A0A096N771_PAPAN Loading...

V-type proton ATPase subunit a

Essential component of the vacuolar proton pump (V-ATPase), a multimeric enzyme that catalyzes the translocation of protons across the membranes. Required for assembly and activity of the V-ATPase.

AlphaFold DB , UniProt , Accession A0A096N771, Species PAPAN (Papio anubis, Olive baboon), Gene ATP6V0A2, Length 856 aa.

						>A0A096N771_PAPAN|A0A096N771|ATP6V0A2
MGSLFRSETMCLAQLFLQSGTAYECLSALGEKGLVQFRDLNQNISTFQRKFVGEVKRCEELERILVYLVQEINRADIPLPEGETSPPAPPLKQVLEMQEQLQKLEVELREVTKNKEKLRKNLLELIEYTHMLRVTQTFVKRNVEFEPTYEEFPSLESDSLLDYSCMQRLGAKLGFVSGLINQGKVEAFEKMLWRVCKGYTIVSYAELDESLEDPETGEVIKWYVFLISFWGEQIGHKVKKICDCYHCHVYPYPNTAEERREIQEGLNTRIQDLYTVLHKTEDYLRQVLCKAAESVYSRVIQVKKMKAIYHMLNMCSFDVTNKCLIAEVWCPEADLQDLRRALEEGSRESGATIPSFMNIIPTKETPPTRIRTNKFTEGFQNIVDAYGVGSYREVNPALFTIITFPFLFAVMFGDFGHGFVMFLFALLLVLNENHPRLNQSQEIMRMFFNGRYILLLMGLFSVYTGLIYNDCFSKSVNLFGSGWNVSAMYTSSHPPAERKKMVLWNDSVVRHNSILQLDPSVPGVFQGPYPLGIDPIWNLATNRLTFLNSFKMKMSVILGIIHMTFGVILGIFNHLHFRKKFNIYLVSIPELLFMLCIFGYLIFMIFYKWLVFSAETSRVAPSILIEFINMFLFPTSKTNGLYTGQEYVQRVLLVVTALSVPVLFLGKPLFLLWLHNGRSCFGVNRSGYTLIRKESEEEVSLLGNQDVEEGDHQVEDGCREMACEEFNFGEILMTQVIHSIEYCLGCISNTASYLRLWALSLAHAQLSDVLWAMLMRVGLRVDTTYGVLLLLPVIALFAVLTIFILLIMEGLSAFLHAIRLHWVEFQNKFYVGAGTKFVPFSFSLLSSKFNNDDSVA
					

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(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	36.3	Very low	76.1	Confident	256 Å²	256	57.5 Å²	57.5	100%	1.261	32%	0.319	S	S	*	.				0	44.4	0	-73.7	-168	166.8	0	0	112.6
2	G	49.5	Very low	77.5	Confident	56 Å²	56	53.2 Å²	53.2	58%	0.577	30%	0.295	S	S	*	.			trans	-139.8	14.9	-173	0	0	0	0	0	116.3	L4	G2-L4 VanDerWaalsContact C-N 3.3Å; G2-L4 PolarHBondContact O-N 3.33Å
3	S	60	Low	78.5	Confident	30 Å²	30	49.1 Å²	49.1	21%	0.21	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-9	-166.6	64	0	0	0	0	115.8	R6 E8	S3-R6 CarbonylContact C-O 3.4Å; S3-E8 WeakPolarHBondContact CB-OE1 3.27Å
4	L	73.3	Confident	79.4	Confident	41 Å²	41	48.2 Å²	48.2	22%	0.215	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-29.2	-177.8	-149.3	111.8	0	0	0	112.7	G2 T376 N395 L398 I401	G2-L4 VanDerWaalsContact C-N 3.3Å; G2-L4 PolarHBondContact O-N 3.33Å; L4-T376 HydrophobicContact CD1-CG2 3.91Å; L4-N395 WeakPolarHBondContact O-CB 3.38Å; L4-N395 PolarHBondContact O-ND2 3.37Å; L4-N395 VanDerWaalsContact O-ND2 3.16Å; L4-L398 HydrophobicContact CD2-CB 4.03Å; L4-L398 HydrophobicContact CD2-CD1 3.55Å; L4-L398 HydrophobicContact CD2-CG 4.33Å; L4-I401 HydrophobicContact CD2-CD1 4.45Å
5	F	85.3	Confident	80.1	Confident	75 Å²	75	45 Å²	45	33%	0.329	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-33.7	-179.9	-177.7	-112.6	0	0	0	112.1	V394 N395 L398 F399	F5-V394 HydrophobicContact CD2-CG1 4.48Å; F5-V394 HydrophobicContact CE1-CG2 4.03Å; F5-V394 HydrophobicContact CE2-CG1 3.93Å; F5-V394 HydrophobicContact CE2-CG2 4.31Å; F5-V394 HydrophobicContact CZ-CG1 4.2Å; F5-V394 HydrophobicContact CZ-CG2 3.74Å; F5-V394 WeakPolarHBondContact O-CA 3.35Å; F5-N395 PolarHBondContact O-N 2.91Å; F5-L398 HydrophobicContact CD2-CD2 4.01Å; F5-F399 HydrophobicContact CE2-CZ 4.13Å
6	R	86.8	Confident	80.7	Confident	48 Å²	48	45.2 Å²	45.2	18%	0.181	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-145.1	160	177.7	-68.5	-175.7	175.3	152.9	1.7	109.9	S3 V394 F572 H576	S3-R6 CarbonylContact C-O 3.4Å; R6-V394 HydrophobicContact CG-CG2 4.47Å; R6-F572 PolarHBondContact NH2-O 3.06Å; R6-H576 VanDerWaalsContact CZ-CG 3.5Å; R6-H576 PolarHBondContact NH1-CD2 3.34Å; R6-H576 PolarHBondContact NH1-NE2 3.11Å
7	S	88.3	Confident	81.1	Confident	12 Å²	12	42.5 Å²	42.5	8%	0.084	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-59.1	152	174	74.9	0	0	0	0	112.1	R369 Y391 R392	S7-R369 WeakPolarHBondContact CA-O 3.34Å; S7-Y391 WeakPolarHBondContact OG-CD2 3.19Å; S7-R392 WeakPolarHBondContact OG-CA 3.34Å; S7-R392 PolarHBondContact OG-N 3.03Å
8	E	88.1	Confident	81.4	Confident	25 Å²	25	43.9 Å²	43.9	12%	0.117	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-66.6	158.7	177	-56.9	-158.5	136.2	0	0	112.4	S3 M10 R369 R371 Y391	S3-E8 WeakPolarHBondContact CB-OE1 3.27Å; E8-M10 PolarHBondContact O-N 3.17Å; E8-R369 PolarHBondContact N-O 3.44Å; E8-R371 VanDerWaalsContact CD-NE 3.26Å; E8-R371 WeakPolarHBondContact OE1-CD 3.27Å; E8-R371 VanDerWaalsContact OE1-CG 3.27Å; E8-R371 WeakPolarHBondContact OE1-CG 3.26Å; E8-R371 IonicContact OE1-CZ 3.8Å; E8-R371 IonicContact OE1-NE 2.89Å; E8-R371 PolarHBondContact OE1-NE 3.31Å; E8-R371 IonicContact OE1-NH2 3.49Å; E8-R371 IonicContact OE2-CZ 3.74Å; E8-R371 IonicContact OE2-NE 3.4Å; E8-R371 PolarHBondContact OE2-NE 3.16Å; E8-R371 VanDerWaalsContact OE2-NE 3.09Å; E8-R371 IonicContact OE2-NH2 2.75Å; E8-Y391 WeakPolarHBondContact O-CE2 3.4Å
9	T	88.9	Confident	81.3	Confident	55 Å²	55	45.2 Å²	45.2	34%	0.337	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-74.9	124.5	171.8	51	0	0	0	0	110	P331 E332 Y391	T9-P331 WeakPolarHBondContact O-CA 3.26Å; T9-E332 WeakPolarHBondContact CB-OE2 3.45Å; T9-E332 PolarHBondContact O-N 3.09Å; T9-E332 PolarHBondContact OG1-OE2 2.88Å; T9-Y391 VanDerWaalsContact CA-OH 3.3Å; T9-Y391 WeakPolarHBondContact CA-OH 3.13Å
10	M	90.8	Very high	81.2	Confident	18 Å²	18	46.1 Å²	46.1	9%	0.089	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	142.7	176.4	-69.5	-64.1	-178.5	0	0	110.4	E8 W329 P331 P366 P367 R369 Y391 F837	E8-M10 PolarHBondContact O-N 3.17Å; M10-W329 HydrophobicContact CB-CE3 4.18Å; M10-P331 HydrophobicContact CE-CG 4.06Å; M10-P331 HydrophobicContact SD-CB 4.22Å; M10-P331 HydrophobicContact SD-CG 3.92Å; M10-P366 HydrophobicContact CB-CB 3.67Å; M10-P366 HydrophobicContact CB-CG 4.31Å; M10-P366 HydrophobicContact CG-CB 4.18Å; M10-P367 WeakPolarHBondContact CG-O 3.42Å; M10-R369 HydrophobicContact CE-CB 3.17Å; M10-R369 HydrophobicContact CE-CG 4.23Å; M10-Y391 HydrophobicContact CB-CE2 4.05Å; M10-Y391 HydrophobicContact CG-CE2 3.99Å; M10-Y391 PolarHBondContact N-OH 3.47Å; M10-F837 HydrophobicContact CE-CB 4.24Å; M10-F837 HydrophobicContact CE-CD1 4.4Å; M10-F837 HydrophobicContact CE-CD2 3.67Å; M10-F837 HydrophobicContact CE-CE2 4.06Å; M10-F837 HydrophobicContact CE-CG 3.85Å; M10-F837 HydrophobicContact SD-CD2 4.48Å; M10-F837 HydrophobicContact SD-CE2 4.46Å
11	C	90	Very high	81.3	Confident	16 Å²	16	44.1 Å²	44.1	11%	0.108	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	143.8	167.4	57.1	0	0	0	0	109.7	C330 L335 I359	C11-C330 PolarHBondContact N-O 3.43Å; C11-C330 PolarHBondContact O-N 3.47Å; C11-C330 VanDerWaalsContact O-N 3.09Å; C11-C330 PolarHBondContact SG-O 3.32Å; C11-L335 VanDerWaalsContact SG-CD2 3.53Å; C11-I359 HydrophobicContact CB-CG2 4.37Å
12	L	92.6	Very high	83.6	Confident	6 Å²	6	32 Å²	32	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	118.8	167.5	-174.5	68	0	0	0	107.8	E327 W329 I360 T362	L12-E327 HydrophobicContact CD1-CB 4.3Å; L12-W329 HydrophobicContact CB-CE3 4.04Å; L12-W329 HydrophobicContact CB-CH2 4.05Å; L12-W329 HydrophobicContact CB-CZ3 3.7Å; L12-W329 HydrophobicContact CD1-CD2 3.97Å; L12-W329 HydrophobicContact CD1-CE3 4.23Å; L12-W329 HydrophobicContact CD1-CG 4.48Å; L12-W329 HydrophobicContact CD1-CH2 4.43Å; L12-W329 HydrophobicContact CD1-CZ2 4.15Å; L12-W329 HydrophobicContact CD1-CZ3 4.43Å; L12-I360 HydrophobicContact CD2-CB 4.45Å; L12-I360 PolarHBondContact O-N 3.06Å; L12-T362 HydrophobicContact CB-CG2 3.79Å; L12-T362 HydrophobicContact CD2-CG2 3.77Å; L12-T362 HydrophobicContact CG-CG2 4.4Å
13	A	90.4	Very high	85.4	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	140.9	177.6	0	0	0	0	0	110.3	V328 M357 N358	A13-V328 HydrophobicContact CB-CG2 3.94Å; A13-V328 PolarHBondContact N-O 3.01Å; A13-V328 PolarHBondContact O-N 3.41Å; A13-M357 HydrophobicContact CB-CG 3.75Å; A13-M357 HydrophobicContact CB-SD 3.48Å; A13-M357 WeakPolarHBondContact CB-SD 3.48Å; A13-N358 CarbonylContact C-O 3.56Å; A13-N358 VanDerWaalsContact CA-O 3.3Å; A13-N358 WeakPolarHBondContact CA-O 3.37Å
14	Q	91.4	Very high	86.7	Confident	37 Å²	37	31.3 Å²	31.3	17%	0.173	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.2	173.7	-170.1	177.2	42.1	0	0	108.8	F16 I325 A326 M357 N358 I360	Q14-F16 HydrophobicContact CB-CE2 4.44Å; Q14-F16 HydrophobicContact CG-CE2 3.98Å; Q14-F16 HydrophobicContact CG-CZ 4.07Å; Q14-F16 VanDerWaalsContact OE1-CZ 3.3Å; Q14-I325 HydrophobicContact CG-CG2 3.65Å; Q14-A326 CarbonylContact C-O 3.47Å; Q14-A326 WeakPolarHBondContact CA-O 3.27Å; Q14-M357 CarbonylContact O-C 3.34Å; Q14-M357 VanDerWaalsContact O-CA 3.31Å; Q14-M357 WeakPolarHBondContact O-CA 3.49Å; Q14-N358 PolarHBondContact N-O 3.16Å; Q14-N358 PolarHBondContact O-N 3.36Å; Q14-I360 HydrophobicContact CB-CD1 3.63Å; Q14-I360 HydrophobicContact CB-CG1 4.14Å; Q14-I360 HydrophobicContact CG-CD1 4.19Å
15	L	90.3	Very high	87.3	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.9	178.6	-53.4	-178.3	0	0	0	109.3	L17 L29 I325 A326 V328 L342 M357	L15-L17 HydrophobicContact CB-CG 4.41Å; L15-L29 HydrophobicContact CD1-CD1 4.08Å; L15-I325 WeakPolarHBondContact O-CA 3.39Å; L15-A326 HydrophobicContact CB-CB 4.26Å; L15-A326 PolarHBondContact N-O 3.18Å; L15-A326 PolarHBondContact O-N 3.34Å; L15-V328 HydrophobicContact CD1-CG1 3.79Å; L15-V328 HydrophobicContact CD1-CG2 3.94Å; L15-V328 HydrophobicContact CD2-CG2 4.24Å; L15-V328 HydrophobicContact CG-CG1 4.3Å; L15-V328 HydrophobicContact CG-CG2 3.89Å; L15-L342 HydrophobicContact CD2-CD1 3.8Å; L15-M357 HydrophobicContact CD2-CB 3.77Å; L15-M357 HydrophobicContact CD2-CG 3.73Å; L15-M357 HydrophobicContact CD2-SD 3.92Å
16	F	88.8	Confident	87.5	Confident	48 Å²	48	25.8 Å²	25.8	21%	0.211	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	106.1	170.6	-66.2	-88.4	0	0	0	108.5	Q14 I325 S355 F356 N358	Q14-F16 HydrophobicContact CB-CE2 4.44Å; Q14-F16 HydrophobicContact CG-CE2 3.98Å; Q14-F16 HydrophobicContact CG-CZ 4.07Å; Q14-F16 VanDerWaalsContact OE1-CZ 3.3Å; F16-I325 HydrophobicContact CD1-CD1 4.45Å; F16-I325 HydrophobicContact CD1-CG1 3.95Å; F16-I325 HydrophobicContact CE1-CD1 3.94Å; F16-I325 HydrophobicContact CE1-CG1 3.88Å; F16-S355 WeakPolarHBondContact O-CA 3.29Å; F16-S355 WeakPolarHBondContact O-CB 3.46Å; F16-F356 HydrophobicContact CB-CD1 4.43Å; F16-F356 HydrophobicContact CB-CE1 4.09Å; F16-F356 HydrophobicContact CB-CE2 4.25Å; F16-F356 HydrophobicContact CB-CZ 3.98Å; F16-F356 AromaticContact CD2-CD2 3.99Å; F16-F356 HydrophobicContact CD2-CD2 3.99Å; F16-F356 AromaticContact CD2-CE2 3.45Å; F16-F356 HydrophobicContact CD2-CE2 3.45Å; F16-F356 VanDerWaalsContact CD2-CE2 3.45Å; F16-F356 AromaticContact CD2-CZ 3.88Å; F16-F356 HydrophobicContact CD2-CZ 3.88Å; F16-F356 HydrophobicContact CE2-CE2 4.01Å; F16-F356 AromaticContact CG-CE2 3.97Å; F16-F356 HydrophobicContact CG-CE2 3.97Å; F16-F356 AromaticContact CG-CZ 3.91Å; F16-F356 HydrophobicContact CG-CZ 3.91Å; F16-F356 PolarHBondContact N-O 3.46Å; F16-F356 PolarHBondContact O-N 3.45Å; F16-N358 HydrophobicContact CE2-CB 4.38Å
17	L	87.6	Confident	87.5	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.2	-177.1	-60.8	172.4	0	0	0	109.7	L15 A22 C25 L26 C323 L324 L342	L15-L17 HydrophobicContact CB-CG 4.41Å; L17-A22 HydrophobicContact CB-CB 4.05Å; L17-A22 HydrophobicContact CD1-CB 4.49Å; L17-C25 HydrophobicContact CD2-CB 3.82Å; L17-L26 HydrophobicContact CD1-CG 4.42Å; L17-C323 CarbonylContact O-C 3.56Å; L17-C323 WeakPolarHBondContact O-CA 3.4Å; L17-L324 HydrophobicContact CB-CB 4.21Å; L17-L324 PolarHBondContact N-O 2.51Å; L17-L324 PolarHBondContact O-N 3.36Å; L17-L342 HydrophobicContact CD2-CD2 3.92Å
18	Q	86.4	Confident	87.4	Confident	68 Å²	68	24.8 Å²	24.8	32%	0.318	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	137.4	172.5	-169.1	177.9	4.2	0	0	109.8	G20 T21 A22	Q18-G20 PolarHBondContact O-N 3.07Å; Q18-T21 PolarHBondContact O-N 3.13Å; Q18-T21 PolarHBondContact O-OG1 3.25Å; Q18-A22 WeakPolarHBondContact O-CB 3.43Å; Q18-A22 PolarHBondContact O-N 2.98Å
19	S	79.8	Confident	87.4	Confident	67 Å²	67	23.7 Å²	23.7	47%	0.469	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-28.9	-176.6	46.8	0	0	0	0	115.1	K322	S19-K322 PolarHBondContact N-O 3.02Å; S19-K322 PolarHBondContact OG-O 2.88Å; S19-K322 VanDerWaalsContact OG-O 3.05Å
20	G	78.7	Confident	87.3	Confident	64 Å²	64	21.1 Å²	21.1	66%	0.66	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-25.1	176	0	0	0	0	0	115.2	Q18	Q18-G20 PolarHBondContact O-N 3.07Å
21	T	83.6	Confident	87	Confident	4 Å²	4	24.2 Å²	24.2	3%	0.025	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-9.8	-176.6	61.5	0	0	0	0	113.5	Q18 Y23 E24 C25 A351	Q18-T21 PolarHBondContact O-N 3.13Å; Q18-T21 PolarHBondContact O-OG1 3.25Å; T21-Y23 PolarHBondContact O-N 3Å; T21-E24 PolarHBondContact O-N 3.38Å; T21-E24 VanDerWaalsContact O-N 3.16Å; T21-C25 PolarHBondContact O-N 3.19Å; T21-C25 PolarHBondContact O-SG 3.08Å; T21-A351 HydrophobicContact CG2-CB 3.36Å
22	A	85.3	Confident	86.7	Confident	2 Å²	2	27.4 Å²	27.4	2%	0.017	16%	0.156	C	C	.	.	H	α-helix	trans	-57.3	-36	-173.1	0	0	0	0	0	113.1	L17 Q18 L26 L312 L324	L17-A22 HydrophobicContact CB-CB 4.05Å; L17-A22 HydrophobicContact CD1-CB 4.49Å; Q18-A22 WeakPolarHBondContact O-CB 3.43Å; Q18-A22 PolarHBondContact O-N 2.98Å; A22-L26 WeakPolarHBondContact O-CB 3.42Å; A22-L26 VanDerWaalsContact O-CG 3.27Å; A22-L26 WeakPolarHBondContact O-CG 3.41Å; A22-L26 PolarHBondContact O-N 3.05Å; A22-L312 HydrophobicContact CB-CD2 3.9Å; A22-L324 HydrophobicContact CB-CD1 3.62Å
23	Y	87.8	Confident	86.3	Confident	19 Å²	19	27.5 Å²	27.5	8%	0.075	16%	0.159	C	C	.	.	H	α-helix	trans	-65.1	-47.5	178.2	-173.7	-87	0	0	0	112.2	T21 L26 S27 P89 L91 M305 I308 Y309	T21-Y23 PolarHBondContact O-N 3Å; Y23-L26 PolarHBondContact O-N 3.33Å; Y23-S27 WeakPolarHBondContact O-CB 3.47Å; Y23-S27 PolarHBondContact O-N 2.95Å; Y23-P89 WeakPolarHBondContact CE1-O 3.36Å; Y23-P89 PolarHBondContact OH-O 3.11Å; Y23-L91 HydrophobicContact CD2-CD1 4.19Å; Y23-L91 HydrophobicContact CG-CD1 4.19Å; Y23-M305 HydrophobicContact CE2-CG 4.39Å; Y23-I308 HydrophobicContact CD2-CG2 3.61Å; Y23-I308 HydrophobicContact CE1-CD1 4.25Å; Y23-I308 HydrophobicContact CE2-CB 4.18Å; Y23-I308 HydrophobicContact CE2-CD1 4.13Å; Y23-I308 HydrophobicContact CE2-CG2 3.76Å; Y23-I308 HydrophobicContact CG-CG2 4.28Å; Y23-Y309 HydrophobicContact CD2-CE1 4.16Å; Y23-Y309 HydrophobicContact CE2-CE1 4.28Å; Y23-Y309 HydrophobicContact CE2-CE2 4.06Å; Y23-Y309 AromaticContact CE2-CZ 3.86Å
24	E	86.5	Confident	86	Confident	52 Å²	52	28.5 Å²	28.5	24%	0.243	16%	0.164	C	C	.	.	H	α-helix	trans	-71.1	-39.3	-178.8	-66.1	-179.8	-166.8	0	0	111.3	T21 L26 S27 A28 S349	T21-E24 PolarHBondContact O-N 3.38Å; T21-E24 VanDerWaalsContact O-N 3.16Å; E24-L26 PolarHBondContact O-N 3.5Å; E24-S27 WeakPolarHBondContact O-CB 3.49Å; E24-S27 PolarHBondContact O-N 3.06Å; E24-A28 PolarHBondContact O-N 3.05Å; E24-S349 WeakPolarHBondContact OE2-CA 3.16Å; E24-S349 VanDerWaalsContact OE2-CB 3.27Å; E24-S349 WeakPolarHBondContact OE2-CB 3.47Å; E24-S349 PolarHBondContact OE2-N 2.9Å; E24-S349 PolarHBondContact OE2-OG 3.21Å
25	C	86.5	Confident	85.9	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.6	-46.5	172.6	-66.1	0	0	0	0	111.3	L17 T21 S27 A28 L29 L342	L17-C25 HydrophobicContact CD2-CB 3.82Å; T21-C25 PolarHBondContact O-N 3.19Å; T21-C25 PolarHBondContact O-SG 3.08Å; C25-S27 VanDerWaalsContact C-N 3.33Å; C25-S27 PolarHBondContact O-N 3.05Å; C25-A28 PolarHBondContact O-N 3.41Å; C25-L29 WeakPolarHBondContact O-CG 3.43Å; C25-L29 PolarHBondContact O-N 3.48Å; C25-L342 HydrophobicContact CB-CD2 4.39Å
26	L	88.3	Confident	86	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67	-33.8	177.3	-76.7	170.4	0	0	0	112.9	L17 A22 Y23 E24 L29 G30 F37 I308 L312	L17-L26 HydrophobicContact CD1-CG 4.42Å; A22-L26 WeakPolarHBondContact O-CB 3.42Å; A22-L26 VanDerWaalsContact O-CG 3.27Å; A22-L26 WeakPolarHBondContact O-CG 3.41Å; A22-L26 PolarHBondContact O-N 3.05Å; Y23-L26 PolarHBondContact O-N 3.33Å; E24-L26 PolarHBondContact O-N 3.5Å; L26-L29 HydrophobicContact CD2-CD1 4.27Å; L26-L29 PolarHBondContact O-N 3.24Å; L26-G30 PolarHBondContact O-N 3.03Å; L26-F37 HydrophobicContact CD2-CE1 3.83Å; L26-F37 HydrophobicContact CD2-CE2 4.03Å; L26-F37 HydrophobicContact CD2-CZ 3.25Å; L26-I308 HydrophobicContact CB-CG2 3.93Å; L26-I308 HydrophobicContact CD1-CG2 4.19Å; L26-L312 HydrophobicContact CD1-CB 4.5Å; L26-L312 HydrophobicContact CD1-CD1 4.33Å; L26-L312 HydrophobicContact CD1-CD2 3.31Å; L26-L312 HydrophobicContact CD1-CG 3.4Å; L26-L312 VanDerWaalsContact CD1-CG 3.4Å
27	S	88.4	Confident	86.1	Confident	21 Å²	21	27.7 Å²	27.7	15%	0.147	16%	0.161	C	C	.	.	H	α-helix	trans	-60	-51.1	171.6	179.3	0	0	0	0	111	Y23 E24 C25 L29 G30 E31 A88 F842	Y23-S27 WeakPolarHBondContact O-CB 3.47Å; Y23-S27 PolarHBondContact O-N 2.95Å; E24-S27 WeakPolarHBondContact O-CB 3.49Å; E24-S27 PolarHBondContact O-N 3.06Å; C25-S27 VanDerWaalsContact C-N 3.33Å; C25-S27 PolarHBondContact O-N 3.05Å; S27-L29 VanDerWaalsContact C-N 3.3Å; S27-L29 PolarHBondContact O-N 3.27Å; S27-G30 PolarHBondContact O-N 2.73Å; S27-G30 VanDerWaalsContact O-N 3.15Å; S27-E31 WeakPolarHBondContact O-CG 3.47Å; S27-E31 PolarHBondContact O-N 2.87Å; S27-A88 WeakPolarHBondContact OG-CB 3.31Å; S27-F842 WeakPolarHBondContact O-CE2 3.49Å
28	A	86	Confident	86.2	Confident	18 Å²	18	31 Å²	31	15%	0.149	17%	0.173	C	C	.	.	H	α-helix	trans	-60.4	-38.7	177.3	0	0	0	0	0	112.4	E24 C25 K32	E24-A28 PolarHBondContact O-N 3.05Å; C25-A28 PolarHBondContact O-N 3.41Å; A28-K32 PolarHBondContact O-N 3.3Å
29	L	87.3	Confident	86.3	Confident	3 Å²	3	29.2 Å²	29.2	2%	0.016	17%	0.166	C	C	.	.	H	α-helix	trans	-65.7	-41.7	174.7	-69.2	175.1	0	0	0	112.7	L15 C25 L26 S27 K32 G33 F37 L338 A341 L342	L15-L29 HydrophobicContact CD1-CD1 4.08Å; C25-L29 WeakPolarHBondContact O-CG 3.43Å; C25-L29 PolarHBondContact O-N 3.48Å; L26-L29 HydrophobicContact CD2-CD1 4.27Å; L26-L29 PolarHBondContact O-N 3.24Å; S27-L29 VanDerWaalsContact C-N 3.3Å; S27-L29 PolarHBondContact O-N 3.27Å; L29-K32 PolarHBondContact O-N 2.97Å; L29-G33 PolarHBondContact O-N 3.44Å; L29-F37 HydrophobicContact CD1-CZ 4.47Å; L29-L338 HydrophobicContact CD2-CD1 3.18Å; L29-A341 HydrophobicContact CD2-CB 4.06Å; L29-L342 HydrophobicContact CD1-CD2 4Å; L29-L342 HydrophobicContact CD2-CD2 4.38Å; L29-L342 HydrophobicContact CD2-CG 4.46Å; L29-L342 HydrophobicContact CG-CD2 4.4Å
30	G	86.1	Confident	86.6	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67.9	-31.9	179.3	0	0	0	0	0	113.5	L26 S27 F840 S841 F842	L26-G30 PolarHBondContact O-N 3.03Å; S27-G30 PolarHBondContact O-N 2.73Å; S27-G30 VanDerWaalsContact O-N 3.15Å; G30-F840 VanDerWaalsContact CA-CE1 3.47Å; G30-S841 WeakPolarHBondContact O-CA 3.4Å; G30-F842 WeakPolarHBondContact O-CD2 3.38Å; G30-F842 PolarHBondContact O-N 3.29Å
