD 3.39Å; P232-C234 PolarHBondContact O-N 2.72Å
233	K	27.8	Very low	27.4	Very low	180 Å²	180	139.2 Å²	139.2	78%	0.783	75%	0.752	S	S	*	*			trans	-65	84.1	166.7	-77.4	-175.8	178.2	179.6	0	106.7	V231 Y235	V231-K233 PolarHBondContact O-N 3.32Å; K233-Y235 PolarHBondContact O-N 3.28Å
234	C	27.2	Very low	27.4	Very low	105 Å²	105	137.1 Å²	137.1	71%	0.709	75%	0.75	S	S	*	*			trans	-58.7	98.1	161.9	-68.9	0	0	0	0	105.5	P232 Q236	P232-C234 PolarHBondContact O-N 2.72Å; C234-Q236 PolarHBondContact O-N 3.47Å
235	Y	25.7	Very low	27.4	Very low	210 Å²	210	137.9 Å²	137.9	82%	0.824	75%	0.748	S	S	*	*			trans	-60.3	92.7	158.6	-77.3	-88.6	0	0	0	105.5	K233 P237	K233-Y235 PolarHBondContact O-N 3.28Å; Y235-P237 VanDerWaalsContact O-CD 3.23Å; Y235-P237 WeakPolarHBondContact O-CD 3.5Å
236	Q	25.6	Very low	27.3	Very low	165 Å²	165	137.7 Å²	137.7	77%	0.771	75%	0.752	S	S	*	*			trans	-60	118.2	162.3	-82.9	-175.4	-26.5	0	0	105.3	C234 T238	C234-Q236 PolarHBondContact O-N 3.47Å; Q236-T238 VanDerWaalsContact C-N 3.33Å; Q236-T238 PolarHBondContact O-N 2.9Å
237	P	26.7	Very low	27.2	Very low	108 Å²	108	137.2 Å²	137.2	70%	0.701	75%	0.749	S	S	*	*			trans	-60.5	106.7	168.7	24	-29	0	0	0	105.4	Y235 N239	Y235-P237 VanDerWaalsContact O-CD 3.23Å; Y235-P237 WeakPolarHBondContact O-CD 3.5Å; P237-N239 PolarHBondContact O-N 3.23Å
238	T	26.6	Very low	27.1	Very low	106 Å²	106	134.8 Å²	134.8	65%	0.65	75%	0.748	S	S	*	*			trans	-64.9	98.3	173.5	-36.9	0	0	0	0	105.5	Q236 H240	Q236-T238 VanDerWaalsContact C-N 3.33Å; Q236-T238 PolarHBondContact O-N 2.9Å; T238-H240 VanDerWaalsContact CG2-CD2 3.43Å; T238-H240 WeakPolarHBondContact CG2-CD2 3.14Å; T238-H240 WeakPolarHBondContact CG2-NE2 3.35Å; T238-H240 PolarHBondContact O-N 2.81Å
239	N	25.9	Very low	27.1	Very low	149 Å²	149	133.4 Å²	133.4	80%	0.797	74%	0.74	S	S	*	*			trans	-62.6	70.8	164.3	-76.2	-24.6	0	0	0	107.3	P237 A241	P237-N239 PolarHBondContact O-N 3.23Å; N239-A241 PolarHBondContact O-N 2.83Å
240	H	27.8	Very low	27	Very low	153 Å²	153	133.3 Å²	133.3	71%	0.708	75%	0.749	S	S	*	*			trans	-71.4	89.2	154.5	-73.4	-58.8	0	0	0	105.1	T238 V242	T238-H240 VanDerWaalsContact CG2-CD2 3.43Å; T238-H240 WeakPolarHBondContact CG2-CD2 3.14Å; T238-H240 WeakPolarHBondContact CG2-NE2 3.35Å; T238-H240 PolarHBondContact O-N 2.81Å; H240-V242 VanDerWaalsContact C-N 3.3Å; H240-V242 PolarHBondContact O-N 2.83Å
241	A	27.8	Very low	27.1	Very low	88 Å²	88	131 Å²	131	73%	0.727	74%	0.74	S	S	*	*			trans	-47.9	103.9	160	0	0	0	0	0	106.5	N239	N239-A241 PolarHBondContact O-N 2.83Å
242	V	24.3	Very low	27	Very low	129 Å²	129	129.3 Å²	129.3	78%	0.782	75%	0.746	S	S	*	*			trans	-56.2	124	168.2	178	0	0	0	0	105.4	H240 S244	H240-V242 VanDerWaalsContact C-N 3.3Å; H240-V242 PolarHBondContact O-N 2.83Å; V242-S244 PolarHBondContact O-N 2.77Å
243	P	29.5	Very low	27.1	Very low	114 Å²	114	130 Å²	130	74%	0.74	75%	0.749	S	S	*	*			trans	-52.5	112.4	-173.2	-25.7	32.3	0	0	0	110.4	K245	P243-K245 PolarHBondContact O-N 3.16Å; P243-K245 VanDerWaalsContact O-N 3.16Å
244	S	26.5	Very low	27.2	Very low	112 Å²	112	125.4 Å²	125.4	78%	0.783	74%	0.744	S	S	*	*			trans	-54.4	118.1	170.4	32.1	0	0	0	0	108.7	V242	V242-S244 PolarHBondContact O-N 2.77Å
245	K	27	Very low	27.3	Very low	190 Å²	190	127.2 Å²	127.2	83%	0.826	75%	0.747	S	S	*	*			trans	30	100.8	162.7	-67.5	-177.1	177.8	-176.9	0	114.1	P243 V247	P243-K245 PolarHBondContact O-N 3.16Å; P243-K245 VanDerWaalsContact O-N 3.16Å; K245-V247 VanDerWaalsContact C-N 3.31Å; K245-V247 PolarHBondContact O-N 3.49Å
246	V	25.7	Very low	27.5	Very low	132 Å²	132	124.2 Å²	124.2	80%	0.8	75%	0.745	S	S	*	*			trans	-54.8	103.4	157.3	176.4	0	0	0	0	107	I248	V246-I248 PolarHBondContact O-N 3.01Å; V246-I248 VanDerWaalsContact O-N 3.11Å
247	V	27.8	Very low	27.8	Very low	110 Å²	110	123.1 Å²	123.1	67%	0.667	74%	0.74	S	S	*	*			trans	-68.1	104.5	168.3	176.9	0	0	0	0	104.9	K245 N249	K245-V247 VanDerWaalsContact C-N 3.31Å; K245-V247 PolarHBondContact O-N 3.49Å; V247-N249 PolarHBondContact O-N 2.96Å
248	I	26.3	Very low	27.9	Very low	145 Å²	145	124 Å²	124	74%	0.744	74%	0.743	S	S	*	*			trans	-68.7	92.4	170.2	-58.6	172.8	0	0	0	105.8	V246 S250	V246-I248 PolarHBondContact O-N 3.01Å; V246-I248 VanDerWaalsContact O-N 3.11Å; I248-S250 PolarHBondContact O-N 2.84Å
249	N	26.8	Very low	28	Very low	124 Å²	124	127.2 Å²	127.2	66%	0.663	75%	0.745	S	S	*	*			trans	-61.8	120.2	168.1	-79.7	-20.4	0	0	0	107.7	V247 S251	V247-N249 PolarHBondContact O-N 2.96Å; N249-S251 PolarHBondContact O-N 3.46Å
250	S	27.2	Very low	28	Very low	127 Å²	127	128.6 Å²	128.6	89%	0.888	75%	0.746	S	S	*	*	S	Bend	trans	-74.9	28.4	-174.8	-42.6	0	0	0	0	113.9	I248	I248-S250 PolarHBondContact O-N 2.84Å
251	S	29.5	Very low	28	Very low	88 Å²	88	130.9 Å²	130.9	62%	0.615	75%	0.75	S	S	*	*			trans	-106.4	94.8	175.6	60.6	0	0	0	0	109.2	N249 V253	N249-S251 PolarHBondContact O-N 3.46Å; S251-V253 PolarHBondContact O-N 3.49Å
252	G	25.5	Very low	28.2	Very low	84 Å²	84	133.5 Å²	133.5	87%	0.866	75%	0.752	S	S	*	*			trans	-59.2	105.9	165.6	0	0	0	0	0	109.7
253	V	31.3	Very low	28.5	Very low	112 Å²	112	134.6 Å²	134.6	68%	0.679	75%	0.753	S	S	*	*			trans	-132.8	105.4	160	-173.7	0	0	0	0	105.7	S251 N255	S251-V253 PolarHBondContact O-N 3.49Å; V253-N255 PolarHBondContact O-N 3.21Å
254	A	29.7	Very low	28.5	Very low	83 Å²	83	136 Å²	136	69%	0.686	76%	0.755	S	S	*	*			trans	-62.5	112.6	171.8	0	0	0	0	0	108.2
255	N	30.2	Very low	28.7	Very low	142 Å²	142	138.2 Å²	138.2	76%	0.759	76%	0.756	S	S	*	*			trans	-95	94.2	163	-83.1	-17.7	0	0	0	107.2	V253 Q257	V253-N255 PolarHBondContact O-N 3.21Å; N255-Q257 VanDerWaalsContact C-N 3.32Å; N255-Q257 PolarHBondContact O-N 3.4Å
256	D	28.9	Very low	28.7	Very low	147 Å²	147	139.8 Å²	139.8	79%	0.786	76%	0.757	S	S	*	*			trans	-63.2	89.6	167.7	-69.9	-34	0	0	0	109.1
257	Q	33.1	Very low	28.9	Very low	142 Å²	142	141 Å²	141	66%	0.664	76%	0.758	S	S	*	*			trans	-105.7	87.8	160.6	-69.2	-155.9	-5.7	0	0	108.8	N255 Y259	N255-Q257 VanDerWaalsContact C-N 3.32Å; N255-Q257 PolarHBondContact O-N 3.4Å; Q257-Y259 HydrophobicContact CB-CE2 4.31Å; Q257-Y259 WeakPolarHBondContact O-CD2 3.17Å; Q257-Y259 PolarHBondContact O-N 3.33Å
258	T	28.5	Very low	29	Very low	126 Å²	126	143.1 Å²	143.1	77%	0.773	76%	0.761	S	S	*	*			trans	-55.7	97.6	165.5	-57.5	0	0	0	0	109.3	Q260	T258-Q260 PolarHBondContact O-N 3.09Å
259	Y	28.3	Very low	29.4	Very low	175 Å²	175	143.1 Å²	143.1	69%	0.686	76%	0.762	S	S	*	*			trans	-79	102.5	164.4	-74.3	-79.7	0	0	0	108.5	Q257 Y261	Q257-Y259 HydrophobicContact CB-CE2 4.31Å; Q257-Y259 WeakPolarHBondContact O-CD2 3.17Å; Q257-Y259 PolarHBondContact O-N 3.33Å; Y259-Y261 PolarHBondContact O-N 2.94Å
260	Q	25.7	Very low	29.5	Very low	177 Å²	177	142.4 Å²	142.4	83%	0.827	77%	0.767	S	S	*	*			trans	-74.4	100.4	174.9	-158.6	172.9	6.6	0	0	108.1	T258	T258-Q260 PolarHBondContact O-N 3.09Å
261	Y	29.2	Very low	29.6	Very low	201 Å²	201	147.5 Å²	147.5	79%	0.788	77%	0.767	S	S	*	*			trans	-84.5	116.3	171.1	-86.4	-86.7	0	0	0	109.4	Y259 N263	Y259-Y261 PolarHBondContact O-N 2.94Å; Y261-N263 PolarHBondContact O-N 3.36Å
262	D	32	Very low	29.8	Very low	143 Å²	143	152.3 Å²	152.3	77%	0.765	78%	0.78	S	S	*	*			trans	-64.5	110.1	173.2	-91	-36.1	0	0	0	110.7	N264	D262-N264 PolarHBondContact O-N 3.22Å; D262-N264 VanDerWaalsContact O-N 3.09Å
263	N	29.4	Very low	30.1	Very low	152 Å²	152	156 Å²	156	81%	0.813	78%	0.777	S	S	*	*			trans	-75.3	83.7	173.9	-73.9	-43.3	0	0	0	110.4	Y261	Y261-N263 PolarHBondContact O-N 3.36Å
264	N	30.2	Very low	30.2	Very low	145 Å²	145	158.2 Å²	158.2	78%	0.775	79%	0.786	S	S	*	*			trans	-140.7	34.7	174.5	-86	-35.3	0	0	0	114.6	D262	D262-N264 PolarHBondContact O-N 3.22Å; D262-N264 VanDerWaalsContact O-N 3.09Å
265	I	30.6	Very low	30.3	Very low	158 Å²	158	158.5 Å²	158.5	81%	0.81	78%	0.782	S	S	*	*			trans	-101.3	92.9	167.4	-53.1	180	0	0	0	108.8	L267	I265-L267 PolarHBondContact O-N 3.01Å
266	R	26.9	Very low	30.6	Very low	223 Å²	223	160.9 Å²	160.9	84%	0.842	79%	0.786	S	S	*	*			trans	-66.4	106.3	172.1	-160.8	177.5	-175.7	-168.4	-0.4	108	E268	R266-E268 PolarHBondContact O-N 3.45Å
267	L	30.3	Very low	30.6	Very low	157 Å²	157	164.2 Å²	164.2	82%	0.822	79%	0.789	S	S	*	*			trans	-73.1	106.7	171.4	-106.2	95.7	0	0	0	108.7	I265	I265-L267 PolarHBondContact O-N 3.01Å
268	E	30.5	Very low	30.5	Very low	155 Å²	155	165.5 Å²	165.5	72%	0.724	80%	0.795	S	S	*	*			trans	-67.3	129.5	166.1	-85	-89.8	151	0	0	110.6	R266 S270	R266-E268 PolarHBondContact O-N 3.45Å; E268-S270 PolarHBondContact O-N 2.88Å
269	D	33.3	Very low	30.5	Very low	144 Å²	144	163.8 Å²	163.8	77%	0.77	79%	0.786	S	S	*	*			trans	-6.6	98.4	170.6	-65.8	-28.4	0	0	0	117.9	R271	D269-R271 PolarHBondContact O-N 3.48Å
270	S	28.4	Very low	30.6	Very low	110 Å²	110	163.3 Å²	163.3	77%	0.769	79%	0.792	S	S	*	*			trans	-61.7	104.3	161.1	37.6	0	0	0	0	110.6	E268 Q272	E268-S270 PolarHBondContact O-N 2.88Å; S270-Q272 PolarHBondContact O-N 3.28Å
271	R	31.2	Very low	30.8	Very low	234 Å²	234	165.7 Å²	165.7	88%	0.883	79%	0.794	S	S	*	*			trans	-50.2	119.3	169.5	-66.3	-173.8	-178.2	-153	0.3	110	D269 I273	D269-R271 PolarHBondContact O-N 3.48Å; R271-I273 PolarHBondContact O-N 3.21Å
272	Q	33.1	Very low	30.9	Very low	189 Å²	189	163.2 Å²	163.2	88%	0.883	79%	0.792	S	S	*	*			trans	-54.1	108.3	175.8	-74.9	171.1	-5.2	0	0	110.5	S270 N274	S270-Q272 PolarHBondContact O-N 3.28Å; Q272-N274 PolarHBondContact O-N 3.41Å
273	I	32.2	Very low	30.6	Very low	160 Å²	160	165.8 Å²	165.8	82%	0.821	80%	0.797	S	S	*	*			trans	-73	108.4	167.6	-62	171.6	0	0	0	106.6	R271 S275	R271-I273 PolarHBondContact O-N 3.21Å; I273-S275 VanDerWaalsContact C-N 3.34Å; I273-S275 PolarHBondContact O-N 3.3Å
274	N	32.5	Very low	30.5	Very low	160 Å²	160	162.3 Å²	162.3	86%	0.856	79%	0.79	S	S	*	*			trans	-69	84.1	-177.4	-141	-11.6	0	0	0	109.6	Q272 K276	Q272-N274 PolarHBondContact O-N 3.41Å; N274-K276 PolarHBondContact O-N 3.23Å; N274-K276 VanDerWaalsContact O-N 3.13Å
275	S	32.4	Very low	30.6	Very low	88 Å²	88	161.3 Å²	161.3	62%	0.615	79%	0.791	S	S	*	*			trans	-77.7	96	176.6	49	0	0	0	0	109.5	I273 Y277	I273-S275 VanDerWaalsContact C-N 3.34Å; I273-S275 PolarHBondContact O-N 3.3Å; S275-Y277 PolarHBondContact O-N 2.75Å
276	K	35.4	Very low	30.8	Very low	193 Å²	193	161.1 Å²	161.1	84%	0.839	79%	0.79	S	S	*	*			trans	-68	17.2	-177.5	-153.9	177.3	-178.9	-180	0	114.9	N274	N274-K276 PolarHBondContact O-N 3.23Å; N274-K276 VanDerWaalsContact O-N 3.13Å
277	Y	29.3	Very low	30.9	Very low	217 Å²	217	155.6 Å²	155.6	85%	0.851	78%	0.783	S	S	*	*			trans	-129.3	77.2	-176.7	-73.1	-83.4	0	0	0	110.2	S275 P279	S275-Y277 PolarHBondContact O-N 2.75Å; Y277-P279 WeakPolarHBondContact O-CD 3.43Å
278	Q	30.8	Very low	31.2	Very low	169 Å²	169	157.7 Å²	157.7	79%	0.79	79%	0.786	S	S	*	*			trans	-85.9	114.2	165.3	-75.8	-91	-28.1	0	0	107.7	M280	Q278-M280 PolarHBondContact O-N 2.99Å
279	P	29.2	Very low	31.2	Very low	89 Å²	89	157.8 Å²	157.8	58%	0.578	79%	0.79	S	S	*	*			trans	-62.2	120.5	173.7	23.2	-29.9	0	0	0	109.3	Y277 W281	Y277-P279 WeakPolarHBondContact O-CD 3.43Å; P279-W281 PolarHBondContact O-N 3.32Å; P279-W281 VanDerWaalsContact O-N 3.16Å
280	M	30.2	Very low	31.1	Very low	166 Å²	166	159.9 Å²	159.9	82%	0.818	80%	0.795	S	S	*	*			trans	-77.9	100.9	-177.3	-158.7	-174.1	-42.2	0	0	109.2	Q278 I282	Q278-M280 PolarHBondContact O-N 2.99Å; M280-I282 PolarHBondContact O-N 2.73Å; M280-I282 VanDerWaalsContact O-N 3.14Å
281	W	29.1	Very low	31.1	Very low	227 Å²	227	160.1 Å²	160.1	86%	0.86	80%	0.796	S	S	*	*			trans	-75.7	96.6	175.5	-62.7	91.7	0	0	0	110	P279 K283	P279-W281 PolarHBondContact O-N 3.32Å; P279-W281 VanDerWaalsContact O-N 3.16Å; W281-K283 PolarHBondContact O-N 3.1Å
282	I	31.1	Very low	31.1	Very low	148 Å²	148	153.8 Å²	153.8	76%	0.759	79%	0.787	S	S	*	*			trans	-76.4	104.9	172	-56.9	174.1	0	0	0	107.7	M280 A284	M280-I282 PolarHBondContact O-N 2.73Å; M280-I282 VanDerWaalsContact O-N 3.14Å; I282-A284 PolarHBondContact O-N 2.92Å
283	K	27.7	Very low	30.7	Very low	197 Å²	197	155.2 Å²	155.2	86%	0.857	79%	0.785	S	S	*	*			trans	-68.3	99.8	170.7	-75.4	-178	176.6	178.1	0	109	W281	W281-K283 PolarHBondContact O-N 3.1Å
284	A	26.9	Very low	30.6	Very low	80 Å²	80	156 Å²	156	66%	0.661	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-63.3	131.6	167.2	0	0	0	0	0	109.3	I282 I286	I282-A284 PolarHBondContact O-N 2.92Å; A284-I286 PolarHBondContact O-N 3.33Å
285	P	32.6	Very low	30.3	Very low	124 Å²	124	158 Å²	158	81%	0.805	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-62.7	123.6	178.5	-8.6	17	0	0	0	110.6	P287	P285-P287 WeakPolarHBondContact O-CD 3.36Å
286	I	33.9	Very low	30.2	Very low	153 Å²	153	159.4 Å²	159.4	79%	0.785	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-65.6	122.6	172	-60.2	169.8	0	0	0	107.7	A284 K288	A284-I286 PolarHBondContact O-N 3.33Å; I286-K288 PolarHBondContact O-N 2.94Å; I286-K288 VanDerWaalsContact O-N 3.13Å
287	P	29.9	Very low	30	Very low	108 Å²	108	157 Å²	157	70%	0.701	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-60	117.5	178.4	-19.5	30.8	0	0	0	109.8	P285 L289	P285-P287 WeakPolarHBondContact O-CD 3.36Å; P287-L289 VanDerWaalsContact C-N 3.3Å; P287-L289 PolarHBondContact O-N 3.22Å
288	K	34.8	Very low	29.9	Very low	201 Å²	201	152.7 Å²	152.7	87%	0.874	79%	0.788	S	S	*	*			trans	-70.9	90.6	169.5	-70.1	-175.6	178.9	178.3	0	108	I286 Q290	I286-K288 PolarHBondContact O-N 2.94Å; I286-K288 VanDerWaalsContact O-N 3.13Å; K288-Q290 PolarHBondContact O-N 3.39Å
289	L	31	Very low	29.6	Very low	156 Å²	156	148 Å²	148	82%	0.817	79%	0.785	S	S	*	*			trans	-63.4	98.4	166.3	-78	163	0	0	0	108.1	P287 C291	P287-L289 VanDerWaalsContact C-N 3.3Å; P287-L289 PolarHBondContact O-N 3.22Å; L289-C291 VanDerWaalsContact C-N 3.29Å; L289-C291 PolarHBondContact O-N 3.45Å
290	Q	32.4	Very low	29.5	Very low	188 Å²	188	151.7 Å²	151.7	88%	0.879	80%	0.8	S	S	*	*			trans	-72	89.9	166.4	-74.3	-154.3	-15.2	0	0	108.4	K288 S292	K288-Q290 PolarHBondContact O-N 3.39Å; Q290-S292 PolarHBondContact O-N 3.44Å
291	C	27.5	Very low	29.2	Very low	116 Å²	116	148.5 Å²	148.5	78%	0.784	80%	0.8	S	S	*	*			trans	-71	85.4	165.1	-66.7	0	0	0	0	108.7	L289 R293	L289-C291 VanDerWaalsContact C-N 3.29Å; L289-C291 PolarHBondContact O-N 3.45Å; C291-R293 VanDerWaalsContact C-N 3.31Å; C291-R293 PolarHBondContact O-N 3.38Å
292	S	30.7	Very low	29.2	Very low	101 Å²	101	141 Å²	141	71%	0.706	79%	0.794	S	S	*	*			trans	-68.3	96	163.9	-176.8	0	0	0	0	107.9	Q290 Q294	Q290-S292 PolarHBondContact O-N 3.44Å; S292-Q294 PolarHBondContact O-N 3.08Å
293	R	25.8	Very low	28.9	Very low	218 Å²	218	140.4 Å²	140.4	82%	0.823	80%	0.796	S	S	*	*			trans	-75.5	78.8	177.1	-156.3	178.1	-168.4	-163.9	4.9	107.8	C291 R295	C291-R293 VanDerWaalsContact C-N 3.31Å; C291-R293 PolarHBondContact O-N 3.38Å; R293-R295 VanDerWaalsContact C-N 3.33Å; R293-R295 PolarHBondContact O-N 3.02Å
294	Q	29	Very low	28.9	Very low	177 Å²	177	139 Å²	139	83%	0.827	80%	0.797	S	S	*	*			trans	-66.9	95.8	169.2	-84.9	-174.9	-26.5	0	0	108.6	S292 S296	S292-Q294 PolarHBondContact O-N 3.08Å; Q294-S296 PolarHBondContact O-N 3.03Å
295	R	27	Very low	28.8	Very low	202 Å²	202	143.7 Å²	143.7	76%	0.762	81%	0.805	S	S	*	*			trans	-65.8	98.3	162.8	-82.3	-178.4	168.6	-164.7	-3	107.4	R293 N297	R293-R295 VanDerWaalsContact C-N 3.33Å; R293-R295 PolarHBondContact O-N 3.02Å; R295-N297 VanDerWaalsContact C-N 3.34Å; R295-N297 PolarHBondContact O-N 3.47Å
296	S	30.8	Very low	28.5	Very low	117 Å²	117	144.3 Å²	144.3	82%	0.818	81%	0.809	S	S	*	*			trans	-70.3	94.8	164.3	51.5	0	0	0	0	108.1	Q294 S298	Q294-S296 PolarHBondContact O-N 3.03Å; S296-S298 PolarHBondContact O-N 2.98Å
297	N	29.7	Very low	28.1	Very low	144 Å²	144	140 Å²	140	77%	0.77	80%	0.803	S	S	*	*			trans	-65	116.4	166.7	-81.2	-16.5	0	0	0	108.3	R295 G299	R295-N297 VanDerWaalsContact C-N 3.34Å; R295-N297 PolarHBondContact O-N 3.47Å; N297-G299 PolarHBondContact O-N 3.23Å
298	S	27.1	Very low	28.1	Very low	125 Å²	125	143.7 Å²	143.7	87%	0.874	81%	0.811	S	S	*	*			trans	-60.8	111.8	162.5	51.8	0	0	0	0	109	S296	S296-S298 PolarHBondContact O-N 2.98Å
299	G	24.9	Very low	27.6	Very low	71 Å²	71	142.8 Å²	142.8	73%	0.732	81%	0.81	S	S	*	*			trans	-164.2	111.5	178.9	0	0	0	0	0	112.3	N297	N297-G299 PolarHBondContact O-N 3.23Å
300	N	28	Very low	27.3	Very low	167 Å²	167	143 Å²	143	89%	0.893	81%	0.81	S	S	*	*			trans	71.7	105	165.6	-87.9	-2.2	0	0	0	120	G302	N300-G302 PolarHBondContact O-N 3.29Å; N300-G302 VanDerWaalsContact O-N 3.11Å
301	A	23.3	Very low	27.3	Very low	99 Å²	99	141.5 Å²	141.5	82%	0.818	80%	0.803	S	S	*	*			trans	-50	104.3	152	0	0	0	0	0	111.2
302	G	29	Very low	27.1	Very low	70 Å²	70	142.5 Å²	142.5	72%	0.722	80%	0.801	S	S	*	*			trans	-93.9	99.7	160.6	0	0	0	0	0	108.6	N300 L304	N300-G302 PolarHBondContact O-N 3.29Å; N300-G302 VanDerWaalsContact O-N 3.11Å; G302-L304 PolarHBondContact O-N 2.68Å; G302-L304 VanDerWaalsContact O-N 3.11Å
303	V	24.2	Very low	27	Very low	134 Å²	134	146.1 Å²	146.1	81%	0.812	80%	0.804	S	S	*	*			trans	-63.2	104.6	170.1	175.8	0	0	0	0	107.8
304	L	27.8	Very low	26.9	Very low	168 Å²	168	141.8 Å²	141.8	88%	0.88	80%	0.802	S	S	*	*			trans	-113.8	116.8	165.7	-77.6	172.1	0	0	0	108.5	G302	G302-L304 PolarHBondContact O-N 2.68Å; G302-L304 VanDerWaalsContact O-N 3.11Å
305	Q	26.1	Very low	26.9	Very low	178 Å²	178	140.1 Å²	140.1	83%	0.832	80%	0.799	S	S	*	*			trans	-60.3	143.4	-176.5	-71.7	177.1	-10.5	0	0	111.9	G307	Q305-G307 PolarHBondContact O-N 2.77Å
306	P	25.7	Very low	26.9	Very low	137 Å²	137	138 Å²	138	89%	0.89	80%	0.801	S	S	*	*			trans	-75.8	108.9	168.3	29.8	-28.9	0	0	0	109
307	G	25.1	Very low	26.9	Very low	64 Å²	64	137.1 Å²	137.1	66%	0.66	79%	0.793	S	S	*	*			trans	-132.7	139.7	173.8	0	0	0	0	0	110.1	Q305	Q305-G307 PolarHBondContact O-N 2.77Å
308	Q	30	Very low	26.7	Very low	184 Å²	184	137.4 Å²	137.4	86%	0.86	79%	0.794	S	S	*	*			trans	87.3	89.3	170.4	-52.6	178.8	-2.5	0	0	113.9
309	Q	25.4	Very low	26.7	Very low	183 Å²	183	139 Å²	139	86%	0.855	79%	0.787	S	S	*	*				91	112.7	82.7	-86	-172.5	9.7	0	0	111.1	E311	Q309-E311 PolarHBondContact O-N 2.7Å
310	I	24.9	Very low	26.9	Very low	160 Å²	160	145.6 Å²	145.6	82%	0.821	79%	0.792	S	S	*	*			trans	-74.2	112.9	174.5	-65.7	158.6	0	0	0	106.8
311	E	30.4	Very low	26.9	Very low	156 Å²	156	148.5 Å²	148.5	73%	0.729	79%	0.792	S	S	*	*			trans	-100.4	122.8	160.6	-81.2	-170.2	166.1	0	0	109.6	Q309 F313	Q309-E311 PolarHBondContact O-N 2.7Å; E311-F313 HydrophobicContact CB-CE2 4.49Å; E311-F313 PolarHBondContact O-N 2.94Å
312	N	24.6	Very low	27	Very low	138 Å²	138	153.6 Å²	153.6	74%	0.738	79%	0.791	S	S	*	*			trans	-63.6	118.3	177.5	-69	-49.4	0	0	0	110.9
313	F	28.2	Very low	27.1	Very low	177 Å²	177	155.9 Å²	155.9	78%	0.776	79%	0.793	S	S	*	*			trans	-118.9	72.5	158.9	-73.2	-76.6	0	0	0	110.1	E311 N315	E311-F313 HydrophobicContact CB-CE2 4.49Å; E311-F313 PolarHBondContact O-N 2.94Å; F313-N315 PolarHBondContact O-N 2.76Å
314	T	24.6	Very low	27.1	Very low	127 Å²	127	155.2 Å²	155.2	78%	0.779	80%	0.795	S	S	*	*			trans	-74.2	96.5	152.1	27.6	0	0	0	0	108.2
315	N	27.4	Very low	27.1	Very low	142 Å²	142	151.9 Å²	151.9	76%	0.759	79%	0.786	S	S	*	*			trans	-153.1	86.9	158.5	-96.6	-37.4	0	0	0	108.4	F313	F313-N315 PolarHBondContact O-N 2.76Å
316	I	28.2	Very low	27.2	Very low	158 Å²	158	151.1 Å²	151.1	81%	0.81	79%	0.787	S	S	*	*			trans	-104.1	106.8	162.2	-62.2	173.8	0	0	0	106.3
317	P	30.7	Very low	27.4	Very low	98 Å²	98	149.9 Å²	149.9	64%	0.636	78%	0.779	S	S	*	*			trans	-81.2	116.8	166.8	-7	25.2	0	0	0	109.3	H319	P317-H319 PolarHBondContact O-N 3.47Å; P317-H319 VanDerWaalsContact O-N 3.15Å
318	N	25.7	Very low	27.4	Very low	150 Å²	150	153.2 Å²	153.2	80%	0.802	79%	0.786	S	S	*	*			trans	-63.5	103.3	164.9	-77.2	-38.4	0	0	0	109.8
319	H	27.5	Very low	27.3	Very low	158 Å²	158	151.3 Å²	151.3	73%	0.731	78%	0.782	S	S	*	*			trans	-136.4	76.2	171.9	-92	-55	0	0	0	111.2	P317	P317-H319 PolarHBondContact O-N 3.47Å; P317-H319 VanDerWaalsContact O-N 3.15Å
320	Y	27.3	Very low	27.3	Very low	210 Å²	210	150.4 Å²	150.4	82%	0.824	78%	0.782	S	S	*	*			trans	-150.5	77.4	155.2	-81.7	-71	0	0	0	109.4	Y322	Y320-Y322 HydrophobicContact CD1-CE2 4.14Å
321	Y	28.3	Very low	27.4	Very low	228 Å²	228	149.3 Å²	149.3	89%	0.894	78%	0.783	S	S	*	*			trans	-96.1	106.6	156.8	-84.4	-81.4	0	0	0	107.2	P323	Y321-P323 WeakPolarHBondContact O-CD 3.39Å
322	Y	26.6	Very low	27.2	Very low	205 Å²	205	147.4 Å²	147.4	80%	0.804	78%	0.784	S	S	*	*			trans	-80.5	120.7	164.3	-92.6	-89.6	0	0	0	108.4	Y320	Y320-Y322 HydrophobicContact CD1-CE2 4.14Å
323	P	29.9	Very low	27.2	Very low	118 Å²	118	147.1 Å²	147.1	77%	0.766	78%	0.783	S	S	*	*			trans	-87.9	116.5	171.1	26.2	-16	0	0	0	109.7	Y321	Y321-P323 WeakPolarHBondContact O-CD 3.39Å
324	S	24.1	Very low	27.2	Very low	121 Å²	121	146.3 Å²	146.3	85%	0.846	79%	0.787	S	S	*	*			trans	-85.2	103.4	164.6	65.8	0	0	0	0	109.9
325	S	29	Very low	27.3	Very low	98 Å²	98	149.1 Å²	149.1	69%	0.685	79%	0.791	S	S	*	*			trans	-173.5	99.5	156.4	53.5	0	0	0	0	109.8
326	N	28	Very low	27.2	Very low	162 Å²	162	146.3 Å²	146.3	87%	0.866	80%	0.795	S	S	*	*			trans	-143.8	105.2	152.7	-91.7	-33.4	0	0	0	107.9
327	P	29.4	Very low	26.9	Very low	110 Å²	110	143.8 Å²	143.8	71%	0.714	79%	0.792	S	S	*	*			trans	-75.2	132.9	179.6	29.7	-30.5	0	0	0	110.1	N329	P327-N329 PolarHBondContact O-N 3.07Å; P327-N329 VanDerWaalsContact O-N 3.14Å
328	V	25.6	Very low	26.7	Very low	135 Å²	135	145.8 Å²	145.8	82%	0.818	80%	0.795	S	S	*	*			trans	-69	106.8	173.7	174.9	0	0	0	0	108.2	L330	V328-L330 PolarHBondContact O-N 3.39Å
329	N	27.3	Very low	26.7	Very low	143 Å²	143	146.7 Å²	146.7	77%	0.765	80%	0.795	S	S	*	*			trans	-65.7	115	170.2	-83.6	-43.6	0	0	0	109.6	P327 T331	P327-N329 PolarHBondContact O-N 3.07Å; P327-N329 VanDerWaalsContact O-N 3.14Å; N329-T331 PolarHBondContact O-N 3.44Å
330	L	26	Very low	26.6	Very low	165 Å²	165	147.9 Å²	147.9	86%	0.864	80%	0.8	S	S	*	*			trans	-78.8	106.7	163.9	-70.9	164.1	0	0	0	107.7	V328 P332	V328-L330 PolarHBondContact O-N 3.39Å; L330-P332 WeakPolarHBondContact O-CD 3.19Å
331	T	27.3	Very low	26.7	Very low	137 Å²	137	143.4 Å²	143.4	84%	0.84	80%	0.799	S	S	*	*			trans	-105	107.8	167.3	-0.7	0	0	0	0	108.8	N329	N329-T331 PolarHBondContact O-N 3.44Å
332	P	26.3	Very low	26.5	Very low	115 Å²	115	143.2 Å²	143.2	75%	0.747	80%	0.799	S	S	*	*			trans	-96.3	112.9	170.4	32.4	-24.2	0	0	0	109.6	L330	L330-P332 WeakPolarHBondContact O-CD 3.19Å
333	N	23.1	Very low	26.5	Very low	133 Å²	133	142.5 Å²	142.5	71%	0.711	80%	0.802	S	S	*	*			trans	-173	117.7	151.3	-130.2	-13.2	0	0	0	109.9
334	N	29.9	Very low	26.7	Very low	160 Å²	160	141.7 Å²	141.7	86%	0.856	80%	0.798	S	S	*	*				-170.5	134.9	117.6	-91.1	-13.3	0	0	0	110.6
335	Q	25.3	Very low	26.8	Very low	186 Å²	186	143.9 Å²	143.9	87%	0.869	80%	0.8	S	S	*	*			trans	-71.7	129.3	-171.8	-63.5	170	-24.6	0	0	110.7
336	G	25.4	Very low	27	Very low	82 Å²	82	146.7 Å²	146.7	85%	0.845	81%	0.805	S	S	*	*			trans	-128.9	93	162.5	0	0	0	0	0	107.5
337	S	22.8	Very low	27.1	Very low	106 Å²	106	144.4 Å²	144.4	74%	0.741	80%	0.799	S	S	*	*			trans	-80.2	168	-177.4	-177.7	0	0	0	0	111.6
338	I	25.8	Very low	27	Very low	139 Å²	139	147.6 Å²	147.6	71%	0.713	81%	0.81	S	S	*	*			trans	86.4	92.1	157.6	-33.6	176.5	0	0	0	117
339	H	27	Very low	27.2	Very low	170 Å²	170	146.6 Å²	146.6	79%	0.787	81%	0.808	S	S	*	*				-175.8	111.8	103	-115.1	-83.2	0	0	0	110.3
340	H	24.5	Very low	27	Very low	183 Å²	183	145.9 Å²	145.9	85%	0.847	80%	0.804	S	S	*	*			trans	-86.9	129.1	161.3	-69.8	-73.2	0	0	0	108.2
341	S	30.3	Very low	27.3	Very low	115 Å²	115	145.9 Å²	145.9	80%	0.804	80%	0.802	S	S	*	*			trans	-137.2	117.6	157.8	50.4	0	0	0	0	108.6
342	Y	23.4	Very low	27.2	Very low	224 Å²	224	146.1 Å²	146.1	88%	0.878	80%	0.798	S	S	*	*			trans	-62.1	143.7	178.5	-88.1	-112.2	0	0	0	113.2
343	E	27.1	Very low	27.2	Very low	190 Å²	190	145.5 Å²	145.5	89%	0.888	80%	0.797	S	S	*	*			trans	-162.3	152.9	135.7	-107.8	-153.1	117.4	0	0	110.5
344	P	32.7	Very low	27.3	Very low	102 Å²	102	144.6 Å²	144.6	66%	0.662	80%	0.801	S	S	*	*			trans	-112.4	161.6	-137.4	18.2	4.1	0	0	0	114.8	I346	P344-I346 PolarHBondContact O-N 3.05Å
345	N	26.7	Very low	27.1	Very low	166 Å²	166	144.7 Å²	144.7	89%	0.888	80%	0.798	S	S	*	*			trans	-52.6	125.5	168.5	-63.6	-60.4	0	0	0	112.7
346	I	32.8	Very low	27.2	Very low	158 Å²	158	141 Å²	141	81%	0.81	78%	0.784	S	S	*	*			trans	-120	133	155.6	-60.7	177.8	0	0	0	107.9	P344	P344-I346 PolarHBondContact O-N 3.05Å
347	P	29.6	Very low	27.4	Very low	114 Å²	114	147 Å²	147	74%	0.74	79%	0.787	S	S	*	*			trans	-87.5	147.3	-158	-1.5	22	0	0	0	113.1	S349	P347-S349 PolarHBondContact O-N 3.13Å
348	L	27.9	Very low	27.8	Very low	177 Å²	177	151 Å²	151	93%	0.927	79%	0.787	S	S	*	*			trans	-59.6	119.8	171	-72.2	96.4	0	0	0	111	N350	L348-N350 PolarHBondContact O-N 3.28Å
349	S	29.4	Very low	27.9	Very low	113 Å²	113	151.9 Å²	151.9	79%	0.79	79%	0.793	S	S	*	*			trans	-78.7	112.9	168.9	50.2	0	0	0	0	110.4	P347 M351	P347-S349 PolarHBondContact O-N 3.13Å; S349-M351 PolarHBondContact O-N 3.04Å
350	N	24.7	Very low	28	Very low	128 Å²	128	150.8 Å²	150.8	68%	0.684	79%	0.793	S	S	*	*			trans	-75.8	91.4	171.8	178.9	7.2	0	0	0	109.6	L348 N352	L348-N350 PolarHBondContact O-N 3.28Å; N350-N352 PolarHBondContact O-N 3.43Å; N350-N352 PolarHBondContact OD1-ND2 3.15Å; N350-N352 PolarHBondContact OD1-OD1 3.38Å
351	M	30.6	Very low	28.1	Very low	166 Å²	166	146.8 Å²	146.8	82%	0.818	79%	0.786	S	S	*	*			trans	-95.1	83.3	167.1	-71.1	-151	88.9	0	0	110.3	S349 S353	S349-M351 PolarHBondContact O-N 3.04Å; M351-S353 PolarHBondContact O-N 3.28Å; M351-S353 VanDerWaalsContact O-N 3.08Å
352	N	26.2	Very low	28	Very low	142 Å²	142	147.3 Å²	147.3	76%	0.759	78%	0.784	S	S	*	*			trans	-64.5	97.4	157.6	-77.2	-35.7	0	0	0	108.8	N350	N350-N352 PolarHBondContact O-N 3.43Å; N350-N352 PolarHBondContact OD1-ND2 3.15Å; N350-N352 PolarHBondContact OD1-OD1 3.38Å
353	S	26.8	Very low	28.2	Very low	102 Å²	102	142.4 Å²	142.4	71%	0.713	78%	0.778	S	S	*	*			trans	-120.1	110.4	159.9	66.4	0	0	0	0	109.4	M351	M351-S353 PolarHBondContact O-N 3.28Å; M351-S353 VanDerWaalsContact O-N 3.08Å
354	S	25	Very low	28.4	Very low	113 Å²	113	141.5 Å²	141.5	79%	0.79	77%	0.771	S	S	*	*			trans	-53.8	133.3	165.5	50.8	0	0	0	0	110.8
355	M	25.8	Very low	28.2	Very low	162 Å²	162	140.8 Å²	140.8	80%	0.798	77%	0.768	S	S	*	*			trans	-176.1	131.5	140.5	-101	-76.1	-173.4	0	0	111.2
356	N	27.3	Very low	28.3	Very low	109 Å²	109	141.7 Å²	141.7	58%	0.583	76%	0.764	S	S	*	*			trans	77.6	88.4	153.9	-60.5	-29.7	0	0	0	119.3	Y358	N356-Y358 VanDerWaalsContact C-N 3.32Å; N356-Y358 HydrophobicContact CB-CD2 4.13Å; N356-Y358 HydrophobicContact CB-CE2 3.91Å; N356-Y358 PolarHBondContact O-N 2.98Å
357	K	29.7	Very low	28	Very low	207 Å²	207	144 Å²	144	90%	0.9	76%	0.763	S	S	*	*			trans	-47.6	90.4	147.3	-65.5	172.7	178.3	176.2	0	110.3
358	Y	30	Very low	28.1	Very low	192 Å²	192	144.8 Å²	144.8	75%	0.753	76%	0.761	S	S	*	*			trans	-82.2	117.8	159.6	-82.6	-83.5	0	0	0	108.4	N356 N360	N356-Y358 VanDerWaalsContact C-N 3.32Å; N356-Y358 HydrophobicContact CB-CD2 4.13Å; N356-Y358 HydrophobicContact CB-CE2 3.91Å; N356-Y358 PolarHBondContact O-N 2.98Å; Y358-N360 VanDerWaalsContact C-N 3.33Å; Y358-N360 PolarHBondContact O-N 3.09Å
359	N	27.9	Very low	28.1	Very low	156 Å²	156	145.5 Å²	145.5	83%	0.834	76%	0.757	S	S	*	*			trans	-59	93.1	172.5	-70.7	-32.8	0	0	0	109.1	S361	N359-S361 PolarHBondContact O-N 3.11Å
360	N	30.3	Very low	28.2	Very low	148 Å²	148	148 Å²	148	79%	0.791	76%	0.76	S	S	*	*			trans	-67.8	90.3	165.5	-79.2	-20.6	0	0	0	107.9	Y358 T362	Y358-N360 VanDerWaalsContact C-N 3.33Å; Y358-N360 PolarHBondContact O-N 3.09Å; N360-T362 PolarHBondContact O-N 3.2Å
361	S	26.4	Very low	28.5	Very low	98 Å²	98	147.3 Å²	147.3	69%	0.685	76%	0.761	S	S	*	*			trans	-41.8	107.6	161	141.9	0	0	0	0	107.8	N359 V363	N359-S361 PolarHBondContact O-N 3.11Å; S361-V363 PolarHBondContact O-N 3.26Å
362	T	27.7	Very low	28.7	Very low	127 Å²	127	144.7 Å²	144.7	78%	0.779	76%	0.756	S	S	*	*			trans	-69.6	88.2	176.2	-21.9	0	0	0	0	106.4	N360 K364	N360-T362 PolarHBondContact O-N 3.2Å; T362-K364 PolarHBondContact O-N 3.24Å
363	V	27.8	Very low	29.1	Very low	121 Å²	121	147.5 Å²	147.5	73%	0.733	76%	0.762	S	S	*	*			trans	-64.2	96.2	166	-179.1	0	0	0	0	105	S361 S365	S361-V363 PolarHBondContact O-N 3.26Å; V363-S365 PolarHBondContact O-N 3.17Å
364	K	30.9	Very low	29.4	Very low	171 Å²	171	149.4 Å²	149.4	74%	0.743	76%	0.763	S	S	*	*			trans	-60.1	88.5	169.1	-78	178.9	177.7	176.2	0	106.6	T362 F366	T362-K364 PolarHBondContact O-N 3.24Å; K364-F366 VanDerWaalsContact O-CD2 3.26Å; K364-F366 WeakPolarHBondContact O-CD2 3.46Å; K364-F366 PolarHBondContact O-N 3.28Å
365	S	29	Very low	29.8	Very low	86 Å²	86	155.3 Å²	155.3	60%	0.601	77%	0.768	S	S	*	*			trans	-59	106.6	165.7	167.7	0	0	0	0	106.5	V363 R367	V363-S365 PolarHBondContact O-N 3.17Å; S365-R367 PolarHBondContact O-N 3.27Å
366	F	28	Very low	30.2	Very low	186 Å²	186	157.9 Å²	157.9	82%	0.816	77%	0.769	S	S	*	*			trans	-65.7	68.4	171.5	-68.8	-90.7	0	0	0	109.8	K364	K364-F366 VanDerWaalsContact O-CD2 3.26Å; K364-F366 WeakPolarHBondContact O-CD2 3.46Å; K364-F366 PolarHBondContact O-N 3.28Å
367	R	27.5	Very low	30.4	Very low	205 Å²	205	161.1 Å²	161.1	77%	0.774	78%	0.778	S	S	*	*			trans	-81	130.4	162.8	-90.2	-170.2	-172.2	-163	2.7	107.4	S365	S365-R367 PolarHBondContact O-N 3.27Å
368	N	30.8	Very low	30.6	Very low	131 Å²	131	157.3 Å²	157.3	70%	0.701	77%	0.772	S	S	*	*			trans	88.3	69.6	160.5	-45.2	-24.4	0	0	0	117.3
369	F	28.8	Very low	30.6	Very low	193 Å²	193	157.4 Å²	157.4	85%	0.846	77%	0.772	S	S	*	*	S	Bend	trans	-115.8	32.8	153.9	-87.8	-71.9	0	0	0	112.8
370	L	30.4	Very low	31.1	Very low	164 Å²	164	158.5 Å²	158.5	86%	0.859	77%	0.773	S	S	*	*			trans	-144.8	69.9	168.3	-69	173.7	0	0	0	109.3	P372	L370-P372 WeakPolarHBondContact O-CD 3.41Å
371	T	32	Very low	31.5	Very low	115 Å²	115	159.2 Å²	159.2	71%	0.706	78%	0.776	S	S	*	*			trans	-91.1	107.2	153.3	38.4	0	0	0	0	106.9	K373	T371-K373 PolarHBondContact O-N 2.93Å
372	P	34.5	Very low	32.1	Very low	110 Å²	110	161.6 Å²	161.6	71%	0.714	78%	0.781	S	S	*	*			trans	-63.2	110.4	167.3	-10.9	25.9	0	0	0	106.2	L370 L374	L370-P372 WeakPolarHBondContact O-CD 3.41Å; P372-L374 PolarHBondContact O-N 3.45Å
373	K	34	Very low	32.4	Very low	202 Å²	202	167.3 Å²	167.3	88%	0.878	79%	0.788	S	S	*	*			trans	-66.7	60.5	166.3	-75.3	-180	173.9	173.4	0	109.6	T371 R375	T371-K373 PolarHBondContact O-N 2.93Å; K373-R375 VanDerWaalsContact C-N 3.3Å; K373-R375 PolarHBondContact O-N 3.03Å
374	L	34.1	Very low	32.8	Very low	142 Å²	142	167.6 Å²	167.6	74%	0.743	79%	0.79	S	S	*	*			trans	-94.6	71	157.4	-96.6	103	0	0	0	107.5	P372 R376	P372-L374 PolarHBondContact O-N 3.45Å; L374-R376 PolarHBondContact O-N 3.32Å
375	R	32.2	Very low	32.9	Very low	236 Å²	236	168.2 Å²	168.2	89%	0.891	80%	0.796	S	S	*	*			trans	-70.4	90.6	163.9	-155.7	176.7	-168.7	173.2	2.7	105.9	K373 K377	K373-R375 VanDerWaalsContact C-N 3.3Å; K373-R375 PolarHBondContact O-N 3.03Å; R375-K377 PolarHBondContact O-N 2.99Å; R375-K377 VanDerWaalsContact O-N 3.11Å
376	R	35.3	Very low	33.2	Very low	217 Å²	217	169.8 Å²	169.8	82%	0.819	81%	0.807	S	S	*	*			trans	-56.7	115.2	169.1	-74.1	-178.2	174.4	159.2	-1.8	106.5	L374 T378	L374-R376 PolarHBondContact O-N 3.32Å; R376-T378 VanDerWaalsContact C-N 3.31Å; R376-T378 PolarHBondContact O-N 3.19Å
377	K	31.8	Very low	33.5	Very low	176 Å²	176	167 Å²	167	77%	0.765	80%	0.804	S	S	*	*			trans	-70.6	92.7	170.4	-74.5	-169.8	175.2	-173	0	107.1	R375 Y379	R375-K377 PolarHBondContact O-N 2.99Å; R375-K377 VanDerWaalsContact O-N 3.11Å; K377-Y379 HydrophobicContact CB-CE2 4.44Å; K377-Y379 PolarHBondContact O-N 3.16Å
378	T	32.3	Very low	33.7	Very low	128 Å²	128	168.5 Å²	168.5	79%	0.785	81%	0.81	S	S	*	*			trans	-70.7	110	166.5	-34.4	0	0	0	0	106.2	R376 E380	R376-T378 VanDerWaalsContact C-N 3.31Å; R376-T378 PolarHBondContact O-N 3.19Å; T378-E380 PolarHBondContact O-N 3.41Å
379	Y	31.3	Very low	33.9	Very low	193 Å²	193	170.1 Å²	170.1	76%	0.757	82%	0.818	S	S	*	*			trans	-73.4	108.2	171.4	-72.4	-93.8	0	0	0	106.9	K377 L381	K377-Y379 HydrophobicContact CB-CE2 4.44Å; K377-Y379 PolarHBondContact O-N 3.16Å; Y379-L381 PolarHBondContact O-N 2.91Å
380	E	37.4	Very low	34.1	Very low	179 Å²	179	170 Å²	170	84%	0.836	82%	0.817	S	S	*	*			trans	-69.2	117.2	162.1	-76.2	-177.4	168.1	0	0	107	T378 D382	T378-E380 PolarHBondContact O-N 3.41Å; E380-D382 PolarHBondContact O-N 3.25Å
381	L	40.2	Very low	34.2	Very low	164 Å²	164	171 Å²	171	86%	0.859	82%	0.817	S	S	*	*			trans	-76.9	104.6	176.7	-75.5	160.4	0	0	0	107.3	Y379 R383	Y379-L381 PolarHBondContact O-N 2.91Å; L381-R383 PolarHBondContact O-N 3.02Å; L381-R383 VanDerWaalsContact O-N 3.09Å
382	D	37.4	Very low	34.4	Very low	148 Å²	148	171.7 Å²	171.7	79%	0.791	82%	0.817	S	S	*	*			trans	-54.4	116.2	170.2	-74.9	-36.2	0	0	0	109	E380 T384	E380-D382 PolarHBondContact O-N 3.25Å; D382-T384 VanDerWaalsContact C-N 3.34Å; D382-T384 PolarHBondContact O-N 3.42Å
383	R	33.8	Very low	34.3	Very low	247 Å²	247	174 Å²	174	93%	0.932	82%	0.823	S	S	*	*			trans	-63.1	94.7	170.3	-101.1	177.9	171	163.3	-3.1	107.9	L381 E385	L381-R383 PolarHBondContact O-N 3.02Å; L381-R383 VanDerWaalsContact O-N 3.09Å; R383-E385 PolarHBondContact O-N 3.42Å
384	T	36.2	Very low	34.3	Very low	127 Å²	127	172.9 Å²	172.9	78%	0.779	82%	0.821	S	S	*	*			trans	-72	113	169.1	48.7	0	0	0	0	108.8	D382	D382-T384 VanDerWaalsContact C-N 3.34Å; D382-T384 PolarHBondContact O-N 3.42Å
385	E	34.4	Very low	34.1	Very low	184 Å²	184	175.7 Å²	175.7	86%	0.86	83%	0.827	S	S	*	*			trans	-56.5	135.1	173.7	-70.8	-178.7	155.9	0	0	111.3	R383 V387	R383-E385 PolarHBondContact O-N 3.42Å; E385-V387 PolarHBondContact O-N 2.93Å
386	S	35.1	Very low	34	Very low	119 Å²	119	170.4 Å²	170.4	83%	0.832	82%	0.823	S	S	*	*			trans	-69.4	98.9	-179.3	-57.4	0	0	0	0	111.1	R388	S386-R388 PolarHBondContact O-N 3.03Å
387	V	34.5	Very low	33.6	Very low	126 Å²	126	168.6 Å²	168.6	76%	0.764	83%	0.826	S	S	*	*			trans	-68.3	110	169.5	178.8	0	0	0	0	108.7	E385 L389	E385-V387 PolarHBondContact O-N 2.93Å; V387-L389 PolarHBondContact O-N 3.3Å; V387-L389 VanDerWaalsContact O-N 3.11Å
388	R	31.4	Very low	33.3	Very low	238 Å²	238	167 Å²	167	90%	0.898	83%	0.826	S	S	*	*			trans	-68.7	101.1	171.4	-70.5	-176.5	177.9	178.2	-0.7	108.9	S386 K390	S386-R388 PolarHBondContact O-N 3.03Å; R388-K390 PolarHBondContact O-N 3.34Å
389	L	34.1	Very low	33.2	Very low	164 Å²	164	168.3 Å²	168.3	86%	0.859	83%	0.828	S	S	*	*			trans	-68.2	122.8	170	-81	158.3	0	0	0	109.1	V387 Q391	V387-L389 PolarHBondContact O-N 3.3Å; V387-L389 VanDerWaalsContact O-N 3.11Å; L389-Q391 PolarHBondContact O-N 2.9Å
390	K	34.9	Very low	32.9	Very low	190 Å²	190	164.6 Å²	164.6	83%	0.826	83%	0.831	S	S	*	*			trans	-65.8	131	174.7	-75.3	-155.7	172.5	-170.8	0	109.7	R388 D392	R388-K390 PolarHBondContact O-N 3.34Å; K390-D392 PolarHBondContact O-N 2.77Å
391	Q	32.2	Very low	32.6	Very low	186 Å²	186	161.8 Å²	161.8	87%	0.869	83%	0.825	S	S	*	*			trans	-84.3	98.4	178.8	-151	168.7	5.2	0	0	106.3	L389	L389-Q391 PolarHBondContact O-N 2.9Å
392	D	34.9	Very low	31.8	Very low	130 Å²	130	162.6 Å²	162.6	70%	0.695	83%	0.825	S	S	*	*			trans	-80.5	120.3	176.2	-75.6	-36.2	0	0	0	109.7	K390 H394	K390-D392 PolarHBondContact O-N 2.77Å; D392-H394 PolarHBondContact O-N 3.05Å
393	D	32.9	Very low	31.4	Very low	157 Å²	157	163.4 Å²	163.4	84%	0.84	82%	0.824	S	S	*	*			trans	-66.1	114.5	178.7	-69.4	-53.9	0	0	0	111.3
394	H	34.4	Very low	31	Very low	180 Å²	180	160.7 Å²	160.7	83%	0.833	82%	0.821	S	S	*	*			trans	-118.7	111.7	171.7	-75.6	-14.2	0	0	0	112	D392	D392-H394 PolarHBondContact O-N 3.05Å
395	K	30.4	Very low	30.8	Very low	200 Å²	200	162.1 Å²	162.1	87%	0.87	82%	0.823	S	S	*	*			trans	-65.2	138.6	175.2	-129.4	176.2	-178.4	179.7	0	110.6
396	P	29.1	Very low	30.2	Very low	125 Å²	125	156.5 Å²	156.5	81%	0.812	82%	0.815	S	S	*	*			trans	-82.2	122.3	-179.9	31.6	-31.2	0	0	0	110.5
397	M	27.8	Very low	29.8	Very low	180 Å²	180	158 Å²	158	89%	0.887	81%	0.813	S	S	*	*			trans	-111.5	117.1	168.2	-102	-68.2	-161.9	0	0	109.3
398	N	25.2	Very low	29.6	Very low	142 Å²	142	159 Å²	159	76%	0.759	81%	0.814	S	S	*	*			trans	-53.9	136.3	158.3	-76.1	-34.2	0	0	0	109.4
399	N	29.8	Very low	29.5	Very low	155 Å²	155	155.9 Å²	155.9	83%	0.829	82%	0.816	S	S	*	*				-178	124.9	122.7	-86.7	-21.7	0	0	0	110.9
400	S	24.5	Very low	29.2	Very low	116 Å²	116	153.5 Å²	153.5	81%	0.811	81%	0.813	S	S	*	*			trans	-70.4	115.4	168.1	160.3	0	0	0	0	109.8
401	V	31.1	Very low	28.8	Very low	120 Å²	120	154.7 Å²	154.7	73%	0.727	81%	0.812	S	S	*	*			trans	-146.2	114.3	154.6	-176.9	0	0	0	0	108.7	Q403	V401-Q403 HydrophobicContact CG1-CG 4.45Å; V401-Q403 PolarHBondContact O-N 3.3Å
402	E	24.4	Very low	28.7	Very low	181 Å²	181	151.6 Å²	151.6	85%	0.846	81%	0.811	S	S	*	*			trans	-55.9	119.2	165.1	-69.8	163.2	124	0	0	110.5
403	Q	29.5	Very low	28.4	Very low	164 Å²	164	150.6 Å²	150.6	77%	0.766	81%	0.805	S	S	*	*			trans	-141.8	107.8	153.1	-71.1	-165.8	0.8	0	0	110.1	V401 L405	V401-Q403 HydrophobicContact CG1-CG 4.45Å; V401-Q403 PolarHBondContact O-N 3.3Å; Q403-L405 PolarHBondContact O-N 3.39Å
404	H	25	Very low	28.2	Very low	190 Å²	190	148.8 Å²	148.8	88%	0.88	80%	0.795	S	S	*	*			trans	-56.6	110.5	159.2	-84.1	-94.9	0	0	0	109.8
405	L	30.9	Very low	28.1	Very low	157 Å²	157	149 Å²	149	82%	0.822	80%	0.797	S	S	*	*			trans	-149.1	116.6	152.8	-93.3	120.5	0	0	0	108.5	Q403	Q403-L405 PolarHBondContact O-N 3.39Å
406	G	23.3	Very low	28.1	Very low	67 Å²	67	150.1 Å²	150.1	69%	0.691	80%	0.795	S	S	*	*			trans	-71.5	178.6	179	0	0	0	0	0	113.4
407	N	25.7	Very low	28.4	Very low	149 Å²	149	150.6 Å²	150.6	80%	0.797	79%	0.791	S	S	*	*			trans	75	101.7	170	-60.7	-14.1	0	0	0	114.6
408	N	30.4	Very low	28.3	Very low	147 Å²	147	148.1 Å²	148.1	79%	0.786	78%	0.781	S	S	*	*				175.9	96.2	105	-78.9	-33.2	0	0	0	108.4	S410	N408-S410 PolarHBondContact O-N 3.01Å
409	N	28.3	Very low	28.6	Very low	173 Å²	173	147.6 Å²	147.6	93%	0.925	79%	0.786	S	S	*	*			trans	-65.6	91.2	162.9	-82.5	-27.3	0	0	0	107.9	R411	N409-R411 VanDerWaalsContact C-N 3.3Å; N409-R411 PolarHBondContact O-N 3Å
410	S	29.1	Very low	28.7	Very low	115 Å²	115	147.8 Å²	147.8	80%	0.804	79%	0.786	S	S	*	*			trans	-64	97.8	164.1	36	0	0	0	0	108.2	N408 S412	N408-S410 PolarHBondContact O-N 3.01Å; S410-S412 VanDerWaalsContact C-N 3.34Å; S410-S412 PolarHBondContact O-N 3.04Å
411	R	25.9	Very low	29.2	Very low	214 Å²	214	151 Å²	151	81%	0.808	79%	0.786	S	S	*	*			trans	-46.2	86.9	166	-152.5	179.3	-171.3	179.6	5.3	110.6	N409 I413	N409-R411 VanDerWaalsContact C-N 3.3Å; N409-R411 PolarHBondContact O-N 3Å; R411-I413 HydrophobicContact CB-CG1 4.47Å; R411-I413 HydrophobicContact CG-CD1 4.04Å; R411-I413 HydrophobicContact CG-CG1 3.78Å; R411-I413 PolarHBondContact O-N 3.47Å; R411-I413 VanDerWaalsContact O-N 3.16Å
412	S	29.5	Very low	29.4	Very low	122 Å²	122	154.8 Å²	154.8	85%	0.853	79%	0.792	S	S	*	*			trans	-73.5	101.1	160.8	173.5	0	0	0	0	107.9	S410	S410-S412 VanDerWaalsContact C-N 3.34Å; S410-S412 PolarHBondContact O-N 3.04Å
413	I	29.2	Very low	30	Very low	108 Å²	108	151.4 Å²	151.4	55%	0.554	78%	0.783	S	S	*	*			trans	-88.7	136.6	175.3	-64.3	171.8	0	0	0	107.1	R411	R411-I413 HydrophobicContact CB-CG1 4.47Å; R411-I413 HydrophobicContact CG-CD1 4.04Å; R411-I413 HydrophobicContact CG-CG1 3.78Å; R411-I413 PolarHBondContact O-N 3.47Å; R411-I413 VanDerWaalsContact O-N 3.16Å
414	N	29.5	Very low	30.3	Very low	120 Å²	120	149 Å²	149	64%	0.642	78%	0.78	S	S	*	*			trans	79.7	85.8	162.9	-63.9	-20.2	0	0	0	118.8
415	E	31.8	Very low	31	Very low	184 Å²	184	143.5 Å²	143.5	86%	0.86	76%	0.762	S	S	*	*				-128.3	77.1	121.1	-79.1	-161.9	151.9	0	0	109.8	N417	E415-N417 PolarHBondContact O-N 3.07Å
416	R	29.8	Very low	31.5	Very low	223 Å²	223	140.7 Å²	140.7	84%	0.842	76%	0.756	S	S	*	*			trans	-76.2	92.9	153.3	-79.5	-177.3	-172.3	145.6	2.2	107.3
417	N	35.9	Very low	32.7	Very low	135 Å²	135	141.4 Å²	141.4	72%	0.722	75%	0.747	S	S	*	*			trans	-129.5	88.1	161.1	-82.5	-38.4	0	0	0	110.4	E415	E415-N417 PolarHBondContact O-N 3.07Å
418	N	26.1	Very low	34.5	Very low	128 Å²	128	137.9 Å²	137.9	68%	0.684	73%	0.734	S	S	*	*			trans	58.8	107.5	150.7	-71.7	-30.7	0	0	0	120.9	L420	N418-L420 PolarHBondContact O-N 2.92Å
419	P	31.7	Very low	35.4	Very low	131 Å²	131	139.1 Å²	139.1	85%	0.851	73%	0.729	S	S	*	*	S	Bend	trans	-74.4	27.6	168.2	31.5	-34	0	0	0	114.7
420	L	32.3	Very low	37.6	Very low	160 Å²	160	134.7 Å²	134.7	84%	0.838	71%	0.708	S	S	*	*			trans	-103.1	38.9	175.8	-78.5	169.7	0	0	0	112.5	N418	N418-L420 PolarHBondContact O-N 2.92Å
421	K	33.6	Very low	39.7	Very low	184 Å²	184	133.7 Å²	133.7	80%	0.8	69%	0.694	S	S	*	*			trans	-141.2	73.7	156.6	-75.2	-173.3	-178.6	174	0	107.7	V423	K421-V423 HydrophobicContact CB-CG2 4.29Å; K421-V423 PolarHBondContact O-N 3.43Å
422	K	36	Very low	41.7	Very low	199 Å²	199	126.2 Å²	126.2	87%	0.865	68%	0.678	S	S	*	*			trans	-64.5	85.7	143.5	-92.6	-173.4	175.7	-175.7	0	104.7	V424	K422-V424 PolarHBondContact O-N 3.21Å
423	V	37.2	Very low	44.1	Very low	109 Å²	109	125 Å²	125	66%	0.661	66%	0.661	S	S	*	*			trans	-55.6	97.7	152.4	178.1	0	0	0	0	102.6	K421 S425	K421-V423 HydrophobicContact CB-CG2 4.29Å; K421-V423 PolarHBondContact O-N 3.43Å; V423-S425 PolarHBondContact O-N 3.1Å
424	V	35.7	Very low	46.7	Very low	114 Å²	114	124.4 Å²	124.4	69%	0.691	66%	0.66	S	S	*	*			trans	-57.5	107.3	164.5	174.5	0	0	0	0	102.5	K422 S426	K422-V424 PolarHBondContact O-N 3.21Å; V424-S426 PolarHBondContact O-N 3.29Å; V424-S426 VanDerWaalsContact O-N 3.08Å
425	S	39.3	Very low	49.4	Very low	74 Å²	74	124.8 Å²	124.8	52%	0.517	66%	0.661	S	S	.	*			trans	-44.6	123.9	177.8	-41.3	0	0	0	0	106.5	V423 T427 S428	V423-S425 PolarHBondContact O-N 3.1Å; S425-T427 PolarHBondContact O-N 3.3Å; S425-T427 PolarHBondContact O-OG1 2.83Å; S425-S428 PolarHBondContact O-N 3.16Å