31	E	85.4	Confident	86.9	Confident	84 Å²	84	26.7 Å²	26.7	39%	0.393	13%	0.132	S	C	.	.	H	α-helix	trans	-69.9	-32.7	173.2	-66.7	-64.6	171	0	0	112	S27 K304 F842	S27-E31 WeakPolarHBondContact O-CG 3.47Å; S27-E31 PolarHBondContact O-N 2.87Å; E31-K304 IonicContact OE1-NZ 3.87Å; E31-K304 PolarHBondContact OE1-NZ 3.46Å; E31-K304 IonicContact OE2-NZ 3.54Å; E31-F842 HydrophobicContact CG-CD2 3.95Å; E31-F842 HydrophobicContact CG-CE2 4.1Å
32	K	84.1	Confident	86.8	Confident	82 Å²	82	33 Å²	33	36%	0.357	16%	0.161	S	C	.	.	H	α-helix	trans	-84	-28.9	177.7	-63.4	-150.7	-173.5	173.1	0	114.1	A28 L29 L34 A341 E344	A28-K32 PolarHBondContact O-N 3.3Å; L29-K32 PolarHBondContact O-N 2.97Å; K32-L34 HydrophobicContact CB-CD1 3.92Å; K32-L34 HydrophobicContact CB-CG 3.93Å; K32-L34 HydrophobicContact CD-CD1 4.36Å; K32-A341 HydrophobicContact CD-CB 4.12Å; K32-E344 IonicContact NZ-OE2 3.54Å; K32-E344 PolarHBondContact NZ-OE2 3.33Å; K32-E344 VanDerWaalsContact NZ-OE2 3.16Å
33	G	83.8	Confident	86.7	Confident	9 Å²	9	40.8 Å²	40.8	9%	0.093	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.2	38	172.2	0	0	0	0	0	115.2	L29 P839 F840	L29-G33 PolarHBondContact O-N 3.44Å; G33-P839 WeakPolarHBondContact O-CB 3.44Å; G33-F840 WeakPolarHBondContact CA-O 3.37Å
34	L	83.8	Confident	86.7	Confident	21 Å²	21	43.2 Å²	43.2	11%	0.11	22%	0.216	C	C	.	.			trans	-105.9	-17.9	-167.7	-59.9	175.3	0	0	0	115.3	K32 D334 D337	K32-L34 HydrophobicContact CB-CD1 3.92Å; K32-L34 HydrophobicContact CB-CG 3.93Å; K32-L34 HydrophobicContact CD-CD1 4.36Å; L34-D334 HydrophobicContact CD2-CB 4.26Å; L34-D337 HydrophobicContact CD1-CB 3.84Å
35	V	89.3	Confident	86.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.223	C	C	.	.			trans	-122.5	142.3	-166.6	-68.4	0	0	0	0	111.9	F37 V328 W329 C330 L338 F840	V35-F37 HydrophobicContact CG2-CE2 3.83Å; V35-F37 HydrophobicContact CG2-CZ 4.22Å; V35-V328 HydrophobicContact CB-CB 4.08Å; V35-V328 HydrophobicContact CB-CG1 4.36Å; V35-V328 HydrophobicContact CB-CG2 4.38Å; V35-V328 HydrophobicContact CG1-CB 4.36Å; V35-V328 HydrophobicContact CG1-CG2 4.12Å; V35-W329 WeakPolarHBondContact CA-O 3.44Å; V35-C330 HydrophobicContact CG1-CB 4.21Å; V35-L338 HydrophobicContact CG1-CD1 3.63Å; V35-L338 HydrophobicContact CG1-CD2 3.68Å; V35-L338 HydrophobicContact CG1-CG 4.26Å; V35-F840 WeakPolarHBondContact O-CB 3.4Å; V35-F840 PolarHBondContact O-N 3.37Å
36	Q	91.6	Very high	86.3	Confident	45 Å²	45	47.6 Å²	47.6	21%	0.21	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	120.6	169.6	178.6	175.1	4.9	0	0	109.1	V328 W329 F837 V838	Q36-V328 CarbonylContact O-C 3.02Å; Q36-V328 VanDerWaalsContact O-CA 3.3Å; Q36-V328 WeakPolarHBondContact O-CA 3.39Å; Q36-W329 HydrophobicContact CB-CB 4.36Å; Q36-W329 PolarHBondContact N-O 3Å; Q36-W329 PolarHBondContact O-N 3.41Å; Q36-F837 HydrophobicContact CB-CD2 3.94Å; Q36-F837 HydrophobicContact CB-CE2 3.52Å; Q36-F837 HydrophobicContact CB-CZ 4.24Å; Q36-V838 WeakPolarHBondContact CB-O 3.36Å; Q36-V838 WeakPolarHBondContact CG-O 3.48Å
37	F	91	Very high	86.1	Confident	23 Å²	23	55 Å²	55	10%	0.101	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	140.9	179.1	-73	-91.9	0	0	0	111.6	L26 L29 V35 M311 A326 V328 F840	L26-F37 HydrophobicContact CD2-CE1 3.83Å; L26-F37 HydrophobicContact CD2-CE2 4.03Å; L26-F37 HydrophobicContact CD2-CZ 3.25Å; L29-F37 HydrophobicContact CD1-CZ 4.47Å; V35-F37 HydrophobicContact CG2-CE2 3.83Å; V35-F37 HydrophobicContact CG2-CZ 4.22Å; F37-M311 HydrophobicContact CB-SD 4.01Å; F37-M311 HydrophobicContact CD2-CG 4.14Å; F37-M311 HydrophobicContact CD2-SD 3.55Å; F37-M311 VanDerWaalsContact CD2-SD 3.55Å; F37-M311 HydrophobicContact CE2-CG 4.36Å; F37-M311 HydrophobicContact CE2-SD 4.33Å; F37-M311 HydrophobicContact CG-SD 3.92Å; F37-A326 HydrophobicContact CD1-CB 4.1Å; F37-A326 HydrophobicContact CE1-CB 3.88Å; F37-V328 HydrophobicContact CD1-CG1 3.6Å; F37-V328 HydrophobicContact CE1-CG1 3.58Å; F37-V328 HydrophobicContact CG-CG1 4.09Å; F37-V328 HydrophobicContact CZ-CG1 4.04Å; F37-F840 HydrophobicContact CD2-CB 3.95Å; F37-F840 HydrophobicContact CD2-CG 4.27Å; F37-F840 HydrophobicContact CE2-CB 3.97Å; F37-F840 AromaticContact CE2-CD1 3.89Å; F37-F840 HydrophobicContact CE2-CD1 3.89Å; F37-F840 HydrophobicContact CE2-CG 4.03Å
38	R	89.6	Confident	85.9	Confident	68 Å²	68	61 Å²	61	26%	0.257	31%	0.307	S	S	.	.			trans	-94.9	140.1	167.3	-173	-174.2	177.4	178.9	10.2	109.4	L40 E327 E364	R38-L40 PolarHBondContact O-N 3Å; R38-E327 HydrophobicContact CB-CB 4.12Å; R38-E327 VanDerWaalsContact CD-OE2 3.29Å; R38-E327 WeakPolarHBondContact CD-OE2 3.22Å; R38-E327 IonicContact CZ-OE2 2.69Å; R38-E327 PolarHBondContact N-O 3.05Å; R38-E327 IonicContact NE-OE2 3.69Å; R38-E327 IonicContact NH1-OE2 3.09Å; R38-E327 PolarHBondContact NH1-OE2 3.38Å; R38-E364 IonicContact CZ-OE1 2.62Å; R38-E364 IonicContact CZ-OE2 3.54Å; R38-E364 VanDerWaalsContact CZ-OE2 3.23Å; R38-E364 IonicContact NE-OE2 3.78Å; R38-E364 IonicContact NH1-OE1 3.56Å; R38-E364 IonicContact NH1-OE2 2.85Å; R38-E364 PolarHBondContact NH1-OE2 3.49Å; R38-E364 VanDerWaalsContact NH2-CD 3.26Å; R38-E364 IonicContact NH2-OE1 3.63Å; R38-E364 PolarHBondContact NH2-OE1 3.46Å; R38-E364 IonicContact NH2-OE2 3.52Å; R38-E364 PolarHBondContact NH2-OE2 3.01Å
39	D	88.9	Confident	85.8	Confident	31 Å²	31	61.7 Å²	61.7	17%	0.166	31%	0.306	C	S	.	.			trans	-73.3	112.6	169.6	-159.6	-16.3	0	0	0	110	N41 Q42 R49 M314	D39-N41 WeakPolarHBondContact OD1-CA 3.36Å; D39-N41 PolarHBondContact OD1-N 3.45Å; D39-Q42 HydrophobicContact CB-CG 3.84Å; D39-R49 IonicContact OD1-NH2 3.97Å; D39-R49 PolarHBondContact OD1-NH2 2.9Å; D39-R49 IonicContact OD2-CZ 2.68Å; D39-R49 IonicContact OD2-NH1 2.8Å; D39-R49 IonicContact OD2-NH2 3.87Å; D39-R49 PolarHBondContact OD2-NH2 2.95Å; D39-M314 HydrophobicContact CB-CE 3.37Å; D39-M314 HydrophobicContact CB-SD 4.08Å; D39-M314 VanDerWaalsContact CG-SD 3.57Å
40	L	87	Confident	85.6	Confident	48 Å²	48	67.9 Å²	67.9	25%	0.251	33%	0.332	S	S	.	.	S	Bend	trans	-85.6	-15.3	172.8	-65.7	177.2	0	0	0	112.4	R38 M314 I325 E327	R38-L40 PolarHBondContact O-N 3Å; L40-M314 PolarHBondContact N-O 3.47Å; L40-I325 WeakPolarHBondContact CD1-O 3.31Å; L40-E327 HydrophobicContact CD1-CG 4.35Å; L40-E327 HydrophobicContact CD2-CB 4.05Å; L40-E327 HydrophobicContact CD2-CG 3.86Å; L40-E327 HydrophobicContact CG-CB 4.5Å
41	N	84.8	Confident	85.6	Confident	31 Å²	31	70 Å²	70	17%	0.166	34%	0.342	C	S	.	.			trans	-113.7	41.3	-171.7	-60.3	-36	0	0	0	111.7	D39 N43 I44 R49 N313 C315	D39-N41 WeakPolarHBondContact OD1-CA 3.36Å; D39-N41 PolarHBondContact OD1-N 3.45Å; N41-N43 VanDerWaalsContact C-N 3.26Å; N41-N43 PolarHBondContact O-N 2.96Å; N41-I44 HydrophobicContact CB-CB 4.47Å; N41-I44 HydrophobicContact CB-CD1 4.27Å; N41-I44 PolarHBondContact O-N 3.49Å; N41-R49 PolarHBondContact O-NH2 2.91Å; N41-N313 PolarHBondContact ND2-O 3.29Å; N41-C315 PolarHBondContact ND2-O 2.97Å
42	Q	80.9	Confident	85.7	Confident	136 Å²	136	67.2 Å²	67.2	64%	0.636	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-31.5	-178.4	-66.2	-176.5	3.2	0	0	113.2	D39 I44	D39-Q42 HydrophobicContact CB-CG 3.84Å; Q42-I44 VanDerWaalsContact C-N 3.25Å; Q42-I44 PolarHBondContact O-N 3.16Å
43	N	84.2	Confident	86	Confident	166 Å²	166	65.9 Å²	65.9	89%	0.888	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-6.7	-178.7	-62.8	-19.7	0	0	0	113.3	N41	N41-N43 VanDerWaalsContact C-N 3.26Å; N41-N43 PolarHBondContact O-N 2.96Å
44	I	86.4	Confident	86.1	Confident	70 Å²	70	68.5 Å²	68.5	36%	0.359	35%	0.349	S	S	.	.	S	Bend	trans	-105.6	125.7	-176.3	-56.4	176.6	0	0	0	108.9	N41 Q42 Q48 R49	N41-I44 HydrophobicContact CB-CB 4.47Å; N41-I44 HydrophobicContact CB-CD1 4.27Å; N41-I44 PolarHBondContact O-N 3.49Å; Q42-I44 VanDerWaalsContact C-N 3.25Å; Q42-I44 PolarHBondContact O-N 3.16Å; I44-Q48 HydrophobicContact CG2-CB 3.64Å; I44-R49 HydrophobicContact CG2-CG 4.33Å
45	S	85.8	Confident	86.3	Confident	54 Å²	54	68.5 Å²	68.5	38%	0.378	35%	0.35	S	S	.	.			trans	-59.3	148.6	175.5	67.5	0	0	0	0	111.5	F47 Q48	S45-F47 PolarHBondContact O-N 2.97Å; S45-F47 VanDerWaalsContact O-N 3.12Å; S45-Q48 PolarHBondContact O-N 2.86Å; S45-Q48 WeakPolarHBondContact OG-CG 3.28Å; S45-Q48 PolarHBondContact OG-OE1 3.18Å
46	T	80.2	Confident	86.3	Confident	89 Å²	89	73.9 Å²	73.9	55%	0.546	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-54.6	-36.2	-176.4	51.2	0	0	0	0	113	Q48 R49 V52	T46-Q48 PolarHBondContact O-N 3.25Å; T46-R49 WeakPolarHBondContact O-CB 3.4Å; T46-R49 PolarHBondContact O-N 3Å; T46-V52 WeakPolarHBondContact O-CG2 3.31Å
47	F	82.5	Confident	86.2	Confident	156 Å²	156	73.9 Å²	73.9	68%	0.684	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-70.7	-25.7	179.8	-64.9	-73.8	0	0	0	115	S45 R49	S45-F47 PolarHBondContact O-N 2.97Å; S45-F47 VanDerWaalsContact O-N 3.12Å; F47-R49 VanDerWaalsContact C-N 3.3Å
48	Q	84.6	Confident	86.1	Confident	147 Å²	147	72.8 Å²	72.8	69%	0.687	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-85.8	-5.9	-179.8	-71.2	168.2	-19.8	0	0	112.3	I44 S45 T46	I44-Q48 HydrophobicContact CG2-CB 3.64Å; S45-Q48 PolarHBondContact O-N 2.86Å; S45-Q48 WeakPolarHBondContact OG-CG 3.28Å; S45-Q48 PolarHBondContact OG-OE1 3.18Å; T46-Q48 PolarHBondContact O-N 3.25Å
49	R	85.2	Confident	86	Confident	33 Å²	33	73.9 Å²	73.9	13%	0.125	38%	0.375	C	S	.	.	S	Bend	trans	-70.2	150.2	178.2	-60.5	-175	179.2	-165.4	-7.8	110.9	D39 N41 I44 T46 F47 F51 V52 N313 M314	D39-R49 IonicContact OD1-NH2 3.97Å; D39-R49 PolarHBondContact OD1-NH2 2.9Å; D39-R49 IonicContact OD2-CZ 2.68Å; D39-R49 IonicContact OD2-NH1 2.8Å; D39-R49 IonicContact OD2-NH2 3.87Å; D39-R49 PolarHBondContact OD2-NH2 2.95Å; N41-R49 PolarHBondContact O-NH2 2.91Å; I44-R49 HydrophobicContact CG2-CG 4.33Å; T46-R49 WeakPolarHBondContact O-CB 3.4Å; T46-R49 PolarHBondContact O-N 3Å; F47-R49 VanDerWaalsContact C-N 3.3Å; R49-F51 PolarHBondContact O-N 2.76Å; R49-V52 HydrophobicContact CB-CG2 3.95Å; R49-V52 WeakPolarHBondContact O-CG2 3.42Å; R49-N313 HydrophobicContact CB-CB 4.45Å; R49-M314 PolarHBondContact NH1-SD 2.9Å
50	K	82.4	Confident	86.1	Confident	133 Å²	133	76.3 Å²	76.3	58%	0.578	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-38.7	-169.9	-172.3	175.2	-180	176.3	0	114.2
51	F	85.8	Confident	86.2	Confident	45 Å²	45	74.1 Å²	74.1	20%	0.197	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	20.6	-174.4	-58	-82.6	0	0	0	113.7	R49 G53 E54 V55 Y309 L312 N313 L324	R49-F51 PolarHBondContact O-N 2.76Å; F51-G53 VanDerWaalsContact C-N 3.31Å; F51-G53 PolarHBondContact O-N 2.9Å; F51-E54 PolarHBondContact O-N 3.04Å; F51-V55 WeakPolarHBondContact O-CG2 3.28Å; F51-V55 PolarHBondContact O-N 3.23Å; F51-V55 VanDerWaalsContact O-N 3.1Å; F51-Y309 HydrophobicContact CB-CD1 4.5Å; F51-Y309 HydrophobicContact CD1-CD1 4.38Å; F51-L312 HydrophobicContact CD2-CB 3.73Å; F51-L312 HydrophobicContact CE2-CB 3.83Å; F51-L312 HydrophobicContact CG-CB 4.27Å; F51-L312 HydrophobicContact CZ-CB 4.45Å; F51-L312 HydrophobicContact CZ-CD1 4.5Å; F51-N313 WeakPolarHBondContact CA-OD1 3.46Å; F51-N313 VanDerWaalsContact CB-OD1 3.25Å; F51-N313 WeakPolarHBondContact CB-OD1 3.24Å; F51-N313 PolarHBondContact N-OD1 3.21Å; F51-L324 HydrophobicContact CE2-CD2 4.47Å; F51-L324 HydrophobicContact CZ-CD1 4.49Å
52	V	88.4	Confident	86.3	Confident	25 Å²	25	75.3 Å²	75.3	15%	0.152	38%	0.378	C	S	.	.	H	α-helix	trans	-62.9	-37.6	179.1	174	0	0	0	0	112.2	T46 R49 E54 V55 K56	T46-V52 WeakPolarHBondContact O-CG2 3.31Å; R49-V52 HydrophobicContact CB-CG2 3.95Å; R49-V52 WeakPolarHBondContact O-CG2 3.42Å; V52-E54 VanDerWaalsContact C-N 3.29Å; V52-E54 PolarHBondContact O-N 3.11Å; V52-V55 PolarHBondContact O-N 3.45Å; V52-K56 HydrophobicContact CG1-CD 4.24Å; V52-K56 HydrophobicContact CG1-CG 4.38Å; V52-K56 WeakPolarHBondContact O-CG 3.29Å; V52-K56 PolarHBondContact O-N 3.05Å
53	G	88.9	Confident	86.8	Confident	53 Å²	53	76 Å²	76	55%	0.546	38%	0.375	S	S	.	.	H	α-helix	trans	-59.2	-41.6	176.5	0	0	0	0	0	112.2	F51 K56 R57	F51-G53 VanDerWaalsContact C-N 3.31Å; F51-G53 PolarHBondContact O-N 2.9Å; G53-K56 PolarHBondContact O-N 3.02Å; G53-R57 WeakPolarHBondContact O-CB 3.48Å; G53-R57 PolarHBondContact O-N 3.16Å
54	E	87.2	Confident	87.1	Confident	65 Å²	65	68.1 Å²	68.1	30%	0.304	33%	0.333	S	S	.	.	H	α-helix	trans	-70.1	-39.6	178	-61.4	-57.3	155.5	0	0	112.3	F51 V52 R57 C58 Y309	F51-E54 PolarHBondContact O-N 3.04Å; V52-E54 VanDerWaalsContact C-N 3.29Å; V52-E54 PolarHBondContact O-N 3.11Å; E54-R57 WeakPolarHBondContact O-CB 3.21Å; E54-R57 PolarHBondContact O-N 3.46Å; E54-R57 IonicContact OE2-CZ 3.16Å; E54-R57 IonicContact OE2-NE 2.71Å; E54-R57 PolarHBondContact OE2-NE 3.11Å; E54-R57 IonicContact OE2-NH2 3.19Å; E54-R57 PolarHBondContact OE2-NH2 3.26Å; E54-C58 PolarHBondContact O-N 2.96Å; E54-C58 PolarHBondContact O-SG 3.32Å; E54-Y309 HydrophobicContact CB-CD1 3.79Å; E54-Y309 HydrophobicContact CB-CD2 4.06Å; E54-Y309 HydrophobicContact CB-CE1 3.84Å; E54-Y309 HydrophobicContact CB-CE2 4.07Å; E54-Y309 HydrophobicContact CB-CG 3.92Å; E54-Y309 HydrophobicContact CG-CD1 4.28Å; E54-Y309 HydrophobicContact CG-CE1 3.93Å
55	V	88.2	Confident	87.1	Confident	20 Å²	20	64.9 Å²	64.9	12%	0.121	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-45.8	174.7	176	0	0	0	0	110.8	F51 V52 R57 C58 E59	F51-V55 WeakPolarHBondContact O-CG2 3.28Å; F51-V55 PolarHBondContact O-N 3.23Å; F51-V55 VanDerWaalsContact O-N 3.1Å; V52-V55 PolarHBondContact O-N 3.45Å; V55-R57 VanDerWaalsContact C-N 3.28Å; V55-R57 PolarHBondContact O-N 3.36Å; V55-C58 WeakPolarHBondContact O-CB 3.32Å; V55-C58 PolarHBondContact O-N 3.47Å; V55-C58 VanDerWaalsContact O-N 3.1Å; V55-E59 WeakPolarHBondContact O-CG 3.24Å; V55-E59 PolarHBondContact O-N 3.25Å
56	K	89.4	Confident	87.2	Confident	113 Å²	113	65.8 Å²	65.8	49%	0.491	32%	0.319	S	S	.	.	H	α-helix	trans	-59.9	-38.5	175.7	-74.6	-177.7	177	-175.5	0	112.4	V52 G53 E59 E60	V52-K56 HydrophobicContact CG1-CD 4.24Å; V52-K56 HydrophobicContact CG1-CG 4.38Å; V52-K56 WeakPolarHBondContact O-CG 3.29Å; V52-K56 PolarHBondContact O-N 3.05Å; G53-K56 PolarHBondContact O-N 3.02Å; K56-E59 PolarHBondContact O-N 3.47Å; K56-E60 PolarHBondContact O-N 3.39Å
57	R	88.9	Confident	87.6	Confident	45 Å²	45	63.7 Å²	63.7	17%	0.17	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-40.8	175	-168.6	170.3	71.4	112.5	-5	111.7	G53 E54 V55 E60 L61 Q98	G53-R57 WeakPolarHBondContact O-CB 3.48Å; G53-R57 PolarHBondContact O-N 3.16Å; E54-R57 WeakPolarHBondContact O-CB 3.21Å; E54-R57 PolarHBondContact O-N 3.46Å; E54-R57 IonicContact OE2-CZ 3.16Å; E54-R57 IonicContact OE2-NE 2.71Å; E54-R57 PolarHBondContact OE2-NE 3.11Å; E54-R57 IonicContact OE2-NH2 3.19Å; E54-R57 PolarHBondContact OE2-NH2 3.26Å; V55-R57 VanDerWaalsContact C-N 3.28Å; V55-R57 PolarHBondContact O-N 3.36Å; R57-E60 PolarHBondContact O-N 3.45Å; R57-L61 WeakPolarHBondContact O-CG 3.41Å; R57-L61 PolarHBondContact O-N 2.92Å; R57-L61 VanDerWaalsContact O-N 3.16Å; R57-Q98 VanDerWaalsContact CD-OE1 3.26Å
58	C	88.3	Confident	87.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-41	174.1	-60	0	0	0	0	112.2	E54 V55 E60 L61 E62 M305 K306	E54-C58 PolarHBondContact O-N 2.96Å; E54-C58 PolarHBondContact O-SG 3.32Å; V55-C58 WeakPolarHBondContact O-CB 3.32Å; V55-C58 PolarHBondContact O-N 3.47Å; V55-C58 VanDerWaalsContact O-N 3.1Å; C58-E60 VanDerWaalsContact C-N 3.34Å; C58-L61 PolarHBondContact O-N 2.94Å; C58-E62 WeakPolarHBondContact O-CB 3.27Å; C58-E62 PolarHBondContact O-N 3.47Å; C58-M305 HydrophobicContact CB-CE 4.32Å; C58-M305 WeakPolarHBondContact SG-CE 3.12Å; C58-K306 HydrophobicContact CB-CB 3.99Å; C58-K306 HydrophobicContact CB-CG 4.27Å
59	E	88.8	Confident	87.8	Confident	91 Å²	91	49.7 Å²	49.7	43%	0.425	24%	0.239	S	C	.	.	H	α-helix	trans	-64	-37.8	176.9	-72.9	172.8	173	0	0	112.2	V55 K56 E62 R63	V55-E59 WeakPolarHBondContact O-CG 3.24Å; V55-E59 PolarHBondContact O-N 3.25Å; K56-E59 PolarHBondContact O-N 3.47Å; E59-E62 WeakPolarHBondContact O-CB 3.37Å; E59-E62 PolarHBondContact O-N 3.45Å; E59-R63 PolarHBondContact O-N 3.44Å
60	E	89.8	Confident	87.9	Confident	83 Å²	83	52.9 Å²	52.9	39%	0.388	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-44	173.9	-178.6	162.5	-140.9	0	0	111.7	K56 R57 C58 E62 R63 I64	K56-E60 PolarHBondContact O-N 3.39Å; R57-E60 PolarHBondContact O-N 3.45Å; C58-E60 VanDerWaalsContact C-N 3.34Å; E60-E62 VanDerWaalsContact C-N 3.31Å; E60-E62 PolarHBondContact O-N 3.36Å; E60-R63 WeakPolarHBondContact O-CB 3.37Å; E60-R63 PolarHBondContact O-N 3.48Å; E60-R63 IonicContact OE1-NH2 3.82Å; E60-R63 PolarHBondContact OE1-NH2 3.41Å; E60-I64 HydrophobicContact CG-CD1 4.38Å; E60-I64 VanDerWaalsContact O-CG1 3.31Å; E60-I64 WeakPolarHBondContact O-CG1 3.24Å; E60-I64 PolarHBondContact O-N 2.99Å
61	L	88.8	Confident	87.9	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-62.2	-38.9	174.4	-68.2	175	0	0	0	112.2	R57 C58 I64 L65 M97 Q98 L101 V302 M305	R57-L61 WeakPolarHBondContact O-CG 3.41Å; R57-L61 PolarHBondContact O-N 2.92Å; R57-L61 VanDerWaalsContact O-N 3.16Å; C58-L61 PolarHBondContact O-N 2.94Å; L61-I64 PolarHBondContact O-N 2.96Å; L61-L65 VanDerWaalsContact O-CG 3.31Å; L61-L65 WeakPolarHBondContact O-CG 3.47Å; L61-L65 PolarHBondContact O-N 3.47Å; L61-M97 HydrophobicContact CD1-CE 4.19Å; L61-Q98 HydrophobicContact CD1-CB 4.36Å; L61-Q98 HydrophobicContact CD2-CB 4.05Å; L61-Q98 HydrophobicContact CD2-CG 4.01Å; L61-L101 HydrophobicContact CD2-CB 4.32Å; L61-L101 HydrophobicContact CD2-CD1 4.07Å; L61-V302 HydrophobicContact CB-CG1 4.12Å; L61-V302 HydrophobicContact CB-CG2 4.14Å; L61-V302 HydrophobicContact CD1-CG2 4.4Å; L61-M305 HydrophobicContact CD1-CE 3.93Å
62	E	88.6	Confident	87.9	Confident	56 Å²	56	45.2 Å²	45.2	26%	0.262	22%	0.222	S	C	.	.	H	α-helix	trans	-61.7	-45.1	174.7	-174.4	171.1	-155.3	0	0	111.1	C58 E59 E60 I64 L65 V66 V302 K306	C58-E62 WeakPolarHBondContact O-CB 3.27Å; C58-E62 PolarHBondContact O-N 3.47Å; E59-E62 WeakPolarHBondContact O-CB 3.37Å; E59-E62 PolarHBondContact O-N 3.45Å; E60-E62 VanDerWaalsContact C-N 3.31Å; E60-E62 PolarHBondContact O-N 3.36Å; E62-I64 VanDerWaalsContact C-N 3.32Å; E62-I64 PolarHBondContact O-N 2.99Å; E62-L65 PolarHBondContact O-N 3.27Å; E62-V66 WeakPolarHBondContact O-CG2 3.45Å; E62-V66 PolarHBondContact O-N 2.99Å; E62-V302 HydrophobicContact CB-CG1 4.31Å; E62-K306 IonicContact OE2-NZ 3.67Å; E62-K306 PolarHBondContact OE2-NZ 2.85Å
63	R	90.3	Very high	87.7	Confident	149 Å²	149	47.1 Å²	47.1	56%	0.562	23%	0.232	S	C	*	.	H	α-helix	trans	-57.7	-43.6	174.5	-175.2	-171.3	68.8	-171	-6	112.1	E59 E60 V66 Y67	E59-R63 PolarHBondContact O-N 3.44Å; E60-R63 WeakPolarHBondContact O-CB 3.37Å; E60-R63 PolarHBondContact O-N 3.48Å; E60-R63 IonicContact OE1-NH2 3.82Å; E60-R63 PolarHBondContact OE1-NH2 3.41Å; R63-V66 PolarHBondContact O-N 2.92Å; R63-Y67 PolarHBondContact O-N 2.98Å; R63-Y67 VanDerWaalsContact O-N 3.09Å