426	S	41.9	Very low	51.7	Low	99 Å²	99	118.6 Å²	118.6	69%	0.692	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	7.6	179.4	23.9	0	0	0	0	113.3	V424 S428 Y429	V424-S426 PolarHBondContact O-N 3.29Å; V424-S426 VanDerWaalsContact O-N 3.08Å; S426-S428 PolarHBondContact O-N 3.13Å; S426-Y429 PolarHBondContact O-N 3.47Å
427	T	48.5	Very low	54.5	Low	82 Å²	82	112 Å²	112	50%	0.503	63%	0.625	S	S	.	*	H	α-helix	trans	-58.6	-27.6	170.7	57.9	0	0	0	0	112.3	S425 Y429 T430 D431	S425-T427 PolarHBondContact O-N 3.3Å; S425-T427 PolarHBondContact O-OG1 2.83Å; T427-Y429 VanDerWaalsContact C-N 3.32Å; T427-Y429 PolarHBondContact O-N 3.46Å; T427-T430 PolarHBondContact O-N 3.11Å; T427-D431 VanDerWaalsContact O-CB 3.28Å; T427-D431 WeakPolarHBondContact O-CB 3.31Å; T427-D431 PolarHBondContact O-N 3.13Å; T427-D431 VanDerWaalsContact O-OD2 3.06Å
428	S	62.4	Low	56.9	Low	75 Å²	75	108.2 Å²	108.2	52%	0.524	61%	0.613	S	S	.	*	H	α-helix	trans	-62.8	-33	-178.7	68.3	0	0	0	0	114.8	S425 S426 A432	S425-S428 PolarHBondContact O-N 3.16Å; S426-S428 PolarHBondContact O-N 3.13Å; S428-A432 VanDerWaalsContact O-CB 3.24Å; S428-A432 WeakPolarHBondContact O-CB 3.45Å; S428-A432 PolarHBondContact O-N 3.42Å; S428-A432 VanDerWaalsContact O-N 3.09Å
429	Y	50.7	Low	59.7	Low	173 Å²	173	104.6 Å²	104.6	68%	0.678	60%	0.601	S	S	*	*	H	α-helix	trans	-79.4	-42.4	-178.6	-163.1	-89.3	0	0	0	111.4	S426 T427 D431 A432 L433	S426-Y429 PolarHBondContact O-N 3.47Å; T427-Y429 VanDerWaalsContact C-N 3.32Å; T427-Y429 PolarHBondContact O-N 3.46Å; Y429-D431 VanDerWaalsContact C-N 3.34Å; Y429-A432 PolarHBondContact O-N 2.97Å; Y429-L433 WeakPolarHBondContact O-CB 3.38Å; Y429-L433 PolarHBondContact O-N 3.18Å
430	T	72.9	Confident	62	Low	79 Å²	79	103.8 Å²	103.8	49%	0.485	59%	0.589	S	S	.	*	H	α-helix	trans	-63.8	-41.2	176.1	-45.9	0	0	0	0	111	T427 L433 N434	T427-T430 PolarHBondContact O-N 3.11Å; T430-L433 PolarHBondContact O-N 2.97Å; T430-N434 WeakPolarHBondContact O-CB 3.45Å; T430-N434 PolarHBondContact O-N 3.24Å; T430-N434 PolarHBondContact O-ND2 3.49Å
431	D	73.9	Confident	64.6	Low	95 Å²	95	99.5 Å²	99.5	51%	0.508	57%	0.57	S	S	.	*	H	α-helix	trans	-65.6	-41.2	176.5	-65.5	-22.1	0	0	0	111.6	T427 Y429 N434 L435	T427-D431 VanDerWaalsContact O-CB 3.28Å; T427-D431 WeakPolarHBondContact O-CB 3.31Å; T427-D431 PolarHBondContact O-N 3.13Å; T427-D431 VanDerWaalsContact O-OD2 3.06Å; Y429-D431 VanDerWaalsContact C-N 3.34Å; D431-N434 PolarHBondContact O-N 3.04Å; D431-L435 WeakPolarHBondContact O-CB 3.4Å; D431-L435 PolarHBondContact O-N 3.05Å
432	A	68.4	Low	67.2	Low	57 Å²	57	93.4 Å²	93.4	47%	0.471	55%	0.554	S	S	.	*	H	α-helix	trans	-65	-39.9	175.7	0	0	0	0	0	112.3	S428 Y429 L435 A436	S428-A432 VanDerWaalsContact O-CB 3.24Å; S428-A432 WeakPolarHBondContact O-CB 3.45Å; S428-A432 PolarHBondContact O-N 3.42Å; S428-A432 VanDerWaalsContact O-N 3.09Å; Y429-A432 PolarHBondContact O-N 2.97Å; A432-L435 PolarHBondContact O-N 3.34Å; A432-A436 WeakPolarHBondContact O-CB 3.49Å; A432-A436 PolarHBondContact O-N 3.21Å
433	L	79.5	Confident	69.4	Low	96 Å²	96	89.7 Å²	89.7	50%	0.503	54%	0.543	S	S	.	.	H	α-helix	trans	-65.8	-45.1	176.3	-161.8	83	0	0	0	110.9	Y429 T430 L435 A436 V437	Y429-L433 WeakPolarHBondContact O-CB 3.38Å; Y429-L433 PolarHBondContact O-N 3.18Å; T430-L433 PolarHBondContact O-N 2.97Å; L433-L435 VanDerWaalsContact C-N 3.31Å; L433-L435 PolarHBondContact O-N 2.73Å; L433-A436 PolarHBondContact O-N 3.26Å; L433-V437 WeakPolarHBondContact O-CG2 3.32Å; L433-V437 PolarHBondContact O-N 3.38Å
434	N	84.8	Confident	71.3	Confident	96 Å²	96	89.2 Å²	89.2	51%	0.513	54%	0.537	S	S	.	.	H	α-helix	trans	-61	-40.1	176.5	-72.7	-22.3	0	0	0	111.8	T430 D431 V437 A438	T430-N434 WeakPolarHBondContact O-CB 3.45Å; T430-N434 PolarHBondContact O-N 3.24Å; T430-N434 PolarHBondContact O-ND2 3.49Å; D431-N434 PolarHBondContact O-N 3.04Å; N434-V437 PolarHBondContact O-N 3.06Å; N434-A438 WeakPolarHBondContact O-CB 3.33Å; N434-A438 PolarHBondContact O-N 3.09Å
435	L	84.4	Confident	73.4	Confident	128 Å²	128	89.4 Å²	89.4	67%	0.67	53%	0.53	S	S	*	.	H	α-helix	trans	-66	-41.2	176.4	-172.4	67	0	0	0	112	D431 A432 L433 A438 A439	D431-L435 WeakPolarHBondContact O-CB 3.4Å; D431-L435 PolarHBondContact O-N 3.05Å; A432-L435 PolarHBondContact O-N 3.34Å; L433-L435 VanDerWaalsContact C-N 3.31Å; L433-L435 PolarHBondContact O-N 2.73Å; L435-A438 PolarHBondContact O-N 3.09Å; L435-A439 WeakPolarHBondContact O-CB 3.44Å; L435-A439 PolarHBondContact O-N 2.92Å
436	A	80.9	Confident	74.8	Confident	53 Å²	53	88.5 Å²	88.5	44%	0.438	53%	0.527	S	S	.	.	H	α-helix	trans	-65.4	-41	176.7	0	0	0	0	0	112.1	A432 L433 A439 N440	A432-A436 WeakPolarHBondContact O-CB 3.49Å; A432-A436 PolarHBondContact O-N 3.21Å; L433-A436 PolarHBondContact O-N 3.26Å; A436-A439 PolarHBondContact O-N 3.5Å; A436-N440 PolarHBondContact O-N 2.9Å
437	V	87.8	Confident	76.2	Confident	85 Å²	85	89.8 Å²	89.8	52%	0.515	52%	0.52	S	S	.	.	H	α-helix	trans	-63.3	-46.2	174.5	172.1	0	0	0	0	110.6	L433 N434 A439 N440 T441	L433-V437 WeakPolarHBondContact O-CG2 3.32Å; L433-V437 PolarHBondContact O-N 3.38Å; N434-V437 PolarHBondContact O-N 3.06Å; V437-A439 VanDerWaalsContact C-N 3.34Å; V437-A439 PolarHBondContact O-N 3.33Å; V437-N440 PolarHBondContact O-N 3.27Å; V437-T441 PolarHBondContact O-N 3.44Å; V437-T441 PolarHBondContact O-OG1 3.15Å; V437-T441 VanDerWaalsContact O-OG1 3.04Å
438	A	86.1	Confident	77.1	Confident	56 Å²	56	90 Å²	90	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-60.7	-41	177.3	0	0	0	0	0	112.6	N434 L435 T441 A442	N434-A438 WeakPolarHBondContact O-CB 3.33Å; N434-A438 PolarHBondContact O-N 3.09Å; L435-A438 PolarHBondContact O-N 3.09Å; A438-T441 PolarHBondContact O-N 3.33Å; A438-A442 WeakPolarHBondContact O-CB 3.49Å; A438-A442 PolarHBondContact O-N 2.91Å
439	A	84.9	Confident	77.3	Confident	52 Å²	52	92.2 Å²	92.2	43%	0.43	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-42.3	177	0	0	0	0	0	112.3	L435 A436 V437 A442 L443	L435-A439 WeakPolarHBondContact O-CB 3.44Å; L435-A439 PolarHBondContact O-N 2.92Å; A436-A439 PolarHBondContact O-N 3.5Å; V437-A439 VanDerWaalsContact C-N 3.34Å; V437-A439 PolarHBondContact O-N 3.33Å; A439-A442 PolarHBondContact O-N 3.06Å; A439-L443 PolarHBondContact O-N 2.99Å
440	N	80.4	Confident	77.3	Confident	113 Å²	113	86.4 Å²	86.4	60%	0.604	51%	0.505	S	S	*	.	H	α-helix	trans	-65.4	-42.2	175.4	-85	-15.6	0	0	0	112	A436 V437 A442 L443 N444	A436-N440 PolarHBondContact O-N 2.9Å; V437-N440 PolarHBondContact O-N 3.27Å; N440-A442 PolarHBondContact O-N 3.35Å; N440-L443 PolarHBondContact O-N 3.35Å; N440-N444 WeakPolarHBondContact O-CB 3.25Å; N440-N444 PolarHBondContact O-N 2.92Å
441	T	88	Confident	76.1	Confident	70 Å²	70	86.7 Å²	86.7	43%	0.429	50%	0.503	S	S	.	.	H	α-helix	trans	-61.8	-44.2	176.2	-55.2	0	0	0	0	111.5	V437 A438 L443 N444 E445	V437-T441 PolarHBondContact O-N 3.44Å; V437-T441 PolarHBondContact O-OG1 3.15Å; V437-T441 VanDerWaalsContact O-OG1 3.04Å; A438-T441 PolarHBondContact O-N 3.33Å; T441-L443 VanDerWaalsContact C-N 3.35Å; T441-L443 PolarHBondContact O-N 2.95Å; T441-N444 PolarHBondContact O-N 3.03Å; T441-N444 VanDerWaalsContact O-N 3.17Å; T441-E445 PolarHBondContact O-N 3.11Å
442	A	87.1	Confident	75.1	Confident	56 Å²	56	87.2 Å²	87.2	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-62.4	-39.8	177.9	0	0	0	0	0	112.6	A438 A439 N440 A446	A438-A442 WeakPolarHBondContact O-CB 3.49Å; A438-A442 PolarHBondContact O-N 2.91Å; A439-A442 PolarHBondContact O-N 3.06Å; N440-A442 PolarHBondContact O-N 3.35Å; A442-A446 WeakPolarHBondContact O-CB 3.41Å; A442-A446 PolarHBondContact O-N 3.35Å
443	L	83.6	Confident	74.1	Confident	121 Å²	121	88 Å²	88	63%	0.634	51%	0.512	S	S	*	.	H	α-helix	trans	-64.1	-40.9	173.8	-80.1	170.3	0	0	0	111.9	A439 N440 T441 A446 F447	A439-L443 PolarHBondContact O-N 2.99Å; N440-L443 PolarHBondContact O-N 3.35Å; T441-L443 VanDerWaalsContact C-N 3.35Å; T441-L443 PolarHBondContact O-N 2.95Å; L443-A446 PolarHBondContact O-N 3.01Å; L443-F447 WeakPolarHBondContact O-CB 3.26Å; L443-F447 PolarHBondContact O-N 3.28Å
444	N	75.7	Confident	72.1	Confident	100 Å²	100	87.9 Å²	87.9	54%	0.535	52%	0.515	S	S	.	.	H	α-helix	trans	-69.5	-38.9	-179.7	-136.4	18.6	0	0	0	111.8	N440 T441 F447 N448	N440-N444 WeakPolarHBondContact O-CB 3.25Å; N440-N444 PolarHBondContact O-N 2.92Å; T441-N444 PolarHBondContact O-N 3.03Å; T441-N444 VanDerWaalsContact O-N 3.17Å; N444-F447 PolarHBondContact O-N 3.1Å; N444-N448 WeakPolarHBondContact O-CB 3.21Å; N444-N448 VanDerWaalsContact O-CG 3.27Å; N444-N448 PolarHBondContact O-N 3.48Å; N444-N448 PolarHBondContact O-ND2 2.91Å; N444-N448 VanDerWaalsContact O-ND2 3.14Å
445	E	80.6	Confident	69.8	Low	117 Å²	117	90.2 Å²	90.2	55%	0.547	53%	0.527	S	S	.	.	H	α-helix	trans	-65.1	-41.6	172.8	-75.4	-175.9	178.2	0	0	112.2	T441 F447 N448 Q449	T441-E445 PolarHBondContact O-N 3.11Å; E445-F447 VanDerWaalsContact C-N 3.32Å; E445-F447 PolarHBondContact O-N 3.26Å; E445-N448 PolarHBondContact O-N 2.9Å; E445-Q449 WeakPolarHBondContact O-CB 3.47Å; E445-Q449 WeakPolarHBondContact O-CG 3.45Å; E445-Q449 PolarHBondContact O-N 2.99Å
446	A	69.1	Low	67.3	Low	56 Å²	56	88.5 Å²	88.5	46%	0.463	53%	0.527	S	S	.	.	H	α-helix	trans	-62.6	-40.7	175.1	0	0	0	0	0	111.5	A442 L443 Q449 S450	A442-A446 WeakPolarHBondContact O-CB 3.41Å; A442-A446 PolarHBondContact O-N 3.35Å; L443-A446 PolarHBondContact O-N 3.01Å; A446-Q449 PolarHBondContact O-N 2.76Å; A446-S450 PolarHBondContact O-N 3.05Å; A446-S450 VanDerWaalsContact O-N 3.09Å
447	F	70.7	Confident	64.9	Low	126 Å²	126	95.8 Å²	95.8	55%	0.553	54%	0.544	S	S	*	.	H	α-helix	trans	-63	-47.3	175.2	-172.3	-104.9	0	0	0	111.5	L443 N444 E445 Q449 S450 I451	L443-F447 WeakPolarHBondContact O-CB 3.26Å; L443-F447 PolarHBondContact O-N 3.28Å; N444-F447 PolarHBondContact O-N 3.1Å; E445-F447 VanDerWaalsContact C-N 3.32Å; E445-F447 PolarHBondContact O-N 3.26Å; F447-Q449 VanDerWaalsContact C-N 3.35Å; F447-Q449 PolarHBondContact O-N 2.93Å; F447-S450 WeakPolarHBondContact O-CB 3.45Å; F447-S450 PolarHBondContact O-N 3.22Å; F447-S450 VanDerWaalsContact O-N 3.11Å; F447-S450 PolarHBondContact O-OG 2.94Å; F447-I451 HydrophobicContact CD1-CD1 3.78Å; F447-I451 HydrophobicContact CE1-CD1 3.52Å; F447-I451 HydrophobicContact CE1-CG1 4.45Å; F447-I451 HydrophobicContact CZ-CD1 4.13Å; F447-I451 WeakPolarHBondContact O-CG1 3.33Å; F447-I451 PolarHBondContact O-N 2.93Å
448	N	66.9	Low	62.2	Low	86 Å²	86	99.9 Å²	99.9	46%	0.46	56%	0.558	S	S	.	*	H	α-helix	trans	-66.9	-32.6	179.2	-69.7	-32.3	0	0	0	113.4	N444 E445 S450 I451 T452	N444-N448 WeakPolarHBondContact O-CB 3.21Å; N444-N448 VanDerWaalsContact O-CG 3.27Å; N444-N448 PolarHBondContact O-N 3.48Å; N444-N448 PolarHBondContact O-ND2 2.91Å; N444-N448 VanDerWaalsContact O-ND2 3.14Å; E445-N448 PolarHBondContact O-N 2.9Å; N448-S450 VanDerWaalsContact C-N 3.34Å; N448-I451 PolarHBondContact O-N 2.97Å; N448-T452 PolarHBondContact O-N 3.3Å; N448-T452 VanDerWaalsContact O-N 3.14Å; N448-T452 PolarHBondContact O-OG1 2.95Å
449	Q	65.7	Low	59.5	Low	121 Å²	121	106.4 Å²	106.4	57%	0.565	58%	0.576	S	S	*	*	H	α-helix	trans	-66.1	-35.4	171.2	-78.5	179.7	72.8	0	0	112.4	E445 A446 F447 I451 T452 S453	E445-Q449 WeakPolarHBondContact O-CB 3.47Å; E445-Q449 WeakPolarHBondContact O-CG 3.45Å; E445-Q449 PolarHBondContact O-N 2.99Å; A446-Q449 PolarHBondContact O-N 2.76Å; F447-Q449 VanDerWaalsContact C-N 3.35Å; F447-Q449 PolarHBondContact O-N 2.93Å; Q449-I451 VanDerWaalsContact C-N 3.34Å; Q449-I451 PolarHBondContact O-N 3.36Å; Q449-T452 WeakPolarHBondContact CA-OG1 3.41Å; Q449-T452 PolarHBondContact O-OG1 3.3Å; Q449-S453 WeakPolarHBondContact O-CB 3.46Å; Q449-S453 PolarHBondContact O-N 2.85Å; Q449-S453 PolarHBondContact O-OG 3.46Å
450	S	51.2	Low	56.9	Low	52 Å²	52	109.8 Å²	109.8	36%	0.364	59%	0.591	S	S	.	*	H	α-helix	trans	-65.9	-36.5	176.7	78.9	0	0	0	0	112.4	A446 F447 N448	A446-S450 PolarHBondContact O-N 3.05Å; A446-S450 VanDerWaalsContact O-N 3.09Å; F447-S450 WeakPolarHBondContact O-CB 3.45Å; F447-S450 PolarHBondContact O-N 3.22Å; F447-S450 VanDerWaalsContact O-N 3.11Å; F447-S450 PolarHBondContact O-OG 2.94Å; N448-S450 VanDerWaalsContact C-N 3.34Å
451	I	48.3	Very low	54.3	Low	84 Å²	84	112.9 Å²	112.9	43%	0.431	61%	0.607	S	S	.	*	H	α-helix	trans	-74.2	-40.5	179.5	-53.9	162.1	0	0	0	110.8	F447 N448 Q449 S453 T454	F447-I451 HydrophobicContact CD1-CD1 3.78Å; F447-I451 HydrophobicContact CE1-CD1 3.52Å; F447-I451 HydrophobicContact CE1-CG1 4.45Å; F447-I451 HydrophobicContact CZ-CD1 4.13Å; F447-I451 WeakPolarHBondContact O-CG1 3.33Å; F447-I451 PolarHBondContact O-N 2.93Å; N448-I451 PolarHBondContact O-N 2.97Å; Q449-I451 VanDerWaalsContact C-N 3.34Å; Q449-I451 PolarHBondContact O-N 3.36Å; I451-S453 VanDerWaalsContact C-N 3.3Å; I451-S453 PolarHBondContact O-N 2.93Å; I451-T454 PolarHBondContact O-N 2.9Å; I451-T454 PolarHBondContact O-OG1 2.94Å
452	T	52.3	Low	51.4	Low	106 Å²	106	113.7 Å²	113.7	65%	0.65	62%	0.616	S	S	*	*	H	α-helix	trans	-72.1	-23.8	178.4	39.2	0	0	0	0	113.2	N448 Q449	N448-T452 PolarHBondContact O-N 3.3Å; N448-T452 VanDerWaalsContact O-N 3.14Å; N448-T452 PolarHBondContact O-OG1 2.95Å; Q449-T452 WeakPolarHBondContact CA-OG1 3.41Å; Q449-T452 PolarHBondContact O-OG1 3.3Å
453	S	47.7	Very low	48.7	Very low	74 Å²	74	117.2 Å²	117.2	52%	0.517	63%	0.632	S	S	.	*	G	3₁₀ helix	trans	-80.7	-12.3	176.6	-57.2	0	0	0	0	113.8	Q449 I451	Q449-S453 WeakPolarHBondContact O-CB 3.46Å; Q449-S453 PolarHBondContact O-N 2.85Å; Q449-S453 PolarHBondContact O-OG 3.46Å; I451-S453 VanDerWaalsContact C-N 3.3Å; I451-S453 PolarHBondContact O-N 2.93Å
454	T	37.4	Very low	45.9	Very low	93 Å²	93	117 Å²	117	57%	0.571	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-82.3	-10.8	179.6	39.1	0	0	0	0	114.9	I451 S456	I451-T454 PolarHBondContact O-N 2.9Å; I451-T454 PolarHBondContact O-OG1 2.94Å; T454-S456 VanDerWaalsContact C-N 3.31Å; T454-S456 PolarHBondContact O-N 3.34Å
455	D	36.5	Very low	43.8	Very low	145 Å²	145	120.6 Å²	120.6	78%	0.775	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-82	-1.7	177.2	-79.9	-17	0	0	0	114.3
456	S	32.9	Very low	41.2	Very low	93 Å²	93	122.5 Å²	122.5	65%	0.65	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-95.8	6.5	-178.2	77.2	0	0	0	0	115.9	T454 Q458	T454-S456 VanDerWaalsContact C-N 3.31Å; T454-S456 PolarHBondContact O-N 3.34Å; S456-Q458 VanDerWaalsContact C-N 3.34Å
457	Y	30.1	Very low	39.1	Very low	206 Å²	206	125.9 Å²	125.9	81%	0.808	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-86.8	-0.1	178.2	-81.9	-76.3	0	0	0	115
458	Q	31.7	Very low	37	Very low	171 Å²	171	125.8 Å²	125.8	80%	0.799	70%	0.695	S	S	*	*	S	Bend	trans	-115.1	116.9	169.8	-69.8	-81.3	16.3	0	0	108	S456	S456-Q458 VanDerWaalsContact C-N 3.34Å
459	K	28.9	Very low	35.2	Very low	193 Å²	193	128.7 Å²	128.7	84%	0.839	71%	0.709	S	S	*	*			trans	88.8	86.5	162.8	-150.9	176.6	-164.1	176	0	116.2
460	T	30.8	Very low	33.3	Very low	122 Å²	122	127.8 Å²	127.8	75%	0.748	72%	0.717	S	S	*	*				-166.5	73.4	129.4	48.9	0	0	0	0	110.8	S462	T460-S462 PolarHBondContact O-N 3.2Å
461	N	26.1	Very low	32	Very low	178 Å²	178	134.2 Å²	134.2	95%	0.952	74%	0.738	S	S	*	*			trans	-83.8	73.2	147.1	-85.5	-16.6	0	0	0	107.2
462	S	26.4	Very low	31	Very low	88 Å²	88	139.6 Å²	139.6	62%	0.615	76%	0.759	S	S	*	*			trans	-179.2	102.6	164.3	54.6	0	0	0	0	108.7	T460	T460-S462 PolarHBondContact O-N 3.2Å
463	T	29.7	Very low	29.8	Very low	130 Å²	130	143.6 Å²	143.6	80%	0.798	77%	0.77	S	S	*	*				175.9	81.9	129.7	-66.5	0	0	0	0	106.1	Q465	T463-Q465 PolarHBondContact O-N 2.94Å
464	S	24.5	Very low	28.7	Very low	117 Å²	117	148.4 Å²	148.4	82%	0.818	78%	0.784	S	S	*	*			trans	-71.5	103.6	153.6	51.4	0	0	0	0	107.9
465	Q	31.5	Very low	28.1	Very low	174 Å²	174	153.5 Å²	153.5	81%	0.813	80%	0.798	S	S	*	*			trans	-145.4	122	150.4	-76.3	-149.9	-1.1	0	0	111	T463	T463-Q465 PolarHBondContact O-N 2.94Å
466	N	25.8	Very low	27.6	Very low	157 Å²	157	155.6 Å²	155.6	84%	0.84	80%	0.801	S	S	*	*			trans	-52.5	128.2	174.7	-62	-41.9	0	0	0	112.1
467	T	26.6	Very low	27.1	Very low	127 Å²	127	161.1 Å²	161.1	78%	0.779	81%	0.813	S	S	*	*			trans	-147.2	102.5	143.9	25.2	0	0	0	0	109	I469	T467-I469 PolarHBondContact O-N 2.93Å
468	P	27	Very low	26.9	Very low	125 Å²	125	157.2 Å²	157.2	81%	0.812	81%	0.811	S	S	*	*			trans	-71	109.7	172.1	26.1	-29	0	0	0	109.1	S470	P468-S470 PolarHBondContact O-N 3.5Å; P468-S470 VanDerWaalsContact O-N 3.11Å
469	I	28.6	Very low	26.5	Very low	146 Å²	146	155.9 Å²	155.9	75%	0.749	82%	0.815	S	S	*	*			trans	-70.6	107.3	172.3	-64.6	171.9	0	0	0	107.8	T467 F471	T467-I469 PolarHBondContact O-N 2.93Å; I469-F471 PolarHBondContact O-N 3.47Å
470	S	25.5	Very low	26.2	Very low	103 Å²	103	152.9 Å²	152.9	72%	0.72	81%	0.813	S	S	*	*			trans	-59.2	110.3	175	175.4	0	0	0	0	111.4	P468 K472	P468-S470 PolarHBondContact O-N 3.5Å; P468-S470 VanDerWaalsContact O-N 3.11Å; S470-K472 PolarHBondContact O-N 3.12Å
471	F	24.5	Very low	26	Very low	186 Å²	186	152.3 Å²	152.3	82%	0.816	81%	0.814	S	S	*	*			trans	-80.7	110.7	161.8	-85.4	-87.4	0	0	0	108.7	I469 Q473	I469-F471 PolarHBondContact O-N 3.47Å; F471-Q473 PolarHBondContact O-N 3.32Å
472	K	26.8	Very low	26	Very low	198 Å²	198	149.6 Å²	149.6	86%	0.861	81%	0.806	S	S	*	*			trans	-61.9	100.5	171.3	-73.4	-177	176.5	178.4	0	109.5	S470 Q474	S470-K472 PolarHBondContact O-N 3.12Å; K472-Q474 PolarHBondContact O-N 3.47Å
473	Q	27.8	Very low	26.1	Very low	189 Å²	189	153.5 Å²	153.5	88%	0.883	82%	0.818	S	S	*	*			trans	-71.8	115.8	169.1	-73.4	179.8	-21.6	0	0	109.5	F471	F471-Q473 PolarHBondContact O-N 3.32Å
474	Q	22.9	Very low	25.9	Very low	175 Å²	175	154.7 Å²	154.7	82%	0.818	82%	0.82	S	S	*	*			trans	-75.1	122.9	177.6	-170.7	169.5	-7.5	0	0	109.6	K472 F476	K472-Q474 PolarHBondContact O-N 3.47Å; Q474-F476 PolarHBondContact O-N 2.92Å
475	K	24.4	Very low	25.8	Very low	201 Å²	201	155.1 Å²	155.1	87%	0.874	82%	0.82	S	S	*	*			trans	-62.7	114.4	-176.4	-66.4	173	176.5	179	0	111.5
476	F	25.9	Very low	25.5	Very low	188 Å²	188	150.3 Å²	150.3	83%	0.825	82%	0.816	S	S	*	*			trans	-96.2	123.7	153.6	-81.4	-79.3	0	0	0	108.8	Q474 T478	Q474-F476 PolarHBondContact O-N 2.92Å; F476-T478 PolarHBondContact O-N 3Å
477	K	24	Very low	25.6	Very low	209 Å²	209	148.6 Å²	148.6	91%	0.909	82%	0.817	S	S	*	*			trans	-71.6	107.1	174.4	-94.3	173.4	168.6	178	0	108.6
478	T	25.1	Very low	25.4	Very low	125 Å²	125	147.8 Å²	147.8	77%	0.767	82%	0.816	S	S	*	*			trans	-87.8	117.2	165.5	-4.1	0	0	0	0	108.4	F476 T480	F476-T478 PolarHBondContact O-N 3Å; T478-T480 PolarHBondContact O-N 3.47Å
479	T	22.5	Very low	25.4	Very low	143 Å²	143	149.5 Å²	149.5	88%	0.877	82%	0.817	S	S	*	*			trans	-84.9	102.5	168.1	40.8	0	0	0	0	108.5
480	T	24	Very low	25.2	Very low	130 Å²	130	150 Å²	150	80%	0.798	82%	0.819	S	S	*	*			trans	-107	118.7	173.6	-14.1	0	0	0	0	108.2	T478	T478-T480 PolarHBondContact O-N 3.47Å
481	S	26.8	Very low	25.3	Very low	109 Å²	109	151.3 Å²	151.3	76%	0.762	82%	0.823	S	S	*	*			trans	-96.8	142.5	164.4	40.2	0	0	0	0	109.8
482	P	25.1	Very low	25.1	Very low	122 Å²	122	149.7 Å²	149.7	79%	0.792	82%	0.823	S	S	*	*			trans	-93	134.6	-165.3	35.5	-30.7	0	0	0	111.4
483	I	28.1	Very low	25.2	Very low	170 Å²	170	149 Å²	149	87%	0.872	82%	0.823	S	S	*	*			trans	-115.2	125.6	164.2	-65.2	175.2	0	0	0	107.8
484	N	25.3	Very low	25	Very low	155 Å²	155	151 Å²	151	83%	0.829	82%	0.823	S	S	*	*			trans	-62.4	145.3	-167.7	-95.5	-40	0	0	0	114.1
485	P	24.4	Very low	25.1	Very low	126 Å²	126	147.8 Å²	147.8	82%	0.818	82%	0.819	S	S	*	*			trans	-83.7	123.5	172.5	32.9	-29.8	0	0	0	110.5
486	G	24.8	Very low	25.1	Very low	72 Å²	72	144.4 Å²	144.4	74%	0.742	82%	0.818	S	S	*	*			trans	-154.1	89	176.5	0	0	0	0	0	111
487	S	28.3	Very low	25.2	Very low	122 Å²	122	139.6 Å²	139.6	85%	0.853	81%	0.813	S	S	*	*			trans	162	96.7	138.9	48.6	0	0	0	0	109.3
488	S	21.1	Very low	25.3	Very low	109 Å²	109	138.3 Å²	138.3	76%	0.762	81%	0.81	S	S	*	*			trans	-64.2	141.5	149.5	40.5	0	0	0	0	109.1
489	I	27.9	Very low	25.4	Very low	161 Å²	161	140.2 Å²	140.2	83%	0.826	82%	0.815	S	S	*	*				178.2	131.8	124.3	-84	151.5	0	0	0	108
490	I	23.7	Very low	25.6	Very low	157 Å²	157	140.1 Å²	140.1	81%	0.805	81%	0.809	S	S	*	*			trans	-73.8	138.8	-179.7	-65	155.2	0	0	0	109.1
491	T	27.5	Very low	25.7	Very low	131 Å²	131	142.3 Å²	142.3	80%	0.804	82%	0.815	S	S	*	*			trans	-146.3	118.7	153.1	-19.9	0	0	0	0	109.6
492	N	21.1	Very low	25.7	Very low	152 Å²	152	142.8 Å²	142.8	81%	0.813	81%	0.813	S	S	*	*			trans	-90.7	111.9	177.9	-135.7	-2.2	0	0	0	106.1
493	E	28.5	Very low	25.8	Very low	182 Å²	182	143 Å²	143	85%	0.85	81%	0.814	S	S	*	*			trans	-145.8	139.3	168.3	-88.6	-65.2	154.8	0	0	109.2
494	R	22.7	Very low	25.8	Very low	233 Å²	233	142.9 Å²	142.9	88%	0.879	81%	0.814	S	S	*	*			trans	-111.9	115.6	-158.3	169.2	-171.8	-171.4	168.9	2.5	108.3
495	S	25.5	Very low	25.8	Very low	107 Å²	107	142.2 Å²	142.2	75%	0.748	81%	0.81	S	S	*	*			trans	-173.5	139.9	143.1	55.4	0	0	0	0	112.2