64	I	89.6	Confident	87.4	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-62.8	-45.5	177.9	-65	171.6	0	0	0	110.5	E60 L61 E62 V66 Y67 L68 Q102 E105	E60-I64 HydrophobicContact CG-CD1 4.38Å; E60-I64 VanDerWaalsContact O-CG1 3.31Å; E60-I64 WeakPolarHBondContact O-CG1 3.24Å; E60-I64 PolarHBondContact O-N 2.99Å; L61-I64 PolarHBondContact O-N 2.96Å; E62-I64 VanDerWaalsContact C-N 3.32Å; E62-I64 PolarHBondContact O-N 2.99Å; I64-V66 PolarHBondContact O-N 2.93Å; I64-Y67 WeakPolarHBondContact O-CB 3.3Å; I64-Y67 PolarHBondContact O-N 2.93Å; I64-L68 HydrophobicContact CG2-CD1 4.27Å; I64-L68 WeakPolarHBondContact O-CG 3.42Å; I64-L68 PolarHBondContact O-N 2.76Å; I64-Q102 HydrophobicContact CD1-CG 4Å; I64-E105 VanDerWaalsContact CD1-OE2 3.25Å; I64-E105 WeakPolarHBondContact CD1-OE2 3.44Å; I64-E105 VanDerWaalsContact CG1-OE2 3.24Å; I64-E105 WeakPolarHBondContact CG1-OE2 3.41Å; I64-E105 HydrophobicContact CG2-CB 3.82Å; I64-E105 HydrophobicContact CG2-CG 4.1Å
65	L	87.8	Confident	87.1	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-38.6	179.3	-72.4	165.6	0	0	0	112.3	L61 E62 Y67 L68 V69 L101 R298 V299 V302	L61-L65 VanDerWaalsContact O-CG 3.31Å; L61-L65 WeakPolarHBondContact O-CG 3.47Å; L61-L65 PolarHBondContact O-N 3.47Å; E62-L65 PolarHBondContact O-N 3.27Å; L65-Y67 VanDerWaalsContact C-N 3.34Å; L65-L68 HydrophobicContact CD2-CD1 4.37Å; L65-L68 PolarHBondContact O-N 2.87Å; L65-V69 VanDerWaalsContact O-CG2 3.3Å; L65-V69 WeakPolarHBondContact O-CG2 3.44Å; L65-V69 PolarHBondContact O-N 2.93Å; L65-L101 HydrophobicContact CD1-CD1 4.27Å; L65-L101 HydrophobicContact CD2-CD1 4.18Å; L65-L101 HydrophobicContact CD2-CD2 3.6Å; L65-L101 HydrophobicContact CG-CD1 4.24Å; L65-L101 HydrophobicContact CG-CD2 4.32Å; L65-R298 HydrophobicContact CD1-CB 4.49Å; L65-R298 HydrophobicContact CD2-CB 4.03Å; L65-V299 HydrophobicContact CB-CG2 3.77Å; L65-V299 HydrophobicContact CD1-CG2 3.85Å; L65-V299 HydrophobicContact CD2-CG2 4.09Å; L65-V299 HydrophobicContact CG-CG2 4.13Å; L65-V302 HydrophobicContact CD1-CB 4.09Å; L65-V302 HydrophobicContact CD1-CG2 3.73Å
66	V	88.4	Confident	86.7	Confident	72 Å²	72	58.4 Å²	58.4	44%	0.436	27%	0.271	S	S	.	.	H	α-helix	trans	-60.2	-45.3	173.6	170	0	0	0	0	110.7	E62 R63 I64 L68 V69 Q70	E62-V66 WeakPolarHBondContact O-CG2 3.45Å; E62-V66 PolarHBondContact O-N 2.99Å; R63-V66 PolarHBondContact O-N 2.92Å; I64-V66 PolarHBondContact O-N 2.93Å; V66-L68 PolarHBondContact O-N 2.77Å; V66-V69 PolarHBondContact O-N 2.98Å; V66-Q70 WeakPolarHBondContact O-CG 3.36Å; V66-Q70 PolarHBondContact O-N 3.36Å
67	Y	88.3	Confident	86.3	Confident	46 Å²	46	54.4 Å²	54.4	18%	0.18	26%	0.255	C	S	.	.	H	α-helix	trans	-59.1	-45.8	174.9	170.2	-109.1	0	0	0	112.1	R63 I64 L65 V69 Q70 E71 E105 L108	R63-Y67 PolarHBondContact O-N 2.98Å; R63-Y67 VanDerWaalsContact O-N 3.09Å; I64-Y67 WeakPolarHBondContact O-CB 3.3Å; I64-Y67 PolarHBondContact O-N 2.93Å; L65-Y67 VanDerWaalsContact C-N 3.34Å; Y67-V69 PolarHBondContact O-N 2.91Å; Y67-Q70 PolarHBondContact O-N 2.97Å; Y67-E71 HydrophobicContact CD2-CG 4.32Å; Y67-E71 HydrophobicContact CE1-CG 4.38Å; Y67-E71 HydrophobicContact CE2-CG 3.79Å; Y67-E71 PolarHBondContact O-N 3.42Å; Y67-E105 HydrophobicContact CD1-CG 4.25Å; Y67-E105 HydrophobicContact CE1-CG 4.42Å; Y67-L108 HydrophobicContact CE1-CD2 4.05Å
68	L	86.3	Confident	85.5	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-60.6	-43.1	177.3	-69.1	173.3	0	0	0	112.2	I64 L65 V66 Q70 E71 I72 L101 L104 L108 V295	I64-L68 HydrophobicContact CG2-CD1 4.27Å; I64-L68 WeakPolarHBondContact O-CG 3.42Å; I64-L68 PolarHBondContact O-N 2.76Å; L65-L68 HydrophobicContact CD2-CD1 4.37Å; L65-L68 PolarHBondContact O-N 2.87Å; V66-L68 PolarHBondContact O-N 2.77Å; L68-Q70 VanDerWaalsContact C-N 3.34Å; L68-Q70 PolarHBondContact O-N 3.31Å; L68-E71 PolarHBondContact O-N 2.71Å; L68-I72 WeakPolarHBondContact O-CD1 3.45Å; L68-I72 WeakPolarHBondContact O-CG1 3.42Å; L68-I72 PolarHBondContact O-N 2.85Å; L68-L101 HydrophobicContact CD1-CD2 4.05Å; L68-L104 HydrophobicContact CD1-CD2 3.97Å; L68-L104 HydrophobicContact CD2-CD2 4.3Å; L68-L104 HydrophobicContact CD2-CG 4.35Å; L68-L108 HydrophobicContact CD2-CD2 3.56Å; L68-V295 HydrophobicContact CB-CG2 4.42Å; L68-V295 HydrophobicContact CD1-CG2 4.37Å
69	V	85.4	Confident	84.6	Confident	7 Å²	7	59.8 Å²	59.8	4%	0.042	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-40.2	177.9	171.8	0	0	0	0	111.3	L65 V66 Y67 E71 I72 N73 V295 F849	L65-V69 VanDerWaalsContact O-CG2 3.3Å; L65-V69 WeakPolarHBondContact O-CG2 3.44Å; L65-V69 PolarHBondContact O-N 2.93Å; V66-V69 PolarHBondContact O-N 2.98Å; Y67-V69 PolarHBondContact O-N 2.91Å; V69-E71 VanDerWaalsContact C-N 3.34Å; V69-E71 PolarHBondContact O-N 3.1Å; V69-I72 PolarHBondContact O-N 3.41Å; V69-N73 WeakPolarHBondContact O-CB 3.25Å; V69-N73 VanDerWaalsContact O-CG 3.23Å; V69-N73 PolarHBondContact O-N 3.41Å; V69-N73 PolarHBondContact O-ND2 3.48Å; V69-V295 HydrophobicContact CG2-CG1 3.55Å; V69-F849 HydrophobicContact CG1-CB 4.19Å; V69-F849 HydrophobicContact CG2-CD1 3.86Å; V69-F849 HydrophobicContact CG2-CE1 4.45Å
70	Q	85.4	Confident	83.5	Confident	100 Å²	100	58.5 Å²	58.5	47%	0.467	29%	0.292	S	S	.	.	H	α-helix	trans	-61.1	-42.7	175.3	-73.3	175.6	-5	0	0	111.8	V66 Y67 L68 N73 R74	V66-Q70 WeakPolarHBondContact O-CG 3.36Å; V66-Q70 PolarHBondContact O-N 3.36Å; Y67-Q70 PolarHBondContact O-N 2.97Å; L68-Q70 VanDerWaalsContact C-N 3.34Å; L68-Q70 PolarHBondContact O-N 3.31Å; Q70-N73 PolarHBondContact O-N 3.02Å; Q70-R74 VanDerWaalsContact O-CG 3.32Å; Q70-R74 WeakPolarHBondContact O-CG 3.38Å; Q70-R74 PolarHBondContact O-N 3.23Å
71	E	84.1	Confident	82	Confident	18 Å²	18	60.9 Å²	60.9	8%	0.084	30%	0.304	C	S	.	.	H	α-helix	trans	-68.5	-37.2	177.3	-69.6	-64.3	122.5	0	0	112.7	Y67 L68 V69 R74 A75 L108 L288	Y67-E71 HydrophobicContact CD2-CG 4.32Å; Y67-E71 HydrophobicContact CE1-CG 4.38Å; Y67-E71 HydrophobicContact CE2-CG 3.79Å; Y67-E71 PolarHBondContact O-N 3.42Å; L68-E71 PolarHBondContact O-N 2.71Å; V69-E71 VanDerWaalsContact C-N 3.34Å; V69-E71 PolarHBondContact O-N 3.1Å; E71-R74 PolarHBondContact O-N 3.19Å; E71-R74 IonicContact OE1-CZ 3.53Å; E71-R74 IonicContact OE1-NE 3.09Å; E71-R74 IonicContact OE1-NH1 3.98Å; E71-R74 PolarHBondContact OE1-NH1 3.25Å; E71-A75 PolarHBondContact O-N 2.86Å; E71-L108 HydrophobicContact CB-CD2 4.06Å; E71-L108 HydrophobicContact CG-CD2 4.07Å; E71-L288 HydrophobicContact CB-CD2 4.18Å
72	I	85.3	Confident	80.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.3	-44.1	174.2	-68.2	164.8	0	0	0	110.7	L68 V69 A75 D76 I77 L79 L288 A292 V295	L68-I72 WeakPolarHBondContact O-CD1 3.45Å; L68-I72 WeakPolarHBondContact O-CG1 3.42Å; L68-I72 PolarHBondContact O-N 2.85Å; V69-I72 PolarHBondContact O-N 3.41Å; I72-A75 PolarHBondContact O-N 3.21Å; I72-A75 VanDerWaalsContact O-N 3.12Å; I72-D76 PolarHBondContact O-N 3.18Å; I72-I77 HydrophobicContact CG2-CB 4.02Å; I72-I77 HydrophobicContact CG2-CG2 4.45Å; I72-I77 PolarHBondContact O-N 2.86Å; I72-L79 HydrophobicContact CD1-CD2 4.39Å; I72-L79 HydrophobicContact CG2-CD2 4.03Å; I72-L79 HydrophobicContact CG2-CG 4.09Å; I72-L288 HydrophobicContact CG1-CD2 3.98Å; I72-A292 HydrophobicContact CD1-CB 4.12Å; I72-A292 HydrophobicContact CG2-CB 4.29Å; I72-V295 HydrophobicContact CD1-CB 4.4Å; I72-V295 HydrophobicContact CD1-CG1 4.47Å; I72-V295 HydrophobicContact CD1-CG2 4.09Å
73	N	83.7	Confident	78.7	Confident	65 Å²	65	69.2 Å²	69.2	35%	0.348	35%	0.35	S	S	.	.	H	α-helix	trans	-64.8	-38.7	177.4	-72.2	-21.2	0	0	0	111.8	V69 Q70 A75 D76	V69-N73 WeakPolarHBondContact O-CB 3.25Å; V69-N73 VanDerWaalsContact O-CG 3.23Å; V69-N73 PolarHBondContact O-N 3.41Å; V69-N73 PolarHBondContact O-ND2 3.48Å; Q70-N73 PolarHBondContact O-N 3.02Å; N73-A75 PolarHBondContact O-N 3.46Å; N73-D76 PolarHBondContact O-N 3.27Å
74	R	83.3	Confident	77.1	Confident	189 Å²	189	67.7 Å²	67.7	71%	0.713	36%	0.358	S	S	*	.	H	α-helix	trans	-62.4	-25.8	173.3	-77.7	173	174	-176.7	-6.5	113.2	Q70 E71	Q70-R74 VanDerWaalsContact O-CG 3.32Å; Q70-R74 WeakPolarHBondContact O-CG 3.38Å; Q70-R74 PolarHBondContact O-N 3.23Å; E71-R74 PolarHBondContact O-N 3.19Å; E71-R74 IonicContact OE1-CZ 3.53Å; E71-R74 IonicContact OE1-NE 3.09Å; E71-R74 IonicContact OE1-NH1 3.98Å; E71-R74 PolarHBondContact OE1-NH1 3.25Å
75	A	81.3	Confident	75.7	Confident	33 Å²	33	71.5 Å²	71.5	27%	0.273	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	2.3	179.2	0	0	0	0	0	113.7	E71 I72 N73 I77 L288	E71-A75 PolarHBondContact O-N 2.86Å; I72-A75 PolarHBondContact O-N 3.21Å; I72-A75 VanDerWaalsContact O-N 3.12Å; N73-A75 PolarHBondContact O-N 3.46Å; A75-I77 HydrophobicContact CB-CD1 3.85Å; A75-I77 HydrophobicContact CB-CG1 3.98Å; A75-I77 PolarHBondContact O-N 3.13Å; A75-L288 HydrophobicContact CB-CD1 3.89Å
76	D	79.8	Confident	74.8	Confident	152 Å²	152	72.4 Å²	72.4	81%	0.813	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	34.3	-176.3	-70.4	-36.7	0	0	0	113.8	I72 N73	I72-D76 PolarHBondContact O-N 3.18Å; N73-D76 PolarHBondContact O-N 3.27Å
77	I	80.3	Confident	73.8	Confident	29 Å²	29	73.4 Å²	73.4	15%	0.149	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-86.1	124.2	177.2	-61.4	167.9	0	0	0	108.5	I72 A75 L79 L288 A292	I72-I77 HydrophobicContact CG2-CB 4.02Å; I72-I77 HydrophobicContact CG2-CG2 4.45Å; I72-I77 PolarHBondContact O-N 2.86Å; A75-I77 HydrophobicContact CB-CD1 3.85Å; A75-I77 HydrophobicContact CB-CG1 3.98Å; A75-I77 PolarHBondContact O-N 3.13Å; I77-L79 PolarHBondContact O-N 2.74Å; I77-L288 HydrophobicContact CD1-CB 3.6Å; I77-L288 HydrophobicContact CD1-CD1 4.38Å; I77-A292 HydrophobicContact CG2-CB 4.15Å
78	P	72.8	Confident	72.9	Confident	113 Å²	113	71.9 Å²	71.9	73%	0.734	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-66.5	123.5	178.5	26.8	-33.2	0	0	0	110.3
79	L	68.7	Low	72.4	Confident	45 Å²	45	72 Å²	72	24%	0.236	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-74.7	129	172.9	-75	154.6	0	0	0	109.4	I72 I77 E81	I72-L79 HydrophobicContact CD1-CD2 4.39Å; I72-L79 HydrophobicContact CG2-CD2 4.03Å; I72-L79 HydrophobicContact CG2-CG 4.09Å; I77-L79 PolarHBondContact O-N 2.74Å; L79-E81 PolarHBondContact O-N 2.94Å
80	P	66.3	Low	71.9	Confident	64 Å²	64	74 Å²	74	42%	0.416	41%	0.41	S	S	.	.			trans	-67.2	115.1	171.4	25.3	-29.8	0	0	0	109.3	G82	P80-G82 PolarHBondContact O-N 3.47Å; P80-G82 VanDerWaalsContact O-N 3.1Å
81	E	58.5	Low	71.3	Confident	134 Å²	134	73.8 Å²	73.8	63%	0.626	41%	0.411	S	S	*	.			trans	-72.9	99.5	168.2	-67.9	-172.8	160	0	0	108	L79 E83 Q439	L79-E81 PolarHBondContact O-N 2.94Å; E81-E83 PolarHBondContact O-N 3.25Å; E81-Q439 PolarHBondContact OE1-NE2 3Å; E81-Q439 PolarHBondContact OE2-NE2 3.12Å
82	G	55	Low	70.7	Confident	30 Å²	30	81.7 Å²	81.7	31%	0.309	45%	0.445	S	S	.	.			trans	-66.6	123.4	175.4	0	0	0	0	0	111.1	P80 T84 Y296	P80-G82 PolarHBondContact O-N 3.47Å; P80-G82 VanDerWaalsContact O-N 3.1Å; G82-T84 PolarHBondContact O-N 3.41Å; G82-Y296 PolarHBondContact O-OH 2.55Å
83	E	51.8	Low	70.4	Confident	202 Å²	202	86.5 Å²	86.5	94%	0.944	47%	0.468	S	S	*	.	S	Bend	trans	-69.1	-15.8	178.4	-67	-174.7	162.3	0	0	113.6	E81	E81-E83 PolarHBondContact O-N 3.25Å
84	T	57.7	Low	70.1	Confident	118 Å²	118	83.5 Å²	83.5	72%	0.724	45%	0.452	S	S	*	.	S	Bend	trans	-120.1	128.8	-176	53	0	0	0	0	111.5	G82 P86	G82-T84 PolarHBondContact O-N 3.41Å; T84-P86 WeakPolarHBondContact O-CD 3.47Å
85	S	60.3	Low	70.1	Confident	81 Å²	81	80 Å²	80	57%	0.566	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-72.1	119.7	173.6	50.6	0	0	0	0	109.2
86	P	67.4	Low	70.3	Confident	21 Å²	21	84 Å²	84	14%	0.136	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-64.9	146.9	178.4	26.5	-35.1	0	0	0	110.6	T84 I300 Q301 K304	T84-P86 WeakPolarHBondContact O-CD 3.47Å; P86-I300 HydrophobicContact CG-CB 4.08Å; P86-I300 HydrophobicContact CG-CG2 4.08Å; P86-Q301 HydrophobicContact CB-CG 4.4Å; P86-Q301 HydrophobicContact CG-CG 4.16Å; P86-K304 WeakPolarHBondContact O-CE 3.16Å; P86-K304 PolarHBondContact O-NZ 2.99Å
87	P	67.3	Low	70.4	Confident	94 Å²	94	77.4 Å²	77.4	61%	0.61	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-61.5	156.4	173.2	27.2	-34.1	0	0	0	110.9
88	A	69.7	Low	70.6	Confident	13 Å²	13	77.5 Å²	77.5	11%	0.107	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-59.8	139.9	175.3	0	0	0	0	0	110.5	S27 K304 I308	S27-A88 WeakPolarHBondContact OG-CB 3.31Å; A88-K304 HydrophobicContact CB-CB 4.32Å; A88-K304 HydrophobicContact CB-CD 4.28Å; A88-I308 HydrophobicContact CB-CD1 4.12Å
89	P	75.6	Confident	71.4	Confident	3 Å²	3	78.8 Å²	78.8	2%	0.019	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-70	135.9	-177.5	28.9	-33.5	0	0	0	110.3	Y23 V94 Q301	Y23-P89 WeakPolarHBondContact CE1-O 3.36Å; Y23-P89 PolarHBondContact OH-O 3.11Å; P89-V94 HydrophobicContact CB-CG2 4.43Å; P89-V94 HydrophobicContact CG-CG2 4.23Å; P89-Q301 HydrophobicContact CG-CB 4.08Å; P89-Q301 HydrophobicContact CG-CG 4.48Å
90	P	74.7	Confident	72.3	Confident	51 Å²	51	81.7 Å²	81.7	33%	0.331	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-63.5	151.3	171.1	27.9	-34.7	0	0	0	110.2	K92 Q93 V94	P90-K92 PolarHBondContact O-N 3.28Å; P90-Q93 VanDerWaalsContact CD-OE1 3.31Å; P90-Q93 HydrophobicContact CG-CB 4.14Å; P90-Q93 VanDerWaalsContact CG-CD 3.49Å; P90-Q93 HydrophobicContact CG-CG 3.81Å; P90-Q93 PolarHBondContact O-N 3.37Å; P90-V94 PolarHBondContact O-N 3Å
91	L	72.8	Confident	73.3	Confident	95 Å²	95	78.6 Å²	78.6	50%	0.497	41%	0.412	S	S	.	.	H	α-helix	trans	-51.9	-32.7	-173.2	-156.1	87.8	0	0	0	113.5	Y23 V94 Y309	Y23-L91 HydrophobicContact CD2-CD1 4.19Å; Y23-L91 HydrophobicContact CG-CD1 4.19Å; L91-V94 PolarHBondContact O-N 3.41Å; L91-Y309 WeakPolarHBondContact CD1-OH 3.44Å
92	K	73.4	Confident	74.8	Confident	184 Å²	184	75.5 Å²	75.5	80%	0.8	40%	0.398	S	S	*	.	H	α-helix	trans	-66	-38	178.5	-65.7	-179.8	-178.8	174.1	0	113.2	P90 V94	P90-K92 PolarHBondContact O-N 3.28Å; K92-V94 VanDerWaalsContact C-N 3.32Å
93	Q	76.9	Confident	76.5	Confident	101 Å²	101	81.1 Å²	81.1	47%	0.472	41%	0.414	S	S	.	.	H	α-helix	trans	-79.2	-17	-178	-70	176.9	4.7	0	0	112.6	P90 L95 E96 M97	P90-Q93 VanDerWaalsContact CD-OE1 3.31Å; P90-Q93 HydrophobicContact CG-CB 4.14Å; P90-Q93 VanDerWaalsContact CG-CD 3.49Å; P90-Q93 HydrophobicContact CG-CG 3.81Å; P90-Q93 PolarHBondContact O-N 3.37Å; Q93-L95 VanDerWaalsContact C-N 3.35Å; Q93-L95 PolarHBondContact O-N 2.96Å; Q93-E96 PolarHBondContact O-N 2.68Å; Q93-M97 VanDerWaalsContact O-CB 3.28Å; Q93-M97 WeakPolarHBondContact O-CB 3.4Å; Q93-M97 PolarHBondContact O-N 3.35Å
94	V	78.4	Confident	78.2	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.006	38%	0.376	C	S	.	.	H	α-helix	trans	-62.4	-42.2	-179.8	177.4	0	0	0	0	111.6	P89 P90 L91 K92 Q98 M305	P89-V94 HydrophobicContact CB-CG2 4.43Å; P89-V94 HydrophobicContact CG-CG2 4.23Å; P90-V94 PolarHBondContact O-N 3Å; L91-V94 PolarHBondContact O-N 3.41Å; K92-V94 VanDerWaalsContact C-N 3.32Å; V94-Q98 WeakPolarHBondContact O-CB 3.27Å; V94-Q98 PolarHBondContact O-N 2.99Å; V94-M305 HydrophobicContact CB-SD 4.14Å; V94-M305 HydrophobicContact CG1-CE 3.89Å; V94-M305 HydrophobicContact CG1-SD 3.37Å; V94-M305 WeakPolarHBondContact CG1-SD 3.41Å; V94-M305 HydrophobicContact CG2-SD 3.59Å; V94-M305 VanDerWaalsContact CG2-SD 3.59Å
95	L	82.6	Confident	79.6	Confident	115 Å²	115	68.2 Å²	68.2	60%	0.602	35%	0.346	S	S	*	.	H	α-helix	trans	-68.2	-44.6	-179.9	-71.5	167.6	0	0	0	111.5	Q93 M97 Q98 E99	Q93-L95 VanDerWaalsContact C-N 3.35Å; Q93-L95 PolarHBondContact O-N 2.96Å; L95-M97 VanDerWaalsContact C-N 3.34Å; L95-M97 PolarHBondContact O-N 3.47Å; L95-Q98 WeakPolarHBondContact O-CB 3.5Å; L95-Q98 PolarHBondContact O-N 2.94Å; L95-E99 PolarHBondContact O-N 3.15Å
96	E	85.2	Confident	81.1	Confident	117 Å²	117	68 Å²	68	55%	0.547	34%	0.341	S	S	.	.	H	α-helix	trans	-61.4	-43.6	176.3	-64.7	177	179.5	0	0	111.3	Q93 Q98 E99 Q100	Q93-E96 PolarHBondContact O-N 2.68Å; E96-Q98 VanDerWaalsContact C-N 3.32Å; E96-Q98 PolarHBondContact O-N 3.4Å; E96-E99 PolarHBondContact O-N 2.92Å; E96-Q100 VanDerWaalsContact O-CG 3.28Å; E96-Q100 WeakPolarHBondContact O-CG 3.43Å; E96-Q100 PolarHBondContact O-N 2.92Å
97	M	82.6	Confident	82.2	Confident	14 Å²	14	69.8 Å²	69.8	7%	0.069	35%	0.348	C	S	.	.	H	α-helix	trans	-62.4	-41.1	177.1	-175.4	-172.8	70.9	0	0	111.6	L61 Q93 L95 Q100 L101 R298 V302 M305	L61-M97 HydrophobicContact CD1-CE 4.19Å; Q93-M97 VanDerWaalsContact O-CB 3.28Å; Q93-M97 WeakPolarHBondContact O-CB 3.4Å; Q93-M97 PolarHBondContact O-N 3.35Å; L95-M97 VanDerWaalsContact C-N 3.34Å; L95-M97 PolarHBondContact O-N 3.47Å; M97-Q100 PolarHBondContact O-N 3.38Å; M97-L101 HydrophobicContact CG-CD1 4.05Å; M97-L101 WeakPolarHBondContact O-CB 3.5Å; M97-L101 WeakPolarHBondContact O-CG 3.49Å; M97-L101 PolarHBondContact O-N 3.41Å; M97-R298 HydrophobicContact SD-CG 4.45Å; M97-V302 HydrophobicContact CE-CG2 3.53Å; M97-V302 HydrophobicContact SD-CG2 4.4Å; M97-M305 HydrophobicContact CE-CE 4.42Å
98	Q	85.4	Confident	83.1	Confident	32 Å²	32	65.4 Å²	65.4	15%	0.15	32%	0.319	C	S	.	.	H	α-helix	trans	-61.9	-48.2	176.5	169.6	173.3	-2.4	0	0	111.5	R57 L61 V94 L95 E96 Q100 L101 Q102	R57-Q98 VanDerWaalsContact CD-OE1 3.26Å; L61-Q98 HydrophobicContact CD1-CB 4.36Å; L61-Q98 HydrophobicContact CD2-CB 4.05Å; L61-Q98 HydrophobicContact CD2-CG 4.01Å; V94-Q98 WeakPolarHBondContact O-CB 3.27Å; V94-Q98 PolarHBondContact O-N 2.99Å; L95-Q98 WeakPolarHBondContact O-CB 3.5Å; L95-Q98 PolarHBondContact O-N 2.94Å; E96-Q98 VanDerWaalsContact C-N 3.32Å; E96-Q98 PolarHBondContact O-N 3.4Å; Q98-Q100 VanDerWaalsContact C-N 3.32Å; Q98-Q100 PolarHBondContact O-N 3.35Å; Q98-L101 PolarHBondContact O-N 2.95Å; Q98-Q102 HydrophobicContact CG-CG 4.41Å; Q98-Q102 WeakPolarHBondContact O-CB 3.26Å; Q98-Q102 WeakPolarHBondContact O-CG 3.34Å; Q98-Q102 PolarHBondContact O-N 3.46Å
99	E	88.8	Confident	84.1	Confident	140 Å²	140	71.1 Å²	71.1	65%	0.654	34%	0.338	S	S	*	.	H	α-helix	trans	-61	-43.1	179.2	-172.1	179.5	175.7	0	0	111.2	L95 E96 K103	L95-E99 PolarHBondContact O-N 3.15Å; E96-E99 PolarHBondContact O-N 2.92Å; E99-K103 VanDerWaalsContact O-CB 3.24Å; E99-K103 WeakPolarHBondContact O-CB 3.3Å; E99-K103 PolarHBondContact O-N 3.41Å
100	Q	87.1	Confident	84.8	Confident	105 Å²	105	76.5 Å²	76.5	49%	0.491	36%	0.363	S	S	.	.	H	α-helix	trans	-62.2	-43.9	176.1	-72.3	177.9	6.7	0	0	112.8	E96 M97 Q98 L104	E96-Q100 VanDerWaalsContact O-CG 3.28Å; E96-Q100 WeakPolarHBondContact O-CG 3.43Å; E96-Q100 PolarHBondContact O-N 2.92Å; M97-Q100 PolarHBondContact O-N 3.38Å; Q98-Q100 VanDerWaalsContact C-N 3.32Å; Q98-Q100 PolarHBondContact O-N 3.35Å; Q100-L104 VanDerWaalsContact O-CB 3.31Å; Q100-L104 WeakPolarHBondContact O-CB 3.41Å; Q100-L104 PolarHBondContact O-N 3.49Å