496	P	25.3	Very low	25.8	Very low	130 Å²	130	141.2 Å²	141.2	84%	0.844	81%	0.812	S	S	*	*			trans	-86.9	114.1	173.1	32.2	-27.5	0	0	0	110
497	A	28.4	Very low	25.8	Very low	87 Å²	87	143.8 Å²	143.8	72%	0.719	81%	0.813	S	S	*	*			trans	-95.6	120.1	170.9	0	0	0	0	0	109.6	L499	A497-L499 PolarHBondContact O-N 3.19Å
498	E	25.1	Very low	25.6	Very low	182 Å²	182	147.6 Å²	147.6	85%	0.85	82%	0.815	S	S	*	*			trans	-57.9	116.6	170	-65.7	176.5	151.7	0	0	109.7	N500	E498-N500 PolarHBondContact O-N 2.93Å
499	L	28	Very low	25.9	Very low	165 Å²	165	150.2 Å²	150.2	86%	0.864	82%	0.817	S	S	*	*			trans	-81.5	97.8	175.8	-76	171.1	0	0	0	109.4	A497 L501	A497-L499 PolarHBondContact O-N 3.19Å; L499-L501 PolarHBondContact O-N 2.97Å
500	N	26.1	Very low	25.6	Very low	141 Å²	141	150.7 Å²	150.7	75%	0.754	82%	0.815	S	S	*	*			trans	-55.4	116.7	164.7	-73.9	-56.7	0	0	0	110.2	E498 T502	E498-N500 PolarHBondContact O-N 2.93Å; N500-T502 PolarHBondContact O-N 3.09Å
501	L	25.1	Very low	25.8	Very low	176 Å²	176	150.5 Å²	150.5	92%	0.921	82%	0.816	S	S	*	*			trans	-80.3	92.5	166.5	-71.5	163.4	0	0	0	108.1	L499	L499-L501 PolarHBondContact O-N 2.97Å
502	T	27.2	Very low	25.8	Very low	118 Å²	118	152.5 Å²	152.5	72%	0.724	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-81.3	135.3	167.9	41	0	0	0	0	110.7	N500	N500-T502 PolarHBondContact O-N 3.09Å
503	P	28.1	Very low	26	Very low	127 Å²	127	151.3 Å²	151.3	83%	0.825	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-70.7	133.5	-177.4	-13.3	28.9	0	0	0	111.9
504	I	26.7	Very low	26	Very low	167 Å²	167	149.8 Å²	149.8	86%	0.856	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-77.7	133.6	178.3	-68.9	166.1	0	0	0	110.5
505	D	27.3	Very low	26.1	Very low	142 Å²	142	144.3 Å²	144.3	76%	0.759	80%	0.803	S	S	*	*			trans	-19.2	130.3	-179.8	-66.3	-52.6	0	0	0	120.5	V507	D505-V507 PolarHBondContact O-N 3.39Å
506	A	23.4	Very low	26	Very low	104 Å²	104	144 Å²	144	86%	0.86	80%	0.799	S	S	*	*			trans	-66.4	106.1	165.1	0	0	0	0	0	111.1	K508	A506-K508 PolarHBondContact O-N 3.31Å
507	V	25.2	Very low	26	Very low	126 Å²	126	146.1 Å²	146.1	76%	0.764	80%	0.798	S	S	*	*			trans	-77.3	105.3	168.1	-178.4	0	0	0	0	108.9	D505 M509	D505-V507 PolarHBondContact O-N 3.39Å; V507-M509 PolarHBondContact O-N 3.48Å; V507-M509 VanDerWaalsContact O-N 3.09Å
508	K	24.4	Very low	25.9	Very low	203 Å²	203	152.8 Å²	152.8	88%	0.883	80%	0.804	S	S	*	*			trans	-48.1	106.7	163	-98.7	172.7	166.8	175.8	0	109.7	A506	A506-K508 PolarHBondContact O-N 3.31Å
509	M	26.1	Very low	25.8	Very low	164 Å²	164	150.2 Å²	150.2	81%	0.808	80%	0.801	S	S	*	*			trans	-111.6	119.9	160.9	-86.8	-76.8	-152	0	0	108.6	V507 N511	V507-M509 PolarHBondContact O-N 3.48Å; V507-M509 VanDerWaalsContact O-N 3.09Å; M509-N511 PolarHBondContact O-N 3.23Å; M509-N511 VanDerWaalsContact O-N 3.11Å
510	E	23.1	Very low	25.8	Very low	170 Å²	170	151.5 Å²	151.5	79%	0.794	80%	0.8	S	S	*	*			trans	-71.4	91.1	-172.6	-167.9	177.5	-161.7	0	0	109.8	K512	E510-K512 PolarHBondContact O-N 2.92Å
511	N	26.7	Very low	25.7	Very low	153 Å²	153	152 Å²	152	82%	0.818	80%	0.801	S	S	*	*			trans	-74.3	95.9	172.4	-81.2	-23.3	0	0	0	109.4	M509 T513	M509-N511 PolarHBondContact O-N 3.23Å; M509-N511 VanDerWaalsContact O-N 3.11Å; N511-T513 PolarHBondContact O-N 3.03Å
512	K	27.4	Very low	25.8	Very low	174 Å²	174	148.8 Å²	148.8	76%	0.757	79%	0.793	S	S	*	*			trans	-50.4	124.6	166.6	-77.7	177	177.6	174.5	0	109.9	E510 N514	E510-K512 PolarHBondContact O-N 2.92Å; K512-N514 VanDerWaalsContact C-N 3.33Å; K512-N514 PolarHBondContact O-N 3.47Å
513	T	25.7	Very low	25.9	Very low	126 Å²	126	151.4 Å²	151.4	77%	0.773	80%	0.795	S	S	*	*			trans	-68.8	76.6	-178	40.6	0	0	0	0	111.7	N511 T515	N511-T513 PolarHBondContact O-N 3.03Å; T513-T515 PolarHBondContact O-N 2.94Å; T513-T515 PolarHBondContact O-OG1 3.06Å
514	N	28.1	Very low	26	Very low	151 Å²	151	151 Å²	151	81%	0.807	79%	0.792	S	S	*	*			trans	-74.9	98.2	164.4	-75.6	-13.2	0	0	0	108.9	K512 C516	K512-N514 VanDerWaalsContact C-N 3.33Å; K512-N514 PolarHBondContact O-N 3.47Å; N514-C516 VanDerWaalsContact C-N 3.28Å; N514-C516 PolarHBondContact O-N 2.94Å
515	T	26.2	Very low	26	Very low	118 Å²	118	153.2 Å²	153.2	72%	0.724	79%	0.791	S	S	*	*			trans	-68.7	80.6	178.7	-54.5	0	0	0	0	109	T513 Q517	T513-T515 PolarHBondContact O-N 2.94Å; T513-T515 PolarHBondContact O-OG1 3.06Å; T515-Q517 PolarHBondContact O-N 3.48Å
516	C	23.4	Very low	26.1	Very low	101 Å²	101	155.2 Å²	155.2	68%	0.682	79%	0.793	S	S	*	*			trans	-79.2	106	169.1	-86.6	0	0	0	0	109.3	N514 W518	N514-C516 VanDerWaalsContact C-N 3.28Å; N514-C516 PolarHBondContact O-N 2.94Å; C516-W518 PolarHBondContact O-N 3.35Å
517	Q	25.4	Very low	26.3	Very low	173 Å²	173	157.4 Å²	157.4	81%	0.808	79%	0.79	S	S	*	*			trans	-61.1	93.9	170.7	-69.3	-101.5	-1.3	0	0	109.7	T515 T519	T515-Q517 PolarHBondContact O-N 3.48Å; Q517-T519 PolarHBondContact O-N 3.47Å
518	W	24.3	Very low	26.3	Very low	227 Å²	227	158.2 Å²	158.2	86%	0.86	79%	0.789	S	S	*	*			trans	-80.2	106.7	167.1	-72.9	92.2	0	0	0	109	C516 K520	C516-W518 PolarHBondContact O-N 3.35Å; W518-K520 PolarHBondContact O-N 2.9Å
519	T	24.8	Very low	26.6	Very low	128 Å²	128	153.2 Å²	153.2	79%	0.785	78%	0.779	S	S	*	*			trans	-63.7	105.7	172.1	-46.7	0	0	0	0	109	Q517 I521	Q517-T519 PolarHBondContact O-N 3.47Å; T519-I521 PolarHBondContact O-N 2.99Å
520	K	26.3	Very low	26.5	Very low	192 Å²	192	153.1 Å²	153.1	84%	0.835	78%	0.781	S	S	*	*			trans	-62	97.3	174.5	-70.4	177.1	178.9	175.8	0	109.9	W518 S522	W518-K520 PolarHBondContact O-N 2.9Å; K520-S522 VanDerWaalsContact C-N 3.26Å; K520-S522 PolarHBondContact O-N 3.25Å; K520-S522 VanDerWaalsContact O-N 3.08Å
521	I	25.6	Very low	26.7	Very low	152 Å²	152	149.2 Å²	149.2	78%	0.779	77%	0.772	S	S	*	*			trans	-81.2	87.6	160	-59.7	174.4	0	0	0	106.6	T519 K523	T519-I521 PolarHBondContact O-N 2.99Å; I521-K523 PolarHBondContact O-N 2.91Å
522	S	27.1	Very low	26.7	Very low	108 Å²	108	147.6 Å²	147.6	76%	0.755	77%	0.771	S	S	*	*			trans	-70.7	113.4	168	51.7	0	0	0	0	108.6	K520	K520-S522 VanDerWaalsContact C-N 3.26Å; K520-S522 PolarHBondContact O-N 3.25Å; K520-S522 VanDerWaalsContact O-N 3.08Å
523	K	28.7	Very low	26.6	Very low	174 Å²	174	147.4 Å²	147.4	76%	0.757	78%	0.776	S	S	*	*			trans	-118.4	127.1	153.2	-75.4	-170.5	180	-179.6	0	107.7	I521 Y525	I521-K523 PolarHBondContact O-N 2.91Å; K523-Y525 PolarHBondContact O-N 2.94Å; K523-Y525 VanDerWaalsContact O-N 3.11Å
524	P	29.9	Very low	26.5	Very low	117 Å²	117	145.8 Å²	145.8	76%	0.76	77%	0.77	S	S	*	*			trans	-73	107.3	-170.5	29	-33.1	0	0	0	109.5	K526	P524-K526 VanDerWaalsContact C-N 3.34Å; P524-K526 PolarHBondContact O-N 2.97Å
525	Y	26.5	Very low	26.3	Very low	215 Å²	215	143.5 Å²	143.5	84%	0.843	77%	0.766	S	S	*	*			trans	-67.9	99.9	159.8	-89.7	-91.8	0	0	0	107.2	K523 N527	K523-Y525 PolarHBondContact O-N 2.94Å; K523-Y525 VanDerWaalsContact O-N 3.11Å; Y525-N527 PolarHBondContact O-N 2.93Å
526	K	29.2	Very low	26.3	Very low	183 Å²	183	146 Å²	146	80%	0.796	77%	0.773	S	S	*	*			trans	-63.2	103.8	167	-75.6	-179.3	177.2	-179.6	0	107.1	P524 I528	P524-K526 VanDerWaalsContact C-N 3.34Å; P524-K526 PolarHBondContact O-N 2.97Å; K526-I528 PolarHBondContact O-N 3.31Å
527	N	27.9	Very low	26.5	Very low	150 Å²	150	144.9 Å²	144.9	80%	0.802	77%	0.766	S	S	*	*			trans	-62.1	98.2	166.8	-67.4	-32.2	0	0	0	107.7	Y525 S529	Y525-N527 PolarHBondContact O-N 2.93Å; N527-S529 PolarHBondContact O-N 3.32Å
528	I	26.2	Very low	26.4	Very low	144 Å²	144	145.2 Å²	145.2	74%	0.738	77%	0.768	S	S	*	*			trans	-80	83.5	169.2	-47.7	172.8	0	0	0	105.8	K526 L530	K526-I528 PolarHBondContact O-N 3.31Å; I528-L530 HydrophobicContact CG2-CD2 4.35Å; I528-L530 HydrophobicContact CG2-CG 4.37Å; I528-L530 PolarHBondContact O-N 3.27Å
529	S	29.8	Very low	26.5	Very low	97 Å²	97	145 Å²	145	68%	0.678	77%	0.768	S	S	*	*			trans	-70.7	103.9	167.2	58.9	0	0	0	0	107.9	N527 S531	N527-S529 PolarHBondContact O-N 3.32Å; S529-S531 PolarHBondContact O-N 2.83Å
530	L	25	Very low	26.5	Very low	163 Å²	163	145.9 Å²	145.9	85%	0.853	77%	0.768	S	S	*	*			trans	-77.1	79.5	171.3	-69.8	164.6	0	0	0	108.6	I528	I528-L530 HydrophobicContact CG2-CD2 4.35Å; I528-L530 HydrophobicContact CG2-CG 4.37Å; I528-L530 PolarHBondContact O-N 3.27Å
531	S	27.6	Very low	26.7	Very low	87 Å²	87	144.7 Å²	144.7	61%	0.608	77%	0.771	S	S	*	*			trans	-76.4	132.1	162.5	-60.9	0	0	0	0	108.4	S529 I533	S529-S531 PolarHBondContact O-N 2.83Å; S531-I533 PolarHBondContact O-N 2.89Å; S531-I533 VanDerWaalsContact O-N 3.1Å
532	P	25.1	Very low	26.6	Very low	120 Å²	120	140.3 Å²	140.3	78%	0.779	76%	0.763	S	S	*	*			trans	-69.7	109.4	-179.4	13.7	-8.4	0	0	0	109.3	S534	P532-S534 PolarHBondContact O-N 2.89Å; P532-S534 VanDerWaalsContact O-N 3.1Å
533	I	26.1	Very low	26.8	Very low	170 Å²	170	143 Å²	143	87%	0.872	77%	0.769	S	S	*	*			trans	-78.3	97.3	175.8	-60.1	173.5	0	0	0	107.6	S531	S531-I533 PolarHBondContact O-N 2.89Å; S531-I533 VanDerWaalsContact O-N 3.1Å
534	S	23	Very low	26.8	Very low	92 Å²	92	143.4 Å²	143.4	64%	0.643	77%	0.771	S	S	*	*			trans	-84.5	132.8	164.5	-58.5	0	0	0	0	109.2	P532	P532-S534 PolarHBondContact O-N 2.89Å; P532-S534 VanDerWaalsContact O-N 3.1Å
535	S	24.1	Very low	26.6	Very low	103 Å²	103	144.8 Å²	144.8	72%	0.72	77%	0.772	S	S	*	*			trans	57.7	114.2	153.8	52.7	0	0	0	0	118.9
536	I	27.1	Very low	26.6	Very low	170 Å²	170	140 Å²	140	87%	0.872	77%	0.77	S	S	*	*				-171.1	154.5	116.9	-103.2	158.1	0	0	0	112.8
537	S	26.1	Very low	26.3	Very low	77 Å²	77	136.6 Å²	136.6	54%	0.538	77%	0.769	S	S	.	*			trans	-62.7	145.1	-163.6	48.8	0	0	0	0	117.7
538	Q	24.9	Very low	26.2	Very low	181 Å²	181	134.9 Å²	134.9	85%	0.846	76%	0.764	S	S	*	*			trans	18	103.8	130.9	-64.7	175.9	-5.3	0	0	116.4
539	Y	26.4	Very low	26.2	Very low	222 Å²	222	133.9 Å²	133.9	87%	0.871	76%	0.76	S	S	*	*			trans	-123.4	98.5	148	-91.5	-91.8	0	0	0	107.6
540	N	24.4	Very low	26.1	Very low	146 Å²	146	137.5 Å²	137.5	78%	0.781	76%	0.763	S	S	*	*			trans	-91.9	127.5	159.5	-87	-20.7	0	0	0	106.9
541	N	30.1	Very low	26	Very low	167 Å²	167	138.1 Å²	138.1	89%	0.893	76%	0.762	S	S	*	*			trans	162.1	112.8	155.9	-83.9	-8.1	0	0	0	104
542	G	24.4	Very low	26.2	Very low	60 Å²	60	141.9 Å²	141.9	62%	0.619	77%	0.772	S	S	*	*				91.7	114.8	65.1	0	0	0	0	0	107.2
543	D	31.5	Very low	26.3	Very low	164 Å²	164	141.5 Å²	141.5	88%	0.877	76%	0.763	S	S	*	*			trans	139.6	95.4	163	-69.4	-17.1	0	0	0	109.5
544	K	28	Very low	26.5	Very low	184 Å²	184	141 Å²	141	80%	0.8	76%	0.755	S	S	*	*				54.7	103.9	71.4	-68.8	-166.7	-179.6	178.9	0	115.3
545	N	25.8	Very low	26.8	Very low	145 Å²	145	144.3 Å²	144.3	78%	0.775	77%	0.765	S	S	*	*			trans	86	150	137.5	-55.6	-17.3	0	0	0	120.7
546	S	25.2	Very low	26.9	Very low	116 Å²	116	148.5 Å²	148.5	81%	0.811	77%	0.771	S	S	*	*			trans	86.3	113.9	176.5	78	0	0	0	0	114.4
547	S	23.8	Very low	27	Very low	110 Å²	110	150.2 Å²	150.2	77%	0.769	77%	0.772	S	S	*	*			cis	77.7	120.8	36.8	-150.8	0	0	0	0	114.7
548	V	24.8	Very low	27.3	Very low	114 Å²	114	155.8 Å²	155.8	69%	0.691	79%	0.786	S	S	*	*			trans	96.7	118.2	152.2	-168.1	0	0	0	0	118.5
549	D	26.1	Very low	27.5	Very low	124 Å²	124	154.7 Å²	154.7	66%	0.663	79%	0.785	S	S	*	*			trans	104.9	129.1	136.3	-87.5	-7	0	0	0	124.5
550	K	29	Very low	27.8	Very low	172 Å²	172	150.9 Å²	150.9	75%	0.748	78%	0.78	S	S	*	*			trans	80.1	101.9	145.5	-65.9	163	-170.4	176.5	0	117.7
551	Q	23	Very low	28	Very low	176 Å²	176	150 Å²	150	82%	0.822	78%	0.78	S	S	*	*				69.6	108.5	83.3	-171.4	175.6	24.3	0	0	113.6
552	M	30.9	Very low	27.9	Very low	167 Å²	167	147.9 Å²	147.9	82%	0.823	77%	0.773	S	S	*	*			trans	177.8	108.3	138	-94.9	-75.8	174.2	0	0	110.9
553	D	27.9	Very low	28.1	Very low	111 Å²	111	152.9 Å²	152.9	59%	0.594	78%	0.78	S	S	*	*			trans	43.3	123.2	137.2	-85.9	-9.8	0	0	0	124.5
554	K	29.3	Very low	27.9	Very low	161 Å²	161	153 Å²	153	70%	0.7	78%	0.775	S	S	*	*				61.3	100.4	125.9	-60.5	166.5	-172.3	149.6	0	118.9
555	N	30.5	Very low	27.9	Very low	161 Å²	161	150 Å²	150	86%	0.861	77%	0.773	S	S	*	*				-174.4	123.4	96.3	-95.8	-24.8	0	0	0	111.9
556	K	26.8	Very low	28	Very low	191 Å²	191	150.4 Å²	150.4	83%	0.83	77%	0.774	S	S	*	*			trans	-85.7	124.4	178.1	-72.9	172.2	173.5	177.6	0	109.3
557	F	28.7	Very low	28.2	Very low	206 Å²	206	155.4 Å²	155.4	90%	0.904	78%	0.777	S	S	*	*			trans	-132.1	91.1	143.8	-87.9	-80.2	0	0	0	106.9
558	K	32.3	Very low	28.2	Very low	193 Å²	193	155.1 Å²	155.1	84%	0.839	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-96.4	119.9	163.8	-82.7	-175.6	174	-173	0	105.8
559	I	29.2	Very low	28.4	Very low	159 Å²	159	157.5 Å²	157.5	82%	0.815	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-92	129.1	170	-66.9	168.6	0	0	0	106.5
560	D	33.3	Very low	28.4	Very low	142 Å²	142	158.9 Å²	158.9	76%	0.759	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-63.8	134.2	-166.6	-60.5	-58.9	0	0	0	113.5
561	T	27.2	Very low	28.6	Very low	128 Å²	128	160.5 Å²	160.5	79%	0.785	80%	0.798	S	S	*	*			trans	-100.7	108.9	159.6	-59.4	0	0	0	0	106.5	E563	T561-E563 PolarHBondContact O-N 2.94Å
562	T	28.4	Very low	28.8	Very low	121 Å²	121	157.8 Å²	157.8	74%	0.742	80%	0.798	S	S	*	*			trans	-82.8	92.2	-175.4	-19.7	0	0	0	0	109.6
563	E	29.2	Very low	28.7	Very low	166 Å²	166	161.5 Å²	161.5	78%	0.776	80%	0.803	S	S	*	*			trans	-91.3	106.4	162.7	-68.6	-171.7	171.3	0	0	108.2	T561 T565	T561-E563 PolarHBondContact O-N 2.94Å; E563-T565 PolarHBondContact O-N 3.43Å
564	Q	27.3	Very low	28.7	Very low	166 Å²	166	161.3 Å²	161.3	78%	0.776	81%	0.811	S	S	*	*			trans	-79.6	98.7	176.2	-68.4	-175.7	14.7	0	0	109.5	L566	Q564-L566 PolarHBondContact O-N 3.24Å
565	T	26.4	Very low	28.8	Very low	122 Å²	122	159.8 Å²	159.8	75%	0.748	82%	0.818	S	S	*	*			trans	-79.3	106.1	167	-46.6	0	0	0	0	108.8	E563	E563-T565 PolarHBondContact O-N 3.43Å
566	L	28.3	Very low	28.8	Very low	153 Å²	153	162 Å²	162	80%	0.801	82%	0.819	S	S	*	*			trans	-92.4	132.8	169.3	-81.1	165.9	0	0	0	110.1	Q564	Q564-L566 PolarHBondContact O-N 3.24Å
567	Y	29.1	Very low	28.7	Very low	220 Å²	220	160.7 Å²	160.7	86%	0.863	82%	0.821	S	S	*	*			trans	-61.2	141.9	-167.7	-82.4	-107.3	0	0	0	114.2
568	S	24.5	Very low	28.8	Very low	104 Å²	104	158.9 Å²	158.9	73%	0.727	82%	0.82	S	S	*	*			trans	-90.3	115.7	166.4	-60.2	0	0	0	0	108.9
569	D	29.2	Very low	28.6	Very low	165 Å²	165	157 Å²	157	88%	0.882	82%	0.817	S	S	*	*			trans	-115.9	105.1	166.8	-109	-19.9	0	0	0	109.7
570	N	25.4	Very low	28.7	Very low	153 Å²	153	154.9 Å²	154.9	82%	0.818	82%	0.816	S	S	*	*			trans	-84.2	113.6	173.6	-69.4	-50.2	0	0	0	108.8
571	K	33.6	Very low	28.4	Very low	205 Å²	205	156 Å²	156	89%	0.891	82%	0.817	S	S	*	*			trans	-134.6	99.3	158.2	-107.3	167.5	-177.8	170	0	110.5
572	S	28.2	Very low	28.5	Very low	119 Å²	119	159.2 Å²	159.2	83%	0.832	82%	0.82	S	S	*	*			trans	-54.1	124.8	165.5	39.8	0	0	0	0	111.2
573	R	28.5	Very low	28.4	Very low	245 Å²	245	158 Å²	158	93%	0.925	82%	0.816	S	S	*	*			trans	-132.6	111.5	159.8	-156.9	175.2	-167.3	-157.5	3.3	108.8
574	S	27.4	Very low	28.4	Very low	108 Å²	108	157 Å²	157	76%	0.755	82%	0.817	S	S	*	*			trans	-67.6	164.4	-177.2	-41.6	0	0	0	0	112.6
575	P	31.9	Very low	28.4	Very low	129 Å²	129	155.8 Å²	155.8	84%	0.838	82%	0.815	S	S	*	*			trans	-94.2	150.1	-153.6	36.4	-32.7	0	0	0	113.2
576	K	29.4	Very low	28.8	Very low	207 Å²	207	159.7 Å²	159.7	90%	0.9	82%	0.822	S	S	*	*			trans	-116.9	114.7	169.9	-129.3	173.5	-175.8	177	0	109.2
577	L	25	Very low	28.7	Very low	163 Å²	163	158.7 Å²	158.7	85%	0.853	82%	0.822	S	S	*	*			trans	-62.9	125.3	169.4	-79	154.2	0	0	0	109.6
578	L	31.8	Very low	28.9	Very low	169 Å²	169	156.3 Å²	156.3	89%	0.885	82%	0.819	S	S	*	*			trans	-125.1	113.4	157.9	-83.8	170.7	0	0	0	107.8
579	I	27.4	Very low	29.1	Very low	153 Å²	153	157.4 Å²	157.4	79%	0.785	82%	0.822	S	S	*	*			trans	-79.3	123.3	170.1	-65.4	157.6	0	0	0	106.1
580	S	30.5	Very low	29.1	Very low	114 Å²	114	156.7 Å²	156.7	80%	0.797	82%	0.818	S	S	*	*			trans	-149.4	119.5	154.8	65.9	0	0	0	0	109.9
581	E	27.2	Very low	29.4	Very low	167 Å²	167	155.3 Å²	155.3	78%	0.78	82%	0.815	S	S	*	*			trans	-56.1	141.4	171.6	-56.8	164.7	150.2	0	0	111.7
582	K	30.8	Very low	29.2	Very low	195 Å²	195	153.2 Å²	153.2	85%	0.848	81%	0.814	S	S	*	*				168.9	146.6	115.6	-89.1	-177.6	-178.3	-172.8	0	111.1
583	S	25.4	Very low	29.3	Very low	94 Å²	94	153.1 Å²	153.1	66%	0.657	81%	0.808	S	S	*	*			trans	-59.1	149.2	179	52.8	0	0	0	0	113.1
584	D	30	Very low	29.4	Very low	147 Å²	147	152.7 Å²	152.7	79%	0.786	81%	0.807	S	S	*	*				173.9	148.3	111.8	-79.8	-15.5	0	0	0	110.1
585	D	26.7	Very low	29.6	Very low	140 Å²	140	159.1 Å²	159.1	75%	0.749	81%	0.814	S	S	*	*			trans	-23.4	126.9	176.6	-67	-48.1	0	0	0	117.1
586	F	34.5	Very low	29.8	Very low	203 Å²	203	160.2 Å²	160.2	89%	0.89	81%	0.812	S	S	*	*				-173.1	115.1	116.3	-98.8	-71.3	0	0	0	108.9	E588	F586-E588 PolarHBondContact O-N 2.86Å
587	T	27.3	Very low	30.1	Very low	132 Å²	132	156.1 Å²	156.1	81%	0.81	81%	0.806	S	S	*	*			trans	-75.4	96.2	178	47.6	0	0	0	0	110.8
588	E	31.5	Very low	30.6	Very low	171 Å²	171	152 Å²	152	80%	0.799	80%	0.803	S	S	*	*			trans	-114.8	96.9	156.5	-77.6	-168.9	171.2	0	0	109.2	F586 N590	F586-E588 PolarHBondContact O-N 2.86Å; E588-N590 PolarHBondContact O-N 3.34Å
589	T	28.7	Very low	30.6	Very low	126 Å²	126	155.4 Å²	155.4	77%	0.773	80%	0.804	S	S	*	*			trans	-68.3	94	173.4	49.3	0	0	0	0	109.6	T591	T589-T591 PolarHBondContact O-N 2.83Å; T589-T591 VanDerWaalsContact O-N 3.16Å
590	N	30	Very low	31.1	Very low	150 Å²	150	156.3 Å²	156.3	80%	0.802	81%	0.81	S	S	*	*			trans	-71.3	96.4	163.9	-86.5	-58.1	0	0	0	109.2	E588 D592	E588-N590 PolarHBondContact O-N 3.34Å; N590-D592 PolarHBondContact O-N 3.14Å
591	T	32.6	Very low	31.5	Very low	124 Å²	124	160.5 Å²	160.5	76%	0.761	81%	0.813	S	S	*	*			trans	-81.7	90.6	165.5	30.2	0	0	0	0	109.6	T589 T593	T589-T591 PolarHBondContact O-N 2.83Å; T589-T591 VanDerWaalsContact O-N 3.16Å; T591-T593 VanDerWaalsContact C-N 3.35Å; T591-T593 PolarHBondContact O-N 3.38Å; T591-T593 PolarHBondContact O-OG1 3.41Å
592	D	28.7	Very low	31.8	Very low	161 Å²	161	157.6 Å²	157.6	86%	0.861	81%	0.812	S	S	*	*			trans	-58.2	89.2	170.8	-159.7	2.2	0	0	0	110.4	N590 R594	N590-D592 PolarHBondContact O-N 3.14Å; D592-R594 PolarHBondContact O-N 2.87Å
593	T	30.7	Very low	32.1	Very low	118 Å²	118	153.2 Å²	153.2	72%	0.724	81%	0.805	S	S	*	*			trans	-91.3	101.8	178.3	-51.5	0	0	0	0	108.7	T591 R595	T591-T593 VanDerWaalsContact C-N 3.35Å; T591-T593 PolarHBondContact O-N 3.38Å; T591-T593 PolarHBondContact O-OG1 3.41Å; T593-R595 PolarHBondContact O-N 3.24Å; T593-R595 VanDerWaalsContact O-N 3.15Å
594	R	30.8	Very low	32.5	Very low	235 Å²	235	155 Å²	155	89%	0.887	81%	0.807	S	S	*	*			trans	-40.3	118.3	168	-88.7	-175.5	-178.8	-156.6	0.4	110.9	D592 I596	D592-R594 PolarHBondContact O-N 2.87Å; R594-I596 PolarHBondContact O-N 3.39Å; R594-I596 VanDerWaalsContact O-N 3.15Å
595	R	30.7	Very low	32.6	Very low	243 Å²	243	158.7 Å²	158.7	92%	0.917	81%	0.81	S	S	*	*			trans	-62	110.4	171.3	-70.5	-179.5	-179.2	169.7	1.3	109.7	T593	T593-R595 PolarHBondContact O-N 3.24Å; T593-R595 VanDerWaalsContact O-N 3.15Å
596	I	37.2	Very low	32.8	Very low	152 Å²	152	159.5 Å²	159.5	78%	0.779	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-73.1	136.2	163.5	-62.1	174.5	0	0	0	107.8	R594 G598	R594-I596 PolarHBondContact O-N 3.39Å; R594-I596 VanDerWaalsContact O-N 3.15Å; I596-G598 PolarHBondContact O-N 3.32Å
597	P	35.6	Very low	32.4	Very low	121 Å²	121	155.1 Å²	155.1	79%	0.786	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-53.1	132.6	-177.3	-25.5	33.3	0	0	0	112.8	R599	P597-R599 PolarHBondContact O-N 3.23Å
598	G	35.2	Very low	32.7	Very low	76 Å²	76	154.4 Å²	154.4	78%	0.784	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-54.6	120.4	-171.3	0	0	0	0	0	113.5	I596 L600	I596-G598 PolarHBondContact O-N 3.32Å; G598-L600 PolarHBondContact O-N 3.18Å
599	R	31.7	Very low	32.6	Very low	241 Å²	241	152 Å²	152	91%	0.909	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-51.3	126.1	160.6	-165.7	176.4	-164.8	165.7	3.8	108.7	P597 K601	P597-R599 PolarHBondContact O-N 3.23Å; R599-K601 PolarHBondContact O-N 3.09Å
600	L	38.4	Very low	32.7	Very low	173 Å²	173	153.4 Å²	153.4	91%	0.906	80%	0.798	S	S	*	*			trans	-47.4	107.1	173.4	-72.5	160.9	0	0	0	109	G598 S602	G598-L600 PolarHBondContact O-N 3.18Å; L600-S602 PolarHBondContact O-N 3.22Å; L600-S602 VanDerWaalsContact O-N 3.11Å
601	K	37.9	Very low	32.5	Very low	201 Å²	201	150.9 Å²	150.9	87%	0.874	79%	0.792	S	S	*	*			trans	-62	116.5	171	-74.2	-178.1	176.3	179	0	106.3	R599 S603	R599-K601 PolarHBondContact O-N 3.09Å; K601-S603 PolarHBondContact O-N 2.96Å; K601-S603 VanDerWaalsContact O-N 3.08Å
602	S	33.5	Very low	32.5	Very low	106 Å²	106	150.7 Å²	150.7	74%	0.741	79%	0.793	S	S	*	*			trans	-50.8	119.7	162.4	53.1	0	0	0	0	107.1	L600 L604	L600-S602 PolarHBondContact O-N 3.22Å; L600-S602 VanDerWaalsContact O-N 3.11Å; S602-L604 PolarHBondContact O-N 3.02Å