101	L	87.6	Confident	85.5	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-67.9	-43.1	-179.7	-79.4	172.6	0	0	0	112.1	L61 L65 L68 M97 Q98 L104 E105	L61-L101 HydrophobicContact CD2-CB 4.32Å; L61-L101 HydrophobicContact CD2-CD1 4.07Å; L65-L101 HydrophobicContact CD1-CD1 4.27Å; L65-L101 HydrophobicContact CD2-CD1 4.18Å; L65-L101 HydrophobicContact CD2-CD2 3.6Å; L65-L101 HydrophobicContact CG-CD1 4.24Å; L65-L101 HydrophobicContact CG-CD2 4.32Å; L68-L101 HydrophobicContact CD1-CD2 4.05Å; M97-L101 HydrophobicContact CG-CD1 4.05Å; M97-L101 WeakPolarHBondContact O-CB 3.5Å; M97-L101 WeakPolarHBondContact O-CG 3.49Å; M97-L101 PolarHBondContact O-N 3.41Å; Q98-L101 PolarHBondContact O-N 2.95Å; L101-L104 PolarHBondContact O-N 2.88Å; L101-E105 PolarHBondContact O-N 3.21Å
102	Q	89.9	Confident	86.2	Confident	69 Å²	69	71.5 Å²	71.5	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-64.8	-42.4	176.4	-72.7	-179.3	-17.1	0	0	111.3	I64 Q98 L104 E105 V106	I64-Q102 HydrophobicContact CD1-CG 4Å; Q98-Q102 HydrophobicContact CG-CG 4.41Å; Q98-Q102 WeakPolarHBondContact O-CB 3.26Å; Q98-Q102 WeakPolarHBondContact O-CG 3.34Å; Q98-Q102 PolarHBondContact O-N 3.46Å; Q102-L104 VanDerWaalsContact C-N 3.34Å; Q102-L104 PolarHBondContact O-N 2.92Å; Q102-E105 PolarHBondContact O-N 3.33Å; Q102-V106 WeakPolarHBondContact O-CG2 3.24Å; Q102-V106 PolarHBondContact O-N 3Å
103	K	90.3	Very high	87	Confident	147 Å²	147	68.5 Å²	68.5	64%	0.639	32%	0.322	S	S	*	.	H	α-helix	trans	-60.9	-44.4	175.8	-174.3	178.3	-180	-179.9	0	111.7	E99 V106 E107	E99-K103 VanDerWaalsContact O-CB 3.24Å; E99-K103 WeakPolarHBondContact O-CB 3.3Å; E99-K103 PolarHBondContact O-N 3.41Å; K103-V106 PolarHBondContact O-N 2.84Å; K103-E107 WeakPolarHBondContact O-CB 3.48Å; K103-E107 PolarHBondContact O-N 3.42Å
104	L	87.7	Confident	87.6	Confident	29 Å²	29	67.5 Å²	67.5	15%	0.152	32%	0.32	C	S	.	.	H	α-helix	trans	-64.4	-40.1	178	-175	66.6	0	0	0	112	L68 Q100 L101 Q102 L108 V287 A291	L68-L104 HydrophobicContact CD1-CD2 3.97Å; L68-L104 HydrophobicContact CD2-CD2 4.3Å; L68-L104 HydrophobicContact CD2-CG 4.35Å; Q100-L104 VanDerWaalsContact O-CB 3.31Å; Q100-L104 WeakPolarHBondContact O-CB 3.41Å; Q100-L104 PolarHBondContact O-N 3.49Å; L101-L104 PolarHBondContact O-N 2.88Å; Q102-L104 VanDerWaalsContact C-N 3.34Å; Q102-L104 PolarHBondContact O-N 2.92Å; L104-L108 VanDerWaalsContact O-CB 3.27Å; L104-L108 WeakPolarHBondContact O-CB 3.38Å; L104-L108 PolarHBondContact O-N 3.49Å; L104-V287 HydrophobicContact CD1-CG1 3.71Å; L104-A291 HydrophobicContact CD2-CB 3.9Å
105	E	88.5	Confident	88	Confident	20 Å²	20	69.7 Å²	69.7	9%	0.093	33%	0.33	C	S	.	.	H	α-helix	trans	-61	-48	175.4	-172.3	-162.6	177	0	0	111.6	I64 Y67 L101 Q102 L108 R109	I64-E105 VanDerWaalsContact CD1-OE2 3.25Å; I64-E105 WeakPolarHBondContact CD1-OE2 3.44Å; I64-E105 VanDerWaalsContact CG1-OE2 3.24Å; I64-E105 WeakPolarHBondContact CG1-OE2 3.41Å; I64-E105 HydrophobicContact CG2-CB 3.82Å; I64-E105 HydrophobicContact CG2-CG 4.1Å; Y67-E105 HydrophobicContact CD1-CG 4.25Å; Y67-E105 HydrophobicContact CE1-CG 4.42Å; L101-E105 PolarHBondContact O-N 3.21Å; Q102-E105 PolarHBondContact O-N 3.33Å; E105-L108 PolarHBondContact O-N 3.34Å; E105-R109 VanDerWaalsContact O-CB 3.26Å; E105-R109 WeakPolarHBondContact O-CB 3.43Å; E105-R109 PolarHBondContact O-N 3.26Å; E105-R109 IonicContact OE1-CZ 3.44Å; E105-R109 IonicContact OE1-NH1 3.49Å; E105-R109 IonicContact OE1-NH2 3.67Å; E105-R109 PolarHBondContact OE1-NH2 2.9Å
106	V	91.3	Very high	88.3	Confident	77 Å²	77	70.2 Å²	70.2	47%	0.467	33%	0.329	S	S	.	.	H	α-helix	trans	-62.4	-48.1	-179.7	172.4	0	0	0	0	110.2	Q102 K103 L108 R109 E110	Q102-V106 WeakPolarHBondContact O-CG2 3.24Å; Q102-V106 PolarHBondContact O-N 3Å; K103-V106 PolarHBondContact O-N 2.84Å; V106-L108 PolarHBondContact O-N 3.11Å; V106-R109 PolarHBondContact O-N 3.42Å; V106-E110 HydrophobicContact CG1-CG 4.48Å; V106-E110 WeakPolarHBondContact O-CB 3.25Å; V106-E110 WeakPolarHBondContact O-CG 3.34Å; V106-E110 PolarHBondContact O-N 2.93Å
107	E	89.3	Confident	88.4	Confident	58 Å²	58	70 Å²	70	27%	0.271	33%	0.326	S	S	.	.	H	α-helix	trans	-59.1	-47.3	177.8	-175.1	176.7	179.9	0	0	111.5	K103 R109 E110 V111 Y283	K103-E107 WeakPolarHBondContact O-CB 3.48Å; K103-E107 PolarHBondContact O-N 3.42Å; E107-R109 PolarHBondContact O-N 3.02Å; E107-E110 PolarHBondContact O-N 3.32Å; E107-V111 VanDerWaalsContact O-CG2 3.26Å; E107-V111 WeakPolarHBondContact O-CG2 3.32Å; E107-V111 PolarHBondContact O-N 2.93Å; E107-Y283 PolarHBondContact OE1-OH 3.49Å
108	L	87.9	Confident	88.7	Confident	2 Å²	2	71 Å²	71	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-63.7	-44.6	179.9	-167.6	71	0	0	0	111.4	Y67 L68 E71 L104 E105 V106 E110 V111 T112 L284 L288	Y67-L108 HydrophobicContact CE1-CD2 4.05Å; L68-L108 HydrophobicContact CD2-CD2 3.56Å; E71-L108 HydrophobicContact CB-CD2 4.06Å; E71-L108 HydrophobicContact CG-CD2 4.07Å; L104-L108 VanDerWaalsContact O-CB 3.27Å; L104-L108 WeakPolarHBondContact O-CB 3.38Å; L104-L108 PolarHBondContact O-N 3.49Å; E105-L108 PolarHBondContact O-N 3.34Å; V106-L108 PolarHBondContact O-N 3.11Å; L108-E110 VanDerWaalsContact C-N 3.32Å; L108-E110 PolarHBondContact O-N 2.85Å; L108-V111 PolarHBondContact O-N 3.16Å; L108-T112 WeakPolarHBondContact O-CB 3.44Å; L108-T112 PolarHBondContact O-N 3Å; L108-T112 PolarHBondContact O-OG1 3.4Å; L108-L284 HydrophobicContact CD1-CD1 3.3Å; L108-L284 HydrophobicContact CG-CD1 4.46Å; L108-L288 HydrophobicContact CD1-CD2 3.82Å; L108-L288 HydrophobicContact CD1-CG 4.15Å; L108-L288 HydrophobicContact CD2-CD2 4.07Å
109	R	89.4	Confident	88.8	Confident	133 Å²	133	75.1 Å²	75.1	50%	0.502	35%	0.346	S	S	.	.	H	α-helix	trans	-63.7	-38.6	179.1	-174	174.1	-69.4	169.2	7.5	111.8	E105 V106 E107 K113	E105-R109 VanDerWaalsContact O-CB 3.26Å; E105-R109 WeakPolarHBondContact O-CB 3.43Å; E105-R109 PolarHBondContact O-N 3.26Å; E105-R109 IonicContact OE1-CZ 3.44Å; E105-R109 IonicContact OE1-NH1 3.49Å; E105-R109 IonicContact OE1-NH2 3.67Å; E105-R109 PolarHBondContact OE1-NH2 2.9Å; V106-R109 PolarHBondContact O-N 3.42Å; E107-R109 PolarHBondContact O-N 3.02Å; R109-K113 VanDerWaalsContact O-CB 3.23Å; R109-K113 WeakPolarHBondContact O-CB 3.3Å; R109-K113 PolarHBondContact O-N 3.34Å
110	E	90.4	Very high	88.7	Confident	116 Å²	116	72.4 Å²	72.4	54%	0.542	33%	0.332	S	S	.	.	H	α-helix	trans	-66	-45.9	175.2	-75.3	-179.9	-179.1	0	0	111.8	V106 E107 L108 K113 N114	V106-E110 HydrophobicContact CG1-CG 4.48Å; V106-E110 WeakPolarHBondContact O-CB 3.25Å; V106-E110 WeakPolarHBondContact O-CG 3.34Å; V106-E110 PolarHBondContact O-N 2.93Å; E107-E110 PolarHBondContact O-N 3.32Å; L108-E110 VanDerWaalsContact C-N 3.32Å; L108-E110 PolarHBondContact O-N 2.85Å; E110-K113 PolarHBondContact O-N 2.9Å; E110-N114 WeakPolarHBondContact O-CB 3.39Å; E110-N114 PolarHBondContact O-N 3.23Å; E110-N114 PolarHBondContact O-ND2 3.32Å
111	V	89.1	Confident	88.8	Confident	22 Å²	22	70.9 Å²	70.9	13%	0.133	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-45.2	178	174.9	0	0	0	0	110.9	E107 L108 N114 K115 Y283 L284	E107-V111 VanDerWaalsContact O-CG2 3.26Å; E107-V111 WeakPolarHBondContact O-CG2 3.32Å; E107-V111 PolarHBondContact O-N 2.93Å; L108-V111 PolarHBondContact O-N 3.16Å; V111-N114 PolarHBondContact O-N 3.38Å; V111-K115 WeakPolarHBondContact O-CB 3.42Å; V111-K115 PolarHBondContact O-N 3.02Å; V111-Y283 HydrophobicContact CG1-CD1 4.45Å; V111-Y283 HydrophobicContact CG2-CD1 4.08Å; V111-Y283 HydrophobicContact CG2-CE1 3.96Å; V111-L284 HydrophobicContact CG1-CB 3.99Å; V111-L284 HydrophobicContact CG1-CD1 4Å; V111-L284 HydrophobicContact CG1-CG 4.48Å
112	T	87.4	Confident	88.8	Confident	20 Å²	20	71.6 Å²	71.6	12%	0.123	33%	0.331	C	S	.	.	H	α-helix	trans	-62.5	-44.9	177.6	-59.5	0	0	0	0	111.3	L108 N114 K115 E116	L108-T112 WeakPolarHBondContact O-CB 3.44Å; L108-T112 PolarHBondContact O-N 3Å; L108-T112 PolarHBondContact O-OG1 3.4Å; T112-N114 VanDerWaalsContact C-N 3.32Å; T112-N114 PolarHBondContact O-N 3.41Å; T112-K115 WeakPolarHBondContact O-CB 3.44Å; T112-K115 PolarHBondContact O-N 3.14Å; T112-E116 WeakPolarHBondContact O-CG 3.38Å; T112-E116 PolarHBondContact O-N 2.98Å
113	K	90.3	Very high	88.6	Confident	120 Å²	120	69.1 Å²	69.1	52%	0.522	32%	0.32	S	S	.	.	H	α-helix	trans	-62.3	-38.4	175.7	-173.9	178.2	-173.9	176.3	0	112.5	R109 E110 K117	R109-K113 VanDerWaalsContact O-CB 3.23Å; R109-K113 WeakPolarHBondContact O-CB 3.3Å; R109-K113 PolarHBondContact O-N 3.34Å; E110-K113 PolarHBondContact O-N 2.9Å; K113-K117 WeakPolarHBondContact O-CG 3.41Å; K113-K117 PolarHBondContact O-N 3.27Å; K113-K117 VanDerWaalsContact O-N 3.11Å
114	N	90	Very high	88.3	Confident	81 Å²	81	65.4 Å²	65.4	43%	0.433	31%	0.305	S	S	.	.	H	α-helix	trans	-69.5	-40.4	176.7	-70.8	-22	0	0	0	111.3	E110 V111 T112 K117 L118	E110-N114 WeakPolarHBondContact O-CB 3.39Å; E110-N114 PolarHBondContact O-N 3.23Å; E110-N114 PolarHBondContact O-ND2 3.32Å; V111-N114 PolarHBondContact O-N 3.38Å; T112-N114 VanDerWaalsContact C-N 3.32Å; T112-N114 PolarHBondContact O-N 3.41Å; N114-K117 PolarHBondContact O-N 2.93Å; N114-L118 WeakPolarHBondContact O-CB 3.41Å; N114-L118 VanDerWaalsContact O-CG 3.29Å; N114-L118 WeakPolarHBondContact O-CG 3.29Å; N114-L118 PolarHBondContact O-N 2.98Å
115	K	87.6	Confident	88.3	Confident	47 Å²	47	65.3 Å²	65.3	20%	0.204	30%	0.304	C	S	.	.	H	α-helix	trans	-59	-48	173.4	179	-177.6	176.4	169	0	111.4	V111 T112 K117 L118 R119 L277 E281 L284	V111-K115 WeakPolarHBondContact O-CB 3.42Å; V111-K115 PolarHBondContact O-N 3.02Å; T112-K115 WeakPolarHBondContact O-CB 3.44Å; T112-K115 PolarHBondContact O-N 3.14Å; K115-K117 PolarHBondContact O-N 3.3Å; K115-L118 PolarHBondContact O-N 3.33Å; K115-R119 WeakPolarHBondContact O-CB 3.39Å; K115-R119 PolarHBondContact O-N 3.02Å; K115-L277 HydrophobicContact CG-CD1 4.15Å; K115-E281 HydrophobicContact CD-CG 4.3Å; K115-E281 WeakPolarHBondContact CE-OE1 3.18Å; K115-E281 IonicContact NZ-OE1 3.18Å; K115-E281 PolarHBondContact NZ-OE1 3.49Å; K115-L284 HydrophobicContact CD-CD2 4.02Å
116	E	87.4	Confident	88.1	Confident	125 Å²	125	65.6 Å²	65.6	58%	0.584	31%	0.306	S	S	*	.	H	α-helix	trans	-59.9	-45.4	177.7	-74.2	171.6	-177.6	0	0	111.9	T112 L118 R119 K120	T112-E116 WeakPolarHBondContact O-CG 3.38Å; T112-E116 PolarHBondContact O-N 2.98Å; E116-L118 PolarHBondContact O-N 2.8Å; E116-R119 PolarHBondContact O-N 3.27Å; E116-K120 WeakPolarHBondContact O-CB 3.49Å; E116-K120 PolarHBondContact O-N 3.1Å
117	K	89.1	Confident	87.8	Confident	112 Å²	112	61.9 Å²	61.9	49%	0.487	28%	0.284	S	S	.	.	H	α-helix	trans	-61.1	-43.5	175	-74.2	175.5	179.1	-178.1	0	112.5	K113 N114 K115 K120 N121	K113-K117 WeakPolarHBondContact O-CG 3.41Å; K113-K117 PolarHBondContact O-N 3.27Å; K113-K117 VanDerWaalsContact O-N 3.11Å; N114-K117 PolarHBondContact O-N 2.93Å; K115-K117 PolarHBondContact O-N 3.3Å; K117-K120 PolarHBondContact O-N 3.16Å; K117-N121 WeakPolarHBondContact O-CB 2.9Å; K117-N121 PolarHBondContact O-N 3.44Å; K117-N121 PolarHBondContact O-ND2 3.44Å; K117-N121 PolarHBondContact O-OD1 3.45Å
118	L	88.9	Confident	87.7	Confident	35 Å²	35	60.3 Å²	60.3	18%	0.183	28%	0.276	C	S	.	.	H	α-helix	trans	-64.2	-42	177.5	-74.5	169.3	0	0	0	111.4	N114 K115 E116 N121 L122 L273 V276 L277 T280	N114-L118 WeakPolarHBondContact O-CB 3.41Å; N114-L118 VanDerWaalsContact O-CG 3.29Å; N114-L118 WeakPolarHBondContact O-CG 3.29Å; N114-L118 PolarHBondContact O-N 2.98Å; K115-L118 PolarHBondContact O-N 3.33Å; E116-L118 PolarHBondContact O-N 2.8Å; L118-N121 PolarHBondContact O-N 2.91Å; L118-L122 WeakPolarHBondContact O-CB 3.45Å; L118-L122 PolarHBondContact O-N 3.28Å; L118-L273 HydrophobicContact CD2-CD2 3.91Å; L118-V276 HydrophobicContact CD1-CG1 3.92Å; L118-V276 HydrophobicContact CD2-CG1 4.37Å; L118-L277 HydrophobicContact CB-CD1 4.34Å; L118-T280 HydrophobicContact CD1-CG2 4.11Å
119	R	87.4	Confident	87.5	Confident	120 Å²	120	60.5 Å²	60.5	45%	0.453	28%	0.277	S	S	.	.	H	α-helix	trans	-62.1	-45	175.8	-171	179	-175.2	150.3	1	111.3	K115 E116 L122 L123 E212	K115-R119 WeakPolarHBondContact O-CB 3.39Å; K115-R119 PolarHBondContact O-N 3.02Å; E116-R119 PolarHBondContact O-N 3.27Å; R119-L122 PolarHBondContact O-N 3.36Å; R119-L123 WeakPolarHBondContact O-CB 3.44Å; R119-L123 PolarHBondContact O-N 2.8Å; R119-E212 IonicContact CZ-OE2 3.93Å; R119-E212 IonicContact NE-OE2 3.22Å; R119-E212 IonicContact NH2-OE1 3.43Å; R119-E212 IonicContact NH2-OE2 2.69Å; R119-E212 PolarHBondContact NH2-OE2 3.26Å
120	K	86.8	Confident	87.2	Confident	82 Å²	82	55.1 Å²	55.1	36%	0.357	26%	0.257	S	S	.	.	H	α-helix	trans	-59.2	-49	175.5	-176.5	170.4	-179.5	163.1	0	111.7	E116 K117 L122 L123 E124 P214 E215	E116-K120 WeakPolarHBondContact O-CB 3.49Å; E116-K120 PolarHBondContact O-N 3.1Å; K117-K120 PolarHBondContact O-N 3.16Å; K120-L122 VanDerWaalsContact C-N 3.34Å; K120-L122 PolarHBondContact O-N 2.94Å; K120-L123 PolarHBondContact O-N 3.44Å; K120-E124 VanDerWaalsContact CE-OE1 3.29Å; K120-E124 WeakPolarHBondContact CE-OE1 3.49Å; K120-E124 WeakPolarHBondContact O-CG 3.48Å; K120-E124 PolarHBondContact O-N 3.13Å; K120-P214 HydrophobicContact CG-CB 4.34Å; K120-E215 IonicContact NZ-OE1 2.76Å
121	N	88.4	Confident	86.9	Confident	74 Å²	74	49.6 Å²	49.6	40%	0.396	23%	0.232	S	C	.	.	H	α-helix	trans	-62.6	-39.4	178.1	-66.6	-14.3	0	0	0	112.5	K117 L118 L123 L125 L273	K117-N121 WeakPolarHBondContact O-CB 2.9Å; K117-N121 PolarHBondContact O-N 3.44Å; K117-N121 PolarHBondContact O-ND2 3.44Å; K117-N121 PolarHBondContact O-OD1 3.45Å; L118-N121 PolarHBondContact O-N 2.91Å; N121-L123 VanDerWaalsContact C-N 3.33Å; N121-L125 VanDerWaalsContact O-CG 3.31Å; N121-L125 WeakPolarHBondContact O-CG 3.37Å; N121-L125 PolarHBondContact O-N 2.85Å; N121-L273 HydrophobicContact CB-CD1 4.5Å
122	L	87.4	Confident	86.5	Confident	14 Å²	14	48.9 Å²	48.9	7%	0.073	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-45	176.3	-175.9	98.5	0	0	0	110.4	L118 R119 K120 L125 I126 L273 Y274 L277	L118-L122 WeakPolarHBondContact O-CB 3.45Å; L118-L122 PolarHBondContact O-N 3.28Å; R119-L122 PolarHBondContact O-N 3.36Å; K120-L122 VanDerWaalsContact C-N 3.34Å; K120-L122 PolarHBondContact O-N 2.94Å; L122-L125 PolarHBondContact O-N 3.49Å; L122-I126 HydrophobicContact CD2-CD1 3.79Å; L122-I126 HydrophobicContact CG-CD1 3.84Å; L122-I126 VanDerWaalsContact O-CG1 3.3Å; L122-I126 WeakPolarHBondContact O-CG1 3.31Å; L122-I126 PolarHBondContact O-N 3.31Å; L122-L273 HydrophobicContact CD1-CB 3.73Å; L122-Y274 HydrophobicContact CD1-CD1 4.05Å; L122-Y274 HydrophobicContact CD1-CD2 4.07Å; L122-Y274 HydrophobicContact CD1-CE1 4.09Å; L122-Y274 HydrophobicContact CD1-CE2 4.12Å; L122-Y274 HydrophobicContact CD1-CG 4.03Å; L122-Y274 HydrophobicContact CD2-CD1 4.31Å; L122-Y274 HydrophobicContact CD2-CE1 3.71Å; L122-Y274 HydrophobicContact CG-CE1 4.48Å; L122-L277 HydrophobicContact CD2-CD2 4.41Å
123	L	85.2	Confident	86.2	Confident	18 Å²	18	53.6 Å²	53.6	9%	0.094	24%	0.242	C	C	.	.	H	α-helix	trans	-64.3	-44.6	-178.7	-161.4	129.9	0	0	0	111.9	R119 K120 N121 L125 I126 E127 E212 P214	R119-L123 WeakPolarHBondContact O-CB 3.44Å; R119-L123 PolarHBondContact O-N 2.8Å; K120-L123 PolarHBondContact O-N 3.44Å; N121-L123 VanDerWaalsContact C-N 3.33Å; L123-L125 VanDerWaalsContact C-N 3.27Å; L123-L125 PolarHBondContact O-N 3.48Å; L123-I126 PolarHBondContact O-N 3.4Å; L123-I126 VanDerWaalsContact O-N 3.16Å; L123-E127 HydrophobicContact CD2-CG 4.19Å; L123-E127 WeakPolarHBondContact CD2-OE1 3.43Å; L123-E127 WeakPolarHBondContact O-CG 3.35Å; L123-E127 PolarHBondContact O-N 3.12Å; L123-E212 HydrophobicContact CD1-CB 4.37Å; L123-E212 WeakPolarHBondContact CD1-O 3.42Å; L123-P214 HydrophobicContact CD2-CB 4.07Å; L123-P214 HydrophobicContact CD2-CG 3.97Å
124	E	85.7	Confident	85.7	Confident	68 Å²	68	49 Å²	49	32%	0.318	23%	0.225	S	C	.	.	H	α-helix	trans	-57.2	-38.8	174.4	-71.1	173.1	-174.1	0	0	112.2	K120 Y128 Y250	K120-E124 VanDerWaalsContact CE-OE1 3.29Å; K120-E124 WeakPolarHBondContact CE-OE1 3.49Å; K120-E124 WeakPolarHBondContact O-CG 3.48Å; K120-E124 PolarHBondContact O-N 3.13Å; E124-Y128 WeakPolarHBondContact O-CB 3.26Å; E124-Y128 PolarHBondContact O-N 3.01Å; E124-Y128 VanDerWaalsContact O-N 3.09Å; E124-Y250 PolarHBondContact O-OH 3.21Å
125	L	86.9	Confident	85	Confident	27 Å²	27	45.2 Å²	45.2	14%	0.141	20%	0.204	C	C	.	.	H	α-helix	trans	-73.5	-36.5	177.5	-66	171.9	0	0	0	112.9	N121 L122 L123 Y128 T129 L266 R269 I270 L273	N121-L125 VanDerWaalsContact O-CG 3.31Å; N121-L125 WeakPolarHBondContact O-CG 3.37Å; N121-L125 PolarHBondContact O-N 2.85Å; L122-L125 PolarHBondContact O-N 3.49Å; L123-L125 VanDerWaalsContact C-N 3.27Å; L123-L125 PolarHBondContact O-N 3.48Å; L125-Y128 PolarHBondContact O-N 2.95Å; L125-T129 PolarHBondContact O-N 3.24Å; L125-T129 PolarHBondContact O-OG1 2.83Å; L125-L266 HydrophobicContact CD2-CD2 3.58Å; L125-R269 HydrophobicContact CD1-CG 4Å; L125-I270 HydrophobicContact CB-CD1 4.09Å; L125-I270 HydrophobicContact CB-CG1 3.74Å; L125-I270 HydrophobicContact CD1-CG1 4.37Å; L125-L273 HydrophobicContact CD1-CD1 3.41Å; L125-L273 VanDerWaalsContact CD1-CD1 3.41Å
126	I	85	Confident	84.2	Confident	26 Å²	26	46.1 Å²	46.1	13%	0.133	21%	0.209	C	C	.	.	H	α-helix	trans	-63.1	-51.2	174.8	-72.6	167.3	0	0	0	109.2	L122 L123 Y128 T129 H130 L211 I270 Y274	L122-I126 HydrophobicContact CD2-CD1 3.79Å; L122-I126 HydrophobicContact CG-CD1 3.84Å; L122-I126 VanDerWaalsContact O-CG1 3.3Å; L122-I126 WeakPolarHBondContact O-CG1 3.31Å; L122-I126 PolarHBondContact O-N 3.31Å; L123-I126 PolarHBondContact O-N 3.4Å; L123-I126 VanDerWaalsContact O-N 3.16Å; I126-Y128 VanDerWaalsContact C-N 3.28Å; I126-Y128 PolarHBondContact O-N 3.31Å; I126-T129 WeakPolarHBondContact O-CB 3.13Å; I126-T129 PolarHBondContact O-N 3.2Å; I126-H130 VanDerWaalsContact CG2-CD2 3.44Å; I126-H130 WeakPolarHBondContact CG2-CD2 3.32Å; I126-H130 PolarHBondContact O-CD2 3.04Å; I126-H130 PolarHBondContact O-N 3.39Å; I126-L211 HydrophobicContact CG2-CD2 3.92Å; I126-I270 HydrophobicContact CG1-CD1 4.36Å; I126-Y274 WeakPolarHBondContact CD1-OH 3.43Å
127	E	84.4	Confident	83.3	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-51.1	-47.9	174.3	-76.4	178.9	-178.4	0	0	111.9	L123 T129 H130 M131 L179 L211 H248 Y250	L123-E127 HydrophobicContact CD2-CG 4.19Å; L123-E127 WeakPolarHBondContact CD2-OE1 3.43Å; L123-E127 WeakPolarHBondContact O-CG 3.35Å; L123-E127 PolarHBondContact O-N 3.12Å; E127-T129 VanDerWaalsContact C-N 3.32Å; E127-T129 PolarHBondContact O-N 3.4Å; E127-H130 PolarHBondContact O-N 3.23Å; E127-M131 WeakPolarHBondContact O-CB 3.43Å; E127-M131 PolarHBondContact O-N 2.99Å; E127-L179 HydrophobicContact CB-CD1 4.02Å; E127-L179 HydrophobicContact CB-CD2 4.38Å; E127-L179 HydrophobicContact CG-CD2 4.3Å; E127-L211 HydrophobicContact CG-CD1 3.91Å; E127-H248 IonicContact OE2-CG 3.99Å; E127-H248 IonicContact OE2-ND1 3.12Å; E127-Y250 HydrophobicContact CB-CE2 4.1Å; E127-Y250 PolarHBondContact OE2-OH 2.69Å