603	S	38.1	Very low	32.6	Very low	103 Å²	103	149 Å²	149	72%	0.72	79%	0.793	S	S	*	*			trans	-69.3	68.7	173.8	170.1	0	0	0	0	109	K601 R605	K601-S603 PolarHBondContact O-N 2.96Å; K601-S603 VanDerWaalsContact O-N 3.08Å; S603-R605 VanDerWaalsContact C-N 3.31Å; S603-R605 PolarHBondContact O-N 3.27Å
604	L	32.5	Very low	32.5	Very low	131 Å²	131	154.6 Å²	154.6	69%	0.686	80%	0.8	S	S	*	*			trans	-71.7	95.3	165.6	-161.1	77.4	0	0	0	105.5	S602 H606	S602-L604 PolarHBondContact O-N 3.02Å; L604-H606 PolarHBondContact O-N 3.11Å
605	R	31.6	Very low	32.5	Very low	226 Å²	226	154.9 Å²	154.9	85%	0.853	80%	0.801	S	S	*	*			trans	-65.3	100.9	174	-65.9	-166.3	-173.8	-155	4.1	106.9	S603 S607	S603-R605 VanDerWaalsContact C-N 3.31Å; S603-R605 PolarHBondContact O-N 3.27Å; R605-S607 PolarHBondContact O-N 3.23Å
606	H	31.3	Very low	32.8	Very low	156 Å²	156	152 Å²	152	72%	0.722	80%	0.795	S	S	*	*			trans	-55.4	121.3	165.7	-70.2	-81.4	0	0	0	107.4	L604 V608	L604-H606 PolarHBondContact O-N 3.11Å; H606-V608 PolarHBondContact O-N 3.01Å
607	S	26	Very low	32.7	Very low	112 Å²	112	150 Å²	150	78%	0.783	79%	0.792	S	S	*	*			trans	-60.7	107.9	170.1	47.9	0	0	0	0	107.6	R605 T609	R605-S607 PolarHBondContact O-N 3.23Å; S607-T609 PolarHBondContact O-N 2.97Å; S607-T609 VanDerWaalsContact O-N 3.13Å
608	V	34	Very low	32.8	Very low	117 Å²	117	151.3 Å²	151.3	71%	0.709	79%	0.793	S	S	*	*			trans	-72.7	106.2	173.8	178.2	0	0	0	0	106.4	H606 L610	H606-V608 PolarHBondContact O-N 3.01Å; V608-L610 VanDerWaalsContact C-N 3.31Å; V608-L610 HydrophobicContact CG1-CD2 3.97Å; V608-L610 HydrophobicContact CG1-CG 4.23Å; V608-L610 PolarHBondContact O-N 3.08Å
609	T	28.7	Very low	32.9	Very low	121 Å²	121	153.7 Å²	153.7	74%	0.742	79%	0.792	S	S	*	*			trans	-69	92.3	167.2	42.2	0	0	0	0	107.9	S607 S611	S607-T609 PolarHBondContact O-N 2.97Å; S607-T609 VanDerWaalsContact O-N 3.13Å; T609-S611 VanDerWaalsContact C-N 3.33Å; T609-S611 PolarHBondContact O-N 3.34Å
610	L	31	Very low	33.2	Very low	154 Å²	154	148.3 Å²	148.3	81%	0.806	79%	0.786	S	S	*	*			trans	-67.4	98.9	168.2	-68.7	174.5	0	0	0	107.5	V608	V608-L610 VanDerWaalsContact C-N 3.31Å; V608-L610 HydrophobicContact CG1-CD2 3.97Å; V608-L610 HydrophobicContact CG1-CG 4.23Å; V608-L610 PolarHBondContact O-N 3.08Å
611	S	27	Very low	32.8	Very low	98 Å²	98	146.9 Å²	146.9	69%	0.685	78%	0.779	S	S	*	*			trans	-58.3	131	166.9	-62.2	0	0	0	0	107.7	T609 C613	T609-S611 VanDerWaalsContact C-N 3.33Å; T609-S611 PolarHBondContact O-N 3.34Å; S611-C613 PolarHBondContact O-N 3.18Å
612	P	31.1	Very low	32.8	Very low	120 Å²	120	145.4 Å²	145.4	78%	0.779	78%	0.775	S	S	*	*			trans	-54.1	108.5	-179.4	-27	34.2	0	0	0	110.9	R614	P612-R614 VanDerWaalsContact C-N 3.34Å; P612-R614 PolarHBondContact O-N 2.66Å
613	C	31.4	Very low	32.6	Very low	126 Å²	126	148.2 Å²	148.2	85%	0.851	78%	0.776	S	S	*	*			trans	-73.3	92.9	176	-152.3	0	0	0	0	107.5	S611 R615	S611-C613 PolarHBondContact O-N 3.18Å; C613-R615 PolarHBondContact O-N 2.83Å
614	R	28.3	Very low	32.2	Very low	235 Å²	235	149.5 Å²	149.5	89%	0.887	78%	0.783	S	S	*	*			trans	-65.2	100.9	172.8	-76.4	-176.9	170.8	156	-1.9	108	P612 K616	P612-R614 VanDerWaalsContact C-N 3.34Å; P612-R614 PolarHBondContact O-N 2.66Å; R614-K616 PolarHBondContact O-N 3.48Å
615	R	31.5	Very low	32	Very low	240 Å²	240	150.8 Å²	150.8	91%	0.906	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-58.7	124.1	164.7	-63.9	-170.3	-156.1	130.2	3.6	107.1	C613	C613-R615 PolarHBondContact O-N 2.83Å
616	K	36.2	Very low	31.9	Very low	183 Å²	183	145.4 Å²	145.4	80%	0.796	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-62.1	133.2	168.6	-70.4	-77.7	-177.1	169.3	0	106.5	R614 D618	R614-K616 PolarHBondContact O-N 3.48Å; K616-D618 PolarHBondContact O-N 3.45Å
617	P	36	Very low	31.8	Very low	109 Å²	109	143.1 Å²	143.1	71%	0.708	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-62.2	121.3	171.6	24.6	-30.3	0	0	0	107.7	V619	P617-V619 PolarHBondContact O-N 3.25Å; P617-V619 VanDerWaalsContact O-N 3.11Å
618	D	37.5	Very low	31.8	Very low	149 Å²	149	148.5 Å²	148.5	80%	0.797	79%	0.792	S	S	*	*			trans	-62.6	113	168.2	-77.6	-38.1	0	0	0	107.1	K616 T620	K616-D618 PolarHBondContact O-N 3.45Å; D618-T620 VanDerWaalsContact C-N 3.26Å; D618-T620 PolarHBondContact O-N 2.8Å
619	V	37.6	Very low	31.7	Very low	127 Å²	127	151.3 Å²	151.3	77%	0.77	80%	0.802	S	S	*	*			trans	-78.6	81.1	179.3	-176.3	0	0	0	0	106.9	P617 L621	P617-V619 PolarHBondContact O-N 3.25Å; P617-V619 VanDerWaalsContact O-N 3.11Å; V619-L621 PolarHBondContact O-N 3.43Å
620	T	38.6	Very low	31.7	Very low	128 Å²	128	154.2 Å²	154.2	79%	0.785	81%	0.807	S	S	*	*			trans	-79.8	98.1	160.3	43.4	0	0	0	0	107.6	D618 E622	D618-T620 VanDerWaalsContact C-N 3.26Å; D618-T620 PolarHBondContact O-N 2.8Å; T620-E622 PolarHBondContact O-N 2.86Å; T620-E622 VanDerWaalsContact O-N 3.17Å
621	L	29.6	Very low	31.6	Very low	143 Å²	143	152.8 Å²	152.8	75%	0.749	81%	0.807	S	S	*	*			trans	-70.4	89.1	172.6	-175.5	84.9	0	0	0	108.5	V619	V619-L621 PolarHBondContact O-N 3.43Å
622	E	37.7	Very low	31.7	Very low	170 Å²	170	152.9 Å²	152.9	79%	0.794	81%	0.808	S	S	*	*			trans	-123.9	118	166.2	-75	-61.6	153.4	0	0	109.7	T620 C624	T620-E622 PolarHBondContact O-N 2.86Å; T620-E622 VanDerWaalsContact O-N 3.17Å; E622-C624 PolarHBondContact O-N 2.95Å
623	Q	29.3	Very low	31.7	Very low	165 Å²	165	153.3 Å²	153.3	77%	0.771	81%	0.81	S	S	*	*			trans	-67.4	111.4	-179	-73.1	162.2	-49.2	0	0	109.7
624	C	29.7	Very low	31.7	Very low	129 Å²	129	155.1 Å²	155.1	87%	0.872	81%	0.811	S	S	*	*			trans	-122.7	98.2	157.9	-89.3	0	0	0	0	109	E622 S626	E622-C624 PolarHBondContact O-N 2.95Å; C624-S626 PolarHBondContact O-N 3.03Å
625	N	28.6	Very low	31.7	Very low	158 Å²	158	148.3 Å²	148.3	85%	0.845	80%	0.804	S	S	*	*			trans	-62.6	111.6	165.4	-65.7	-46.6	0	0	0	108.7
626	S	29.1	Very low	31.6	Very low	113 Å²	113	145.2 Å²	145.2	79%	0.79	81%	0.805	S	S	*	*			trans	-149.4	131.7	153.5	-153.8	0	0	0	0	110.4	C624	C624-S626 PolarHBondContact O-N 3.03Å
627	P	28.6	Very low	31.2	Very low	108 Å²	108	141.9 Å²	141.9	70%	0.701	81%	0.805	S	S	*	*			trans	-87.5	148.6	-168.5	34.9	-32.3	0	0	0	112.2
628	Y	26.7	Very low	30.8	Very low	225 Å²	225	140.7 Å²	140.7	88%	0.882	80%	0.799	S	S	*	*			trans	58.3	80.6	154.8	-87.6	-98.9	0	0	0	117.3
629	L	31.9	Very low	30.2	Very low	176 Å²	176	137.1 Å²	137.1	92%	0.921	80%	0.797	S	S	*	*			trans	-127.4	118.1	139.8	-75.9	175.7	0	0	0	109.2
630	Q	28	Very low	29.7	Very low	183 Å²	183	139.9 Å²	139.9	86%	0.855	80%	0.799	S	S	*	*			trans	-55.4	126.1	-178.7	-169.7	176.4	-29.6	0	0	110	S632	Q630-S632 PolarHBondContact O-N 3.11Å
631	P	30.4	Very low	29.2	Very low	123 Å²	123	140.5 Å²	140.5	80%	0.799	80%	0.803	S	S	*	*			trans	-72.9	103.9	-174	26.4	-31.4	0	0	0	110.1
632	S	28.8	Very low	29.1	Very low	101 Å²	101	139.2 Å²	139.2	71%	0.706	81%	0.806	S	S	*	*			trans	-63.4	142.1	159.9	-70.2	0	0	0	0	109.1	Q630 L634	Q630-S632 PolarHBondContact O-N 3.11Å; S632-L634 PolarHBondContact O-N 3.05Å
633	P	29.9	Very low	28.6	Very low	128 Å²	128	135.5 Å²	135.5	83%	0.831	80%	0.804	S	S	*	*			trans	-62.6	107.3	-173.6	-14.6	27.7	0	0	0	109.3	A635	P633-A635 VanDerWaalsContact C-N 3.31Å; P633-A635 PolarHBondContact O-N 2.75Å
634	L	30.9	Very low	28.3	Very low	165 Å²	165	131.2 Å²	131.2	86%	0.864	80%	0.804	S	S	*	*			trans	-62.5	100.1	168.5	-74.6	166.5	0	0	0	106.8	S632 L636	S632-L634 PolarHBondContact O-N 3.05Å; L634-L636 PolarHBondContact O-N 2.95Å
635	A	28.6	Very low	28.2	Very low	91 Å²	91	130.8 Å²	130.8	75%	0.752	80%	0.802	S	S	*	*			trans	-51.5	115.6	166.7	0	0	0	0	0	107.1	P633 S637	P633-A635 VanDerWaalsContact C-N 3.31Å; P633-A635 PolarHBondContact O-N 2.75Å; A635-S637 PolarHBondContact O-N 3.29Å
636	L	29.6	Very low	28	Very low	176 Å²	176	130.9 Å²	130.9	92%	0.921	80%	0.801	S	S	*	*			trans	-63.9	81.4	174	-66.5	166.3	0	0	0	107.8	L634 S638	L634-L636 PolarHBondContact O-N 2.95Å; L636-S638 PolarHBondContact O-N 3.27Å
637	S	27.3	Very low	27.8	Very low	113 Å²	113	131.3 Å²	131.3	79%	0.79	80%	0.799	S	S	*	*			trans	-65	106.8	166.8	178.2	0	0	0	0	106.9	A635 G639	A635-S637 PolarHBondContact O-N 3.29Å; S637-G639 PolarHBondContact O-N 3.13Å; S637-G639 VanDerWaalsContact O-N 3.11Å
638	S	29	Very low	27.8	Very low	84 Å²	84	133.9 Å²	133.9	59%	0.587	81%	0.806	S	S	*	*			trans	-56.2	113.3	170.7	56.7	0	0	0	0	108.3	L636 F640	L636-S638 PolarHBondContact O-N 3.27Å; S638-F640 PolarHBondContact O-N 3.28Å
639	G	24.7	Very low	27.9	Very low	73 Å²	73	128.8 Å²	128.8	75%	0.753	80%	0.799	S	S	*	*			trans	-60.2	93.2	-179.8	0	0	0	0	0	112	S637	S637-G639 PolarHBondContact O-N 3.13Å; S637-G639 VanDerWaalsContact O-N 3.11Å
640	F	27.5	Very low	27.6	Very low	185 Å²	185	126.3 Å²	126.3	81%	0.811	79%	0.791	S	S	*	*			trans	-94.6	101.7	154.3	-71.9	-79.5	0	0	0	106.7	S638 S642	S638-F640 PolarHBondContact O-N 3.28Å; F640-S642 PolarHBondContact O-N 2.92Å
641	V	27.5	Very low	27.8	Very low	142 Å²	142	126.1 Å²	126.1	86%	0.861	79%	0.79	S	S	*	*			trans	-64.8	99.1	170.8	174	0	0	0	0	107	A643	V641-A643 PolarHBondContact O-N 3.13Å
642	S	28.4	Very low	27.7	Very low	116 Å²	116	128.3 Å²	128.3	81%	0.811	79%	0.79	S	S	*	*			trans	-68.2	120.3	169.2	-162.9	0	0	0	0	107.9	F640 G644	F640-S642 PolarHBondContact O-N 2.92Å; S642-G644 PolarHBondContact O-N 2.88Å
643	A	26.5	Very low	27.8	Very low	92 Å²	92	128.9 Å²	128.9	76%	0.76	79%	0.792	S	S	*	*			trans	-64.8	119.4	178.4	0	0	0	0	0	110	V641	V641-A643 PolarHBondContact O-N 3.13Å
644	G	22.9	Very low	27.7	Very low	74 Å²	74	130.2 Å²	130.2	76%	0.763	79%	0.792	S	S	*	*			trans	51.6	79	149.2	0	0	0	0	0	117.2	S642	S642-G644 PolarHBondContact O-N 2.88Å
645	S	27.2	Very low	27.8	Very low	120 Å²	120	130.7 Å²	130.7	84%	0.839	79%	0.79	S	S	*	*			trans	-97.6	113.7	145.3	-168.1	0	0	0	0	107.3	V647	S645-V647 PolarHBondContact O-N 3.43Å
646	I	24.7	Very low	27.9	Very low	160 Å²	160	135.4 Å²	135.4	82%	0.821	79%	0.794	S	S	*	*			trans	-65.1	127.9	-177.4	-19.6	175.9	0	0	0	107.5	N648	I646-N648 PolarHBondContact O-N 3.15Å; I646-N648 VanDerWaalsContact O-N 3.15Å
647	V	25.6	Very low	27.9	Very low	123 Å²	123	135.1 Å²	135.1	75%	0.745	79%	0.79	S	S	*	*			trans	-53.8	112.5	176.2	174.6	0	0	0	0	109.4	S645	S645-V647 PolarHBondContact O-N 3.43Å
648	N	28.1	Very low	28.2	Very low	161 Å²	161	136.9 Å²	136.9	86%	0.861	79%	0.79	S	S	*	*			trans	-94.1	129.9	152.1	-91.2	-6.2	0	0	0	107.9	I646	I646-N648 PolarHBondContact O-N 3.15Å; I646-N648 VanDerWaalsContact O-N 3.15Å
649	T	27.6	Very low	28.2	Very low	118 Å²	118	141.6 Å²	141.6	72%	0.724	80%	0.8	S	S	*	*			trans	-63.5	135.4	-169.4	44.1	0	0	0	0	113.5	E651	T649-E651 PolarHBondContact O-N 2.91Å
650	V	27.4	Very low	28.8	Very low	125 Å²	125	144.9 Å²	144.9	76%	0.758	80%	0.801	S	S	*	*			trans	4.8	105.7	147.5	-175.7	0	0	0	0	115.7	E652	V650-E652 HydrophobicContact CG1-CG 4.29Å
651	E	31.7	Very low	28.9	Very low	178 Å²	178	139.4 Å²	139.4	83%	0.832	80%	0.796	S	S	*	*			trans	-119.4	104.2	149.4	-75.5	-178.6	171.9	0	0	107.3	T649 C653	T649-E651 PolarHBondContact O-N 2.91Å; E651-C653 PolarHBondContact O-N 3.19Å; E651-C653 VanDerWaalsContact O-N 3.14Å
652	E	27.1	Very low	29	Very low	170 Å²	170	142 Å²	142	79%	0.794	80%	0.796	S	S	*	*			trans	-67.9	97.6	168.5	-79.1	179.6	137.8	0	0	109.2	V650	V650-E652 HydrophobicContact CG1-CG 4.29Å
653	C	31.2	Very low	29.4	Very low	113 Å²	113	142.3 Å²	142.3	76%	0.764	79%	0.793	S	S	*	*			trans	-104.9	95.1	163.7	-72.1	0	0	0	0	109.1	E651 E655	E651-C653 PolarHBondContact O-N 3.19Å; E651-C653 VanDerWaalsContact O-N 3.14Å; C653-E655 PolarHBondContact O-N 3.04Å
654	N	27.7	Very low	29.8	Very low	155 Å²	155	146.1 Å²	146.1	83%	0.829	80%	0.795	S	S	*	*			trans	-71.1	100.7	163.4	-76.9	-52.8	0	0	0	108.9
655	E	33.3	Very low	30.4	Very low	175 Å²	175	148.4 Å²	148.4	82%	0.818	79%	0.794	S	S	*	*			trans	-138.6	96.3	164.8	-161.1	152.2	-159.2	0	0	112.8	C653	C653-E655 PolarHBondContact O-N 3.04Å
656	K	31.9	Very low	30.8	Very low	191 Å²	191	148.1 Å²	148.1	83%	0.83	79%	0.792	S	S	*	*			trans	38.3	109.8	140.6	-64	179.2	-179.6	176	0	118.1	N658	K656-N658 PolarHBondContact O-N 3.2Å; K656-N658 VanDerWaalsContact O-N 3.13Å
657	M	29.5	Very low	31.5	Very low	170 Å²	170	145.5 Å²	145.5	84%	0.837	79%	0.788	S	S	*	*			trans	-40.9	110.1	158	-57.6	164.5	81.9	0	0	111.5
658	N	32.1	Very low	32.1	Very low	150 Å²	150	149.7 Å²	149.7	80%	0.802	80%	0.796	S	S	*	*			trans	-108.1	113.5	153.5	-120	-15.7	0	0	0	107.7	K656 D660	K656-N658 PolarHBondContact O-N 3.2Å; K656-N658 VanDerWaalsContact O-N 3.13Å; N658-D660 PolarHBondContact O-N 3.05Å
659	K	30.6	Very low	32.6	Very low	182 Å²	182	147.9 Å²	147.9	79%	0.791	79%	0.791	S	S	*	*			trans	-84.4	94.9	175.9	-75.1	-151.4	178.8	-168.3	0	108
660	D	35.5	Very low	33.2	Very low	143 Å²	143	151.4 Å²	151.4	77%	0.765	80%	0.796	S	S	*	*			trans	-127.6	118	166.5	-77.7	-45.8	0	0	0	111	N658	N658-D660 PolarHBondContact O-N 3.05Å
661	G	30.9	Very low	33.8	Very low	69 Å²	69	151.2 Å²	151.2	71%	0.711	80%	0.797	S	S	*	*			trans	53.9	97.7	143.9	0	0	0	0	0	118.4	V663	G661-V663 PolarHBondContact O-N 3.24Å; G661-V663 VanDerWaalsContact O-N 3.1Å
662	F	30	Very low	34.2	Very low	197 Å²	197	148.9 Å²	148.9	86%	0.864	80%	0.795	S	S	*	*			trans	-50.3	110.2	159.4	-126.7	-105.3	0	0	0	110.5	E664	F662-E664 HydrophobicContact CD1-CG 4.16Å; F662-E664 HydrophobicContact CE1-CG 4.41Å
663	V	35.8	Very low	34.7	Very low	122 Å²	122	145.9 Å²	145.9	74%	0.739	79%	0.791	S	S	*	*			trans	-105.8	102.3	162.2	178	0	0	0	0	106.2	G661 T665	G661-V663 PolarHBondContact O-N 3.24Å; G661-V663 VanDerWaalsContact O-N 3.1Å; V663-T665 VanDerWaalsContact C-N 3.32Å; V663-T665 HydrophobicContact CG1-CG2 4.35Å; V663-T665 PolarHBondContact O-N 3.28Å
664	E	35.8	Very low	35.5	Very low	172 Å²	172	145.7 Å²	145.7	80%	0.804	79%	0.788	S	S	*	*			trans	-62.1	92.5	170.3	-83.8	-179.3	148.5	0	0	109.4	F662 S666	F662-E664 HydrophobicContact CD1-CG 4.16Å; F662-E664 HydrophobicContact CE1-CG 4.41Å; E664-S666 PolarHBondContact O-N 3.24Å; E664-S666 VanDerWaalsContact O-N 3.15Å
665	T	35.4	Very low	36.3	Very low	123 Å²	123	144.4 Å²	144.4	76%	0.755	79%	0.788	S	S	*	*			trans	-76.8	96.6	164.5	55.3	0	0	0	0	107.8	V663 S667	V663-T665 VanDerWaalsContact C-N 3.32Å; V663-T665 HydrophobicContact CG1-CG2 4.35Å; V663-T665 PolarHBondContact O-N 3.28Å; T665-S667 PolarHBondContact O-N 3.27Å
666	S	34.4	Very low	36.8	Very low	113 Å²	113	140.9 Å²	140.9	79%	0.79	78%	0.778	S	S	*	*			trans	-57.8	123.6	172.6	56.8	0	0	0	0	110.3	E664 K668	E664-S666 PolarHBondContact O-N 3.24Å; E664-S666 VanDerWaalsContact O-N 3.15Å; S666-K668 PolarHBondContact O-N 2.99Å
667	S	41	Very low	37.3	Very low	106 Å²	106	133.5 Å²	133.5	74%	0.741	76%	0.757	S	S	*	*			trans	-66.7	115.4	178.2	53.5	0	0	0	0	110.1	T665 V669	T665-S667 PolarHBondContact O-N 3.27Å; S667-V669 VanDerWaalsContact C-N 3.35Å; S667-V669 PolarHBondContact O-N 3.22Å
668	K	38.1	Very low	38.5	Very low	210 Å²	210	130.9 Å²	130.9	91%	0.913	75%	0.75	S	S	*	*			trans	-59	87.6	170.5	-79.8	173.8	173.1	173.7	0	111	S666 K670	S666-K668 PolarHBondContact O-N 2.99Å; K668-K670 PolarHBondContact O-N 3.11Å
669	V	38.7	Very low	39.2	Very low	123 Å²	123	131 Å²	131	75%	0.745	75%	0.745	S	S	*	*			trans	-75.1	115.6	163.3	179.6	0	0	0	0	106.9	S667 P671	S667-V669 VanDerWaalsContact C-N 3.35Å; S667-V669 PolarHBondContact O-N 3.22Å; V669-P671 WeakPolarHBondContact O-CD 3.38Å
670	K	39.2	Very low	40	Very low	192 Å²	192	128.1 Å²	128.1	84%	0.835	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-60.4	121.5	175.1	-77.3	-177.5	175.2	179.8	0	108.6	K668 V672	K668-K670 PolarHBondContact O-N 3.11Å; K670-V672 PolarHBondContact O-N 3.01Å
671	P	40.2	Very low	40	Very low	121 Å²	121	128.9 Å²	128.9	79%	0.786	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-66.7	128.6	-178.4	25	-31.2	0	0	0	110.2	V669	V669-P671 WeakPolarHBondContact O-CD 3.38Å
672	V	40.1	Very low	40.2	Very low	130 Å²	130	131.2 Å²	131.2	79%	0.788	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-64.2	134.7	168.8	178.1	0	0	0	0	107.7	K670	K670-V672 PolarHBondContact O-N 3.01Å
673	P	38	Very low	40.8	Very low	107 Å²	107	128.3 Å²	128.3	70%	0.695	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-59.6	141.4	177.7	22.1	-31.3	0	0	0	110.7
674	P	48.3	Very low	41	Very low	108 Å²	108	128.1 Å²	128.1	70%	0.701	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-62.7	148.7	-177.9	24.9	-32.6	0	0	0	111.2	V676	P674-V676 PolarHBondContact O-N 3.24Å
675	P	44.5	Very low	41.3	Very low	129 Å²	129	124.9 Å²	124.9	84%	0.838	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-58.1	121.6	176.6	23.5	-32	0	0	0	110	G677	P675-G677 PolarHBondContact O-N 3.08Å
676	V	43.8	Very low	41.7	Very low	100 Å²	100	124.1 Å²	124.1	61%	0.606	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-65.6	125.4	174.5	-176	0	0	0	0	107.9	P674 D680	P674-V676 PolarHBondContact O-N 3.24Å; V676-D680 HydrophobicContact CG1-CB 4.02Å; V676-D680 VanDerWaalsContact CG1-OD2 3.25Å; V676-D680 WeakPolarHBondContact CG1-OD2 3.23Å
677	G	42.3	Very low	42.1	Very low	37 Å²	37	124.6 Å²	124.6	38%	0.381	70%	0.702	S	S	.	*	P	Polyproline II helix	trans	-61.7	137.5	-177	0	0	0	0	0	110.8	P675 H679 D680	P675-G677 PolarHBondContact O-N 3.08Å; G677-H679 PolarHBondContact O-N 3Å; G677-D680 PolarHBondContact O-N 3.48Å
678	V	54	Low	42.4	Very low	114 Å²	114	126.2 Å²	126.2	69%	0.691	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-54.7	-17.4	176.8	-84.6	0	0	0	0	113.8	D680 Y681	V678-D680 VanDerWaalsContact C-N 3.31Å; V678-D680 PolarHBondContact O-N 3.07Å; V678-Y681 PolarHBondContact O-N 3.46Å
679	H	47	Very low	42.7	Very low	153 Å²	153	123.6 Å²	123.6	71%	0.708	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-73.9	-15.5	176	-55.7	-59.3	0	0	0	114.6	G677 Y681	G677-H679 PolarHBondContact O-N 3Å; H679-Y681 PolarHBondContact O-N 2.79Å
680	D	47.5	Very low	43	Very low	122 Å²	122	122.6 Å²	122.6	65%	0.652	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-75.8	-4.9	174	-68.8	-27.9	0	0	0	112.3	V676 G677 V678	V676-D680 HydrophobicContact CG1-CB 4.02Å; V676-D680 VanDerWaalsContact CG1-OD2 3.25Å; V676-D680 WeakPolarHBondContact CG1-OD2 3.23Å; G677-D680 PolarHBondContact O-N 3.48Å; V678-D680 VanDerWaalsContact C-N 3.31Å; V678-D680 PolarHBondContact O-N 3.07Å
681	Y	34.5	Very low	43.2	Very low	159 Å²	159	118.3 Å²	118.3	62%	0.624	66%	0.662	S	S	*	*	S	Bend	trans	-89.3	123.1	169.5	-65.1	-86.1	0	0	0	109.6	V678 H679 I683	V678-Y681 PolarHBondContact O-N 3.46Å; H679-Y681 PolarHBondContact O-N 2.79Å; Y681-I683 PolarHBondContact O-N 3.14Å; Y681-I683 VanDerWaalsContact O-N 3.09Å
682	P	36.6	Very low	43.5	Very low	118 Å²	118	117.1 Å²	117.1	77%	0.766	65%	0.649	S	S	*	*			trans	-59.5	120.3	177	22.9	-31.1	0	0	0	109.3	V684	P682-V684 PolarHBondContact O-N 3.48Å
683	I	42	Very low	44	Very low	136 Å²	136	118 Å²	118	70%	0.697	64%	0.642	S	S	*	*			trans	-61.6	108.8	177.9	-57.4	171.9	0	0	0	107.7	Y681 T685	Y681-I683 PolarHBondContact O-N 3.14Å; Y681-I683 VanDerWaalsContact O-N 3.09Å; I683-T685 VanDerWaalsContact C-N 3.26Å; I683-T685 HydrophobicContact CB-CG2 4.46Å; I683-T685 HydrophobicContact CG2-CG2 3.69Å; I683-T685 PolarHBondContact O-N 3.04Å
684	V	39.9	Very low	44.5	Very low	117 Å²	117	117 Å²	117	71%	0.709	63%	0.63	S	S	*	*			trans	-70.5	88.5	170	-175.7	0	0	0	0	106.9	P682 L687	P682-V684 PolarHBondContact O-N 3.48Å; V684-L687 HydrophobicContact CG1-CD1 4.48Å; V684-L687 HydrophobicContact CG1-CG 4.45Å
685	T	42.6	Very low	44.5	Very low	104 Å²	104	116.3 Å²	116.3	64%	0.638	62%	0.621	S	S	*	*			trans	-76	124.7	176.3	51.6	0	0	0	0	110	I683	I683-T685 VanDerWaalsContact C-N 3.26Å; I683-T685 HydrophobicContact CB-CG2 4.46Å; I683-T685 HydrophobicContact CG2-CG2 3.69Å; I683-T685 PolarHBondContact O-N 3.04Å
686	N	42.3	Very low	44.4	Very low	107 Å²	107	113.3 Å²	113.3	57%	0.572	60%	0.603	S	S	*	*			trans	36.3	79.9	164.9	-70.3	-29.2	0	0	0	117.1	E688 K689	N686-E688 PolarHBondContact O-N 3.04Å; N686-K689 HydrophobicContact CB-CB 4.41Å; N686-K689 PolarHBondContact O-N 3.45Å
687	L	43.8	Very low	44.6	Very low	123 Å²	123	114.3 Å²	114.3	64%	0.644	60%	0.604	S	S	*	*	H	α-helix	trans	-44.4	-32.4	164.5	-87.4	148.3	0	0	0	113.4	V684 D690 L691	V684-L687 HydrophobicContact CG1-CD1 4.48Å; V684-L687 HydrophobicContact CG1-CG 4.45Å; L687-D690 PolarHBondContact O-N 2.95Å; L687-L691 WeakPolarHBondContact O-CG 3.38Å; L687-L691 PolarHBondContact O-N 2.87Å; L687-L691 VanDerWaalsContact O-N 3.07Å
688	E	46.9	Very low	44.7	Very low	141 Å²	141	116.9 Å²	116.9	66%	0.659	61%	0.608	S	S	*	*	H	α-helix	trans	-66	-35.4	178.8	-167.8	168.7	-163.5	0	0	113.4	N686 N692	N686-E688 PolarHBondContact O-N 3.04Å; E688-N692 VanDerWaalsContact O-CG 3.23Å; E688-N692 PolarHBondContact O-N 3.42Å; E688-N692 VanDerWaalsContact O-N 3.1Å; E688-N692 PolarHBondContact O-ND2 3Å
689	K	45.1	Very low	44.2	Very low	155 Å²	155	116.4 Å²	116.4	67%	0.674	60%	0.602	S	S	*	*	H	α-helix	trans	-68.3	-36.6	175.7	-90.8	-172.3	176.2	-178.5	0	112.1	N686 K693	N686-K689 HydrophobicContact CB-CB 4.41Å; N686-K689 PolarHBondContact O-N 3.45Å; K689-K693 PolarHBondContact O-N 3.24Å
690	D	44.3	Very low	44	Very low	102 Å²	102	114.5 Å²	114.5	55%	0.545	60%	0.597	S	S	.	*	H	α-helix	trans	-74.5	-33.7	-179.7	-74.4	-14.9	0	0	0	111.7	L687	L687-D690 PolarHBondContact O-N 2.95Å
691	L	42.7	Very low	43.8	Very low	101 Å²	101	112.6 Å²	112.6	53%	0.529	59%	0.593	S	S	.	*	H	α-helix	trans	-69	-42.8	173.7	-69.2	174.6	0	0	0	112.4	L687 K693 I694 D695	L687-L691 WeakPolarHBondContact O-CG 3.38Å; L687-L691 PolarHBondContact O-N 2.87Å; L687-L691 VanDerWaalsContact O-N 3.07Å; L691-K693 PolarHBondContact O-N 3.44Å; L691-I694 HydrophobicContact CD2-CD1 4.41Å; L691-I694 WeakPolarHBondContact O-CB 3.32Å; L691-I694 PolarHBondContact O-N 3.27Å; L691-D695 PolarHBondContact O-N 3.06Å
692	N	48	Very low	44.1	Very low	96 Å²	96	111.5 Å²	111.5	51%	0.513	60%	0.597	S	S	.	*	H	α-helix	trans	-63.4	-26.9	179.3	-69.7	-19	0	0	0	113.1	E688 I694 S696	E688-N692 VanDerWaalsContact O-CG 3.23Å; E688-N692 PolarHBondContact O-N 3.42Å; E688-N692 VanDerWaalsContact O-N 3.1Å; E688-N692 PolarHBondContact O-ND2 3Å; N692-I694 VanDerWaalsContact C-N 3.32Å; N692-S696 PolarHBondContact O-N 2.96Å
693	K	50.3	Low	43.8	Very low	149 Å²	149	112.3 Å²	112.3	65%	0.648	60%	0.595	S	S	*	*	H	α-helix	trans	-65.9	-33.8	171.1	-95.4	-177.9	177.1	-179.8	0	112.6	K689 L691 L697	K689-K693 PolarHBondContact O-N 3.24Å; L691-K693 PolarHBondContact O-N 3.44Å; K693-L697 PolarHBondContact O-N 3.5Å
694	I	48.7	Very low	43.4	Very low	85 Å²	85	112.4 Å²	112.4	44%	0.436	60%	0.596	S	S	.	*	H	α-helix	trans	-70.7	-42.8	179.6	-60.5	173.4	0	0	0	109.9	L691 N692 S696 L697 I698	L691-I694 HydrophobicContact CD2-CD1 4.41Å; L691-I694 WeakPolarHBondContact O-CB 3.32Å; L691-I694 PolarHBondContact O-N 3.27Å; N692-I694 VanDerWaalsContact C-N 3.32Å; I694-S696 VanDerWaalsContact C-N 3.31Å; I694-S696 PolarHBondContact O-N 3.46Å; I694-L697 WeakPolarHBondContact O-CB 3.45Å; I694-L697 PolarHBondContact O-N 2.99Å; I694-L697 VanDerWaalsContact O-N 3.13Å; I694-I698 HydrophobicContact CG2-CD1 3.96Å; I694-I698 HydrophobicContact CG2-CG1 4.49Å; I694-I698 WeakPolarHBondContact O-CG1 3.32Å; I694-I698 PolarHBondContact O-N 2.89Å
695	D	47	Very low	43	Very low	95 Å²	95	114 Å²	114	51%	0.508	60%	0.595	S	S	.	*	H	α-helix	trans	-63.9	-35.8	178.6	-73.1	-21.6	0	0	0	112.5	L691 I698 N699	L691-D695 PolarHBondContact O-N 3.06Å; D695-I698 PolarHBondContact O-N 3.17Å; D695-N699 PolarHBondContact O-N 3.07Å; D695-N699 VanDerWaalsContact O-N 3.15Å
696	S	43.6	Very low	42.3	Very low	66 Å²	66	116.1 Å²	116.1	46%	0.462	60%	0.602	S	S	.	*	H	α-helix	trans	-64.2	-40.2	173.1	-167.3	0	0	0	0	112.2	N692 I694 N699 D700	N692-S696 PolarHBondContact O-N 2.96Å; I694-S696 VanDerWaalsContact C-N 3.31Å; I694-S696 PolarHBondContact O-N 3.46Å; S696-N699 PolarHBondContact O-N 3.41Å; S696-D700 PolarHBondContact O-N 3.42Å
697	L	46.9	Very low	41.7	Very low	120 Å²	120	115.4 Å²	115.4	63%	0.628	60%	0.602	S	S	*	*	H	α-helix	trans	-68.3	-32.8	179.1	-93.8	149.5	0	0	0	112.9	K693 I694 S701	K693-L697 PolarHBondContact O-N 3.5Å; I694-L697 WeakPolarHBondContact O-CB 3.45Å; I694-L697 PolarHBondContact O-N 2.99Å; I694-L697 VanDerWaalsContact O-N 3.13Å; L697-S701 PolarHBondContact O-N 3.35Å; L697-S701 PolarHBondContact O-OG 3.44Å
698	I	44.1	Very low	40.8	Very low	92 Å²	92	115.6 Å²	115.6	47%	0.472	60%	0.603	S	S	.	*	H	α-helix	trans	-71.6	-41.8	176.5	-65.5	169.4	0	0	0	110.3	I694 D695 S701	I694-I698 HydrophobicContact CG2-CD1 3.96Å; I694-I698 HydrophobicContact CG2-CG1 4.49Å; I694-I698 WeakPolarHBondContact O-CG1 3.32Å; I694-I698 PolarHBondContact O-N 2.89Å; D695-I698 PolarHBondContact O-N 3.17Å; I698-S701 PolarHBondContact O-N 2.94Å
699	N	43.6	Very low	39.8	Very low	103 Å²	103	115.3 Å²	115.3	55%	0.551	61%	0.611	S	S	*	*	H	α-helix	trans	-72.4	-35.4	-179.4	-74.3	-24.7	0	0	0	113.2	D695 S696 S701 L702	D695-N699 PolarHBondContact O-N 3.07Å; D695-N699 VanDerWaalsContact O-N 3.15Å; S696-N699 PolarHBondContact O-N 3.41Å; N699-S701 PolarHBondContact O-N 3.41Å; N699-L702 PolarHBondContact O-N 3Å
700	D	44.4	Very low	38.8	Very low	113 Å²	113	113.8 Å²	113.8	60%	0.604	62%	0.615	S	S	*	*	H	α-helix	trans	-68.2	-25.1	176.4	-74	-17.5	0	0	0	112.5	S696 L702	S696-D700 PolarHBondContact O-N 3.42Å; D700-L702 VanDerWaalsContact C-N 3.31Å; D700-L702 PolarHBondContact O-N 3.49Å
701	S	43.2	Very low	37.7	Very low	82 Å²	82	114.3 Å²	114.3	57%	0.573	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-16.2	176.8	-59.6	0	0	0	0	113.6	L697 I698 N699	L697-S701 PolarHBondContact O-N 3.35Å; L697-S701 PolarHBondContact O-OG 3.44Å; I698-S701 PolarHBondContact O-N 2.94Å; N699-S701 PolarHBondContact O-N 3.41Å
702	L	39.8	Very low	36.8	Very low	137 Å²	137	117.4 Å²	117.4	72%	0.717	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-8.9	-179.7	-74	171.6	0	0	0	114	N699 D700 I704	N699-L702 PolarHBondContact O-N 3Å; D700-L702 VanDerWaalsContact C-N 3.31Å; D700-L702 PolarHBondContact O-N 3.49Å; L702-I704 PolarHBondContact O-N 3.4Å; L702-I704 VanDerWaalsContact O-N 3.16Å
703	N	30.2	Very low	35.6	Very low	134 Å²	134	118.2 Å²	118.2	72%	0.717	65%	0.647	S	S	*	*			trans	-84.5	31.3	175.6	-82.9	-28.8	0	0	0	113.8	H705	N703-H705 PolarHBondContact O-N 3.09Å
704	I	34.2	Very low	34.2	Very low	139 Å²	139	121 Å²	121	71%	0.713	66%	0.659	S	S	*	*			trans	-78	85.2	164.4	-55.4	179.2	0	0	0	107.8	L702 L706	L702-I704 PolarHBondContact O-N 3.4Å; L702-I704 VanDerWaalsContact O-N 3.16Å; I704-L706 PolarHBondContact O-N 3.47Å
705	H	30.5	Very low	33	Very low	149 Å²	149	122.7 Å²	122.7	69%	0.69	68%	0.678	S	S	*	*			trans	-10.7	89	154.4	-153.5	-105	0	0	0	114.5	N703 T707	N703-H705 PolarHBondContact O-N 3.09Å; H705-T707 WeakPolarHBondContact CE1-CG2 3.48Å; H705-T707 VanDerWaalsContact ND1-CG2 3.27Å; H705-T707 WeakPolarHBondContact ND1-CG2 3.24Å; H705-T707 PolarHBondContact ND1-OG1 3.36Å; H705-T707 PolarHBondContact O-N 2.92Å
706	L	28.7	Very low	31.7	Very low	150 Å²	150	126 Å²	126	79%	0.785	70%	0.696	S	S	*	*			trans	-77.4	76.6	162.6	-129.9	75.2	0	0	0	107.3	I704 D708	I704-L706 PolarHBondContact O-N 3.47Å; L706-D708 VanDerWaalsContact C-N 3.28Å; L706-D708 PolarHBondContact O-N 2.94Å; L706-D708 VanDerWaalsContact O-N 3.08Å
707	T	29	Very low	31.1	Very low	92 Å²	92	128.6 Å²	128.6	56%	0.564	71%	0.711	S	S	*	*			trans	-74	91.7	162.1	23.8	0	0	0	0	108.1	H705 T709	H705-T707 WeakPolarHBondContact CE1-CG2 3.48Å; H705-T707 VanDerWaalsContact ND1-CG2 3.27Å; H705-T707 WeakPolarHBondContact ND1-CG2 3.24Å; H705-T707 PolarHBondContact ND1-OG1 3.36Å; H705-T707 PolarHBondContact O-N 2.92Å; T707-T709 PolarHBondContact O-N 3.24Å; T707-T709 PolarHBondContact O-OG1 3.11Å
708	D	25.9	Very low	29.9	Very low	127 Å²	127	127.8 Å²	127.8	68%	0.679	72%	0.716	S	S	*	*			trans	-56.3	110.2	164.8	-80.2	-31.2	0	0	0	108.7	L706 T710	L706-D708 VanDerWaalsContact C-N 3.28Å; L706-D708 PolarHBondContact O-N 2.94Å; L706-D708 VanDerWaalsContact O-N 3.08Å; D708-T710 PolarHBondContact O-N 3.41Å
709	T	25.5	Very low	28.9	Very low	135 Å²	135	131 Å²	131	83%	0.828	73%	0.729	S	S	*	*			trans	-79.8	70.7	179	-5.7	0	0	0	0	107.3	T707 S711	T707-T709 PolarHBondContact O-N 3.24Å; T707-T709 PolarHBondContact O-OG1 3.11Å; T709-S711 VanDerWaalsContact C-N 3.26Å; T709-S711 PolarHBondContact O-N 2.64Å
710	T	24.5	Very low	28	Very low	122 Å²	122	133.2 Å²	133.2	75%	0.748	74%	0.74	S	S	*	*			trans	-78.2	86.2	166.4	44	0	0	0	0	109	D708 Q712	D708-T710 PolarHBondContact O-N 3.41Å; T710-Q712 PolarHBondContact O-N 3.14Å; T710-Q712 VanDerWaalsContact O-N 3.16Å
711	S	21.2	Very low	26.9	Very low	113 Å²	113	136.2 Å²	136.2	79%	0.79	75%	0.748	S	S	*	*			trans	-62.7	102.4	161.8	53.5	0	0	0	0	109.3	T709	T709-S711 VanDerWaalsContact C-N 3.26Å; T709-S711 PolarHBondContact O-N 2.64Å
712	Q	23.6	Very low	25.9	Very low	167 Å²	167	138.1 Å²	138.1	78%	0.78	75%	0.751	S	S	*	*			trans	-127.5	110.5	164	-77.3	-156.3	21.1	0	0	110.9	T710	T710-Q712 PolarHBondContact O-N 3.14Å; T710-Q712 VanDerWaalsContact O-N 3.16Å
713	T	22.6	Very low	25.2	Very low	113 Å²	113	139.9 Å²	139.9	69%	0.693	76%	0.762	S	S	*	*				73.2	94.6	129.7	-32.3	0	0	0	0	118.4
714	K	20.2	Very low	24.8	Very low	208 Å²	208	138.6 Å²	138.6	90%	0.904	76%	0.763	S	S	*	*				16.3	106.3	129.7	-69.8	176.8	176.7	177	0	116.4
715	S	23.4	Very low	24.2	Very low	120 Å²	120	138.2 Å²	138.2	84%	0.839	76%	0.761	S	S	*	*			trans	-141.5	129.4	142.1	58.5	0	0	0	0	109.6
716	N	20.6	Very low	23.8	Very low	164 Å²	164	139.1 Å²	139.1	88%	0.877	77%	0.766	S	S	*	*			trans	-82.2	175	-173.2	-100.8	-16.1	0	0	0	111.9
717	P	31.8	Very low	23.6	Very low	120 Å²	120	140.9 Å²	140.9	78%	0.779	77%	0.767	S	S	*	*			trans	-103.1	158.1	-130.6	39.1	-36.8	0	0	0	114
718	S	20.5	Very low	23.2	Very low	103 Å²	103	140.9 Å²	140.9	72%	0.72	77%	0.771	S	S	*	*			trans	-154.9	142.7	154.4	-150.1	0	0	0	0	110.1
719	E	23.8	Very low	23.1	Very low	161 Å²	161	141.6 Å²	141.6	75%	0.752	78%	0.775	S	S	*	*			trans	91.3	112.3	154.6	-70.2	163.4	-146.6	0	0	121.3
720	L	24.6	Very low	23	Very low	149 Å²	149	143.1 Å²	143.1	78%	0.78	77%	0.773	S	S	*	*			trans	80.9	94.1	138.2	-69.5	156.8	0	0	0	117.5
721	F	20.5	Very low	23	Very low	176 Å²	176	145.2 Å²	145.2	77%	0.772	77%	0.774	S	S	*	*				79.7	119.6	88.3	-112.2	-118.9	0	0	0	114.6
722	N	22.3	Very low	23.1	Very low	121 Å²	121	148.1 Å²	148.1	65%	0.647	78%	0.775	S	S	*	*			trans	66.2	87	145.4	-62.6	-0.3	0	0	0	118.6
723	N	25.2	Very low	23.2	Very low	175 Å²	175	147.3 Å²	147.3	94%	0.936	77%	0.771	S	S	*	*			trans	-127.3	137.1	132	-84.5	-43.5	0	0	0	110.5
724	S	21.7	Very low	23.2	Very low	107 Å²	107	151.2 Å²	151.2	75%	0.748	78%	0.781	S	S	*	*			trans	-70.9	122.7	-163.2	166.2	0	0	0	0	114
725	I	22	Very low	23.4	Very low	130 Å²	130	150.1 Å²	150.1	67%	0.667	78%	0.78	S	S	*	*				53.8	108.5	127.2	-57.7	179	0	0	0	118.7
726	Q	22.7	Very low	23.4	Very low	168 Å²	168	153.4 Å²	153.4	79%	0.785	78%	0.781	S	S	*	*			trans	74.2	130.8	133.2	-63.3	172.6	-3.8	0	0	123.1
727	K	23.1	Very low	23.6	Very low	187 Å²	187	151 Å²	151	81%	0.813	78%	0.778	S	S	*	*			trans	118.7	91.6	145.7	-69.5	-178	-179.6	177	0	112.3
728	S	21.6	Very low	23.5	Very low	93 Å²	93	154.4 Å²	154.4	65%	0.65	78%	0.78	S	S	*	*				76.9	121	76.6	71.3	0	0	0	0	114.5
729	N	24.2	Very low	24.1	Very low	142 Å²	142	155 Å²	155	76%	0.759	78%	0.782	S	S	*	*			trans	82.4	99	158	-53.7	-9.6	0	0	0	115.6
730	E	22.6	Very low	24.4	Very low	167 Å²	167	154.9 Å²	154.9	78%	0.78	79%	0.786	S	S	*	*				50.1	87.2	81	-65.8	-165.2	153.7	0	0	113
731	Q	25	Very low	24.9	Very low	165 Å²	165	157.4 Å²	157.4	77%	0.771	79%	0.791	S	S	*	*			trans	-131.1	99.7	143.1	-76.8	-166.3	6.1	0	0	109	Q733	Q731-Q733 PolarHBondContact O-N 3.14Å
732	Q	22.7	Very low	25.4	Very low	175 Å²	175	156.6 Å²	156.6	82%	0.818	79%	0.794	S	S	*	*			trans	-62.6	103.8	159.3	-63.3	169.4	21.1	0	0	107.5
733	Q	25.1	Very low	26.1	Very low	149 Å²	149	158.2 Å²	158.2	70%	0.696	80%	0.802	S	S	*	*			trans	-108.5	111.5	161.8	-80.7	-174.2	33.6	0	0	109.1	Q731 Q735	Q731-Q733 PolarHBondContact O-N 3.14Å; Q733-Q735 PolarHBondContact O-N 3.5Å; Q733-Q735 VanDerWaalsContact O-N 3.1Å
734	Q	22.6	Very low	26.6	Very low	195 Å²	195	155.5 Å²	155.5	91%	0.911	79%	0.794	S	S	*	*			trans	-52.3	104.1	172.2	-63.2	163.3	17.9	0	0	109.8
735	Q	25.6	Very low	27.2	Very low	186 Å²	186	158 Å²	158	87%	0.869	80%	0.798	S	S	*	*			trans	-95	105.4	166.4	-73.1	-173.8	29	0	0	108.6	Q733 S737	Q733-Q735 PolarHBondContact O-N 3.5Å; Q733-Q735 VanDerWaalsContact O-N 3.1Å; Q735-S737 PolarHBondContact O-N 3.45Å
736	Q	23.5	Very low	27.7	Very low	188 Å²	188	161 Å²	161	88%	0.879	81%	0.809	S	S	*	*			trans	-47.2	122.8	171.7	-81.6	169	-23.9	0	0	111.2	K738	Q736-K738 PolarHBondContact O-N 3.32Å; Q736-K738 VanDerWaalsContact O-N 3.07Å
737	S	25.1	Very low	28.1	Very low	115 Å²	115	159.2 Å²	159.2	80%	0.804	81%	0.81	S	S	*	*			trans	-60	105.9	167.9	44	0	0	0	0	109.7	Q735	Q735-S737 PolarHBondContact O-N 3.45Å
738	K	29.2	Very low	28.6	Very low	191 Å²	191	157.6 Å²	157.6	83%	0.83	81%	0.809	S	S	*	*			trans	-61.3	126.3	167.9	-91.2	175.2	176.5	170.1	0	108.4	Q736 N740	Q736-K738 PolarHBondContact O-N 3.32Å; Q736-K738 VanDerWaalsContact O-N 3.07Å; K738-N740 PolarHBondContact O-N 3.05Å
739	P	32.2	Very low	29.2	Very low	115 Å²	115	157.9 Å²	157.9	75%	0.747	81%	0.809	S	S	*	*			trans	-63.1	123.6	171.6	25.4	-30.8	0	0	0	108.1	K741	P739-K741 PolarHBondContact O-N 2.81Å
740	N	30.7	Very low	29.9	Very low	159 Å²	159	157 Å²	157	85%	0.85	81%	0.811	S	S	*	*			trans	-52.2	99.9	174	-79.6	-31.2	0	0	0	109.1	K738 L742	K738-N740 PolarHBondContact O-N 3.05Å; N740-L742 PolarHBondContact O-N 2.82Å
741	K	34.7	Very low	30.5	Very low	201 Å²	201	154.6 Å²	154.6	87%	0.874	81%	0.811	S	S	*	*			trans	-62.7	103.9	164.1	-95.7	-178.9	172.2	-179.2	0	106.2	P739 L743	P739-K741 PolarHBondContact O-N 2.81Å; K741-L743 PolarHBondContact O-N 2.84Å
742	L	32.5	Very low	31.1	Very low	159 Å²	159	156.4 Å²	156.4	83%	0.832	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-51.1	116.3	162	-109.5	95.5	0	0	0	106.8	N740	N740-L742 PolarHBondContact O-N 2.82Å
743	L	35.4	Very low	31.9	Very low	155 Å²	155	156.2 Å²	156.2	81%	0.812	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-58.8	134.4	172.1	-76.5	157.8	0	0	0	107.6	K741 L745	K741-L743 PolarHBondContact O-N 2.84Å; L743-L745 PolarHBondContact O-N 3.39Å; L743-L745 VanDerWaalsContact O-N 3.14Å
744	P	35.6	Very low	32.5	Very low	119 Å²	119	157.5 Å²	157.5	77%	0.773	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-56.9	122.9	179.6	21.2	-30	0	0	0	109.1	Q746	P744-Q746 PolarHBondContact O-N 3.36Å
745	L	34.8	Very low	33.3	Very low	160 Å²	160	153.2 Å²	153.2	84%	0.838	81%	0.814	S	S	*	*			trans	-47.2	112.4	174.2	-83.5	149.4	0	0	0	108.7	L743 T747	L743-L745 PolarHBondContact O-N 3.39Å; L743-L745 VanDerWaalsContact O-N 3.14Å; L745-T747 PolarHBondContact O-N 3.45Å
746	Q	32	Very low	33.6	Very low	192 Å²	192	147 Å²	147	90%	0.897	80%	0.8	S	S	*	*			trans	-68.1	97.8	-179.3	-164.3	176.2	3.7	0	0	107.9	P744 L748	P744-Q746 PolarHBondContact O-N 3.36Å; Q746-L748 PolarHBondContact O-N 3.1Å
747	T	30.9	Very low	34.3	Very low	131 Å²	131	150.2 Å²	150.2	80%	0.804	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-64.8	118.4	176.1	50.1	0	0	0	0	108.8	L745	L745-T747 PolarHBondContact O-N 3.45Å
748	L	33.9	Very low	35.1	Very low	153 Å²	153	148 Å²	148	80%	0.801	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-55.2	141.9	175.3	-77.1	160.4	0	0	0	110.5	Q746	Q746-L748 PolarHBondContact O-N 3.1Å
749	P	34.4	Very low	35.8	Very low	99 Å²	99	144.1 Å²	144.1	64%	0.643	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-63.3	147.7	175.7	24.8	-31	0	0	0	110.7	C751	P749-C751 PolarHBondContact O-N 3.3Å; P749-C751 VanDerWaalsContact O-N 3.07Å
750	P	39.5	Very low	36.4	Very low	124 Å²	124	140.8 Å²	140.8	81%	0.805	77%	0.769	S	S	*	*			trans	-60.7	113.2	-179	21.8	-31.2	0	0	0	111.3	K752	P750-K752 PolarHBondContact O-N 3.33Å
751	C	35.2	Very low	37	Very low	116 Å²	116	141 Å²	141	78%	0.784	77%	0.769	S	S	*	*			trans	-73.8	117.6	172.4	-56.3	0	0	0	0	109.3	P749	P749-C751 PolarHBondContact O-N 3.3Å; P749-C751 VanDerWaalsContact O-N 3.07Å
752	K	38.4	Very low	37.3	Very low	203 Å²	203	138.3 Å²	138.3	88%	0.883	76%	0.76	S	S	*	*			trans	-80.3	119.9	169.8	-66.1	-179.7	-178.6	177.6	0	108.3	P750	P750-K752 PolarHBondContact O-N 3.33Å
753	L	38.5	Very low	37.9	Very low	170 Å²	170	134.3 Å²	134.3	89%	0.89	74%	0.74	S	S	*	*			trans	-86.5	115.4	169	-66.2	171.3	0	0	0	108.3	L755	L753-L755 PolarHBondContact O-N 3.33Å
754	L	37.2	Very low	38.5	Very low	176 Å²	176	129 Å²	129	92%	0.921	71%	0.711	S	S	*	*			trans	-77.6	105	168.6	-90.2	151.8	0	0	0	108.2
755	L	39.4	Very low	38.9	Very low	105 Å²	105	127.2 Å²	127.2	55%	0.55	70%	0.701	S	S	.	*			trans	-76.9	121.2	167.9	-169.3	62.4	0	0	0	108	L753 V758 I764	L753-L755 PolarHBondContact O-N 3.33Å; L755-V758 HydrophobicContact CD2-CG2 4.44Å; L755-V758 HydrophobicContact CG-CG2 4.26Å; L755-I764 HydrophobicContact CD2-CD1 3.79Å; L755-I764 HydrophobicContact CD2-CG2 4.1Å
756	G	31.9	Very low	39.7	Very low	57 Å²	57	122.2 Å²	122.2	59%	0.588	68%	0.675	S	S	*	*			trans	-58.2	167.4	177.4	0	0	0	0	0	112.4	V758	G756-V758 WeakPolarHBondContact O-CG2 3.44Å; G756-V758 PolarHBondContact O-N 3.25Å
757	R	39	Very low	40.3	Very low	255 Å²	255	120 Å²	120	96%	0.962	67%	0.665	S	S	*	*			trans	-58.1	104.4	175.2	-74.8	-177	172.5	154.4	-0.7	110.3	A759	R757-A759 PolarHBondContact O-N 2.95Å
758	V	41	Very low	41.1	Very low	68 Å²	68	115.9 Å²	115.9	41%	0.412	64%	0.639	S	S	.	*			trans	-87.2	97.5	171.3	-172.2	0	0	0	0	107.4	L755 G756 S760 I764	L755-V758 HydrophobicContact CD2-CG2 4.44Å; L755-V758 HydrophobicContact CG-CG2 4.26Å; G756-V758 WeakPolarHBondContact O-CG2 3.44Å; G756-V758 PolarHBondContact O-N 3.25Å; V758-S760 PolarHBondContact O-N 3.17Å; V758-I764 HydrophobicContact CB-CD1 3.96Å; V758-I764 HydrophobicContact CG1-CD1 4.08Å; V758-I764 HydrophobicContact CG1-CG1 4.23Å; V758-I764 HydrophobicContact CG2-CD1 3.73Å; V758-I764 HydrophobicContact CG2-CG1 4.44Å
759	A	44.1	Very low	41.4	Very low	110 Å²	110	115.1 Å²	115.1	91%	0.909	63%	0.631	S	S	*	*			trans	-86.8	23.6	-179.9	0	0	0	0	0	113	R757	R757-A759 PolarHBondContact O-N 2.95Å
760	S	45.2	Very low	41.8	Very low	45 Å²	45	114 Å²	114	32%	0.315	62%	0.622	S	S	.	*	S	Bend	trans	-116	145.1	-176.3	-174.5	0	0	0	0	110.5	V758 E762	V758-S760 PolarHBondContact O-N 3.17Å; S760-E762 PolarHBondContact O-N 2.84Å; S760-E762 WeakPolarHBondContact OG-CB 3.48Å; S760-E762 WeakPolarHBondContact OG-CG 3.41Å; S760-E762 PolarHBondContact OG-N 2.85Å; S760-E762 PolarHBondContact OG-OE1 3.08Å
761	N	43.1	Very low	42.3	Very low	162 Å²	162	111.5 Å²	111.5	87%	0.866	61%	0.606	S	S	*	*	S	Bend	trans	-71.5	16.7	168.1	-65.9	-38.9	0	0	0	112.1
762	E	41.5	Very low	43.1	Very low	145 Å²	145	107 Å²	107	68%	0.678	57%	0.574	S	S	*	*	S	Bend	trans	-81.5	140.7	178.9	-77.6	162.7	-129.1	0	0	110.9	S760	S760-E762 PolarHBondContact O-N 2.84Å; S760-E762 WeakPolarHBondContact OG-CB 3.48Å; S760-E762 WeakPolarHBondContact OG-CG 3.41Å; S760-E762 PolarHBondContact OG-N 2.85Å; S760-E762 PolarHBondContact OG-OE1 3.08Å
763	D	44.6	Very low	43.4	Very low	76 Å²	76	99.9 Å²	99.9	41%	0.406	55%	0.549	S	S	.	.			trans	-66.7	134.5	173.4	-64.4	-32.8	0	0	0	109.5	R830	D763-R830 WeakPolarHBondContact OD1-CA 3.34Å; D763-R830 WeakPolarHBondContact OD1-CB 3.44Å; D763-R830 VanDerWaalsContact OD1-CD 3.28Å; D763-R830 WeakPolarHBondContact OD1-CD 3.45Å; D763-R830 WeakPolarHBondContact OD1-CG 3.43Å
764	I	48.3	Very low	44.1	Very low	42 Å²	42	93 Å²	93	22%	0.215	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	111.7	177.3	-57.3	172.2	0	0	0	107	L755 V758 I766 L829	L755-I764 HydrophobicContact CD2-CD1 3.79Å; L755-I764 HydrophobicContact CD2-CG2 4.1Å; V758-I764 HydrophobicContact CB-CD1 3.96Å; V758-I764 HydrophobicContact CG1-CD1 4.08Å; V758-I764 HydrophobicContact CG1-CG1 4.23Å; V758-I764 HydrophobicContact CG2-CD1 3.73Å; V758-I764 HydrophobicContact CG2-CG1 4.44Å; I764-I766 HydrophobicContact CG2-CG1 4.47Å; I764-L829 PolarHBondContact N-O 3.48Å; I764-L829 PolarHBondContact O-N 3.11Å
765	C	43.8	Very low	44.4	Very low	82 Å²	82	89.9 Å²	89.9	55%	0.554	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	126.2	175.8	-65.9	0	0	0	0	109.6	S828	C765-S828 PolarHBondContact SG-OG 3.25Å; C765-S828 VanDerWaalsContact SG-OG 3.34Å
766	I	51	Low	44.8	Very low	56 Å²	56	88.5 Å²	88.5	29%	0.287	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	108.4	172.3	-54.2	174.9	0	0	0	106.8	I764 T768 F772 L829	I764-I766 HydrophobicContact CG2-CG1 4.47Å; I766-T768 HydrophobicContact CG2-CG2 4Å; I766-F772 HydrophobicContact CB-CZ 4.2Å; I766-F772 HydrophobicContact CG2-CE1 4.43Å; I766-F772 HydrophobicContact CG2-CZ 3.76Å; I766-L829 HydrophobicContact CD1-CD1 4.4Å
767	E	45.9	Very low	45.4	Very low	146 Å²	146	88.2 Å²	88.2	68%	0.682	48%	0.481	S	S	*	.			trans	-88.6	123.8	172.1	-66.3	-172.1	-179.4	0	0	109.6
768	T	46.7	Very low	45.7	Very low	43 Å²	43	79.6 Å²	79.6	26%	0.264	46%	0.464	S	S	.	.			trans	-128.6	154.2	172.7	62.1	0	0	0	0	110.8	I766 T770 F772	I766-T768 HydrophobicContact CG2-CG2 4Å; T768-T770 PolarHBondContact OG1-O 3.28Å; T768-F772 HydrophobicContact CG2-CD1 3.57Å; T768-F772 HydrophobicContact CG2-CE1 3.14Å; T768-F772 HydrophobicContact CG2-CG 4.5Å; T768-F772 HydrophobicContact CG2-CZ 3.73Å; T768-F772 WeakPolarHBondContact OG1-CD1 3.38Å; T768-F772 WeakPolarHBondContact OG1-CE1 3.39Å
769	E	40.7	Very low	45.9	Very low	138 Å²	138	80.3 Å²	80.3	65%	0.645	47%	0.469	S	S	*	.	S	Bend	trans	-75	-33.1	178.3	-54.3	-163.1	135.6	0	0	112	R824	E769-R824 IonicContact OE1-CZ 3.76Å; E769-R824 IonicContact OE1-NH2 2.74Å; E769-R824 PolarHBondContact OE1-NH2 3.21Å
770	T	43.3	Very low	45.8	Very low	74 Å²	74	82.8 Å²	82.8	45%	0.454	47%	0.467	S	S	.	.	S	Bend	trans	-104.9	135.4	178.1	40.6	0	0	0	0	110.3	T768 F772 V791	T768-T770 PolarHBondContact OG1-O 3.28Å; T770-F772 PolarHBondContact O-N 3.38Å; T770-V791 HydrophobicContact CG2-CG2 4.08Å