128	Y	86.3	Confident	82.4	Confident	25 Å²	25	40.1 Å²	40.1	10%	0.098	19%	0.188	C	C	.	.	H	α-helix	trans	-64.1	-38.1	-179.8	-173.1	-148.9	0	0	0	112.3	E124 L125 I126 M131 L132 Y250 P251 I262 L266	E124-Y128 WeakPolarHBondContact O-CB 3.26Å; E124-Y128 PolarHBondContact O-N 3.01Å; E124-Y128 VanDerWaalsContact O-N 3.09Å; L125-Y128 PolarHBondContact O-N 2.95Å; I126-Y128 VanDerWaalsContact C-N 3.28Å; I126-Y128 PolarHBondContact O-N 3.31Å; Y128-M131 HydrophobicContact CD2-CE 3.63Å; Y128-M131 HydrophobicContact CD2-SD 4.18Å; Y128-M131 HydrophobicContact CE2-CE 3.51Å; Y128-M131 HydrophobicContact CE2-SD 4.43Å; Y128-M131 WeakPolarHBondContact O-CB 3.23Å; Y128-M131 PolarHBondContact O-N 3.3Å; Y128-L132 HydrophobicContact CD2-CD1 4.45Å; Y128-L132 HydrophobicContact CD2-CG 4.27Å; Y128-L132 HydrophobicContact CE1-CD1 4.43Å; Y128-L132 HydrophobicContact CE2-CD1 4.12Å; Y128-L132 HydrophobicContact CE2-CD2 4.2Å; Y128-L132 HydrophobicContact CE2-CG 4.01Å; Y128-L132 WeakPolarHBondContact O-CG 3.48Å; Y128-L132 PolarHBondContact O-N 3.25Å; Y128-Y250 VanDerWaalsContact CD2-CB 3.42Å; Y128-Y250 HydrophobicContact CD2-CD1 4.01Å; Y128-Y250 HydrophobicContact CD2-CD2 4.21Å; Y128-Y250 AromaticContact CD2-CG 3.62Å; Y128-Y250 HydrophobicContact CD2-CG 3.62Å; Y128-Y250 HydrophobicContact CE2-CG 4.25Å; Y128-Y250 HydrophobicContact CG-CD1 4.01Å; Y128-Y250 HydrophobicContact CG-CG 4.07Å; Y128-P251 PolarHBondContact OH-O 3.2Å; Y128-I262 HydrophobicContact CE1-CG2 3.92Å; Y128-L266 HydrophobicContact CD1-CD1 3.29Å; Y128-L266 HydrophobicContact CD1-CD2 3.66Å; Y128-L266 HydrophobicContact CD1-CG 4.08Å; Y128-L266 HydrophobicContact CE1-CD1 3.59Å; Y128-L266 HydrophobicContact CE1-CD2 4.13Å; Y128-L266 HydrophobicContact CE1-CG 4.34Å; Y128-L266 HydrophobicContact CG-CD1 4Å
129	T	85.3	Confident	81.2	Confident	6 Å²	6	40.8 Å²	40.8	4%	0.037	19%	0.193	C	C	.	.	H	α-helix	trans	-66.2	-44.3	176.8	-57.2	0	0	0	0	111.8	L125 I126 E127 M131 L132 R133 I270	L125-T129 PolarHBondContact O-N 3.24Å; L125-T129 PolarHBondContact O-OG1 2.83Å; I126-T129 WeakPolarHBondContact O-CB 3.13Å; I126-T129 PolarHBondContact O-N 3.2Å; E127-T129 VanDerWaalsContact C-N 3.32Å; E127-T129 PolarHBondContact O-N 3.4Å; T129-M131 VanDerWaalsContact C-N 3.35Å; T129-L132 PolarHBondContact O-N 3.12Å; T129-R133 PolarHBondContact O-N 3.32Å; T129-I270 WeakPolarHBondContact OG1-CD1 3.39Å
130	H	81.3	Confident	79.9	Confident	20 Å²	20	40.9 Å²	40.9	9%	0.093	20%	0.197	C	C	.	.	H	α-helix	trans	-63.7	-41.3	175.2	-77.2	-73.8	0	0	0	111.8	I126 E127 L132 R133 V134 L207 E209	I126-H130 VanDerWaalsContact CG2-CD2 3.44Å; I126-H130 WeakPolarHBondContact CG2-CD2 3.32Å; I126-H130 PolarHBondContact O-CD2 3.04Å; I126-H130 PolarHBondContact O-N 3.39Å; E127-H130 PolarHBondContact O-N 3.23Å; H130-L132 PolarHBondContact O-N 3.34Å; H130-R133 PolarHBondContact O-N 3.5Å; H130-V134 WeakPolarHBondContact O-CG2 3.47Å; H130-V134 PolarHBondContact O-N 3.3Å; H130-L207 HydrophobicContact CB-CD1 3.8Å; H130-L207 HydrophobicContact CB-CD2 4.28Å; H130-E209 IonicContact CE1-OE1 3.93Å; H130-E209 IonicContact CE1-OE2 2.73Å; H130-E209 PolarHBondContact CE1-OE2 3.39Å; H130-E209 IonicContact NE2-OE2 3.78Å
131	M	84.1	Confident	78.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.5	-47.3	175.3	-173.4	-141.9	72.1	0	0	111.6	E127 Y128 T129 R133 V134 T135 S177 L179 V224 Y250	E127-M131 WeakPolarHBondContact O-CB 3.43Å; E127-M131 PolarHBondContact O-N 2.99Å; Y128-M131 HydrophobicContact CD2-CE 3.63Å; Y128-M131 HydrophobicContact CD2-SD 4.18Å; Y128-M131 HydrophobicContact CE2-CE 3.51Å; Y128-M131 HydrophobicContact CE2-SD 4.43Å; Y128-M131 WeakPolarHBondContact O-CB 3.23Å; Y128-M131 PolarHBondContact O-N 3.3Å; T129-M131 VanDerWaalsContact C-N 3.35Å; M131-R133 VanDerWaalsContact C-N 3.33Å; M131-R133 PolarHBondContact O-N 2.92Å; M131-V134 PolarHBondContact O-N 3.19Å; M131-T135 HydrophobicContact CG-CG2 4.37Å; M131-T135 WeakPolarHBondContact O-CB 3.42Å; M131-T135 WeakPolarHBondContact O-CG2 3.29Å; M131-T135 PolarHBondContact O-N 2.72Å; M131-T135 PolarHBondContact O-OG1 3.35Å; M131-S177 WeakPolarHBondContact CE-OG 3.41Å; M131-S177 WeakPolarHBondContact SD-CB 3.4Å; M131-S177 PolarHBondContact SD-OG 2.81Å; M131-L179 HydrophobicContact CB-CD1 4.34Å; M131-V224 HydrophobicContact CB-CG1 4.32Å; M131-V224 HydrophobicContact CG-CG1 3.75Å; M131-Y250 HydrophobicContact SD-CD2 4.1Å; M131-Y250 HydrophobicContact SD-CG 4.4Å
132	L	81.4	Confident	76.6	Confident	6 Å²	6	48.1 Å²	48.1	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-38.9	176.8	-72.1	175	0	0	0	112.3	Y128 T129 H130 T135 Q136 I262 L266	Y128-L132 HydrophobicContact CD2-CD1 4.45Å; Y128-L132 HydrophobicContact CD2-CG 4.27Å; Y128-L132 HydrophobicContact CE1-CD1 4.43Å; Y128-L132 HydrophobicContact CE2-CD1 4.12Å; Y128-L132 HydrophobicContact CE2-CD2 4.2Å; Y128-L132 HydrophobicContact CE2-CG 4.01Å; Y128-L132 WeakPolarHBondContact O-CG 3.48Å; Y128-L132 PolarHBondContact O-N 3.25Å; T129-L132 PolarHBondContact O-N 3.12Å; H130-L132 PolarHBondContact O-N 3.34Å; L132-T135 WeakPolarHBondContact CA-OG1 3.43Å; L132-T135 PolarHBondContact O-OG1 3.06Å; L132-Q136 PolarHBondContact O-N 2.97Å; L132-Q136 VanDerWaalsContact O-N 3.16Å; L132-I262 HydrophobicContact CD1-CG2 4Å; L132-L266 HydrophobicContact CD1-CD1 3.79Å
133	R	82.1	Confident	74.5	Confident	119 Å²	119	53 Å²	53	45%	0.449	26%	0.256	S	S	.	.	H	α-helix	trans	-64.4	-47.8	177.8	-171.9	-176.2	-65.9	162.3	2.1	112	T129 H130 M131 Q136	T129-R133 PolarHBondContact O-N 3.32Å; H130-R133 PolarHBondContact O-N 3.5Å; M131-R133 VanDerWaalsContact C-N 3.33Å; M131-R133 PolarHBondContact O-N 2.92Å; R133-Q136 WeakPolarHBondContact O-CB 3.29Å; R133-Q136 PolarHBondContact O-N 3.45Å
134	V	79.6	Confident	72.2	Confident	25 Å²	25	59.6 Å²	59.6	15%	0.152	29%	0.286	C	S	.	.	H	α-helix	trans	-70.7	-41	-178.4	174.7	0	0	0	0	111.2	H130 M131 Q136 T137 F138 A205 L207 V224	H130-V134 WeakPolarHBondContact O-CG2 3.47Å; H130-V134 PolarHBondContact O-N 3.3Å; M131-V134 PolarHBondContact O-N 3.19Å; V134-Q136 VanDerWaalsContact C-N 3.26Å; V134-Q136 PolarHBondContact O-N 3.02Å; V134-T137 WeakPolarHBondContact O-CB 3.15Å; V134-T137 PolarHBondContact O-N 3.4Å; V134-F138 HydrophobicContact CG1-CE2 3.92Å; V134-F138 HydrophobicContact CG1-CZ 4.06Å; V134-F138 PolarHBondContact O-N 2.97Å; V134-A205 HydrophobicContact CG1-CB 3.66Å; V134-L207 HydrophobicContact CG2-CD1 3.97Å; V134-V224 HydrophobicContact CB-CB 4.41Å; V134-V224 HydrophobicContact CB-CG1 4.4Å; V134-V224 HydrophobicContact CB-CG2 4.38Å; V134-V224 HydrophobicContact CG1-CB 4.1Å; V134-V224 HydrophobicContact CG1-CG1 4.32Å; V134-V224 HydrophobicContact CG1-CG2 4.49Å; V134-V224 HydrophobicContact CG2-CG2 4.48Å
135	T	74.1	Confident	69.9	Low	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.7	-27.2	177.9	53.7	0	0	0	0	113.4	M131 L132 T137 F138 V139 V224 L226 Y252	M131-T135 HydrophobicContact CG-CG2 4.37Å; M131-T135 WeakPolarHBondContact O-CB 3.42Å; M131-T135 WeakPolarHBondContact O-CG2 3.29Å; M131-T135 PolarHBondContact O-N 2.72Å; M131-T135 PolarHBondContact O-OG1 3.35Å; L132-T135 WeakPolarHBondContact CA-OG1 3.43Å; L132-T135 PolarHBondContact O-OG1 3.06Å; T135-T137 PolarHBondContact O-N 3.46Å; T135-F138 HydrophobicContact CG2-CD2 4.29Å; T135-F138 PolarHBondContact O-N 3.42Å; T135-V139 PolarHBondContact O-N 3.34Å; T135-V224 HydrophobicContact CG2-CG1 4.06Å; T135-L226 HydrophobicContact CG2-CB 4.32Å; T135-L226 HydrophobicContact CG2-CD1 4.49Å; T135-Y252 HydrophobicContact CG2-CE2 4.46Å
136	Q	72.1	Confident	67.1	Low	66 Å²	66	72.4 Å²	72.4	31%	0.308	34%	0.343	S	S	.	.	H	α-helix	trans	-59.2	-37.1	171.2	-167.9	180	15.2	0	0	112.1	L132 R133 V134 K140	L132-Q136 PolarHBondContact O-N 2.97Å; L132-Q136 VanDerWaalsContact O-N 3.16Å; R133-Q136 WeakPolarHBondContact O-CB 3.29Å; R133-Q136 PolarHBondContact O-N 3.45Å; V134-Q136 VanDerWaalsContact C-N 3.26Å; V134-Q136 PolarHBondContact O-N 3.02Å; Q136-K140 WeakPolarHBondContact O-CG 3.37Å; Q136-K140 PolarHBondContact O-N 3.32Å; Q136-K140 VanDerWaalsContact O-N 3.11Å
137	T	68.6	Low	65	Low	81 Å²	81	76.7 Å²	76.7	50%	0.497	37%	0.372	S	S	.	.	H	α-helix	trans	-67.7	-40	177.9	-50.9	0	0	0	0	111.5	V134 T135 V139 K140 R141	V134-T137 WeakPolarHBondContact O-CB 3.15Å; V134-T137 PolarHBondContact O-N 3.4Å; T135-T137 PolarHBondContact O-N 3.46Å; T137-V139 PolarHBondContact O-N 2.97Å; T137-K140 PolarHBondContact O-N 3.47Å; T137-R141 WeakPolarHBondContact O-CB 3.33Å; T137-R141 PolarHBondContact O-N 3.4Å
138	F	68.7	Low	62.4	Low	31 Å²	31	82.7 Å²	82.7	14%	0.136	41%	0.409	C	S	.	.	H	α-helix	trans	-62.5	-42.1	176.4	-62.8	-47.2	0	0	0	112.9	V134 T135 R141 N142 Y204 A205 L226	V134-F138 HydrophobicContact CG1-CE2 3.92Å; V134-F138 HydrophobicContact CG1-CZ 4.06Å; V134-F138 PolarHBondContact O-N 2.97Å; T135-F138 HydrophobicContact CG2-CD2 4.29Å; T135-F138 PolarHBondContact O-N 3.42Å; F138-R141 PolarHBondContact O-N 3.38Å; F138-N142 PolarHBondContact O-N 2.84Å; F138-Y204 VanDerWaalsContact CZ-C 3.43Å; F138-A205 HydrophobicContact CE1-CB 3.75Å; F138-A205 HydrophobicContact CE2-CB 4.27Å; F138-A205 HydrophobicContact CZ-CB 3.25Å; F138-L226 HydrophobicContact CB-CD2 4.42Å; F138-L226 HydrophobicContact CD2-CB 4.26Å
139	V	65.1	Low	59.8	Low	48 Å²	48	91.7 Å²	91.7	29%	0.291	44%	0.444	S	S	.	.	H	α-helix	trans	-69.1	-40	179.8	177.4	0	0	0	0	111.2	T135 T137 N142 V143 Y252	T135-V139 PolarHBondContact O-N 3.34Å; T137-V139 PolarHBondContact O-N 2.97Å; V139-N142 PolarHBondContact O-N 2.8Å; V139-V143 WeakPolarHBondContact O-CG2 3.38Å; V139-Y252 WeakPolarHBondContact CG2-OH 3.5Å
140	K	59.6	Low	57.4	Low	122 Å²	122	99.6 Å²	99.6	53%	0.53	48%	0.481	S	S	.	.	H	α-helix	trans	-63.4	-43.3	175.5	-75.7	-177.8	178.6	-178.6	0	112.2	Q136 T137 N142 V143 E144	Q136-K140 WeakPolarHBondContact O-CG 3.37Å; Q136-K140 PolarHBondContact O-N 3.32Å; Q136-K140 VanDerWaalsContact O-N 3.11Å; T137-K140 PolarHBondContact O-N 3.47Å; K140-N142 PolarHBondContact O-N 3.26Å; K140-V143 PolarHBondContact O-N 2.87Å; K140-E144 PolarHBondContact O-N 2.9Å
141	R	53.7	Low	54.9	Low	183 Å²	183	105.9 Å²	105.9	69%	0.691	51%	0.51	S	S	*	.	H	α-helix	trans	-63.2	-28.4	-178.5	-155.6	175.2	-170.1	136.8	1.1	113.4	T137 F138	T137-R141 WeakPolarHBondContact O-CB 3.33Å; T137-R141 PolarHBondContact O-N 3.4Å; F138-R141 PolarHBondContact O-N 3.38Å
142	N	51.5	Low	52.2	Low	126 Å²	126	114.3 Å²	114.3	67%	0.674	55%	0.547	S	S	*	.	H	α-helix	trans	-81.3	-16.1	175.8	-75.4	-13.9	0	0	0	114	F138 V139 K140	F138-N142 PolarHBondContact O-N 2.84Å; V139-N142 PolarHBondContact O-N 2.8Å; K140-N142 PolarHBondContact O-N 3.26Å
143	V	44	Very low	50	Low	115 Å²	115	119.5 Å²	119.5	70%	0.697	58%	0.582	S	S	*	*	H	α-helix	trans	-89.6	-21.9	178.2	176.4	0	0	0	0	111.8	V139 K140 F145	V139-V143 WeakPolarHBondContact O-CG2 3.38Å; K140-V143 PolarHBondContact O-N 2.87Å; V143-F145 VanDerWaalsContact C-N 3.35Å; V143-F145 PolarHBondContact O-N 2.87Å
144	E	36.3	Very low	47.9	Very low	157 Å²	157	119.4 Å²	119.4	73%	0.734	60%	0.599	S	S	*	*	S	Bend	trans	-82.3	-3.3	-178.9	-72.6	174.2	173.5	0	0	114.7	K140 E146	K140-E144 PolarHBondContact O-N 2.9Å; E144-E146 PolarHBondContact O-N 3.45Å
145	F	37	Very low	45.6	Very low	189 Å²	189	125.6 Å²	125.6	83%	0.829	63%	0.63	S	S	*	*			trans	-96.9	64	177.2	-109.1	-88.5	0	0	0	112.2	V143	V143-F145 VanDerWaalsContact C-N 3.35Å; V143-F145 PolarHBondContact O-N 2.87Å
146	E	28.7	Very low	43.6	Very low	176 Å²	176	133.7 Å²	133.7	82%	0.822	67%	0.668	S	S	*	*			trans	-99.8	122.4	152	-105.9	-176.8	161.7	0	0	107.7	E144	E144-E146 PolarHBondContact O-N 3.45Å
147	P	41.5	Very low	41.6	Very low	116 Å²	116	135.4 Å²	135.4	75%	0.753	69%	0.688	S	S	*	*			trans	-84.5	137.4	-171.5	33.3	-31.7	0	0	0	111.5
148	T	28.9	Very low	39.6	Very low	125 Å²	125	139.1 Å²	139.1	77%	0.767	70%	0.704	S	S	*	*			trans	-128	100.4	168.3	-55.4	0	0	0	0	108.9
149	Y	32.4	Very low	38.1	Very low	215 Å²	215	142.8 Å²	142.8	84%	0.843	73%	0.734	S	S	*	*			trans	46	144.6	154.7	-61.4	-85	0	0	0	120.7
150	E	33.9	Very low	37	Very low	172 Å²	172	148.1 Å²	148.1	80%	0.804	76%	0.76	S	S	*	*			cis	-155.5	142.5	49	-75.6	175.9	150.6	0	0	115
151	E	29.9	Very low	35.9	Very low	152 Å²	152	150.5 Å²	150.5	71%	0.71	78%	0.777	S	S	*	*			trans	58	129.4	139.8	-71.6	-172.8	165.1	0	0	122
152	F	27.3	Very low	35	Very low	176 Å²	176	146.9 Å²	146.9	77%	0.772	77%	0.772	S	S	*	*			cis	-164.7	-179.2	20.6	-97.1	-75.2	0	0	0	108.5
153	P	35.7	Very low	34.5	Very low	116 Å²	116	152 Å²	152	75%	0.753	78%	0.783	S	S	*	*			cis	-122.7	165.1	-39.8	28.7	-8.9	0	0	0	113.5
154	S	37.8	Very low	34.4	Very low	116 Å²	116	150.5 Å²	150.5	81%	0.811	78%	0.778	S	S	*	*			trans	-74.8	136.9	177.1	51.4	0	0	0	0	115.1
155	L	31.3	Very low	34.4	Very low	156 Å²	156	146.5 Å²	146.5	82%	0.817	77%	0.767	S	S	*	*			trans	-145.3	100.7	155.3	-108.7	157.7	0	0	0	109.6
156	E	31	Very low	34.6	Very low	170 Å²	170	143.5 Å²	143.5	79%	0.794	76%	0.757	S	S	*	*			trans	47.6	120	146.3	-65.4	177.3	165.6	0	0	122
157	S	30.4	Very low	35.2	Very low	102 Å²	102	144.1 Å²	144.1	71%	0.713	76%	0.759	S	S	*	*			trans	58.8	102.3	140.9	62	0	0	0	0	120.3
158	D	26.8	Very low	35.2	Very low	158 Å²	158	149.6 Å²	149.6	85%	0.845	77%	0.765	S	S	*	*				-170.2	112.2	89.6	-101.4	-15.8	0	0	0	110.9
159	S	36.9	Very low	35.9	Very low	109 Å²	109	150.6 Å²	150.6	76%	0.762	77%	0.765	S	S	*	*			trans	-69.9	122.8	164.6	48	0	0	0	0	109.8
160	L	42.1	Very low	36.5	Very low	159 Å²	159	143.8 Å²	143.8	83%	0.832	76%	0.76	S	S	*	*			trans	-178.6	95.9	141.9	-98.3	173.1	0	0	0	109.5
161	L	37.7	Very low	37.3	Very low	172 Å²	172	138 Å²	138	90%	0.901	74%	0.741	S	S	*	*			trans	-169	99.8	140.8	-99	160.4	0	0	0	108.5	Y163	L161-Y163 PolarHBondContact O-N 2.87Å
162	D	33.6	Very low	38.7	Very low	107 Å²	107	139.2 Å²	139.2	57%	0.572	75%	0.745	S	S	*	*			trans	-52.4	114.7	178.6	-83.9	-44.9	0	0	0	113.8	S164 C165	D162-S164 PolarHBondContact O-N 3.13Å; D162-S164 PolarHBondContact OD1-OG 3.07Å; D162-C165 HydrophobicContact CB-CB 4.31Å
163	Y	42.5	Very low	40.8	Very low	234 Å²	234	134.1 Å²	134.1	92%	0.918	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-8.2	160	-94.6	-92.9	0	0	0	113	L161	L161-Y163 PolarHBondContact O-N 2.87Å
164	S	40.7	Very low	42.7	Very low	83 Å²	83	129.4 Å²	129.4	58%	0.58	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-8.4	-177	60.9	0	0	0	0	114.3	D162	D162-S164 PolarHBondContact O-N 3.13Å; D162-S164 PolarHBondContact OD1-OG 3.07Å
165	C	36.3	Very low	44.7	Very low	74 Å²	74	127 Å²	127	50%	0.5	67%	0.672	S	S	.	*	S	Bend	trans	-82.4	-17.9	-178.1	-104.1	0	0	0	0	114.8	D162	D162-C165 HydrophobicContact CB-CB 4.31Å
166	M	41.2	Very low	47.3	Very low	126 Å²	126	119.9 Å²	119.9	62%	0.621	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-84.2	-12.3	-172.4	-74.5	-169.5	71.2	0	0	115.3	R168	M166-R168 VanDerWaalsContact C-N 3.29Å; M166-R168 PolarHBondContact O-N 2.75Å
167	Q	40.9	Very low	49.8	Very low	188 Å²	188	111.8 Å²	111.8	88%	0.879	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-81.4	-8.5	177	-146.4	160.4	-1	0	0	113
168	R	41.3	Very low	52.5	Low	232 Å²	232	107 Å²	107	88%	0.875	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-87.2	-4.9	178.7	-79.4	-171.9	-177.2	175	3.1	115.3	M166	M166-R168 VanDerWaalsContact C-N 3.29Å; M166-R168 PolarHBondContact O-N 2.75Å
169	L	44.3	Very low	55.2	Low	146 Å²	146	99.4 Å²	99.4	76%	0.764	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-96.7	2.9	-177.2	-94.5	117.8	0	0	0	115.8	A171	L169-A171 PolarHBondContact O-N 2.96Å
170	G	44.2	Very low	57.7	Low	72 Å²	72	94.5 Å²	94.5	74%	0.742	49%	0.488	S	S	*	.			trans	59.3	17.2	177.4	0	0	0	0	0	114.6	K172	G170-K172 PolarHBondContact O-N 3.4Å
171	A	51.8	Low	59.7	Low	49 Å²	49	89 Å²	89	41%	0.405	46%	0.46	S	S	.	.			trans	-75	106.4	-178.9	0	0	0	0	0	109.5	L169 L173 W230	L169-A171 PolarHBondContact O-N 2.96Å; A171-L173 PolarHBondContact O-N 2.89Å; A171-W230 HydrophobicContact CB-CE3 4.35Å
172	K	59.9	Low	61.8	Low	179 Å²	179	85.6 Å²	85.6	78%	0.778	44%	0.439	S	S	*	.			trans	-64.5	127.5	171.6	-71.5	-179.4	177.3	178.3	0	109.5	G170	G170-K172 PolarHBondContact O-N 3.4Å
173	L	70.8	Confident	64.1	Low	68 Å²	68	83.9 Å²	83.9	36%	0.356	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	124.3	170	-172.8	70.1	0	0	0	108.6	A171 F175 W230	A171-L173 PolarHBondContact O-N 2.89Å; L173-F175 HydrophobicContact CD2-CE1 4.04Å; L173-F175 HydrophobicContact CD2-CE2 3.96Å; L173-F175 HydrophobicContact CD2-CZ 3.38Å; L173-F175 HydrophobicContact CG-CE1 4.47Å; L173-F175 HydrophobicContact CG-CE2 4.27Å; L173-F175 HydrophobicContact CG-CZ 4Å; L173-W230 HydrophobicContact CD1-CD2 3.94Å; L173-W230 HydrophobicContact CD1-CE3 4.36Å; L173-W230 HydrophobicContact CD1-CG 4.43Å; L173-W230 HydrophobicContact CD1-CH2 4.26Å; L173-W230 HydrophobicContact CD1-CZ2 3.81Å
174	G	74.9	Confident	66.1	Low	17 Å²	17	77 Å²	77	18%	0.175	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	141.8	176.8	0	0	0	0	0	111.3	S228 F229	G174-S228 WeakPolarHBondContact O-CA 3.47Å; G174-F229 PolarHBondContact N-O 3.31Å; G174-F229 WeakPolarHBondContact O-CD1 3.17Å; G174-F229 PolarHBondContact O-N 3.36Å
175	F	80.9	Confident	68.2	Low	66 Å²	66	74.1 Å²	74.1	29%	0.289	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	135.5	173.3	-60.5	-79	0	0	0	110.2	L173 L226 I227 Y252	L173-F175 HydrophobicContact CD2-CE1 4.04Å; L173-F175 HydrophobicContact CD2-CE2 3.96Å; L173-F175 HydrophobicContact CD2-CZ 3.38Å; L173-F175 HydrophobicContact CG-CE1 4.47Å; L173-F175 HydrophobicContact CG-CE2 4.27Å; L173-F175 HydrophobicContact CG-CZ 4Å; F175-L226 HydrophobicContact CB-CD1 4.31Å; F175-L226 HydrophobicContact CD1-CD1 4.26Å; F175-I227 WeakPolarHBondContact CA-O 3.37Å; F175-Y252 HydrophobicContact CB-CD1 3.59Å; F175-Y252 HydrophobicContact CB-CE1 4.37Å; F175-Y252 HydrophobicContact CB-CG 4.07Å; F175-Y252 HydrophobicContact CD2-CD1 4.04Å; F175-Y252 HydrophobicContact CD2-CE1 4.26Å; F175-Y252 AromaticContact CG-CD1 3.88Å; F175-Y252 HydrophobicContact CG-CD1 3.88Å; F175-Y252 HydrophobicContact CG-CE1 4.21Å
176	V	84.9	Confident	70.5	Confident	7 Å²	7	76.9 Å²	76.9	4%	0.042	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	125.3	167.7	162.8	0	0	0	0	107.3	F225 I227 F229 V238 K239 V249	V176-F225 HydrophobicContact CG1-CE2 4.45Å; V176-I227 PolarHBondContact N-O 2.75Å; V176-I227 PolarHBondContact O-N 2.95Å; V176-F229 HydrophobicContact CB-CE1 4.11Å; V176-F229 HydrophobicContact CG2-CE1 3.59Å; V176-F229 HydrophobicContact CG2-CZ 4.22Å; V176-V238 HydrophobicContact CB-CG1 4.43Å; V176-V238 HydrophobicContact CG1-CG1 4.34Å; V176-K239 HydrophobicContact CG2-CG 4.41Å; V176-V249 HydrophobicContact CG1-CG1 3.89Å