771	P	48.6	Very low	45.8	Very low	72 Å²	72	90 Å²	90	47%	0.468	49%	0.492	S	S	.	.			trans	-53.6	125.3	164.3	-22.1	30.2	0	0	0	109.6	V791	P771-V791 HydrophobicContact CB-CG2 4.3Å; P771-V791 HydrophobicContact CG-CG2 4.31Å; P771-V791 WeakPolarHBondContact O-CG2 3.39Å
772	F	52	Low	45.9	Very low	23 Å²	23	88.4 Å²	88.4	10%	0.101	48%	0.48	C	S	.	.			trans	-129.4	147.1	176.2	67.1	-69.3	0	0	0	109.5	I766 T768 T770 F774 V788	I766-F772 HydrophobicContact CB-CZ 4.2Å; I766-F772 HydrophobicContact CG2-CE1 4.43Å; I766-F772 HydrophobicContact CG2-CZ 3.76Å; T768-F772 HydrophobicContact CG2-CD1 3.57Å; T768-F772 HydrophobicContact CG2-CE1 3.14Å; T768-F772 HydrophobicContact CG2-CG 4.5Å; T768-F772 HydrophobicContact CG2-CZ 3.73Å; T768-F772 WeakPolarHBondContact OG1-CD1 3.38Å; T768-F772 WeakPolarHBondContact OG1-CE1 3.39Å; T770-F772 PolarHBondContact O-N 3.38Å; F772-F774 AromaticContact CD2-CD1 3.67Å; F772-F774 HydrophobicContact CD2-CD1 3.67Å; F772-F774 HydrophobicContact CD2-CE1 4.45Å; F772-F774 AromaticContact CE2-CD1 3.29Å; F772-F774 HydrophobicContact CE2-CD1 3.29Å; F772-F774 AromaticContact CE2-CE1 3.79Å; F772-F774 HydrophobicContact CE2-CE1 3.79Å; F772-F774 HydrophobicContact CE2-CG 4.27Å; F772-F774 HydrophobicContact CZ-CD1 4.14Å; F772-F774 HydrophobicContact CZ-CE1 4.2Å; F772-V788 HydrophobicContact CB-CG1 3.48Å; F772-V788 VanDerWaalsContact CB-CG1 3.48Å; F772-V788 HydrophobicContact CD2-CB 4.37Å; F772-V788 HydrophobicContact CD2-CG1 3.7Å; F772-V788 HydrophobicContact CD2-CG2 4.07Å; F772-V788 HydrophobicContact CG-CG1 3.9Å
773	S	46	Very low	46.2	Very low	52 Å²	52	84.4 Å²	84.4	36%	0.364	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133.4	168.3	62.1	0	0	0	0	108.8	V788 A789	S773-V788 CarbonylContact O-C 3.48Å; S773-V788 VanDerWaalsContact O-CA 3.24Å; S773-V788 WeakPolarHBondContact O-CA 3.45Å; S773-A789 PolarHBondContact N-O 2.77Å; S773-A789 PolarHBondContact O-N 2.92Å; S773-A789 VanDerWaalsContact OG-CB 3.25Å; S773-A789 WeakPolarHBondContact OG-CB 3.42Å
774	F	52.8	Low	46	Very low	27 Å²	27	83.3 Å²	83.3	12%	0.118	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149.2	169.7	59.6	-82.9	0	0	0	109.6	F772 I776 I785 R787 L829	F772-F774 AromaticContact CD2-CD1 3.67Å; F772-F774 HydrophobicContact CD2-CD1 3.67Å; F772-F774 HydrophobicContact CD2-CE1 4.45Å; F772-F774 AromaticContact CE2-CD1 3.29Å; F772-F774 HydrophobicContact CE2-CD1 3.29Å; F772-F774 AromaticContact CE2-CE1 3.79Å; F772-F774 HydrophobicContact CE2-CE1 3.79Å; F772-F774 HydrophobicContact CE2-CG 4.27Å; F772-F774 HydrophobicContact CZ-CD1 4.14Å; F772-F774 HydrophobicContact CZ-CE1 4.2Å; F774-I776 HydrophobicContact CD2-CD1 4.42Å; F774-I776 HydrophobicContact CD2-CG1 3.69Å; F774-I776 HydrophobicContact CE2-CD1 3.6Å; F774-I776 HydrophobicContact CE2-CG1 3.36Å; F774-I776 HydrophobicContact CZ-CD1 4.42Å; F774-I785 HydrophobicContact CB-CG2 3.69Å; F774-I785 HydrophobicContact CD2-CB 4.36Å; F774-I785 HydrophobicContact CD2-CG1 4.21Å; F774-I785 HydrophobicContact CD2-CG2 3.41Å; F774-I785 VanDerWaalsContact CD2-CG2 3.41Å; F774-I785 HydrophobicContact CE2-CD1 4.48Å; F774-I785 HydrophobicContact CE2-CG1 4.45Å; F774-I785 HydrophobicContact CE2-CG2 4.32Å; F774-I785 HydrophobicContact CG-CG2 3.73Å; F774-R787 WeakPolarHBondContact CA-O 3.48Å; F774-L829 HydrophobicContact CE1-CD1 4Å; F774-L829 HydrophobicContact CE2-CD1 3.76Å; F774-L829 HydrophobicContact CE2-CD2 4.43Å; F774-L829 HydrophobicContact CZ-CD1 3.15Å; F774-L829 HydrophobicContact CZ-CD2 3.68Å; F774-L829 HydrophobicContact CZ-CG 3.97Å
775	N	42.9	Very low	46	Very low	110 Å²	110	85 Å²	85	59%	0.588	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	129.7	172.5	-73.2	-21.4	0	0	0	109.3	I785 T786	N775-I785 CarbonylContact O-C 3.52Å; N775-I785 WeakPolarHBondContact O-CA 3.45Å; N775-T786 PolarHBondContact N-O 3.27Å; N775-T786 PolarHBondContact O-N 3.47Å
776	I	48.5	Very low	46	Very low	76 Å²	76	84.5 Å²	84.5	39%	0.39	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	117.6	169.5	-50.2	177.8	0	0	0	107.4	F774 I783 I785	F774-I776 HydrophobicContact CD2-CD1 4.42Å; F774-I776 HydrophobicContact CD2-CG1 3.69Å; F774-I776 HydrophobicContact CE2-CD1 3.6Å; F774-I776 HydrophobicContact CE2-CG1 3.36Å; F774-I776 HydrophobicContact CZ-CD1 4.42Å; I776-I783 HydrophobicContact CG2-CG2 3.38Å; I776-I785 HydrophobicContact CG1-CG1 4.45Å
777	A	44.5	Very low	45.5	Very low	51 Å²	51	92 Å²	92	42%	0.421	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.2	163.3	0	0	0	0	0	107.6	I783 C784	A777-I783 CarbonylContact O-C 3.6Å; A777-C784 HydrophobicContact CB-CB 4.49Å; A777-C784 PolarHBondContact N-O 3.26Å; A777-C784 WeakPolarHBondContact O-CA 3.38Å; A777-C784 PolarHBondContact O-N 2.94Å
778	A	44.8	Very low	45.3	Very low	74 Å²	74	89.2 Å²	89.2	61%	0.612	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.7	171.5	0	0	0	0	0	108.5	E782 I783	A778-E782 CarbonylContact C-O 3.49Å; A778-E782 WeakPolarHBondContact CA-O 3.46Å; A778-I783 HydrophobicContact CB-CG1 3.97Å
779	T	44.9	Very low	45.2	Very low	83 Å²	83	88.1 Å²	88.1	51%	0.509	48%	0.476	S	S	.	.			trans	-95.3	171.6	160.3	65.6	0	0	0	0	108.5	K781 E782	T779-K781 PolarHBondContact O-N 3.5Å; T779-E782 PolarHBondContact N-O 2.67Å; T779-E782 PolarHBondContact O-N 2.92Å; T779-E782 PolarHBondContact OG1-N 3.35Å; T779-E782 PolarHBondContact OG1-O 3.09Å; T779-E782 VanDerWaalsContact OG1-O 3.04Å
780	D	43.6	Very low	45.2	Very low	162 Å²	162	83.6 Å²	83.6	87%	0.866	46%	0.46	S	S	*	.	S	Bend	trans	-58	-19.8	177.8	-57.7	-16.1	0	0	0	113.5
781	K	45.2	Very low	45.3	Very low	196 Å²	196	81.2 Å²	81.2	85%	0.852	45%	0.445	S	S	*	.	S	Bend	trans	-115.8	-26.9	-176.3	-63.5	-177.2	-178	177.9	0	114.1	T779	T779-K781 PolarHBondContact O-N 3.5Å
782	E	44.1	Very low	45.3	Very low	129 Å²	129	82.4 Å²	82.4	60%	0.603	44%	0.444	S	S	*	.			trans	-142	140.9	-167.4	-60.3	-175.2	163	0	0	111.7	A778 T779	A778-E782 CarbonylContact C-O 3.49Å; A778-E782 WeakPolarHBondContact CA-O 3.46Å; T779-E782 PolarHBondContact N-O 2.67Å; T779-E782 PolarHBondContact O-N 2.92Å; T779-E782 PolarHBondContact OG1-N 3.35Å; T779-E782 PolarHBondContact OG1-O 3.09Å; T779-E782 VanDerWaalsContact OG1-O 3.04Å
783	I	48.3	Very low	44.8	Very low	60 Å²	60	86.1 Å²	86.1	31%	0.308	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	108.9	171.5	-59.7	172.7	0	0	0	107.5	I776 A777 A778 L831 F833	I776-I783 HydrophobicContact CG2-CG2 3.38Å; A777-I783 CarbonylContact O-C 3.6Å; A778-I783 HydrophobicContact CB-CG1 3.97Å; I783-L831 HydrophobicContact CD1-CB 4.29Å; I783-L831 HydrophobicContact CD1-CD1 3.81Å; I783-L831 HydrophobicContact CD1-CD2 4.14Å; I783-L831 HydrophobicContact CD1-CG 4.29Å; I783-L831 HydrophobicContact CG2-CD1 4.41Å; I783-L831 HydrophobicContact CG2-CD2 4.45Å; I783-F833 HydrophobicContact CD1-CE1 3.89Å; I783-F833 HydrophobicContact CD1-CZ 4.17Å
784	C	41.2	Very low	44.6	Very low	53 Å²	53	88.2 Å²	88.2	36%	0.358	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	118.9	176.9	-56.1	0	0	0	0	110.2	A777	A777-C784 HydrophobicContact CB-CB 4.49Å; A777-C784 PolarHBondContact N-O 3.26Å; A777-C784 WeakPolarHBondContact O-CA 3.38Å; A777-C784 PolarHBondContact O-N 2.94Å
785	I	46.6	Very low	44.4	Very low	78 Å²	78	92.3 Å²	92.3	40%	0.4	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	113.2	167	-65	170.7	0	0	0	107.7	F774 N775 I776	F774-I785 HydrophobicContact CB-CG2 3.69Å; F774-I785 HydrophobicContact CD2-CB 4.36Å; F774-I785 HydrophobicContact CD2-CG1 4.21Å; F774-I785 HydrophobicContact CD2-CG2 3.41Å; F774-I785 VanDerWaalsContact CD2-CG2 3.41Å; F774-I785 HydrophobicContact CE2-CD1 4.48Å; F774-I785 HydrophobicContact CE2-CG1 4.45Å; F774-I785 HydrophobicContact CE2-CG2 4.32Å; F774-I785 HydrophobicContact CG-CG2 3.73Å; N775-I785 CarbonylContact O-C 3.52Å; N775-I785 WeakPolarHBondContact O-CA 3.45Å; I776-I785 HydrophobicContact CG1-CG1 4.45Å
786	T	44.2	Very low	44	Very low	72 Å²	72	92.2 Å²	92.2	44%	0.442	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	139.4	179.3	41.3	0	0	0	0	111.8	N775	N775-T786 PolarHBondContact N-O 3.27Å; N775-T786 PolarHBondContact O-N 3.47Å
787	R	41.4	Very low	43.4	Very low	212 Å²	212	97.2 Å²	97.2	80%	0.8	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	56.3	96.6	165.8	-155.4	177.3	-173.4	130.7	1.8	115.3	F774 A789	F774-R787 WeakPolarHBondContact CA-O 3.48Å; R787-A789 PolarHBondContact O-N 3.37Å
788	V	41.7	Very low	43	Very low	89 Å²	89	106 Å²	106	54%	0.539	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	101.5	166.1	177.4	0	0	0	0	107.3	F772 S773 S790	F772-V788 HydrophobicContact CB-CG1 3.48Å; F772-V788 VanDerWaalsContact CB-CG1 3.48Å; F772-V788 HydrophobicContact CD2-CB 4.37Å; F772-V788 HydrophobicContact CD2-CG1 3.7Å; F772-V788 HydrophobicContact CD2-CG2 4.07Å; F772-V788 HydrophobicContact CG-CG1 3.9Å; S773-V788 CarbonylContact O-C 3.48Å; S773-V788 VanDerWaalsContact O-CA 3.24Å; S773-V788 WeakPolarHBondContact O-CA 3.45Å; V788-S790 PolarHBondContact O-N 3.44Å
789	A	43.1	Very low	42.6	Very low	19 Å²	19	111.3 Å²	111.3	16%	0.157	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.8	125	167.8	0	0	0	0	0	107.7	S773 R787 D793	S773-A789 PolarHBondContact N-O 2.77Å; S773-A789 PolarHBondContact O-N 2.92Å; S773-A789 VanDerWaalsContact OG-CB 3.25Å; S773-A789 WeakPolarHBondContact OG-CB 3.42Å; R787-A789 PolarHBondContact O-N 3.37Å; A789-D793 WeakPolarHBondContact CA-OD2 3.45Å; A789-D793 HydrophobicContact CB-CB 4.03Å
790	S	42.5	Very low	41.9	Very low	44 Å²	44	115.9 Å²	115.9	31%	0.308	57%	0.568	S	S	.	*			trans	-67	160.4	173.8	174.4	0	0	0	0	110.2	V788 E792 D793 L794	V788-S790 PolarHBondContact O-N 3.44Å; S790-E792 PolarHBondContact O-N 2.94Å; S790-E792 PolarHBondContact OG-N 3.41Å; S790-E792 PolarHBondContact OG-OE2 2.93Å; S790-D793 PolarHBondContact N-OD2 2.91Å; S790-D793 WeakPolarHBondContact O-CB 3.28Å; S790-D793 PolarHBondContact O-N 3.41Å; S790-L794 PolarHBondContact O-N 3.43Å; S790-L794 VanDerWaalsContact O-N 3.15Å
791	V	45.5	Very low	41.3	Very low	23 Å²	23	116.4 Å²	116.4	14%	0.139	57%	0.565	C	S	.	*	H	α-helix	trans	-52.7	-36	169.3	176.5	0	0	0	0	111	T770 P771 L794 K795	T770-V791 HydrophobicContact CG2-CG2 4.08Å; P771-V791 HydrophobicContact CB-CG2 4.3Å; P771-V791 HydrophobicContact CG-CG2 4.31Å; P771-V791 WeakPolarHBondContact O-CG2 3.39Å; V791-L794 PolarHBondContact O-N 3.47Å; V791-K795 HydrophobicContact CG1-CD 4.32Å; V791-K795 HydrophobicContact CG1-CG 4.5Å; V791-K795 WeakPolarHBondContact O-CG 3.42Å; V791-K795 PolarHBondContact O-N 2.94Å
792	E	46.7	Very low	40.5	Very low	98 Å²	98	115 Å²	115	46%	0.458	57%	0.567	S	S	.	*	H	α-helix	trans	-65	-38.5	176.5	-81.8	55.3	-118.3	0	0	111.9	S790 L794 K795 C796	S790-E792 PolarHBondContact O-N 2.94Å; S790-E792 PolarHBondContact OG-N 3.41Å; S790-E792 PolarHBondContact OG-OE2 2.93Å; E792-L794 VanDerWaalsContact C-N 3.27Å; E792-L794 PolarHBondContact O-N 2.94Å; E792-K795 PolarHBondContact O-N 2.98Å; E792-K795 IonicContact OE1-NZ 2.88Å; E792-K795 PolarHBondContact OE1-NZ 3.4Å; E792-C796 PolarHBondContact O-N 3.04Å; E792-C796 PolarHBondContact O-SG 2.94Å; E792-C796 VanDerWaalsContact O-SG 3.34Å
793	D	43.2	Very low	39.8	Very low	100 Å²	100	113.5 Å²	113.5	54%	0.535	57%	0.568	S	S	.	*	H	α-helix	trans	-64.7	-34.7	174.9	-61.2	-34.8	0	0	0	111.4	A789 S790	A789-D793 WeakPolarHBondContact CA-OD2 3.45Å; A789-D793 HydrophobicContact CB-CB 4.03Å; S790-D793 PolarHBondContact N-OD2 2.91Å; S790-D793 WeakPolarHBondContact O-CB 3.28Å; S790-D793 PolarHBondContact O-N 3.41Å
794	L	41.7	Very low	38.8	Very low	97 Å²	97	118.5 Å²	118.5	51%	0.508	60%	0.595	S	S	.	*	H	α-helix	trans	-75.7	-27.7	177.5	-68.1	169.8	0	0	0	113.1	S790 V791 E792	S790-L794 PolarHBondContact O-N 3.43Å; S790-L794 VanDerWaalsContact O-N 3.15Å; V791-L794 PolarHBondContact O-N 3.47Å; E792-L794 VanDerWaalsContact C-N 3.27Å; E792-L794 PolarHBondContact O-N 2.94Å
795	K	48.3	Very low	38.1	Very low	113 Å²	113	126.4 Å²	126.4	49%	0.491	62%	0.623	S	S	.	*	H	α-helix	trans	-74.7	-27.5	176.4	-75.6	173.6	-171.3	153.4	0	112.6	V791 E792 Q797	V791-K795 HydrophobicContact CG1-CD 4.32Å; V791-K795 HydrophobicContact CG1-CG 4.5Å; V791-K795 WeakPolarHBondContact O-CG 3.42Å; V791-K795 PolarHBondContact O-N 2.94Å; E792-K795 PolarHBondContact O-N 2.98Å; E792-K795 IonicContact OE1-NZ 2.88Å; E792-K795 PolarHBondContact OE1-NZ 3.4Å; K795-Q797 PolarHBondContact O-N 3.16Å
796	C	33.9	Very low	37.3	Very low	108 Å²	108	126.3 Å²	126.3	73%	0.73	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-7.4	-175	-75.9	0	0	0	0	115.2	E792	E792-C796 PolarHBondContact O-N 3.04Å; E792-C796 PolarHBondContact O-SG 2.94Å; E792-C796 VanDerWaalsContact O-SG 3.34Å
797	Q	36	Very low	36.5	Very low	181 Å²	181	130 Å²	130	85%	0.846	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	6.7	-178.1	-147.5	174.2	33	0	0	115.5	K795	K795-Q797 PolarHBondContact O-N 3.16Å
798	R	36.8	Very low	36	Very low	236 Å²	236	126.7 Å²	126.7	89%	0.891	66%	0.657	S	S	*	*	S	Bend	trans	-110.3	10.8	-179	-74.6	-161.9	-177	-159.7	2.2	116.2
799	Q	34.8	Very low	35.5	Very low	185 Å²	185	130.5 Å²	130.5	86%	0.864	67%	0.674	S	S	*	*			trans	-123.4	51.4	179.1	-77.7	-172.3	-10.5	0	0	112.8
800	E	30.8	Very low	34.8	Very low	178 Å²	178	134.7 Å²	134.7	83%	0.832	70%	0.702	S	S	*	*	S	Bend	trans	-137.3	136	154.4	-72.5	-170.5	161.1	0	0	107.6
801	H	30.7	Very low	34.2	Very low	174 Å²	174	140.1 Å²	140.1	81%	0.806	73%	0.727	S	S	*	*			trans	76.8	79.5	-167.5	-66	-88.4	0	0	0	117.2
802	D	30	Very low	33.4	Very low	167 Å²	167	145.9 Å²	145.9	89%	0.893	76%	0.757	S	S	*	*				-149.5	109.4	115.1	-105.7	-26.3	0	0	0	110.5
803	P	27.8	Very low	32.7	Very low	96 Å²	96	148.8 Å²	148.8	62%	0.623	78%	0.776	S	S	*	*			trans	-82.3	132.8	172.2	7.3	8.5	0	0	0	111.5
804	L	28	Very low	32.1	Very low	166 Å²	166	150.2 Å²	150.2	87%	0.869	78%	0.784	S	S	*	*			trans	60.2	96	149	-64.3	158.9	0	0	0	118
805	K	27.3	Very low	31.6	Very low	218 Å²	218	151.3 Å²	151.3	95%	0.948	80%	0.799	S	S	*	*				161.6	132.5	124.2	-99.5	173.8	170.2	176.1	0	111.6
806	G	29.1	Very low	30.9	Very low	76 Å²	76	154.4 Å²	154.4	78%	0.784	81%	0.813	S	S	*	*			trans	144.6	69.6	157.7	0	0	0	0	0	114.5
807	N	27.7	Very low	31	Very low	151 Å²	151	154.2 Å²	154.2	81%	0.807	81%	0.813	S	S	*	*			trans	-24.8	131.5	159.1	-65.1	-19.8	0	0	0	115.1
808	N	29.9	Very low	31.2	Very low	142 Å²	142	152.3 Å²	152.3	76%	0.759	81%	0.807	S	S	*	*			trans	41.3	91.9	132.3	-61.3	-10.3	0	0	0	118.1
809	D	32.3	Very low	31.3	Very low	168 Å²	168	149.6 Å²	149.6	90%	0.898	80%	0.802	S	S	*	*			trans	-133.1	87.1	137.6	-86.1	-39.6	0	0	0	108.6	N811	D809-N811 PolarHBondContact O-N 3.14Å; D809-N811 VanDerWaalsContact O-N 3.14Å
810	S	28.8	Very low	31.7	Very low	107 Å²	107	149.1 Å²	149.1	75%	0.748	79%	0.792	S	S	*	*			trans	-69.8	91.9	163.3	51.6	0	0	0	0	108.6
811	N	29.4	Very low	32	Very low	158 Å²	158	147.8 Å²	147.8	85%	0.845	79%	0.791	S	S	*	*			trans	-174	84.5	160.3	-98.1	-18.5	0	0	0	111.5	D809	D809-N811 PolarHBondContact O-N 3.14Å; D809-N811 VanDerWaalsContact O-N 3.14Å
812	N	28.9	Very low	32.4	Very low	144 Å²	144	146.5 Å²	146.5	77%	0.77	78%	0.78	S	S	*	*				-172	102.6	123.8	-126.7	-32.5	0	0	0	110.5	N814	N812-N814 VanDerWaalsContact C-N 3.34Å; N812-N814 PolarHBondContact O-N 3.21Å
813	N	30.9	Very low	32.6	Very low	160 Å²	160	147.8 Å²	147.8	86%	0.856	78%	0.777	S	S	*	*			trans	-68	91.4	164.9	-69.8	-28.2	0	0	0	108.5
814	N	30.8	Very low	32.6	Very low	129 Å²	129	150 Å²	150	69%	0.69	77%	0.773	S	S	*	*			trans	-139.8	64.9	160.9	-95.2	-34.6	0	0	0	108.8	N812 K816	N812-N814 VanDerWaalsContact C-N 3.34Å; N812-N814 PolarHBondContact O-N 3.21Å; N814-K816 PolarHBondContact O-N 3.36Å
815	S	31.6	Very low	32.9	Very low	120 Å²	120	147.9 Å²	147.9	84%	0.839	76%	0.761	S	S	*	*			trans	-71.6	62.8	164.1	60.5	0	0	0	0	109.7	S817	S815-S817 VanDerWaalsContact C-N 3.31Å; S815-S817 PolarHBondContact O-N 3.27Å
816	K	34.1	Very low	33	Very low	179 Å²	179	142 Å²	142	78%	0.778	75%	0.746	S	S	*	*			trans	-66.6	104.7	154.6	-84.3	-179.1	179	176	0	104.7	N814 I818	N814-K816 PolarHBondContact O-N 3.36Å; K816-I818 VanDerWaalsContact C-N 3.3Å; K816-I818 PolarHBondContact O-N 3.09Å
817	S	35.2	Very low	33.1	Very low	104 Å²	104	140.4 Å²	140.4	73%	0.727	72%	0.719	S	S	*	*			trans	-52.7	101.5	170.1	50.4	0	0	0	0	106.9	S815 K819	S815-S817 VanDerWaalsContact C-N 3.31Å; S815-S817 PolarHBondContact O-N 3.27Å; S817-K819 PolarHBondContact O-N 3.34Å
818	I	41	Very low	33.3	Very low	141 Å²	141	136.6 Å²	136.6	72%	0.723	70%	0.704	S	S	*	*			trans	-64.9	94	168.3	-62.7	171	0	0	0	103.3	K816 R820	K816-I818 VanDerWaalsContact C-N 3.3Å; K816-I818 PolarHBondContact O-N 3.09Å; I818-R820 HydrophobicContact CG2-CG 4.12Å; I818-R820 PolarHBondContact O-N 2.72Å
819	K	38.8	Very low	33.7	Very low	179 Å²	179	130.8 Å²	130.8	78%	0.778	67%	0.673	S	S	*	*			trans	-56.1	91.6	163.3	-86.3	-176.2	175.3	-180	0	104.8	S817 N821	S817-K819 PolarHBondContact O-N 3.34Å; K819-N821 PolarHBondContact O-N 2.9Å
820	R	42.5	Very low	33.8	Very low	174 Å²	174	131.5 Å²	131.5	66%	0.657	66%	0.663	S	S	*	*			trans	-66.4	96.2	171.2	-71.8	-177.8	-173.5	154.9	2.4	104.4	I818 Y822	I818-R820 HydrophobicContact CG2-CG 4.12Å; I818-R820 PolarHBondContact O-N 2.72Å; R820-Y822 HydrophobicContact CB-CD2 4.47Å; R820-Y822 HydrophobicContact CB-CE2 4.1Å; R820-Y822 WeakPolarHBondContact O-CD2 3.38Å; R820-Y822 PolarHBondContact O-N 2.87Å
821	N	37.2	Very low	34.2	Very low	150 Å²	150	129.5 Å²	129.5	80%	0.802	64%	0.644	S	S	*	*			trans	-58.6	95.7	164.1	-77.9	-36.8	0	0	0	105.9	K819 K823	K819-N821 PolarHBondContact O-N 2.9Å; N821-K823 PolarHBondContact O-N 3.05Å
822	Y	38.4	Very low	34.3	Very low	147 Å²	147	127.5 Å²	127.5	58%	0.576	64%	0.637	S	S	*	*			trans	-67.5	92.4	171.7	-69.2	-79.7	0	0	0	106.1	R820 R824	R820-Y822 HydrophobicContact CB-CD2 4.47Å; R820-Y822 HydrophobicContact CB-CE2 4.1Å; R820-Y822 WeakPolarHBondContact O-CD2 3.38Å; R820-Y822 PolarHBondContact O-N 2.87Å; Y822-R824 PolarHBondContact O-N 3.05Å; Y822-R824 VanDerWaalsContact O-N 3.1Å
823	K	34.9	Very low	34.6	Very low	194 Å²	194	127.9 Å²	127.9	84%	0.843	63%	0.632	S	S	*	*			trans	-64.8	111	172.5	-159.3	173.6	-173.3	177	0	106.1	N821 I825	N821-K823 PolarHBondContact O-N 3.05Å; K823-I825 PolarHBondContact O-N 3.29Å
824	R	29	Very low	34.6	Very low	143 Å²	143	123.8 Å²	123.8	54%	0.54	63%	0.628	S	S	.	*			trans	-52.6	123.2	175.3	-68.3	-177.6	-177.9	176.3	-0.8	107.9	E769 Y822 P826	E769-R824 IonicContact OE1-CZ 3.76Å; E769-R824 IonicContact OE1-NH2 2.74Å; E769-R824 PolarHBondContact OE1-NH2 3.21Å; Y822-R824 PolarHBondContact O-N 3.05Å; Y822-R824 VanDerWaalsContact O-N 3.1Å; R824-P826 VanDerWaalsContact O-CD 3.27Å; R824-P826 WeakPolarHBondContact O-CD 3.38Å
825	I	32.6	Very low	34.5	Very low	121 Å²	121	123.1 Å²	123.1	62%	0.621	63%	0.633	S	S	*	*			trans	-97.7	103.5	175.8	-58.1	176.4	0	0	0	105.7	K823 I827	K823-I825 PolarHBondContact O-N 3.29Å; I825-I827 PolarHBondContact O-N 2.98Å
826	P	29.2	Very low	34.5	Very low	95 Å²	95	126.3 Å²	126.3	62%	0.617	64%	0.635	S	S	*	*			trans	-63.5	125.9	174.2	25.6	-32.1	0	0	0	108.9	R824	R824-P826 VanDerWaalsContact O-CD 3.27Å; R824-P826 WeakPolarHBondContact O-CD 3.38Å
827	I	32.4	Very low	34.3	Very low	43 Å²	43	121.1 Å²	121.1	22%	0.221	62%	0.621	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.3	112	172.9	-55.3	175.8	0	0	0	106.7	I825 L829	I825-I827 PolarHBondContact O-N 2.98Å; I827-L829 HydrophobicContact CG2-CD2 4.05Å; I827-L829 HydrophobicContact CG2-CG 4.28Å
828	S	32	Very low	34.2	Very low	70 Å²	70	125.8 Å²	125.8	49%	0.49	63%	0.628	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.7	126.2	173.2	-168.2	0	0	0	0	109	C765	C765-S828 PolarHBondContact SG-OG 3.25Å; C765-S828 VanDerWaalsContact SG-OG 3.34Å
829	L	37.3	Very low	33.8	Very low	21 Å²	21	125.6 Å²	125.6	11%	0.11	63%	0.628	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.2	117.5	-179.7	-60.7	162	0	0	0	109.2	I764 I766 F774 I827	I764-L829 PolarHBondContact N-O 3.48Å; I764-L829 PolarHBondContact O-N 3.11Å; I766-L829 HydrophobicContact CD1-CD1 4.4Å; F774-L829 HydrophobicContact CE1-CD1 4Å; F774-L829 HydrophobicContact CE2-CD1 3.76Å; F774-L829 HydrophobicContact CE2-CD2 4.43Å; F774-L829 HydrophobicContact CZ-CD1 3.15Å; F774-L829 HydrophobicContact CZ-CD2 3.68Å; F774-L829 HydrophobicContact CZ-CG 3.97Å; I827-L829 HydrophobicContact CG2-CD2 4.05Å; I827-L829 HydrophobicContact CG2-CG 4.28Å
830	R	35.6	Very low	33.5	Very low	182 Å²	182	124 Å²	124	69%	0.687	63%	0.628	S	S	*	*			trans	-98.8	109.5	173.4	-177.3	159.3	177.9	-155.9	-1.5	110.1	D763	D763-R830 WeakPolarHBondContact OD1-CA 3.34Å; D763-R830 WeakPolarHBondContact OD1-CB 3.44Å; D763-R830 VanDerWaalsContact OD1-CD 3.28Å; D763-R830 WeakPolarHBondContact OD1-CD 3.45Å; D763-R830 WeakPolarHBondContact OD1-CG 3.43Å
831	L	37.2	Very low	33	Very low	66 Å²	66	124.8 Å²	124.8	35%	0.346	64%	0.639	S	S	.	*			trans	-90.1	120	171.8	-61	173.5	0	0	0	108.1	I783	I783-L831 HydrophobicContact CD1-CB 4.29Å; I783-L831 HydrophobicContact CD1-CD1 3.81Å; I783-L831 HydrophobicContact CD1-CD2 4.14Å; I783-L831 HydrophobicContact CD1-CG 4.29Å; I783-L831 HydrophobicContact CG2-CD1 4.41Å; I783-L831 HydrophobicContact CG2-CD2 4.45Å
832	T	31.7	Very low	32.6	Very low	115 Å²	115	122 Å²	122	71%	0.706	63%	0.631	S	S	*	*			trans	-108.1	114.4	179	-28	0	0	0	0	107.9	G834	T832-G834 PolarHBondContact O-N 3.18Å
833	F	33.4	Very low	32.3	Very low	152 Å²	152	122.2 Å²	122.2	67%	0.667	64%	0.641	S	S	*	*			trans	-78.5	107.9	174.1	-60.5	-82.7	0	0	0	108.6	I783	I783-F833 HydrophobicContact CD1-CE1 3.89Å; I783-F833 HydrophobicContact CD1-CZ 4.17Å
834	G	30.8	Very low	32.3	Very low	74 Å²	74	118 Å²	118	76%	0.763	63%	0.631	S	S	*	*			trans	-68.1	129.1	171.1	0	0	0	0	0	109.8	T832	T832-G834 PolarHBondContact O-N 3.18Å
835	S	29.6	Very low	32.5	Very low	116 Å²	116	119.8 Å²	119.8	81%	0.811	65%	0.645	S	S	*	*			trans	-49.8	140.7	176.6	46.6	0	0	0	0	113.3	S837	S835-S837 PolarHBondContact O-N 3.48Å
836	E	30.7	Very low	32.5	Very low	186 Å²	186	117.6 Å²	117.6	87%	0.869	64%	0.641	S	S	*	*			trans	-36.1	122.6	176.6	-60.6	176.4	-175.9	0	0	112.8	K838	E836-K838 PolarHBondContact O-N 3.29Å
837	S	31.5	Very low	32.7	Very low	70 Å²	70	120 Å²	120	49%	0.49	65%	0.649	S	S	.	*			trans	-59.9	111	174.2	54.5	0	0	0	0	108.9	S835 L839	S835-S837 PolarHBondContact O-N 3.48Å; S837-L839 PolarHBondContact O-N 3.46Å
838	K	33.4	Very low	32.8	Very low	203 Å²	203	124.2 Å²	124.2	88%	0.883	67%	0.667	S	S	*	*			trans	-67.9	73.5	161.9	-72.4	-173.8	178.1	-176.8	0	108.3	E836 N840	E836-K838 PolarHBondContact O-N 3.29Å; K838-N840 PolarHBondContact O-N 3.14Å
839	L	31.9	Very low	32.6	Very low	137 Å²	137	126.6 Å²	126.6	72%	0.717	67%	0.674	S	S	*	*			trans	-70.7	85.8	168.7	-86.9	162.2	0	0	0	107.3	S837 Q841	S837-L839 PolarHBondContact O-N 3.46Å; L839-Q841 PolarHBondContact O-N 2.91Å
840	N	31.7	Very low	32.2	Very low	144 Å²	144	133.9 Å²	133.9	77%	0.77	70%	0.702	S	S	*	*			trans	-59.6	126.9	150	-90.5	-35.5	0	0	0	106.1	K838 S842	K838-N840 PolarHBondContact O-N 3.14Å; N840-S842 PolarHBondContact O-N 3.3Å
841	Q	31.9	Very low	31.7	Very low	192 Å²	192	133.8 Å²	133.8	90%	0.897	70%	0.701	S	S	*	*			trans	-67.8	62.4	-175.1	-153.9	164.8	25.9	0	0	110.7	L839 I843	L839-Q841 PolarHBondContact O-N 2.91Å; Q841-I843 PolarHBondContact O-N 3.29Å
842	S	29.8	Very low	31.2	Very low	90 Å²	90	135.5 Å²	135.5	63%	0.629	73%	0.725	S	S	*	*			trans	-88.5	102.4	172.1	162.5	0	0	0	0	106.4	N840 V844	N840-S842 PolarHBondContact O-N 3.3Å; S842-V844 PolarHBondContact O-N 2.89Å
843	I	32.2	Very low	30.8	Very low	153 Å²	153	133.9 Å²	133.9	79%	0.785	71%	0.71	S	S	*	*			trans	-60.2	82.1	173.5	-59.1	162.9	0	0	0	108.4	Q841	Q841-I843 PolarHBondContact O-N 3.29Å
844	V	34.5	Very low	30.6	Very low	105 Å²	105	133.9 Å²	133.9	64%	0.636	71%	0.707	S	S	*	*			trans	-146.5	116.9	164.3	-174.8	0	0	0	0	106	S842 S846	S842-V844 PolarHBondContact O-N 2.89Å; V844-S846 VanDerWaalsContact C-N 3.28Å; V844-S846 PolarHBondContact O-N 3.26Å
845	H	32	Very low	30.5	Very low	180 Å²	180	138.4 Å²	138.4	83%	0.833	70%	0.702	S	S	*	*			trans	-66.5	85.6	178	-66.4	47.7	0	0	0	108.8
846	S	34	Very low	30.5	Very low	76 Å²	76	136.9 Å²	136.9	53%	0.531	69%	0.688	S	S	.	*			trans	-106.8	112.1	165.9	53.8	0	0	0	0	108.5	V844 E848	V844-S846 VanDerWaalsContact C-N 3.28Å; V844-S846 PolarHBondContact O-N 3.26Å; S846-E848 PolarHBondContact O-N 3.32Å
847	N	34.1	Very low	30.3	Very low	146 Å²	146	134.6 Å²	134.6	78%	0.781	68%	0.681	S	S	*	*			trans	-59.1	85.8	169.7	-66.3	-23.9	0	0	0	109.3	N849	N847-N849 PolarHBondContact O-N 3.27Å
848	E	33.5	Very low	30	Very low	130 Å²	130	137.6 Å²	137.6	61%	0.607	69%	0.691	S	S	*	*			trans	-73.9	92.6	175.3	-69.4	-168.8	177.4	0	0	108.9	S846 Y850	S846-E848 PolarHBondContact O-N 3.32Å; E848-Y850 PolarHBondContact O-N 3.35Å
849	N	27.9	Very low	29.9	Very low	120 Å²	120	133.4 Å²	133.4	64%	0.642	68%	0.684	S	S	*	*			trans	-70.6	107.9	174.8	-71.9	-46.6	0	0	0	110	N847 R851	N847-N849 PolarHBondContact O-N 3.27Å; N849-R851 PolarHBondContact O-N 3.48Å
850	Y	28.7	Very low	29.7	Very low	175 Å²	175	134.4 Å²	134.4	69%	0.686	69%	0.685	S	S	*	*			trans	-66.8	129.1	171.2	-62.6	-81.7	0	0	0	110.8	E848	E848-Y850 PolarHBondContact O-N 3.35Å
851	R	25	Very low	29.6	Very low	179 Å²	179	130.5 Å²	130.5	68%	0.675	68%	0.679	S	S	*	*			trans	-99.1	99.2	-176.3	-173.1	-179.9	174.3	-164.5	-1.9	110.4	N849 M853	N849-R851 PolarHBondContact O-N 3.48Å; R851-M853 HydrophobicContact CG-CG 4.29Å; R851-M853 HydrophobicContact CG-SD 4.12Å; R851-M853 PolarHBondContact NE-SD 3.16Å; R851-M853 PolarHBondContact NH2-SD 3.06Å
852	A	26.8	Very low	29.5	Very low	102 Å²	102	126.5 Å²	126.5	84%	0.843	67%	0.672	S	S	*	*			trans	-74.1	122.5	165.1	0	0	0	0	0	109.4
853	M	23.5	Very low	29.6	Very low	82 Å²	82	134.3 Å²	134.3	40%	0.404	69%	0.688	S	S	.	*			trans	-101.6	114.3	177.2	-72.7	-68	-67.7	0	0	109.5	R851 Y855	R851-M853 HydrophobicContact CG-CG 4.29Å; R851-M853 HydrophobicContact CG-SD 4.12Å; R851-M853 PolarHBondContact NE-SD 3.16Å; R851-M853 PolarHBondContact NH2-SD 3.06Å; M853-Y855 HydrophobicContact CB-CD2 4.46Å; M853-Y855 HydrophobicContact CB-CE2 3.62Å; M853-Y855 HydrophobicContact CE-CE1 4.03Å
854	Y	29.9	Very low	29.5	Very low	151 Å²	151	133.6 Å²	133.6	59%	0.592	69%	0.69	S	S	*	*			trans	-93.6	124.3	173.9	-176.5	-116.3	0	0	0	109.6	V856	Y854-V856 HydrophobicContact CD1-CG2 3.67Å; Y854-V856 HydrophobicContact CE1-CG2 3.02Å; Y854-V856 HydrophobicContact CE2-CG2 4.36Å; Y854-V856 VanDerWaalsContact CZ-CG2 3.41Å
855	Y	28.4	Very low	29.4	Very low	170 Å²	170	135 Å²	135	67%	0.667	70%	0.7	S	S	*	*			trans	-114.5	118.3	179.8	-59.6	-81.8	0	0	0	109.5	M853	M853-Y855 HydrophobicContact CB-CD2 4.46Å; M853-Y855 HydrophobicContact CB-CE2 3.62Å; M853-Y855 HydrophobicContact CE-CE1 4.03Å
856	V	28.6	Very low	29.3	Very low	83 Å²	83	133.4 Å²	133.4	50%	0.503	69%	0.693	S	S	.	*			trans	-114	118.4	172.6	-174.3	0	0	0	0	108.8	Y854 I858	Y854-V856 HydrophobicContact CD1-CG2 3.67Å; Y854-V856 HydrophobicContact CE1-CG2 3.02Å; Y854-V856 HydrophobicContact CE2-CG2 4.36Å; Y854-V856 VanDerWaalsContact CZ-CG2 3.41Å; V856-I858 HydrophobicContact CG1-CG1 3.77Å; V856-I858 PolarHBondContact O-N 3.31Å
857	N	26.1	Very low	29.1	Very low	138 Å²	138	137.1 Å²	137.1	74%	0.738	71%	0.706	S	S	*	*			trans	-84.4	98.8	169	-74.1	-28.5	0	0	0	108.5
858	I	26.4	Very low	28.7	Very low	134 Å²	134	139.8 Å²	139.8	69%	0.687	71%	0.705	S	S	*	*			trans	-87	121.4	172.3	-50.8	178.1	0	0	0	108	V856 Q860	V856-I858 HydrophobicContact CG1-CG1 3.77Å; V856-I858 PolarHBondContact O-N 3.31Å; I858-Q860 PolarHBondContact O-N 2.92Å
859	P	30.6	Very low	28.4	Very low	114 Å²	114	143.6 Å²	143.6	74%	0.74	71%	0.714	S	S	*	*			trans	-61.8	124.8	172.6	-9.4	20.5	0	0	0	109.3	G861	P859-G861 VanDerWaalsContact C-N 3.25Å; P859-G861 PolarHBondContact O-N 3.45Å
860	Q	28.5	Very low	28.5	Very low	159 Å²	159	147.8 Å²	147.8	74%	0.743	73%	0.726	S	S	*	*			trans	-69.2	84.2	172.4	-72.7	-175.6	-7.4	0	0	109.7	I858	I858-Q860 PolarHBondContact O-N 2.92Å
861	G	29.3	Very low	28.5	Very low	61 Å²	61	145.3 Å²	145.3	63%	0.629	73%	0.729	S	S	*	*			trans	-82.8	118.2	168.3	0	0	0	0	0	110.7	P859	P859-G861 VanDerWaalsContact C-N 3.25Å; P859-G861 PolarHBondContact O-N 3.45Å
862	S	30.5	Very low	28.5	Very low	109 Å²	109	144 Å²	144	76%	0.762	74%	0.736	S	S	*	*	S	Bend	trans	46.9	102.7	154.5	58.8	0	0	0	0	118.9	T864	S862-T864 PolarHBondContact O-N 3.29Å
863	R	31.3	Very low	28.7	Very low	254 Å²	254	144.9 Å²	144.9	96%	0.958	73%	0.733	S	S	*	*			trans	35.6	71.5	142.2	-62.4	-177.2	176.3	-173.9	-0.6	115.9
864	T	30.8	Very low	29	Very low	137 Å²	137	148.9 Å²	148.9	84%	0.84	76%	0.755	S	S	*	*			trans	-85.7	119.1	153.5	45.2	0	0	0	0	108.3	S862 E866	S862-T864 PolarHBondContact O-N 3.29Å; T864-E866 PolarHBondContact O-N 2.92Å
865	T	31.5	Very low	28.9	Very low	135 Å²	135	151.8 Å²	151.8	83%	0.828	77%	0.771	S	S	*	*			trans	-37.1	125.3	173.5	44.5	0	0	0	0	112	L867	T865-L867 PolarHBondContact O-N 3.13Å
866	E	30.2	Very low	28.9	Very low	147 Å²	147	149.2 Å²	149.2	69%	0.687	78%	0.777	S	S	*	*			trans	-45.2	103.7	172	-66.9	179.9	163.4	0	0	110.5	T864 R868	T864-E866 PolarHBondContact O-N 2.92Å; E866-R868 HydrophobicContact CB-CG 3.96Å; E866-R868 PolarHBondContact O-N 3.17Å; E866-R868 IonicContact OE2-CZ 3.7Å; E866-R868 IonicContact OE2-NE 3Å; E866-R868 PolarHBondContact OE2-NE 3.11Å; E866-R868 IonicContact OE2-NH2 3.47Å; E866-R868 PolarHBondContact OE2-NH2 2.94Å
867	L	30.5	Very low	28.7	Very low	154 Å²	154	153.6 Å²	153.6	81%	0.806	79%	0.792	S	S	*	*			trans	-69.4	82.8	157.1	-173.6	73	0	0	0	106	T865 R869	T865-L867 PolarHBondContact O-N 3.13Å; L867-R869 VanDerWaalsContact C-N 3.31Å; L867-R869 PolarHBondContact O-N 2.89Å
868	R	25.8	Very low	28.9	Very low	202 Å²	202	154.6 Å²	154.6	76%	0.762	80%	0.797	S	S	*	*			trans	-61.2	90	177.1	-75.8	-163	172.1	-168.3	-0.8	109.7	E866 K870	E866-R868 HydrophobicContact CB-CG 3.96Å; E866-R868 PolarHBondContact O-N 3.17Å; E866-R868 IonicContact OE2-CZ 3.7Å; E866-R868 IonicContact OE2-NE 3Å; E866-R868 PolarHBondContact OE2-NE 3.11Å; E866-R868 IonicContact OE2-NH2 3.47Å; E866-R868 PolarHBondContact OE2-NH2 2.94Å; R868-K870 PolarHBondContact O-N 2.82Å
869	R	26.2	Very low	29	Very low	210 Å²	210	152.3 Å²	152.3	79%	0.792	79%	0.792	S	S	*	*			trans	-69.5	118.2	154.1	-76.8	-172.8	-170.2	154	3.7	106.9	L867 T871	L867-R869 VanDerWaalsContact C-N 3.31Å; L867-R869 PolarHBondContact O-N 2.89Å; R869-T871 VanDerWaalsContact C-N 3.25Å; R869-T871 PolarHBondContact O-N 2.91Å
870	K	29.6	Very low	29	Very low	207 Å²	207	155.5 Å²	155.5	90%	0.9	80%	0.796	S	S	*	*			trans	-61.8	85.6	171	-67.5	-177.3	176.4	-178.7	0	109	R868	R868-K870 PolarHBondContact O-N 2.82Å
871	T	29.1	Very low	29	Very low	123 Å²	123	155.6 Å²	155.6	76%	0.755	80%	0.796	S	S	*	*			trans	-96.2	123.7	159.6	46.8	0	0	0	0	107.3	R869	R869-T871 VanDerWaalsContact C-N 3.25Å; R869-T871 PolarHBondContact O-N 2.91Å
872	N	26.1	Very low	28.9	Very low	152 Å²	152	160.8 Å²	160.8	81%	0.813	81%	0.81	S	S	*	*			trans	-54	132.3	-177.5	-74.7	-43.1	0	0	0	110.5	L874	N872-L874 PolarHBondContact O-N 2.87Å
873	P	30.5	Very low	28.9	Very low	120 Å²	120	162.3 Å²	162.3	78%	0.779	81%	0.805	S	S	*	*			trans	-68.5	97.1	177.1	26.9	-31.6	0	0	0	109	K875	P873-K875 PolarHBondContact O-N 2.99Å; P873-K875 VanDerWaalsContact O-N 3.13Å
874	L	28.9	Very low	28.9	Very low	167 Å²	167	158.2 Å²	158.2	87%	0.874	80%	0.802	S	S	*	*			trans	-70.8	106.7	166.5	-149.3	78.1	0	0	0	106.8	N872 S876	N872-L874 PolarHBondContact O-N 2.87Å; L874-S876 PolarHBondContact O-N 2.95Å
875	K	28.7	Very low	29.1	Very low	211 Å²	211	156.8 Å²	156.8	92%	0.917	79%	0.793	S	S	*	*			trans	-51.2	101.8	172	-74.6	174.6	174.5	178.1	0	109.3	P873	P873-K875 PolarHBondContact O-N 2.99Å; P873-K875 VanDerWaalsContact O-N 3.13Å
876	S	27.1	Very low	29.2	Very low	116 Å²	116	158.1 Å²	158.1	81%	0.811	79%	0.79	S	S	*	*			trans	-122.3	104.3	154.1	72.5	0	0	0	0	106.8	L874	L874-S876 PolarHBondContact O-N 2.95Å
877	H	26.3	Very low	29.3	Very low	175 Å²	175	157.7 Å²	157.7	81%	0.81	79%	0.792	S	S	*	*			trans	-82.6	110.3	179.1	-156.7	34.6	0	0	0	106.1
878	N	28.4	Very low	29.1	Very low	159 Å²	159	156.2 Å²	156.2	85%	0.85	78%	0.783	S	S	*	*			trans	-145.7	99.4	159.1	-100.4	-25.5	0	0	0	107.8
879	P	29.6	Very low	29.3	Very low	87 Å²	87	152.3 Å²	152.3	57%	0.565	78%	0.775	S	S	*	*			trans	-75.3	154.3	167.4	31.7	-28.5	0	0	0	109.2
880	H	29.4	Very low	29.3	Very low	180 Å²	180	152.7 Å²	152.7	83%	0.833	78%	0.777	S	S	*	*			trans	88.8	81.2	-178.5	-54.5	-77.5	0	0	0	116.8
881	H	29.1	Very low	29	Very low	161 Å²	161	152.2 Å²	152.2	75%	0.745	77%	0.771	S	S	*	*				176.8	110.6	106.8	-122.2	-55.7	0	0	0	108.6	H883	H881-H883 VanDerWaalsContact C-N 3.26Å; H881-H883 PolarHBondContact O-N 3.44Å
882	N	27.5	Very low	28.9	Very low	171 Å²	171	150.8 Å²	150.8	91%	0.914	77%	0.766	S	S	*	*			trans	-66.2	85.5	167.6	-85	-27.2	0	0	0	109.4
883	H	31	Very low	28.9	Very low	141 Å²	141	151 Å²	151	65%	0.653	77%	0.766	S	S	*	*			trans	-108.1	114	153.5	-80.2	-62.7	0	0	0	107.3	H881 T885	H881-H883 VanDerWaalsContact C-N 3.26Å; H881-H883 PolarHBondContact O-N 3.44Å; H883-T885 HydrophobicContact CB-CG2 4.39Å; H883-T885 PolarHBondContact O-N 3.5Å
884	N	31.4	Very low	28.7	Very low	168 Å²	168	150.7 Å²	150.7	90%	0.898	76%	0.764	S	S	*	*			trans	-67.2	64.7	176.1	-151.3	-0.5	0	0	0	108.9	Q886	N884-Q886 PolarHBondContact O-N 2.87Å
885	T	34.1	Very low	28.7	Very low	107 Å²	107	147.4 Å²	147.4	66%	0.656	75%	0.754	S	S	*	*			trans	-77.5	100.1	173.2	50.1	0	0	0	0	106.4	H883 N887	H883-T885 HydrophobicContact CB-CG2 4.39Å; H883-T885 PolarHBondContact O-N 3.5Å; T885-N887 PolarHBondContact O-N 3.34Å
886	Q	34.2	Very low	28.7	Very low	162 Å²	162	144.7 Å²	144.7	76%	0.757	75%	0.748	S	S	*	*			trans	-45.7	108.9	170	-75.4	165.6	-24.3	0	0	108.8	N884 M888	N884-Q886 PolarHBondContact O-N 2.87Å; Q886-M888 VanDerWaalsContact C-N 3.26Å; Q886-M888 PolarHBondContact O-N 2.85Å
887	N	31.4	Very low	28.6	Very low	139 Å²	139	143.8 Å²	143.8	74%	0.743	74%	0.738	S	S	*	*			trans	-66.1	91.4	174.7	-101.1	-25.7	0	0	0	107.8	T885 I889	T885-N887 PolarHBondContact O-N 3.34Å; N887-I889 PolarHBondContact O-N 3.46Å
888	M	27.5	Very low	28.7	Very low	123 Å²	123	145 Å²	145	61%	0.606	74%	0.736	S	S	*	*			trans	-72.5	96.9	179.3	-156.5	174.5	125.2	0	0	107.6	Q886 R890	Q886-M888 VanDerWaalsContact C-N 3.26Å; Q886-M888 PolarHBondContact O-N 2.85Å; M888-R890 WeakPolarHBondContact O-CG 3.44Å; M888-R890 PolarHBondContact O-N 2.97Å; M888-R890 VanDerWaalsContact O-N 3.14Å
889	I	29.3	Very low	28.7	Very low	119 Å²	119	141.4 Å²	141.4	61%	0.61	72%	0.723	S	S	*	*			trans	-67.5	111.1	176.1	-60.2	174.4	0	0	0	107.5	N887 Y891	N887-I889 PolarHBondContact O-N 3.46Å; I889-Y891 HydrophobicContact CB-CE2 4.37Å; I889-Y891 HydrophobicContact CG2-CD2 4.34Å; I889-Y891 HydrophobicContact CG2-CE1 4.3Å; I889-Y891 HydrophobicContact CG2-CE2 3.68Å
890	R	25.7	Very low	29.2	Very low	219 Å²	219	145.3 Å²	145.3	83%	0.826	73%	0.733	S	S	*	*			trans	-89.7	115.5	-176.9	-57.6	-179.2	-170.6	-172.6	0.7	109.2	M888	M888-R890 WeakPolarHBondContact O-CG 3.44Å; M888-R890 PolarHBondContact O-N 2.97Å; M888-R890 VanDerWaalsContact O-N 3.14Å
891	Y	24.9	Very low	29.6	Very low	197 Å²	197	144.8 Å²	144.8	77%	0.773	73%	0.732	S	S	*	*			trans	-97.1	122.1	168.5	-62.6	-82.2	0	0	0	108.9	I889	I889-Y891 HydrophobicContact CB-CE2 4.37Å; I889-Y891 HydrophobicContact CG2-CD2 4.34Å; I889-Y891 HydrophobicContact CG2-CE1 4.3Å; I889-Y891 HydrophobicContact CG2-CE2 3.68Å
892	S	26	Very low	29.7	Very low	92 Å²	92	142.8 Å²	142.8	64%	0.643	73%	0.725	S	S	*	*			trans	-105.5	122.6	164.8	56.1	0	0	0	0	108.1
893	L	26.2	Very low	30	Very low	158 Å²	158	140 Å²	140	83%	0.827	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-77	145.8	169.7	-73.8	168.5	0	0	0	110
894	P	27	Very low	30.1	Very low	112 Å²	112	141.9 Å²	141.9	73%	0.727	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-63.7	143.5	175.8	-18.4	31.3	0	0	0	112.2	I896	P894-I896 PolarHBondContact O-N 2.94Å
895	C	28.5	Very low	30	Very low	99 Å²	99	140 Å²	140	67%	0.669	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-62.4	125.1	176.2	-52.5	0	0	0	0	110.7
896	I	28.6	Very low	29.8	Very low	153 Å²	153	141.2 Å²	141.2	79%	0.785	72%	0.721	S	S	*	*			trans	-91.8	106.7	166.9	-47.2	174	0	0	0	106.1	P894 Y898	P894-I896 PolarHBondContact O-N 2.94Å; I896-Y898 PolarHBondContact O-N 3.36Å
897	T	25.6	Very low	29.6	Very low	97 Å²	97	137.9 Å²	137.9	60%	0.595	72%	0.716	S	S	*	*			trans	-67.3	114.3	172.4	44.9	0	0	0	0	108.6	C899	T897-C899 PolarHBondContact O-N 3.15Å
898	Y	28.4	Very low	29.6	Very low	201 Å²	201	138.5 Å²	138.5	79%	0.788	72%	0.718	S	S	*	*			trans	-73.2	110	171.6	-171.6	-96.8	0	0	0	108.4	I896 E900	I896-Y898 PolarHBondContact O-N 3.36Å; Y898-E900 HydrophobicContact CE1-CB 4.17Å; Y898-E900 HydrophobicContact CE1-CG 4.15Å
899	C	27.8	Very low	29.6	Very low	83 Å²	83	139 Å²	139	56%	0.561	72%	0.723	S	S	*	*			trans	-105.5	108	173.6	-145.3	0	0	0	0	106.9	T897 E901 L902	T897-C899 PolarHBondContact O-N 3.15Å; C899-E901 PolarHBondContact O-N 3.06Å; C899-E901 VanDerWaalsContact O-N 3.09Å; C899-L902 PolarHBondContact O-N 2.95Å
900	E	39	Very low	29.7	Very low	169 Å²	169	138.4 Å²	138.4	79%	0.79	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-19.8	-172.5	-157.5	167.2	-153.8	0	0	112.9	Y898 L902	Y898-E900 HydrophobicContact CE1-CB 4.17Å; Y898-E900 HydrophobicContact CE1-CG 4.15Å; E900-L902 PolarHBondContact O-N 2.92Å
901	E	38.1	Very low	30.1	Very low	170 Å²	170	133.9 Å²	133.9	79%	0.794	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-0	-176.5	-64.7	-171.8	167.6	0	0	115.7	C899 P903	C899-E901 PolarHBondContact O-N 3.06Å; C899-E901 VanDerWaalsContact O-N 3.09Å; E901-P903 WeakPolarHBondContact O-CD 3.48Å
902	L	32	Very low	30.6	Very low	118 Å²	118	132.3 Å²	132.3	62%	0.618	73%	0.73	S	S	*	*			trans	-105.7	96.3	177.7	-70.1	177.6	0	0	0	112	C899 E900 K904	C899-L902 PolarHBondContact O-N 2.95Å; E900-L902 PolarHBondContact O-N 2.92Å; L902-K904 PolarHBondContact O-N 3.37Å
903	P	33	Very low	31	Very low	114 Å²	114	131.4 Å²	131.4	74%	0.74	74%	0.735	S	S	*	*			trans	-75.7	81.7	167.3	31.5	-32.4	0	0	0	108.6	E901	E901-P903 WeakPolarHBondContact O-CD 3.48Å
904	K	33.1	Very low	31.5	Very low	180 Å²	180	130.9 Å²	130.9	78%	0.783	73%	0.732	S	S	*	*	S	Bend	trans	174.8	134.3	151.6	-93.7	147.6	-165.7	-175.6	0	109.5	L902 I906	L902-K904 PolarHBondContact O-N 3.37Å; K904-I906 PolarHBondContact O-N 3.24Å; K904-I906 VanDerWaalsContact O-N 3.15Å
905	P	29.8	Very low	32	Very low	127 Å²	127	133.3 Å²	133.3	83%	0.825	73%	0.733	S	S	*	*			trans	-61.1	119.8	173.4	25.3	-31.4	0	0	0	109	S907	P905-S907 PolarHBondContact O-N 3.28Å
906	I	29.9	Very low	32.5	Very low	133 Å²	133	138 Å²	138	68%	0.682	74%	0.742	S	S	*	*			trans	-59.9	108.6	170	-62.6	167.7	0	0	0	106	K904 L908	K904-I906 PolarHBondContact O-N 3.24Å; K904-I906 VanDerWaalsContact O-N 3.15Å; I906-L908 PolarHBondContact O-N 3.04Å
907	S	30.4	Very low	32.7	Very low	93 Å²	93	137.4 Å²	137.4	65%	0.65	74%	0.741	S	S	*	*			trans	-62.5	108.7	174.5	-160.8	0	0	0	0	107.4	P905 L909	P905-S907 PolarHBondContact O-N 3.28Å; S907-L909 PolarHBondContact O-N 3.32Å
908	L	31.6	Very low	33.1	Very low	151 Å²	151	147.8 Å²	147.8	79%	0.791	77%	0.769	S	S	*	*			trans	-74.6	58.5	176.1	-68.1	169.2	0	0	0	109.7	I906	I906-L908 PolarHBondContact O-N 3.04Å
909	L	27.2	Very low	33.3	Very low	135 Å²	135	145.2 Å²	145.2	71%	0.707	77%	0.768	S	S	*	*			trans	-103.7	125	162.7	-76	170.3	0	0	0	107.4	S907	S907-L909 PolarHBondContact O-N 3.32Å
910	P	31.2	Very low	33.6	Very low	105 Å²	105	148.4 Å²	148.4	68%	0.682	78%	0.779	S	S	*	*			trans	-57.2	134.9	175.2	23.3	-30.6	0	0	0	108.3	L912	P910-L912 PolarHBondContact O-N 3.39Å
911	P	34.8	Very low	33.3	Very low	125 Å²	125	147.3 Å²	147.3	81%	0.812	78%	0.779	S	S	*	*			trans	-57.9	111.9	176.3	21.8	-30	0	0	0	107.9	G913	P911-G913 PolarHBondContact O-N 3.25Å
912	L	34.2	Very low	33	Very low	163 Å²	163	145.9 Å²	145.9	85%	0.853	78%	0.778	S	S	*	*			trans	-55.5	105.9	166.2	-81.4	155.9	0	0	0	105.9	P910 I914	P910-L912 PolarHBondContact O-N 3.39Å; L912-I914 VanDerWaalsContact C-N 3.25Å; L912-I914 PolarHBondContact O-N 3.41Å
913	G	35.6	Very low	33.1	Very low	74 Å²	74	147.7 Å²	147.7	76%	0.763	79%	0.788	S	S	*	*			trans	-62.1	93	172	0	0	0	0	0	107.8	P911 E915	P911-G913 PolarHBondContact O-N 3.25Å; G913-E915 PolarHBondContact O-N 3.11Å
914	I	36.2	Very low	33.1	Very low	147 Å²	147	149.9 Å²	149.9	75%	0.754	79%	0.791	S	S	*	*			trans	-72.3	94.1	164.9	-60.8	167.8	0	0	0	104.3	L912 K916	L912-I914 VanDerWaalsContact C-N 3.25Å; L912-I914 PolarHBondContact O-N 3.41Å; I914-K916 PolarHBondContact O-N 3.49Å
915	E	36.7	Very low	33.1	Very low	162 Å²	162	147.8 Å²	147.8	76%	0.757	79%	0.791	S	S	*	*			trans	-50.8	108.8	162.9	-75.5	-178	166.1	0	0	107.4	G913 N917	G913-E915 PolarHBondContact O-N 3.11Å; E915-N917 PolarHBondContact O-N 3.11Å
916	K	39.6	Very low	33.4	Very low	197 Å²	197	149.4 Å²	149.4	86%	0.857	79%	0.789	S	S	*	*			trans	-68.9	82	168.4	-73.2	-178.3	177.8	179.4	0	107.7	I914 R918	I914-K916 PolarHBondContact O-N 3.49Å; K916-R918 VanDerWaalsContact C-N 3.26Å; K916-R918 PolarHBondContact O-N 3.3Å
917	N	33.3	Very low	33.6	Very low	142 Å²	142	150.8 Å²	150.8	76%	0.759	80%	0.798	S	S	*	*			trans	-78.8	83.9	154.3	-83	-42.7	0	0	0	107.6	E915	E915-N917 PolarHBondContact O-N 3.11Å
918	R	33.2	Very low	33.9	Very low	315 Å²	315	156 Å²	156	100%	1.189	81%	0.811	S	S	*	*			trans	-164.6	0	149.9	-115.2	-176.5	-171.7	-175.2	3.5	111.4	K916	K916-R918 VanDerWaalsContact C-N 3.26Å; K916-R918 PolarHBondContact O-N 3.3Å

Retrieved 918 of 918 residues in 259.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).