177	S	84.1	Confident	72.8	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	146.9	176.5	51.4	0	0	0	0	110.3	M131 F225 Y250	M131-S177 WeakPolarHBondContact CE-OG 3.41Å; M131-S177 WeakPolarHBondContact SD-CB 3.4Å; M131-S177 PolarHBondContact SD-OG 2.81Å; S177-F225 VanDerWaalsContact CA-O 3.25Å; S177-F225 WeakPolarHBondContact CA-O 3.29Å; S177-Y250 PolarHBondContact O-N 3.09Å; S177-Y250 PolarHBondContact OG-O 3.2Å
178	G	86	Confident	75.1	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	178.4	177.1	0	0	0	0	0	113	F225 H248	G178-F225 VanDerWaalsContact C-CE1 3.41Å; G178-F225 PolarHBondContact N-O 2.88Å; G178-F225 VanDerWaalsContact N-O 3.11Å; G178-F225 WeakPolarHBondContact O-CD1 3.42Å; G178-F225 WeakPolarHBondContact O-CE1 3.23Å; G178-F225 PolarHBondContact O-N 3.34Å; G178-H248 CarbonylContact C-O 3.54Å; G178-H248 WeakPolarHBondContact CA-O 3.32Å
179	L	85.5	Confident	77.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	145.4	176	-62.8	93.6	0	0	0	111	E127 M131 W222 Y223 V224 C247 H248 Y250	E127-L179 HydrophobicContact CB-CD1 4.02Å; E127-L179 HydrophobicContact CB-CD2 4.38Å; E127-L179 HydrophobicContact CG-CD2 4.3Å; M131-L179 HydrophobicContact CB-CD1 4.34Å; L179-W222 HydrophobicContact CB-CE3 3.86Å; L179-W222 HydrophobicContact CB-CZ3 4.38Å; L179-W222 HydrophobicContact CD2-CB 4.03Å; L179-W222 HydrophobicContact CD2-CG 4.47Å; L179-Y223 CarbonylContact C-O 3.58Å; L179-Y223 WeakPolarHBondContact CA-O 3.47Å; L179-V224 HydrophobicContact CD2-CG2 4.28Å; L179-V224 HydrophobicContact CG-CG2 4.26Å; L179-C247 WeakPolarHBondContact O-CA 3.37Å; L179-C247 WeakPolarHBondContact O-CB 3.41Å; L179-H248 PolarHBondContact N-O 2.87Å; L179-H248 PolarHBondContact O-N 3.23Å; L179-Y250 HydrophobicContact CD1-CD2 4Å; L179-Y250 HydrophobicContact CD1-CE2 3.63Å
180	I	87.8	Confident	79.1	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.026	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	143.8	177.2	-170.9	169.1	0	0	0	110.6	K184 V185 F188 Y223 F225	I180-K184 HydrophobicContact CD1-CB 4.1Å; I180-K184 HydrophobicContact CG1-CB 4.14Å; I180-V185 HydrophobicContact CG2-CG2 3.86Å; I180-F188 HydrophobicContact CD1-CB 3.45Å; I180-F188 VanDerWaalsContact CD1-CB 3.45Å; I180-F188 HydrophobicContact CD1-CD1 3.97Å; I180-F188 HydrophobicContact CD1-CD2 4.01Å; I180-F188 HydrophobicContact CD1-CG 3.55Å; I180-Y223 PolarHBondContact N-O 3.24Å; I180-Y223 PolarHBondContact O-N 2.69Å; I180-F225 HydrophobicContact CB-CD1 4.12Å; I180-F225 HydrophobicContact CB-CE1 4.1Å; I180-F225 HydrophobicContact CG2-CD1 3.84Å; I180-F225 HydrophobicContact CG2-CE1 4.34Å
181	N	83.9	Confident	81.1	Confident	43 Å²	43	56.3 Å²	56.3	23%	0.23	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	138.2	175	-177.7	-27.1	0	0	0	110.8	G183 K184 W222	N181-G183 PolarHBondContact O-N 3.46Å; N181-G183 VanDerWaalsContact O-N 3.12Å; N181-G183 PolarHBondContact OD1-N 2.95Å; N181-K184 PolarHBondContact O-N 3.35Å; N181-W222 HydrophobicContact CB-CZ3 4.46Å
182	Q	82	Confident	82.7	Confident	101 Å²	101	54 Å²	54	47%	0.472	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-43.5	-45.2	179.1	-175.2	173.6	18.2	0	0	113.9	K184 V185 Y223	Q182-K184 PolarHBondContact O-N 2.99Å; Q182-K184 VanDerWaalsContact O-N 3.14Å; Q182-V185 WeakPolarHBondContact O-CG2 3.4Å; Q182-V185 PolarHBondContact O-N 3.03Å; Q182-Y223 HydrophobicContact CB-CD2 4.06Å; Q182-Y223 HydrophobicContact CB-CE2 3.71Å; Q182-Y223 HydrophobicContact CG-CD2 4.42Å; Q182-Y223 HydrophobicContact CG-CE2 3.65Å
183	G	82.2	Confident	83.8	Confident	72 Å²	72	54.3 Å²	54.3	74%	0.742	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-65.4	-18.6	-176.5	0	0	0	0	0	114.7	N181	N181-G183 PolarHBondContact O-N 3.46Å; N181-G183 VanDerWaalsContact O-N 3.12Å; N181-G183 PolarHBondContact OD1-N 2.95Å
184	K	85.2	Confident	84.5	Confident	89 Å²	89	59.8 Å²	59.8	39%	0.387	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-104.2	-7.3	-175.9	-62	-179.5	-176.3	174.2	0	113.6	I180 N181 Q182 E186 A187 F188 Y245	I180-K184 HydrophobicContact CD1-CB 4.1Å; I180-K184 HydrophobicContact CG1-CB 4.14Å; N181-K184 PolarHBondContact O-N 3.35Å; Q182-K184 PolarHBondContact O-N 2.99Å; Q182-K184 VanDerWaalsContact O-N 3.14Å; K184-E186 PolarHBondContact O-N 2.79Å; K184-A187 PolarHBondContact O-N 3.42Å; K184-F188 WeakPolarHBondContact O-CB 3.35Å; K184-F188 PolarHBondContact O-N 2.86Å; K184-Y245 HydrophobicContact CB-CD1 4.37Å; K184-Y245 PolarHBondContact NZ-O 3.3Å
185	V	84.6	Confident	85	Confident	22 Å²	22	61.6 Å²	61.6	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-51.1	-172.7	178.1	0	0	0	0	112	I180 Q182 A187 F188 E189 Y223	I180-V185 HydrophobicContact CG2-CG2 3.86Å; Q182-V185 WeakPolarHBondContact O-CG2 3.4Å; Q182-V185 PolarHBondContact O-N 3.03Å; V185-A187 VanDerWaalsContact C-N 3.34Å; V185-A187 PolarHBondContact O-N 3.25Å; V185-F188 WeakPolarHBondContact O-CB 3.39Å; V185-F188 PolarHBondContact O-N 2.83Å; V185-E189 PolarHBondContact O-N 3.03Å; V185-Y223 HydrophobicContact CG2-CD2 3.97Å; V185-Y223 HydrophobicContact CG2-CG 4.03Å
186	E	85.3	Confident	84.8	Confident	133 Å²	133	58.7 Å²	58.7	62%	0.621	29%	0.291	S	S	*	.	H	α-helix	trans	-64.9	-38.4	-176.6	-66.1	-167.6	-171.8	0	0	113	K184 K190	K184-E186 PolarHBondContact O-N 2.79Å; E186-K190 WeakPolarHBondContact O-CB 3.32Å; E186-K190 WeakPolarHBondContact O-CD 3.38Å; E186-K190 VanDerWaalsContact O-CG 3.23Å; E186-K190 WeakPolarHBondContact O-CG 3.43Å; E186-K190 PolarHBondContact O-N 3.05Å; E186-K190 VanDerWaalsContact O-N 3.13Å; E186-K190 IonicContact OE2-NZ 3.95Å; E186-K190 PolarHBondContact OE2-NZ 3.13Å; E186-K190 VanDerWaalsContact OE2-NZ 3.13Å
187	A	88.4	Confident	84.5	Confident	47 Å²	47	66.6 Å²	66.6	39%	0.388	33%	0.325	S	S	.	.	H	α-helix	trans	-68.1	-40.5	178.6	0	0	0	0	0	110.8	K184 V185 M191 Y245	K184-A187 PolarHBondContact O-N 3.42Å; V185-A187 VanDerWaalsContact C-N 3.34Å; V185-A187 PolarHBondContact O-N 3.25Å; A187-M191 WeakPolarHBondContact O-CB 3.32Å; A187-M191 PolarHBondContact O-N 3.2Å; A187-Y245 HydrophobicContact CB-CE1 3.98Å; A187-Y245 PolarHBondContact O-OH 2.88Å
188	F	88.4	Confident	83.8	Confident	6 Å²	6	69 Å²	69	3%	0.026	35%	0.349	C	S	.	.	H	α-helix	trans	-61.7	-47.8	176.3	178.4	-102.5	0	0	0	112.1	I180 K184 V185 M191 L192 F225 I227 I241 Y245	I180-F188 HydrophobicContact CD1-CB 3.45Å; I180-F188 VanDerWaalsContact CD1-CB 3.45Å; I180-F188 HydrophobicContact CD1-CD1 3.97Å; I180-F188 HydrophobicContact CD1-CD2 4.01Å; I180-F188 HydrophobicContact CD1-CG 3.55Å; K184-F188 WeakPolarHBondContact O-CB 3.35Å; K184-F188 PolarHBondContact O-N 2.86Å; V185-F188 WeakPolarHBondContact O-CB 3.39Å; V185-F188 PolarHBondContact O-N 2.83Å; F188-M191 PolarHBondContact O-N 2.93Å; F188-L192 PolarHBondContact O-N 2.78Å; F188-F225 HydrophobicContact CE1-CD1 4.48Å; F188-F225 HydrophobicContact CE1-CD2 4.47Å; F188-F225 HydrophobicContact CE1-CG 4.44Å; F188-F225 HydrophobicContact CZ-CE1 4.43Å; F188-F225 HydrophobicContact CZ-CE2 4.22Å; F188-F225 HydrophobicContact CZ-CZ 4.12Å; F188-I227 HydrophobicContact CE1-CD1 4.01Å; F188-I227 HydrophobicContact CZ-CD1 3.81Å; F188-I241 HydrophobicContact CD2-CG2 4.01Å; F188-I241 HydrophobicContact CE2-CG2 3.8Å; F188-Y245 HydrophobicContact CB-CD1 4.48Å; F188-Y245 HydrophobicContact CB-CG 4.48Å; F188-Y245 AromaticContact CD2-CD2 3.66Å; F188-Y245 HydrophobicContact CD2-CD2 3.66Å; F188-Y245 HydrophobicContact CD2-CE2 4.21Å; F188-Y245 AromaticContact CD2-CG 3.95Å; F188-Y245 HydrophobicContact CD2-CG 3.95Å; F188-Y245 HydrophobicContact CE2-CD2 4.45Å
189	E	84.6	Confident	83.3	Confident	91 Å²	91	76.1 Å²	76.1	43%	0.425	38%	0.377	S	S	.	.	H	α-helix	trans	-61.4	-47.7	177.9	-174	-178.5	-175.3	0	0	111.8	V185 M191 L192 W193	V185-E189 PolarHBondContact O-N 3.03Å; E189-M191 VanDerWaalsContact C-N 3.27Å; E189-M191 PolarHBondContact O-N 3.38Å; E189-L192 PolarHBondContact O-N 3.35Å; E189-W193 WeakPolarHBondContact O-CB 3.45Å; E189-W193 PolarHBondContact O-N 2.99Å
190	K	86.2	Confident	83	Confident	111 Å²	111	77 Å²	77	48%	0.483	38%	0.383	S	S	.	.	H	α-helix	trans	-59.3	-38.4	177.2	-71.8	166.5	-170.5	158.6	0	111.4	E186 R194	E186-K190 WeakPolarHBondContact O-CB 3.32Å; E186-K190 WeakPolarHBondContact O-CD 3.38Å; E186-K190 VanDerWaalsContact O-CG 3.23Å; E186-K190 WeakPolarHBondContact O-CG 3.43Å; E186-K190 PolarHBondContact O-N 3.05Å; E186-K190 VanDerWaalsContact O-N 3.13Å; E186-K190 IonicContact OE2-NZ 3.95Å; E186-K190 PolarHBondContact OE2-NZ 3.13Å; E186-K190 VanDerWaalsContact OE2-NZ 3.13Å; K190-R194 WeakPolarHBondContact O-CB 3.44Å; K190-R194 WeakPolarHBondContact O-CD 3.31Å; K190-R194 WeakPolarHBondContact O-CG 3.47Å; K190-R194 PolarHBondContact O-N 2.89Å; K190-R194 VanDerWaalsContact O-N 3.1Å
191	M	86.5	Confident	82.7	Confident	76 Å²	76	81.9 Å²	81.9	37%	0.374	41%	0.408	S	S	.	.	H	α-helix	trans	-69.5	-44.2	177.6	-172.9	63.8	173.6	0	0	112	A187 F188 E189 W193 R194 V195 I241 Y245	A187-M191 WeakPolarHBondContact O-CB 3.32Å; A187-M191 PolarHBondContact O-N 3.2Å; F188-M191 PolarHBondContact O-N 2.93Å; E189-M191 VanDerWaalsContact C-N 3.27Å; E189-M191 PolarHBondContact O-N 3.38Å; M191-W193 VanDerWaalsContact C-N 3.33Å; M191-W193 PolarHBondContact O-N 3.27Å; M191-R194 PolarHBondContact O-N 3.44Å; M191-V195 HydrophobicContact CE-CG2 3.92Å; M191-V195 WeakPolarHBondContact O-CG2 3.23Å; M191-V195 PolarHBondContact O-N 3.04Å; M191-V195 HydrophobicContact SD-CG2 4.18Å; M191-I241 HydrophobicContact CG-CG2 4.19Å; M191-Y245 HydrophobicContact CB-CE2 4.07Å; M191-Y245 HydrophobicContact CG-CE2 4.12Å
192	L	85.6	Confident	82.5	Confident	1 Å²	1	81.7 Å²	81.7	1%	0.005	41%	0.408	C	S	.	.	H	α-helix	trans	-61.5	-44.5	178	-159.5	81	0	0	0	110.7	F188 E189 R194 V195 C196 V202 I227 V238 I241	F188-L192 PolarHBondContact O-N 2.78Å; E189-L192 PolarHBondContact O-N 3.35Å; L192-R194 PolarHBondContact O-N 2.9Å; L192-V195 PolarHBondContact O-N 2.97Å; L192-C196 VanDerWaalsContact O-CB 3.22Å; L192-C196 WeakPolarHBondContact O-CB 3.31Å; L192-C196 PolarHBondContact O-N 3.32Å; L192-V202 HydrophobicContact CD2-CG2 3.15Å; L192-I227 HydrophobicContact CD1-CD1 4.36Å; L192-I227 HydrophobicContact CD2-CD1 3.99Å; L192-I227 HydrophobicContact CD2-CG1 4.25Å; L192-I227 HydrophobicContact CD2-CG2 4.15Å; L192-V238 HydrophobicContact CD1-CG1 4.28Å; L192-V238 HydrophobicContact CD1-CG2 4.12Å; L192-I241 HydrophobicContact CD1-CD1 4.09Å
193	W	83.2	Confident	82.5	Confident	186 Å²	186	78.5 Å²	78.5	71%	0.705	40%	0.397	S	S	*	.	H	α-helix	trans	-62.7	-42.9	177.9	-166.2	87	0	0	0	112.3	E189 M191 K197	E189-W193 WeakPolarHBondContact O-CB 3.45Å; E189-W193 PolarHBondContact O-N 2.99Å; M191-W193 VanDerWaalsContact C-N 3.33Å; M191-W193 PolarHBondContact O-N 3.27Å; W193-K197 WeakPolarHBondContact O-CA 3.26Å; W193-K197 PolarHBondContact O-N 3.5Å
194	R	84.5	Confident	82.6	Confident	183 Å²	183	81 Å²	81	69%	0.691	39%	0.385	S	S	*	.	H	α-helix	trans	-63.9	-41	178.4	-76.1	171.4	-177.6	-164	1	113.2	K190 M191 L192	K190-R194 WeakPolarHBondContact O-CB 3.44Å; K190-R194 WeakPolarHBondContact O-CD 3.31Å; K190-R194 WeakPolarHBondContact O-CG 3.47Å; K190-R194 PolarHBondContact O-N 2.89Å; K190-R194 VanDerWaalsContact O-N 3.1Å; M191-R194 PolarHBondContact O-N 3.44Å; L192-R194 PolarHBondContact O-N 2.9Å
195	V	84.6	Confident	82.4	Confident	54 Å²	54	78 Å²	78	33%	0.327	38%	0.377	S	S	.	.	H	α-helix	trans	-82.8	-39.8	-175.9	176.5	0	0	0	0	111.8	M191 L192 K237 I241	M191-V195 HydrophobicContact CE-CG2 3.92Å; M191-V195 WeakPolarHBondContact O-CG2 3.23Å; M191-V195 PolarHBondContact O-N 3.04Å; M191-V195 HydrophobicContact SD-CG2 4.18Å; L192-V195 PolarHBondContact O-N 2.97Å; V195-K237 HydrophobicContact CG1-CB 4.48Å; V195-K237 HydrophobicContact CG1-CD 4.18Å; V195-I241 HydrophobicContact CB-CD1 4Å; V195-I241 HydrophobicContact CG1-CD1 4.11Å; V195-I241 HydrophobicContact CG2-CD1 4.13Å
196	C	78.1	Confident	82.1	Confident	6 Å²	6	80.4 Å²	80.4	4%	0.041	39%	0.386	C	S	.	.	H	α-helix	trans	-95.4	-3.7	-173.4	-62.5	0	0	0	0	113.7	L192 G198 Y199 T200	L192-C196 VanDerWaalsContact O-CB 3.22Å; L192-C196 WeakPolarHBondContact O-CB 3.31Å; L192-C196 PolarHBondContact O-N 3.32Å; C196-G198 PolarHBondContact O-N 3.09Å; C196-Y199 WeakPolarHBondContact O-CB 3.48Å; C196-Y199 WeakPolarHBondContact O-CD2 3.36Å; C196-Y199 PolarHBondContact O-N 3.43Å; C196-T200 HydrophobicContact CB-CG2 3.61Å
197	K	77.4	Confident	81.7	Confident	173 Å²	173	74.4 Å²	74.4	75%	0.752	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	46	38.1	172.4	-60.6	-171.1	178.2	-174.3	0	114.3	W193	W193-K197 WeakPolarHBondContact O-CA 3.26Å; W193-K197 PolarHBondContact O-N 3.5Å
198	G	69.4	Low	80.6	Confident	49 Å²	49	79.9 Å²	79.9	51%	0.505	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	1	178.6	0	0	0	0	0	116.7	C196 T200	C196-G198 PolarHBondContact O-N 3.09Å; G198-T200 PolarHBondContact O-N 2.89Å
199	Y	76.5	Confident	79.6	Confident	151 Å²	151	84.7 Å²	84.7	59%	0.592	40%	0.404	S	S	*	.			trans	-79.4	8	176.3	-64.9	-68.1	0	0	0	114.7	C196 I234	C196-Y199 WeakPolarHBondContact O-CB 3.48Å; C196-Y199 WeakPolarHBondContact O-CD2 3.36Å; C196-Y199 PolarHBondContact O-N 3.43Å; Y199-I234 HydrophobicContact CD2-CD1 4.44Å; Y199-I234 HydrophobicContact CG-CD1 4.27Å
200	T	78.7	Confident	78.8	Confident	18 Å²	18	83.5 Å²	83.5	11%	0.11	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.7	-177.8	52.9	0	0	0	0	110.1	C196 G198 I227 S228 F229 I234 V238	C196-T200 HydrophobicContact CB-CG2 3.61Å; G198-T200 PolarHBondContact O-N 2.89Å; T200-I227 HydrophobicContact CG2-CG2 4.29Å; T200-S228 WeakPolarHBondContact CA-O 3.08Å; T200-F229 HydrophobicContact CG2-CB 3.93Å; T200-I234 HydrophobicContact CG2-CG2 4Å; T200-V238 HydrophobicContact CG2-CG2 4.08Å
201	I	81.6	Confident	77.9	Confident	107 Å²	107	79.1 Å²	79.1	55%	0.549	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	126.3	170.2	-55.8	168.2	0	0	0	107.1	I227 S228	I201-I227 WeakPolarHBondContact O-CA 3.48Å; I201-S228 WeakPolarHBondContact CB-OG 3.27Å; I201-S228 PolarHBondContact N-O 3.27Å; I201-S228 PolarHBondContact O-N 2.93Å
202	V	80.3	Confident	77	Confident	40 Å²	40	79 Å²	79	24%	0.242	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	130	177.9	-169.5	0	0	0	0	108.4	L192 I227	L192-V202 HydrophobicContact CD2-CG2 3.15Å; V202-I227 HydrophobicContact CG1-CG1 4.17Å; V202-I227 HydrophobicContact CG2-CG1 4.2Å
203	S	81.3	Confident	76	Confident	34 Å²	34	80.2 Å²	80.2	24%	0.238	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	130	166.9	-56.6	0	0	0	0	108.1	F225 L226	S203-F225 CarbonylContact O-C 3.49Å; S203-F225 VanDerWaalsContact O-CA 3.24Å; S203-F225 WeakPolarHBondContact O-CA 3.38Å; S203-L226 PolarHBondContact N-O 3.24Å; S203-L226 PolarHBondContact O-N 2.78Å
204	Y	83.9	Confident	74.9	Confident	124 Å²	124	73.5 Å²	73.5	49%	0.486	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	151.4	175.1	56.1	-96.6	0	0	0	110.7	F138 Y223 V224	F138-Y204 VanDerWaalsContact CZ-C 3.43Å; Y204-Y223 HydrophobicContact CD2-CD1 4.36Å; Y204-V224 CarbonylContact C-O 3.57Å; Y204-V224 VanDerWaalsContact CA-O 3.23Å; Y204-V224 WeakPolarHBondContact CA-O 3.21Å
205	A	81.2	Confident	73.8	Confident	26 Å²	26	72.7 Å²	72.7	22%	0.215	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	142.9	170.7	0	0	0	0	0	108.2	V134 F138 Y223 V224	V134-A205 HydrophobicContact CG1-CB 3.66Å; F138-A205 HydrophobicContact CE1-CB 3.75Å; F138-A205 HydrophobicContact CE2-CB 4.27Å; F138-A205 HydrophobicContact CZ-CB 3.25Å; A205-Y223 WeakPolarHBondContact O-CA 3.18Å; A205-V224 PolarHBondContact N-O 2.72Å; A205-V224 PolarHBondContact O-N 3.02Å
206	E	79.4	Confident	72.9	Confident	72 Å²	72	74.2 Å²	74.2	34%	0.336	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	138.1	170.1	-169.2	168.1	163.1	0	0	108.9	K221 Y223	E206-K221 IonicContact OE1-NZ 3.02Å; E206-K221 PolarHBondContact OE1-NZ 2.92Å; E206-Y223 HydrophobicContact CB-CD1 4.15Å; E206-Y223 HydrophobicContact CB-CE1 3.58Å; E206-Y223 HydrophobicContact CG-CE1 4.08Å; E206-Y223 HydrophobicContact CG-CE2 4.32Å; E206-Y223 PolarHBondContact OE2-OH 3.17Å
207	L	75.1	Confident	72.1	Confident	8 Å²	8	76.3 Å²	76.3	4%	0.042	41%	0.409	C	S	.	.			trans	-82.2	121.8	167.6	-166.2	68.3	0	0	0	108.4	H130 V134 E209 L211 W222	H130-L207 HydrophobicContact CB-CD1 3.8Å; H130-L207 HydrophobicContact CB-CD2 4.28Å; V134-L207 HydrophobicContact CG2-CD1 3.97Å; L207-E209 WeakPolarHBondContact CD2-O 3.43Å; L207-E209 WeakPolarHBondContact CG-O 3.32Å; L207-E209 PolarHBondContact O-N 2.9Å; L207-L211 HydrophobicContact CD2-CD1 3.58Å; L207-L211 HydrophobicContact CD2-CG 3.99Å; L207-W222 VanDerWaalsContact CB-O 3.22Å; L207-W222 WeakPolarHBondContact CB-O 3.5Å; L207-W222 PolarHBondContact N-O 3Å
208	D	65.8	Low	71.9	Confident	162 Å²	162	74 Å²	74	87%	0.866	40%	0.401	S	S	*	.	S	Bend	trans	-64.4	-25.7	-179.9	-64.4	-39.4	0	0	0	112.5
209	E	68.7	Low	72.1	Confident	106 Å²	106	76 Å²	76	50%	0.495	40%	0.403	S	S	.	.	S	Bend	trans	-95.7	124.6	177.4	-69.4	176.7	-155.1	0	0	110.3	H130 L207	H130-E209 IonicContact CE1-OE1 3.93Å; H130-E209 IonicContact CE1-OE2 2.73Å; H130-E209 PolarHBondContact CE1-OE2 3.39Å; H130-E209 IonicContact NE2-OE2 3.78Å; L207-E209 WeakPolarHBondContact CD2-O 3.43Å; L207-E209 WeakPolarHBondContact CG-O 3.32Å; L207-E209 PolarHBondContact O-N 2.9Å
210	S	67.9	Low	72	Confident	67 Å²	67	70.2 Å²	70.2	47%	0.469	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-77.9	121.4	173.8	57.7	0	0	0	0	110.3	V219	S210-V219 WeakPolarHBondContact OG-CG1 3.47Å
211	L	67.3	Low	71.9	Confident	18 Å²	18	74 Å²	74	9%	0.094	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	146.8	179.6	-63.8	169.2	0	0	0	109.7	I126 E127 L207 I220	I126-L211 HydrophobicContact CG2-CD2 3.92Å; E127-L211 HydrophobicContact CG-CD1 3.91Å; L207-L211 HydrophobicContact CD2-CD1 3.58Å; L207-L211 HydrophobicContact CD2-CG 3.99Å; L211-I220 PolarHBondContact N-O 3.42Å; L211-I220 PolarHBondContact O-N 2.88Å
212	E	67.4	Low	71.9	Confident	74 Å²	74	69.5 Å²	69.5	35%	0.346	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	132.4	172.2	-71	175.2	174.3	0	0	110.1	R119 L123 E218 V219	R119-E212 IonicContact CZ-OE2 3.93Å; R119-E212 IonicContact NE-OE2 3.22Å; R119-E212 IonicContact NH2-OE1 3.43Å; R119-E212 IonicContact NH2-OE2 2.69Å; R119-E212 PolarHBondContact NH2-OE2 3.26Å; L123-E212 HydrophobicContact CD1-CB 4.37Å; L123-E212 WeakPolarHBondContact CD1-O 3.42Å; E212-E218 CarbonylContact C-O 3.59Å; E212-E218 WeakPolarHBondContact CA-O 3.46Å; E212-V219 HydrophobicContact CG-CG2 3.9Å
213	D	64.1	Low	72.2	Confident	26 Å²	26	69.1 Å²	69.1	14%	0.139	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-64.2	131	172.4	-92.6	23	0	0	0	109.8	E215 T216 G217 E218 I220 W222	D213-E215 PolarHBondContact O-N 3.09Å; D213-E215 VanDerWaalsContact O-N 3.12Å; D213-T216 WeakPolarHBondContact CB-OG1 3.46Å; D213-T216 PolarHBondContact OD2-OG1 3.48Å; D213-G217 WeakPolarHBondContact O-CA 3.49Å; D213-G217 PolarHBondContact O-N 2.86Å; D213-E218 PolarHBondContact N-O 2.73Å; D213-I220 HydrophobicContact CB-CD1 4.49Å; D213-I220 VanDerWaalsContact CG-CD1 3.48Å; D213-I220 WeakPolarHBondContact OD2-CD1 3.2Å; D213-W222 WeakPolarHBondContact OD1-CZ2 3.39Å; D213-W222 PolarHBondContact OD1-NE1 3.07Å
214	P	59.9	Low	72.4	Confident	45 Å²	45	67.5 Å²	67.5	29%	0.292	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.6	-176.3	22.3	-29.4	0	0	0	113.9	K120 L123	K120-P214 HydrophobicContact CG-CB 4.34Å; L123-P214 HydrophobicContact CD2-CB 4.07Å; L123-P214 HydrophobicContact CD2-CG 3.97Å
215	E	60.6	Low	72.5	Confident	166 Å²	166	61.7 Å²	61.7	78%	0.776	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-29.9	-176.6	-60.3	-170.3	167	0	0	113.4	K120 D213	K120-E215 IonicContact NZ-OE1 2.76Å; D213-E215 PolarHBondContact O-N 3.09Å; D213-E215 VanDerWaalsContact O-N 3.12Å
216	T	65.8	Low	72.8	Confident	87 Å²	87	61.1 Å²	61.1	53%	0.534	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-20.3	-177.5	62.4	0	0	0	0	113.1	D213 E218	D213-T216 WeakPolarHBondContact CB-OG1 3.46Å; D213-T216 PolarHBondContact OD2-OG1 3.48Å; T216-E218 PolarHBondContact O-N 2.99Å; T216-E218 PolarHBondContact OG1-N 2.86Å
217	G	62.5	Low	73	Confident	50 Å²	50	57.7 Å²	57.7	52%	0.515	31%	0.311	S	S	.	.			trans	68.6	9.1	-175.2	0	0	0	0	0	113.9	D213	D213-G217 WeakPolarHBondContact O-CA 3.49Å; D213-G217 PolarHBondContact O-N 2.86Å
218	E	72.6	Confident	73.4	Confident	125 Å²	125	58.2 Å²	58.2	58%	0.584	32%	0.315	S	S	*	.			trans	-82.1	141.3	176.5	-66.7	-173.6	167.8	0	0	110.4	E212 D213 T216 I220	E212-E218 CarbonylContact C-O 3.59Å; E212-E218 WeakPolarHBondContact CA-O 3.46Å; D213-E218 PolarHBondContact N-O 2.73Å; T216-E218 PolarHBondContact O-N 2.99Å; T216-E218 PolarHBondContact OG1-N 2.86Å; E218-I220 HydrophobicContact CB-CD1 4.35Å; E218-I220 HydrophobicContact CB-CG1 4.07Å; E218-I220 PolarHBondContact O-N 3.25Å
219	V	73.1	Confident	74.3	Confident	90 Å²	90	51.4 Å²	51.4	55%	0.545	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	100.3	178.3	-179.5	0	0	0	0	108.2	S210 E212	S210-V219 WeakPolarHBondContact OG-CG1 3.47Å; E212-V219 HydrophobicContact CG-CG2 3.9Å
220	I	74.4	Confident	74.8	Confident	29 Å²	29	51.3 Å²	51.3	15%	0.149	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	146.4	-175.3	-53.2	-168.5	0	0	0	110.4	L211 D213 E218 W222	L211-I220 PolarHBondContact N-O 3.42Å; L211-I220 PolarHBondContact O-N 2.88Å; D213-I220 HydrophobicContact CB-CD1 4.49Å; D213-I220 VanDerWaalsContact CG-CD1 3.48Å; D213-I220 WeakPolarHBondContact OD2-CD1 3.2Å; E218-I220 HydrophobicContact CB-CD1 4.35Å; E218-I220 HydrophobicContact CB-CG1 4.07Å; E218-I220 PolarHBondContact O-N 3.25Å; I220-W222 VanDerWaalsContact O-CD1 3.25Å
221	K	77	Confident	75.4	Confident	99 Å²	99	49.5 Å²	49.5	43%	0.43	27%	0.265	S	S	.	.			trans	-80.7	121.6	170.6	-72.8	-173	163.2	-153.4	0	110.7	E206	E206-K221 IonicContact OE1-NZ 3.02Å; E206-K221 PolarHBondContact OE1-NZ 2.92Å
222	W	82.8	Confident	76	Confident	12 Å²	12	56 Å²	56	5%	0.045	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	144	179.8	-69.8	90.8	0	0	0	111.5	L179 N181 L207 D213 I220 H248	L179-W222 HydrophobicContact CB-CE3 3.86Å; L179-W222 HydrophobicContact CB-CZ3 4.38Å; L179-W222 HydrophobicContact CD2-CB 4.03Å; L179-W222 HydrophobicContact CD2-CG 4.47Å; N181-W222 HydrophobicContact CB-CZ3 4.46Å; L207-W222 VanDerWaalsContact CB-O 3.22Å; L207-W222 WeakPolarHBondContact CB-O 3.5Å; L207-W222 PolarHBondContact N-O 3Å; D213-W222 WeakPolarHBondContact OD1-CZ2 3.39Å; D213-W222 PolarHBondContact OD1-NE1 3.07Å; I220-W222 VanDerWaalsContact O-CD1 3.25Å; W222-H248 AromaticContact CH2-CD2 3.66Å; W222-H248 AromaticContact CH2-NE2 3.81Å; W222-H248 AromaticContact CZ3-CD2 3.88Å
223	Y	84.9	Confident	76.6	Confident	31 Å²	31	60.4 Å²	60.4	12%	0.122	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.7	170.7	-78.3	-99	0	0	0	109.5	L179 I180 Q182 V185 Y204 A205 E206	L179-Y223 CarbonylContact C-O 3.58Å; L179-Y223 WeakPolarHBondContact CA-O 3.47Å; I180-Y223 PolarHBondContact N-O 3.24Å; I180-Y223 PolarHBondContact O-N 2.69Å; Q182-Y223 HydrophobicContact CB-CD2 4.06Å; Q182-Y223 HydrophobicContact CB-CE2 3.71Å; Q182-Y223 HydrophobicContact CG-CD2 4.42Å; Q182-Y223 HydrophobicContact CG-CE2 3.65Å; V185-Y223 HydrophobicContact CG2-CD2 3.97Å; V185-Y223 HydrophobicContact CG2-CG 4.03Å; Y204-Y223 HydrophobicContact CD2-CD1 4.36Å; A205-Y223 WeakPolarHBondContact O-CA 3.18Å; E206-Y223 HydrophobicContact CB-CD1 4.15Å; E206-Y223 HydrophobicContact CB-CE1 3.58Å; E206-Y223 HydrophobicContact CG-CE1 4.08Å; E206-Y223 HydrophobicContact CG-CE2 4.32Å; E206-Y223 PolarHBondContact OE2-OH 3.17Å
224	V	86.2	Confident	77.5	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	127.5	171.4	178.3	0	0	0	0	107.9	M131 V134 T135 L179 Y204 A205	M131-V224 HydrophobicContact CB-CG1 4.32Å; M131-V224 HydrophobicContact CG-CG1 3.75Å; V134-V224 HydrophobicContact CB-CB 4.41Å; V134-V224 HydrophobicContact CB-CG1 4.4Å; V134-V224 HydrophobicContact CB-CG2 4.38Å; V134-V224 HydrophobicContact CG1-CB 4.1Å; V134-V224 HydrophobicContact CG1-CG1 4.32Å; V134-V224 HydrophobicContact CG1-CG2 4.49Å; V134-V224 HydrophobicContact CG2-CG2 4.48Å; T135-V224 HydrophobicContact CG2-CG1 4.06Å; L179-V224 HydrophobicContact CD2-CG2 4.28Å; L179-V224 HydrophobicContact CG-CG2 4.26Å; Y204-V224 CarbonylContact C-O 3.57Å; Y204-V224 VanDerWaalsContact CA-O 3.23Å; Y204-V224 WeakPolarHBondContact CA-O 3.21Å; A205-V224 PolarHBondContact N-O 2.72Å; A205-V224 PolarHBondContact O-N 3.02Å
225	F	86.9	Confident	78.5	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.009	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	147.5	172.8	66.7	-96.6	0	0	0	111.9	V176 S177 G178 I180 F188 S203 I227 C247	V176-F225 HydrophobicContact CG1-CE2 4.45Å; S177-F225 VanDerWaalsContact CA-O 3.25Å; S177-F225 WeakPolarHBondContact CA-O 3.29Å; G178-F225 VanDerWaalsContact C-CE1 3.41Å; G178-F225 PolarHBondContact N-O 2.88Å; G178-F225 VanDerWaalsContact N-O 3.11Å; G178-F225 WeakPolarHBondContact O-CD1 3.42Å; G178-F225 WeakPolarHBondContact O-CE1 3.23Å; G178-F225 PolarHBondContact O-N 3.34Å; I180-F225 HydrophobicContact CB-CD1 4.12Å; I180-F225 HydrophobicContact CB-CE1 4.1Å; I180-F225 HydrophobicContact CG2-CD1 3.84Å; I180-F225 HydrophobicContact CG2-CE1 4.34Å; F188-F225 HydrophobicContact CE1-CD1 4.48Å; F188-F225 HydrophobicContact CE1-CD2 4.47Å; F188-F225 HydrophobicContact CE1-CG 4.44Å; F188-F225 HydrophobicContact CZ-CE1 4.43Å; F188-F225 HydrophobicContact CZ-CE2 4.22Å; F188-F225 HydrophobicContact CZ-CZ 4.12Å; S203-F225 CarbonylContact O-C 3.49Å; S203-F225 VanDerWaalsContact O-CA 3.24Å; S203-F225 WeakPolarHBondContact O-CA 3.38Å; F225-I227 HydrophobicContact CD2-CD1 3.65Å; F225-I227 HydrophobicContact CD2-CG1 3.76Å; F225-I227 HydrophobicContact CE2-CD1 3.64Å; F225-I227 HydrophobicContact CE2-CG1 4.21Å; F225-C247 HydrophobicContact CE1-CB 3.94Å; F225-C247 HydrophobicContact CZ-CB 3.98Å
226	L	85.7	Confident	79.7	Confident	14 Å²	14	57 Å²	57	7%	0.073	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	119	169.2	-179	66.3	0	0	0	108.1	T135 F138 F175 S203 Y252	T135-L226 HydrophobicContact CG2-CB 4.32Å; T135-L226 HydrophobicContact CG2-CD1 4.49Å; F138-L226 HydrophobicContact CB-CD2 4.42Å; F138-L226 HydrophobicContact CD2-CB 4.26Å; F175-L226 HydrophobicContact CB-CD1 4.31Å; F175-L226 HydrophobicContact CD1-CD1 4.26Å; S203-L226 PolarHBondContact N-O 3.24Å; S203-L226 PolarHBondContact O-N 2.78Å; L226-Y252 HydrophobicContact CD1-CD2 4.23Å; L226-Y252 HydrophobicContact CD1-CE2 4.39Å; L226-Y252 HydrophobicContact CD1-CG 4.39Å
227	I	85.1	Confident	80.6	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116.9	177.7	-59.6	165.7	0	0	0	108.2	F175 V176 F188 L192 T200 I201 V202 F225 F229 V238	F175-I227 WeakPolarHBondContact CA-O 3.37Å; V176-I227 PolarHBondContact N-O 2.75Å; V176-I227 PolarHBondContact O-N 2.95Å; F188-I227 HydrophobicContact CE1-CD1 4.01Å; F188-I227 HydrophobicContact CZ-CD1 3.81Å; L192-I227 HydrophobicContact CD1-CD1 4.36Å; L192-I227 HydrophobicContact CD2-CD1 3.99Å; L192-I227 HydrophobicContact CD2-CG1 4.25Å; L192-I227 HydrophobicContact CD2-CG2 4.15Å; T200-I227 HydrophobicContact CG2-CG2 4.29Å; I201-I227 WeakPolarHBondContact O-CA 3.48Å; V202-I227 HydrophobicContact CG1-CG1 4.17Å; V202-I227 HydrophobicContact CG2-CG1 4.2Å; F225-I227 HydrophobicContact CD2-CD1 3.65Å; F225-I227 HydrophobicContact CD2-CG1 3.76Å; F225-I227 HydrophobicContact CE2-CD1 3.64Å; F225-I227 HydrophobicContact CE2-CG1 4.21Å; I227-F229 HydrophobicContact CG2-CD1 4.43Å; I227-V238 HydrophobicContact CB-CG1 4.48Å; I227-V238 HydrophobicContact CD1-CG1 3.83Å; I227-V238 HydrophobicContact CG2-CG1 4.1Å
228	S	82.8	Confident	81.7	Confident	20 Å²	20	55.7 Å²	55.7	14%	0.14	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.4	167.4	63.6	0	0	0	0	109.8	G174 T200 I201	G174-S228 WeakPolarHBondContact O-CA 3.47Å; T200-S228 WeakPolarHBondContact CA-O 3.08Å; I201-S228 WeakPolarHBondContact CB-OG 3.27Å; I201-S228 PolarHBondContact N-O 3.27Å; I201-S228 PolarHBondContact O-N 2.93Å
229	F	84.4	Confident	82.4	Confident	19 Å²	19	54.8 Å²	54.8	8%	0.083	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	154.8	-179.1	60.6	-91.7	0	0	0	111.5	G174 V176 T200 I227 G231 I234 V238	G174-F229 PolarHBondContact N-O 3.31Å; G174-F229 WeakPolarHBondContact O-CD1 3.17Å; G174-F229 PolarHBondContact O-N 3.36Å; V176-F229 HydrophobicContact CB-CE1 4.11Å; V176-F229 HydrophobicContact CG2-CE1 3.59Å; V176-F229 HydrophobicContact CG2-CZ 4.22Å; T200-F229 HydrophobicContact CG2-CB 3.93Å; I227-F229 HydrophobicContact CG2-CD1 4.43Å; F229-G231 WeakPolarHBondContact CD2-O 3.45Å; F229-I234 HydrophobicContact CB-CG2 3.97Å; F229-V238 HydrophobicContact CD1-CG2 4.5Å
230	W	80.1	Confident	83	Confident	104 Å²	104	57.5 Å²	57.5	39%	0.394	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	116.9	179.8	-63.1	85.4	0	0	0	110.1	A171 L173 I234	A171-W230 HydrophobicContact CB-CE3 4.35Å; L173-W230 HydrophobicContact CD1-CD2 3.94Å; L173-W230 HydrophobicContact CD1-CE3 4.36Å; L173-W230 HydrophobicContact CD1-CG 4.43Å; L173-W230 HydrophobicContact CD1-CH2 4.26Å; L173-W230 HydrophobicContact CD1-CZ2 3.81Å; W230-I234 WeakPolarHBondContact O-CD1 3.44Å
231	G	80.5	Confident	83.7	Confident	28 Å²	28	56.6 Å²	56.6	29%	0.289	26%	0.264	S	S	.	.	S	Bend	trans	90.6	149	174.9	0	0	0	0	0	116.1	F229 I234 G235	F229-G231 WeakPolarHBondContact CD2-O 3.45Å; G231-I234 PolarHBondContact O-N 3.1Å; G231-G235 PolarHBondContact O-N 3.19Å
232	E	79.3	Confident	84.1	Confident	156 Å²	156	51.9 Å²	51.9	73%	0.729	24%	0.243	S	C	*	.	H	α-helix	trans	-69.1	-36.8	-171.1	-67.8	-176.8	166.1	0	0	113.9	I234 G235 H236	E232-I234 VanDerWaalsContact C-N 3.29Å; E232-I234 PolarHBondContact O-N 2.89Å; E232-G235 PolarHBondContact O-N 2.85Å; E232-G235 VanDerWaalsContact O-N 3.16Å; E232-H236 PolarHBondContact O-CD2 3.12Å; E232-H236 PolarHBondContact O-N 3.19Å
233	Q	80.9	Confident	84.2	Confident	166 Å²	166	56.3 Å²	56.3	78%	0.776	27%	0.268	S	S	*	.	H	α-helix	trans	-64.4	-34.3	179.6	-67	-173.4	-3.9	0	0	112.6	K237	Q233-K237 PolarHBondContact O-N 3.41Å
234	I	82.1	Confident	84.3	Confident	38 Å²	38	59.5 Å²	59.5	20%	0.195	29%	0.294	C	S	.	.	H	α-helix	trans	-73.1	-40.9	174.9	-67.5	165.2	0	0	0	109.2	Y199 T200 F229 W230 G231 E232 H236 K237 V238	Y199-I234 HydrophobicContact CD2-CD1 4.44Å; Y199-I234 HydrophobicContact CG-CD1 4.27Å; T200-I234 HydrophobicContact CG2-CG2 4Å; F229-I234 HydrophobicContact CB-CG2 3.97Å; W230-I234 WeakPolarHBondContact O-CD1 3.44Å; G231-I234 PolarHBondContact O-N 3.1Å; E232-I234 VanDerWaalsContact C-N 3.29Å; E232-I234 PolarHBondContact O-N 2.89Å; I234-H236 VanDerWaalsContact C-N 3.32Å; I234-H236 PolarHBondContact O-N 3.39Å; I234-K237 WeakPolarHBondContact O-CA 3.25Å; I234-K237 WeakPolarHBondContact O-CB 3.3Å; I234-K237 PolarHBondContact O-N 3.29Å; I234-V238 HydrophobicContact CG2-CG2 4.18Å; I234-V238 WeakPolarHBondContact O-CG2 3.45Å; I234-V238 PolarHBondContact O-N 2.93Å
235	G	81.3	Confident	84.3	Confident	6 Å²	6	62.3 Å²	62.3	6%	0.062	30%	0.304	C	S	.	.	H	α-helix	trans	-53.9	-43.4	173.5	0	0	0	0	0	113.9	G231 E232 K237 V238 K239	G231-G235 PolarHBondContact O-N 3.19Å; E232-G235 PolarHBondContact O-N 2.85Å; E232-G235 VanDerWaalsContact O-N 3.16Å; G235-K237 VanDerWaalsContact C-N 3.34Å; G235-K237 PolarHBondContact O-N 3.49Å; G235-V238 PolarHBondContact O-N 3.35Å; G235-K239 WeakPolarHBondContact O-CG 3.43Å; G235-K239 PolarHBondContact O-N 3.5Å
236	H	84.9	Confident	84.1	Confident	121 Å²	121	69.1 Å²	69.1	56%	0.56	34%	0.336	S	S	*	.	H	α-helix	trans	-64.9	-35.1	175	-75.1	-68.4	0	0	0	113.4	E232 I234 K240	E232-H236 PolarHBondContact O-CD2 3.12Å; E232-H236 PolarHBondContact O-N 3.19Å; I234-H236 VanDerWaalsContact C-N 3.32Å; I234-H236 PolarHBondContact O-N 3.39Å; H236-K240 WeakPolarHBondContact O-CG 3.29Å; H236-K240 PolarHBondContact O-N 3.46Å; H236-K240 VanDerWaalsContact O-N 3.16Å
237	K	85.6	Confident	83.9	Confident	109 Å²	109	69 Å²	69	47%	0.474	34%	0.336	S	S	.	.	H	α-helix	trans	-68.6	-42.2	174.7	-69.7	178.6	-178.7	178.6	0	111.3	V195 Q233 I234 G235 K240 I241	V195-K237 HydrophobicContact CG1-CB 4.48Å; V195-K237 HydrophobicContact CG1-CD 4.18Å; Q233-K237 PolarHBondContact O-N 3.41Å; I234-K237 WeakPolarHBondContact O-CA 3.25Å; I234-K237 WeakPolarHBondContact O-CB 3.3Å; I234-K237 PolarHBondContact O-N 3.29Å; G235-K237 VanDerWaalsContact C-N 3.34Å; G235-K237 PolarHBondContact O-N 3.49Å; K237-K240 PolarHBondContact O-N 3.14Å; K237-I241 VanDerWaalsContact O-CG1 3.31Å; K237-I241 WeakPolarHBondContact O-CG1 3.3Å; K237-I241 PolarHBondContact O-N 3.48Å
238	V	85.9	Confident	83.7	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-60.2	-47.2	176.4	175.5	0	0	0	0	110.5	V176 L192 T200 I227 F229 I234 G235 K240 I241 C242	V176-V238 HydrophobicContact CB-CG1 4.43Å; V176-V238 HydrophobicContact CG1-CG1 4.34Å; L192-V238 HydrophobicContact CD1-CG1 4.28Å; L192-V238 HydrophobicContact CD1-CG2 4.12Å; T200-V238 HydrophobicContact CG2-CG2 4.08Å; I227-V238 HydrophobicContact CB-CG1 4.48Å; I227-V238 HydrophobicContact CD1-CG1 3.83Å; I227-V238 HydrophobicContact CG2-CG1 4.1Å; F229-V238 HydrophobicContact CD1-CG2 4.5Å; I234-V238 HydrophobicContact CG2-CG2 4.18Å; I234-V238 WeakPolarHBondContact O-CG2 3.45Å; I234-V238 PolarHBondContact O-N 2.93Å; G235-V238 PolarHBondContact O-N 3.35Å; V238-K240 PolarHBondContact O-N 3.05Å; V238-I241 PolarHBondContact O-N 3.46Å; V238-C242 PolarHBondContact O-N 2.96Å; V238-C242 PolarHBondContact O-SG 3.22Å
239	K	86.1	Confident	83.8	Confident	107 Å²	107	73.3 Å²	73.3	47%	0.465	36%	0.358	S	S	.	.	H	α-helix	trans	-58.6	-47	176.8	-72	-176.8	-178	-175.2	0	112.3	V176 G235 I241 C242 D243	V176-K239 HydrophobicContact CG2-CG 4.41Å; G235-K239 WeakPolarHBondContact O-CG 3.43Å; G235-K239 PolarHBondContact O-N 3.5Å; K239-I241 VanDerWaalsContact C-N 3.29Å; K239-I241 PolarHBondContact O-N 3.31Å; K239-C242 WeakPolarHBondContact O-CA 3.35Å; K239-C242 WeakPolarHBondContact O-CB 3.4Å; K239-C242 PolarHBondContact O-N 3.01Å; K239-D243 VanDerWaalsContact O-CG 3.26Å; K239-D243 PolarHBondContact O-N 3.41Å
240	K	86.8	Confident	83.8	Confident	146 Å²	146	74 Å²	74	64%	0.635	36%	0.36	S	S	*	.	H	α-helix	trans	-59.1	-38.3	175.8	-74.9	179.5	177.7	-174	0	113	H236 K237 V238 D243 C244	H236-K240 WeakPolarHBondContact O-CG 3.29Å; H236-K240 PolarHBondContact O-N 3.46Å; H236-K240 VanDerWaalsContact O-N 3.16Å; K237-K240 PolarHBondContact O-N 3.14Å; V238-K240 PolarHBondContact O-N 3.05Å; K240-D243 PolarHBondContact O-N 3.41Å; K240-C244 PolarHBondContact O-N 2.71Å; K240-C244 PolarHBondContact O-SG 3.41Å
241	I	87.8	Confident	83.8	Confident	11 Å²	11	73.8 Å²	73.8	6%	0.056	37%	0.372	C	S	.	.	H	α-helix	trans	-66.7	-42.5	175.7	-65.6	165.4	0	0	0	110	F188 M191 L192 V195 K237 V238 K239 D243 C244 Y245	F188-I241 HydrophobicContact CD2-CG2 4.01Å; F188-I241 HydrophobicContact CE2-CG2 3.8Å; M191-I241 HydrophobicContact CG-CG2 4.19Å; L192-I241 HydrophobicContact CD1-CD1 4.09Å; V195-I241 HydrophobicContact CB-CD1 4Å; V195-I241 HydrophobicContact CG1-CD1 4.11Å; V195-I241 HydrophobicContact CG2-CD1 4.13Å; K237-I241 VanDerWaalsContact O-CG1 3.31Å; K237-I241 WeakPolarHBondContact O-CG1 3.3Å; K237-I241 PolarHBondContact O-N 3.48Å; V238-I241 PolarHBondContact O-N 3.46Å; K239-I241 VanDerWaalsContact C-N 3.29Å; K239-I241 PolarHBondContact O-N 3.31Å; I241-D243 VanDerWaalsContact C-N 3.32Å; I241-D243 PolarHBondContact O-N 3.09Å; I241-C244 PolarHBondContact O-N 2.79Å; I241-Y245 HydrophobicContact CG2-CD2 3.96Å; I241-Y245 HydrophobicContact CG2-CE2 4.03Å; I241-Y245 WeakPolarHBondContact O-CD2 3.34Å; I241-Y245 PolarHBondContact O-N 3.45Å
242	C	86.3	Confident	83.6	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-59.5	-42.8	175.6	-60.9	0	0	0	0	111.7	V238 K239 C244 Y245 H246 C247 V249	V238-C242 PolarHBondContact O-N 2.96Å; V238-C242 PolarHBondContact O-SG 3.22Å; K239-C242 WeakPolarHBondContact O-CA 3.35Å; K239-C242 WeakPolarHBondContact O-CB 3.4Å; K239-C242 PolarHBondContact O-N 3.01Å; C242-C244 PolarHBondContact O-N 3.49Å; C242-Y245 PolarHBondContact O-N 3.3Å; C242-H246 PolarHBondContact O-N 2.95Å; C242-H246 VanDerWaalsContact O-N 3.16Å; C242-C247 HydrophobicContact CB-CB 4.15Å; C242-C247 PolarHBondContact O-N 3.2Å; C242-V249 HydrophobicContact CB-CG2 3.5Å
243	D	85.6	Confident	83.5	Confident	104 Å²	104	66.8 Å²	66.8	56%	0.556	33%	0.332	S	S	*	.	H	α-helix	trans	-63.5	-42.1	176.7	-59.4	-27	0	0	0	111.5	K239 K240 I241 Y245 H246	K239-D243 VanDerWaalsContact O-CG 3.26Å; K239-D243 PolarHBondContact O-N 3.41Å; K240-D243 PolarHBondContact O-N 3.41Å; I241-D243 VanDerWaalsContact C-N 3.32Å; I241-D243 PolarHBondContact O-N 3.09Å; D243-Y245 VanDerWaalsContact C-N 3.31Å; D243-Y245 PolarHBondContact O-N 2.85Å; D243-H246 PolarHBondContact O-N 3.32Å; D243-H246 VanDerWaalsContact O-N 3.11Å; D243-H246 PolarHBondContact O-ND1 2.82Å
244	C	86.3	Confident	82.9	Confident	99 Å²	99	64.4 Å²	64.4	67%	0.669	32%	0.324	S	S	*	.	H	α-helix	trans	-61.1	-34.9	178	-73.2	0	0	0	0	113.6	K240 I241 C242	K240-C244 PolarHBondContact O-N 2.71Å; K240-C244 PolarHBondContact O-SG 3.41Å; I241-C244 PolarHBondContact O-N 2.79Å; C242-C244 PolarHBondContact O-N 3.49Å
245	Y	85.4	Confident	82.5	Confident	58 Å²	58	65.2 Å²	65.2	23%	0.227	33%	0.332	C	S	.	.	H	α-helix	trans	-89.8	-2.5	178.1	-77.3	-85.7	0	0	0	113.6	K184 A187 F188 M191 I241 C242 D243	K184-Y245 HydrophobicContact CB-CD1 4.37Å; K184-Y245 PolarHBondContact NZ-O 3.3Å; A187-Y245 HydrophobicContact CB-CE1 3.98Å; A187-Y245 PolarHBondContact O-OH 2.88Å; F188-Y245 HydrophobicContact CB-CD1 4.48Å; F188-Y245 HydrophobicContact CB-CG 4.48Å; F188-Y245 AromaticContact CD2-CD2 3.66Å; F188-Y245 HydrophobicContact CD2-CD2 3.66Å; F188-Y245 HydrophobicContact CD2-CE2 4.21Å; F188-Y245 AromaticContact CD2-CG 3.95Å; F188-Y245 HydrophobicContact CD2-CG 3.95Å; F188-Y245 HydrophobicContact CE2-CD2 4.45Å; M191-Y245 HydrophobicContact CB-CE2 4.07Å; M191-Y245 HydrophobicContact CG-CE2 4.12Å; I241-Y245 HydrophobicContact CG2-CD2 3.96Å; I241-Y245 HydrophobicContact CG2-CE2 4.03Å; I241-Y245 WeakPolarHBondContact O-CD2 3.34Å; I241-Y245 PolarHBondContact O-N 3.45Å; C242-Y245 PolarHBondContact O-N 3.3Å; D243-Y245 VanDerWaalsContact C-N 3.31Å; D243-Y245 PolarHBondContact O-N 2.85Å
246	H	82.9	Confident	82.2	Confident	145 Å²	145	67.5 Å²	67.5	67%	0.671	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	45.1	-176.1	-53.8	2	0	0	0	111.6	C242 D243	C242-H246 PolarHBondContact O-N 2.95Å; C242-H246 VanDerWaalsContact O-N 3.16Å; D243-H246 PolarHBondContact O-N 3.32Å; D243-H246 VanDerWaalsContact O-N 3.11Å; D243-H246 PolarHBondContact O-ND1 2.82Å
247	C	81.1	Confident	81.9	Confident	12 Å²	12	68.9 Å²	68.9	8%	0.081	36%	0.356	C	S	.	.			trans	-76.8	139	174.1	-57.8	0	0	0	0	110.4	L179 F225 C242 V249	L179-C247 WeakPolarHBondContact O-CA 3.37Å; L179-C247 WeakPolarHBondContact O-CB 3.41Å; F225-C247 HydrophobicContact CE1-CB 3.94Å; F225-C247 HydrophobicContact CZ-CB 3.98Å; C242-C247 HydrophobicContact CB-CB 4.15Å; C242-C247 PolarHBondContact O-N 3.2Å; C247-V249 HydrophobicContact CB-CG2 4.35Å; C247-V249 PolarHBondContact O-N 3.23Å
248	H	82.6	Confident	81.7	Confident	57 Å²	57	68 Å²	68	26%	0.264	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	99.9	171.4	-65.6	-84.6	0	0	0	109.1	E127 G178 L179 W222 Y250	E127-H248 IonicContact OE2-CG 3.99Å; E127-H248 IonicContact OE2-ND1 3.12Å; G178-H248 CarbonylContact C-O 3.54Å; G178-H248 WeakPolarHBondContact CA-O 3.32Å; L179-H248 PolarHBondContact N-O 2.87Å; L179-H248 PolarHBondContact O-N 3.23Å; W222-H248 AromaticContact CH2-CD2 3.66Å; W222-H248 AromaticContact CH2-NE2 3.81Å; W222-H248 AromaticContact CZ3-CD2 3.88Å; H248-Y250 HydrophobicContact CB-CE2 3.93Å
249	V	84.6	Confident	81.2	Confident	54 Å²	54	69.8 Å²	69.8	33%	0.327	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	126.3	-176.5	-178.3	0	0	0	0	110.6	V176 C242 C247	V176-V249 HydrophobicContact CG1-CG1 3.89Å; C242-V249 HydrophobicContact CB-CG2 3.5Å; C247-V249 HydrophobicContact CB-CG2 4.35Å; C247-V249 PolarHBondContact O-N 3.23Å
250	Y	84.1	Confident	81	Confident	34 Å²	34	72.3 Å²	72.3	13%	0.133	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	147	177.7	-61	-77	0	0	0	111.3	E124 E127 Y128 M131 S177 L179 H248 Y252	E124-Y250 PolarHBondContact O-OH 3.21Å; E127-Y250 HydrophobicContact CB-CE2 4.1Å; E127-Y250 PolarHBondContact OE2-OH 2.69Å; Y128-Y250 VanDerWaalsContact CD2-CB 3.42Å; Y128-Y250 HydrophobicContact CD2-CD1 4.01Å; Y128-Y250 HydrophobicContact CD2-CD2 4.21Å; Y128-Y250 AromaticContact CD2-CG 3.62Å; Y128-Y250 HydrophobicContact CD2-CG 3.62Å; Y128-Y250 HydrophobicContact CE2-CG 4.25Å; Y128-Y250 HydrophobicContact CG-CD1 4.01Å; Y128-Y250 HydrophobicContact CG-CG 4.07Å; M131-Y250 HydrophobicContact SD-CD2 4.1Å; M131-Y250 HydrophobicContact SD-CG 4.4Å; S177-Y250 PolarHBondContact O-N 3.09Å; S177-Y250 PolarHBondContact OG-O 3.2Å; L179-Y250 HydrophobicContact CD1-CD2 4Å; L179-Y250 HydrophobicContact CD1-CE2 3.63Å; H248-Y250 HydrophobicContact CB-CE2 3.93Å; Y250-Y252 PolarHBondContact O-N 3.17Å
251	P	79.1	Confident	81	Confident	99 Å²	99	72 Å²	72	64%	0.643	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-66.9	129.9	178.1	27.6	-33	0	0	0	110.7	Y128	Y128-P251 PolarHBondContact OH-O 3.2Å
252	Y	77.3	Confident	80.9	Confident	24 Å²	24	74.2 Å²	74.2	9%	0.094	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-95.3	120	178.1	-172.9	-98.3	0	0	0	110.9	T135 V139 F175 L226 Y250 R259	T135-Y252 HydrophobicContact CG2-CE2 4.46Å; V139-Y252 WeakPolarHBondContact CG2-OH 3.5Å; F175-Y252 HydrophobicContact CB-CD1 3.59Å; F175-Y252 HydrophobicContact CB-CE1 4.37Å; F175-Y252 HydrophobicContact CB-CG 4.07Å; F175-Y252 HydrophobicContact CD2-CD1 4.04Å; F175-Y252 HydrophobicContact CD2-CE1 4.26Å; F175-Y252 AromaticContact CG-CD1 3.88Å; F175-Y252 HydrophobicContact CG-CD1 3.88Å; F175-Y252 HydrophobicContact CG-CE1 4.21Å; L226-Y252 HydrophobicContact CD1-CD2 4.23Å; L226-Y252 HydrophobicContact CD1-CE2 4.39Å; L226-Y252 HydrophobicContact CD1-CG 4.39Å; Y250-Y252 PolarHBondContact O-N 3.17Å; Y252-R259 PolarHBondContact OH-NH1 3Å
253	P	76.3	Confident	80.8	Confident	13 Å²	13	76.4 Å²	76.4	8%	0.084	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-78	137.1	177.1	-8.1	24.4	0	0	0	111.6	E258 R259 I262	P253-E258 HydrophobicContact CB-CB 4.13Å; P253-R259 HydrophobicContact CB-CG 3.75Å; P253-R259 HydrophobicContact CG-CG 3.75Å; P253-I262 HydrophobicContact CB-CD1 4.07Å; P253-I262 HydrophobicContact CG-CD1 3.42Å; P253-I262 VanDerWaalsContact CG-CD1 3.42Å
254	N	69.4	Low	80.9	Confident	115 Å²	115	77.8 Å²	77.8	62%	0.615	39%	0.393	S	S	*	.	S	Bend	trans	-78.6	-29.8	-174.5	-64.8	-31.7	0	0	0	112.4
255	T	73.8	Confident	81.1	Confident	56 Å²	56	75 Å²	75	34%	0.344	38%	0.381	S	S	.	.	S	Bend	trans	-91.2	143	-176.6	-44.1	0	0	0	0	111.1	E257 E258 R259	T255-E257 VanDerWaalsContact C-N 3.32Å; T255-E257 HydrophobicContact CG2-CB 4.2Å; T255-E258 WeakPolarHBondContact CB-OE1 3.49Å; T255-E258 VanDerWaalsContact OG1-CD 3.28Å; T255-E258 PolarHBondContact OG1-OE1 3.26Å; T255-R259 WeakPolarHBondContact O-CG 3.15Å; T255-R259 PolarHBondContact O-N 3.24Å; T255-R259 PolarHBondContact O-NE 3.33Å
256	A	74.6	Confident	81.3	Confident	54 Å²	54	73 Å²	73	45%	0.446	37%	0.374	S	S	.	.	H	α-helix	trans	-68.7	-30.8	175.9	0	0	0	0	0	112.9	R260	A256-R260 PolarHBondContact O-N 3.08Å
257	E	78.2	Confident	81.7	Confident	149 Å²	149	69.1 Å²	69.1	70%	0.696	36%	0.358	S	S	*	.	H	α-helix	trans	-71.2	-49.8	177.6	-64.2	177.4	176.6	0	0	111.3	T255 R259 R260 E261	T255-E257 VanDerWaalsContact C-N 3.32Å; T255-E257 HydrophobicContact CG2-CB 4.2Å; E257-R259 VanDerWaalsContact C-N 3.25Å; E257-R259 PolarHBondContact O-N 3.5Å; E257-R260 PolarHBondContact O-N 3.4Å; E257-E261 PolarHBondContact O-N 3.5Å
258	E	80.9	Confident	82.2	Confident	90 Å²	90	72.2 Å²	72.2	42%	0.421	38%	0.377	S	S	.	.	H	α-helix	trans	-56.2	-38.2	173.9	-69.4	166.3	-150.8	0	0	112.4	P253 T255 E261 I262	P253-E258 HydrophobicContact CB-CB 4.13Å; T255-E258 WeakPolarHBondContact CB-OE1 3.49Å; T255-E258 VanDerWaalsContact OG1-CD 3.28Å; T255-E258 PolarHBondContact OG1-OE1 3.26Å; E258-E261 PolarHBondContact O-N 3.26Å; E258-I262 WeakPolarHBondContact O-CB 3.49Å; E258-I262 WeakPolarHBondContact O-CD1 3.27Å; E258-I262 VanDerWaalsContact O-CG1 3.25Å; E258-I262 WeakPolarHBondContact O-CG1 3.31Å; E258-I262 PolarHBondContact O-N 2.99Å
259	R	76.6	Confident	82.6	Confident	39 Å²	39	77 Å²	77	15%	0.147	39%	0.393	C	S	.	.	H	α-helix	trans	-63.7	-40.9	175.6	-79.3	-174.2	-72.3	162.3	-2.8	112.6	Y252 P253 T255 E257 Q263	Y252-R259 PolarHBondContact OH-NH1 3Å; P253-R259 HydrophobicContact CB-CG 3.75Å; P253-R259 HydrophobicContact CG-CG 3.75Å; T255-R259 WeakPolarHBondContact O-CG 3.15Å; T255-R259 PolarHBondContact O-N 3.24Å; T255-R259 PolarHBondContact O-NE 3.33Å; E257-R259 VanDerWaalsContact C-N 3.25Å; E257-R259 PolarHBondContact O-N 3.5Å; R259-Q263 VanDerWaalsContact O-CB 3.26Å; R259-Q263 WeakPolarHBondContact O-CB 3.37Å; R259-Q263 PolarHBondContact O-N 3.43Å
260	R	80.8	Confident	83	Confident	159 Å²	159	75.2 Å²	75.2	60%	0.6	38%	0.381	S	S	*	.	H	α-helix	trans	-67.5	-44.1	177.6	-75.4	-177.8	-177.9	161.6	0.9	111	A256 E257 I262 Q263 E264	A256-R260 PolarHBondContact O-N 3.08Å; E257-R260 PolarHBondContact O-N 3.4Å; R260-I262 PolarHBondContact O-N 2.94Å; R260-Q263 PolarHBondContact O-N 3.32Å; R260-E264 WeakPolarHBondContact O-CG 3.19Å; R260-E264 PolarHBondContact O-N 3.3Å
261	E	86.7	Confident	83.4	Confident	140 Å²	140	79.7 Å²	79.7	65%	0.654	40%	0.403	S	S	*	.	H	α-helix	trans	-60.4	-45.9	177	-173.5	179.5	-173.5	0	0	111.7	E257 E258 Q263 E264 G265	E257-E261 PolarHBondContact O-N 3.5Å; E258-E261 PolarHBondContact O-N 3.26Å; E261-Q263 PolarHBondContact O-N 2.95Å; E261-E264 PolarHBondContact O-N 3.27Å; E261-G265 PolarHBondContact O-N 3.48Å
262	I	86.5	Confident	84	Confident	58 Å²	58	80 Å²	80	30%	0.297	40%	0.399	S	S	.	.	H	α-helix	trans	-63.6	-41.9	175.7	-70	164.6	0	0	0	110.7	Y128 L132 P253 E258 R260 E264 G265 L266	Y128-I262 HydrophobicContact CE1-CG2 3.92Å; L132-I262 HydrophobicContact CD1-CG2 4Å; P253-I262 HydrophobicContact CB-CD1 4.07Å; P253-I262 HydrophobicContact CG-CD1 3.42Å; P253-I262 VanDerWaalsContact CG-CD1 3.42Å; E258-I262 WeakPolarHBondContact O-CB 3.49Å; E258-I262 WeakPolarHBondContact O-CD1 3.27Å; E258-I262 VanDerWaalsContact O-CG1 3.25Å; E258-I262 WeakPolarHBondContact O-CG1 3.31Å; E258-I262 PolarHBondContact O-N 2.99Å; R260-I262 PolarHBondContact O-N 2.94Å; I262-E264 PolarHBondContact O-N 3.35Å; I262-G265 PolarHBondContact O-N 3.06Å; I262-L266 HydrophobicContact CG2-CD1 3.82Å; I262-L266 HydrophobicContact CG2-CG 4.15Å; I262-L266 WeakPolarHBondContact O-CB 3.35Å; I262-L266 WeakPolarHBondContact O-CG 3.42Å; I262-L266 PolarHBondContact O-N 2.86Å
263	Q	84.3	Confident	84.7	Confident	45 Å²	45	80.2 Å²	80.2	21%	0.21	40%	0.402	C	S	.	.	H	α-helix	trans	-63.2	-42	178.6	-172.7	176.5	6.4	0	0	112.2	R259 R260 E261 L266 N267	R259-Q263 VanDerWaalsContact O-CB 3.26Å; R259-Q263 WeakPolarHBondContact O-CB 3.37Å; R259-Q263 PolarHBondContact O-N 3.43Å; R260-Q263 PolarHBondContact O-N 3.32Å; E261-Q263 PolarHBondContact O-N 2.95Å; Q263-L266 PolarHBondContact O-N 3.32Å; Q263-N267 WeakPolarHBondContact O-CB 3.48Å; Q263-N267 VanDerWaalsContact O-CG 3.22Å; Q263-N267 PolarHBondContact O-N 2.91Å; Q263-N267 PolarHBondContact O-ND2 3.48Å
264	E	87.3	Confident	85.4	Confident	133 Å²	133	85.1 Å²	85.1	62%	0.621	42%	0.42	S	S	*	.	H	α-helix	trans	-65.9	-41.6	174.3	-71.5	175.3	-171.8	0	0	111.6	R260 E261 I262 L266 N267 T268	R260-E264 WeakPolarHBondContact O-CG 3.19Å; R260-E264 PolarHBondContact O-N 3.3Å; E261-E264 PolarHBondContact O-N 3.27Å; I262-E264 PolarHBondContact O-N 3.35Å; E264-L266 PolarHBondContact O-N 3.25Å; E264-N267 PolarHBondContact O-N 3.48Å; E264-T268 WeakPolarHBondContact O-CG2 3.44Å; E264-T268 PolarHBondContact O-N 3.23Å; E264-T268 VanDerWaalsContact O-N 3.09Å; E264-T268 PolarHBondContact O-OG1 3.01Å
265	G	90.7	Very high	86.6	Confident	41 Å²	41	83.1 Å²	83.1	42%	0.423	41%	0.412	S	S	.	.	H	α-helix	trans	-63.9	-36.2	174.4	0	0	0	0	0	114	E261 I262 T268 R269	E261-G265 PolarHBondContact O-N 3.48Å; I262-G265 PolarHBondContact O-N 3.06Å; G265-T268 PolarHBondContact O-OG1 3.48Å; G265-R269 WeakPolarHBondContact O-CB 3.07Å; G265-R269 PolarHBondContact O-N 2.76Å
266	L	90.1	Very high	87.5	Confident	15 Å²	15	83.4 Å²	83.4	8%	0.079	41%	0.413	C	S	.	.	H	α-helix	trans	-69.8	-44.2	174.5	-70.1	168.8	0	0	0	111.3	L125 Y128 L132 I262 Q263 E264 T268 R269 I270	L125-L266 HydrophobicContact CD2-CD2 3.58Å; Y128-L266 HydrophobicContact CD1-CD1 3.29Å; Y128-L266 HydrophobicContact CD1-CD2 3.66Å; Y128-L266 HydrophobicContact CD1-CG 4.08Å; Y128-L266 HydrophobicContact CE1-CD1 3.59Å; Y128-L266 HydrophobicContact CE1-CD2 4.13Å; Y128-L266 HydrophobicContact CE1-CG 4.34Å; Y128-L266 HydrophobicContact CG-CD1 4Å; L132-L266 HydrophobicContact CD1-CD1 3.79Å; I262-L266 HydrophobicContact CG2-CD1 3.82Å; I262-L266 HydrophobicContact CG2-CG 4.15Å; I262-L266 WeakPolarHBondContact O-CB 3.35Å; I262-L266 WeakPolarHBondContact O-CG 3.42Å; I262-L266 PolarHBondContact O-N 2.86Å; Q263-L266 PolarHBondContact O-N 3.32Å; E264-L266 PolarHBondContact O-N 3.25Å; L266-T268 VanDerWaalsContact C-N 3.33Å; L266-T268 PolarHBondContact O-N 3.38Å; L266-R269 PolarHBondContact O-N 3.11Å; L266-I270 WeakPolarHBondContact O-CB 3.37Å; L266-I270 WeakPolarHBondContact O-CG1 3.22Å; L266-I270 PolarHBondContact O-N 2.9Å
267	N	89.6	Confident	88.3	Confident	64 Å²	64	81.9 Å²	81.9	34%	0.342	40%	0.398	S	S	.	.	H	α-helix	trans	-60	-42.6	179	-74.7	-26.6	0	0	0	112	Q263 E264 I270 Q271	Q263-N267 WeakPolarHBondContact O-CB 3.48Å; Q263-N267 VanDerWaalsContact O-CG 3.22Å; Q263-N267 PolarHBondContact O-N 2.91Å; Q263-N267 PolarHBondContact O-ND2 3.48Å; E264-N267 PolarHBondContact O-N 3.48Å; N267-I270 PolarHBondContact O-N 2.9Å; N267-Q271 WeakPolarHBondContact O-CG 3.19Å; N267-Q271 PolarHBondContact O-N 3.43Å
268	T	92.8	Very high	88.9	Confident	77 Å²	77	80 Å²	80	47%	0.472	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-46	175.5	50.9	0	0	0	0	111.5	E264 G265 L266 I270 Q271 D272	E264-T268 WeakPolarHBondContact O-CG2 3.44Å; E264-T268 PolarHBondContact O-N 3.23Å; E264-T268 VanDerWaalsContact O-N 3.09Å; E264-T268 PolarHBondContact O-OG1 3.01Å; G265-T268 PolarHBondContact O-OG1 3.48Å; L266-T268 VanDerWaalsContact C-N 3.33Å; L266-T268 PolarHBondContact O-N 3.38Å; T268-I270 VanDerWaalsContact C-N 3.35Å; T268-I270 PolarHBondContact O-N 2.88Å; T268-Q271 WeakPolarHBondContact O-CB 3.44Å; T268-Q271 PolarHBondContact O-N 3.39Å; T268-D272 PolarHBondContact O-N 3.43Å
269	R	91.9	Very high	89.4	Confident	158 Å²	158	82.7 Å²	82.7	60%	0.596	40%	0.399	S	S	*	.	H	α-helix	trans	-64.8	-36	177.7	-168.5	168.5	-177.7	167.6	-1.9	113.4	L125 G265 L266 D272 L273	L125-R269 HydrophobicContact CD1-CG 4Å; G265-R269 WeakPolarHBondContact O-CB 3.07Å; G265-R269 PolarHBondContact O-N 2.76Å; L266-R269 PolarHBondContact O-N 3.11Å; R269-D272 PolarHBondContact O-N 3.23Å; R269-L273 WeakPolarHBondContact O-CB 3.34Å; R269-L273 WeakPolarHBondContact O-CG 3.4Å; R269-L273 PolarHBondContact O-N 3.41Å
270	I	91.9	Very high	90.1	Very high	17 Å²	17	82.4 Å²	82.4	9%	0.087	40%	0.402	C	S	.	.	H	α-helix	trans	-64.1	-45.4	174.4	-73.2	167.8	0	0	0	109.9	L125 I126 T129 L266 N267 T268 D272 L273 Y274	L125-I270 HydrophobicContact CB-CD1 4.09Å; L125-I270 HydrophobicContact CB-CG1 3.74Å; L125-I270 HydrophobicContact CD1-CG1 4.37Å; I126-I270 HydrophobicContact CG1-CD1 4.36Å; T129-I270 WeakPolarHBondContact OG1-CD1 3.39Å; L266-I270 WeakPolarHBondContact O-CB 3.37Å; L266-I270 WeakPolarHBondContact O-CG1 3.22Å; L266-I270 PolarHBondContact O-N 2.9Å; N267-I270 PolarHBondContact O-N 2.9Å; T268-I270 VanDerWaalsContact C-N 3.35Å; T268-I270 PolarHBondContact O-N 2.88Å; I270-D272 PolarHBondContact O-N 3.05Å; I270-L273 PolarHBondContact O-N 3.42Å; I270-Y274 HydrophobicContact CG2-CD2 3.54Å; I270-Y274 HydrophobicContact CG2-CE2 3.33Å; I270-Y274 WeakPolarHBondContact O-CD2 3.32Å; I270-Y274 PolarHBondContact O-N 3.46Å
271	Q	92.2	Very high	90.5	Very high	128 Å²	128	77.2 Å²	77.2	60%	0.598	38%	0.384	S	S	*	.	H	α-helix	trans	-60.3	-44.6	175.8	-73.6	176.1	-4.4	0	0	111.8	N267 T268 L273 Y274 T275	N267-Q271 WeakPolarHBondContact O-CG 3.19Å; N267-Q271 PolarHBondContact O-N 3.43Å; T268-Q271 WeakPolarHBondContact O-CB 3.44Å; T268-Q271 PolarHBondContact O-N 3.39Å; Q271-L273 PolarHBondContact O-N 3.38Å; Q271-Y274 PolarHBondContact O-N 2.99Å; Q271-T275 WeakPolarHBondContact O-CG2 3.31Å; Q271-T275 PolarHBondContact O-N 3.16Å
272	D	92.9	Very high	90.6	Very high	104 Å²	104	73.2 Å²	73.2	56%	0.556	37%	0.367	S	S	*	.	H	α-helix	trans	-59.8	-47.8	176.1	-71.9	-19.8	0	0	0	111.4	T268 R269 I270 Y274 T275 V276	T268-D272 PolarHBondContact O-N 3.43Å; R269-D272 PolarHBondContact O-N 3.23Å; I270-D272 PolarHBondContact O-N 3.05Å; D272-Y274 PolarHBondContact O-N 3.42Å; D272-T275 PolarHBondContact O-N 3.25Å; D272-T275 VanDerWaalsContact O-N 3.14Å; D272-T275 PolarHBondContact O-OG1 2.93Å; D272-V276 WeakPolarHBondContact O-CG2 3.4Å; D272-V276 PolarHBondContact O-N 3.13Å
273	L	91.7	Very high	90.8	Very high	29 Å²	29	75.5 Å²	75.5	15%	0.152	37%	0.373	C	S	.	.	H	α-helix	trans	-64	-37.2	177.8	-74.8	-179.3	0	0	0	112.9	L118 N121 L122 L125 R269 I270 Q271 T275 V276 L277	L118-L273 HydrophobicContact CD2-CD2 3.91Å; N121-L273 HydrophobicContact CB-CD1 4.5Å; L122-L273 HydrophobicContact CD1-CB 3.73Å; L125-L273 HydrophobicContact CD1-CD1 3.41Å; L125-L273 VanDerWaalsContact CD1-CD1 3.41Å; R269-L273 WeakPolarHBondContact O-CB 3.34Å; R269-L273 WeakPolarHBondContact O-CG 3.4Å; R269-L273 PolarHBondContact O-N 3.41Å; I270-L273 PolarHBondContact O-N 3.42Å; Q271-L273 PolarHBondContact O-N 3.38Å; L273-T275 VanDerWaalsContact C-N 3.3Å; L273-T275 PolarHBondContact O-N 3.07Å; L273-V276 PolarHBondContact O-N 3.39Å; L273-L277 VanDerWaalsContact O-CB 3.23Å; L273-L277 WeakPolarHBondContact O-CB 3.46Å; L273-L277 PolarHBondContact O-N 3.22Å
274	Y	91.4	Very high	91	Very high	117 Å²	117	74 Å²	74	46%	0.459	37%	0.366	S	S	.	.	H	α-helix	trans	-59.9	-42.5	172.5	-87	-59.4	0	0	0	111.4	L122 I126 I270 Q271 D272 V276 L277 H278	L122-Y274 HydrophobicContact CD1-CD1 4.05Å; L122-Y274 HydrophobicContact CD1-CD2 4.07Å; L122-Y274 HydrophobicContact CD1-CE1 4.09Å; L122-Y274 HydrophobicContact CD1-CE2 4.12Å; L122-Y274 HydrophobicContact CD1-CG 4.03Å; L122-Y274 HydrophobicContact CD2-CD1 4.31Å; L122-Y274 HydrophobicContact CD2-CE1 3.71Å; L122-Y274 HydrophobicContact CG-CE1 4.48Å; I126-Y274 WeakPolarHBondContact CD1-OH 3.43Å; I270-Y274 HydrophobicContact CG2-CD2 3.54Å; I270-Y274 HydrophobicContact CG2-CE2 3.33Å; I270-Y274 WeakPolarHBondContact O-CD2 3.32Å; I270-Y274 PolarHBondContact O-N 3.46Å; Q271-Y274 PolarHBondContact O-N 2.99Å; D272-Y274 PolarHBondContact O-N 3.42Å; Y274-V276 PolarHBondContact O-N 2.83Å; Y274-L277 PolarHBondContact O-N 2.95Å; Y274-H278 WeakPolarHBondContact O-CB 3.25Å; Y274-H278 PolarHBondContact O-N 3.4Å
275	T	92.8	Very high	91	Very high	72 Å²	72	74.2 Å²	74.2	44%	0.442	36%	0.361	S	S	.	.	H	α-helix	trans	-66.5	-38.5	178.6	74.3	0	0	0	0	112.1	Q271 D272 L273 K279	Q271-T275 WeakPolarHBondContact O-CG2 3.31Å; Q271-T275 PolarHBondContact O-N 3.16Å; D272-T275 PolarHBondContact O-N 3.25Å; D272-T275 VanDerWaalsContact O-N 3.14Å; D272-T275 PolarHBondContact O-OG1 2.93Å; L273-T275 VanDerWaalsContact C-N 3.3Å; L273-T275 PolarHBondContact O-N 3.07Å; T275-K279 VanDerWaalsContact O-CG 3.31Å; T275-K279 WeakPolarHBondContact O-CG 3.42Å; T275-K279 PolarHBondContact O-N 3.43Å; T275-K279 VanDerWaalsContact O-N 3.12Å
276	V	93.7	Very high	90.9	Very high	63 Å²	63	77.7 Å²	77.7	38%	0.382	37%	0.367	S	S	.	.	H	α-helix	trans	-68.7	-44	176.4	176.2	0	0	0	0	110.5	L118 D272 L273 Y274 H278 K279 T280	L118-V276 HydrophobicContact CD1-CG1 3.92Å; L118-V276 HydrophobicContact CD2-CG1 4.37Å; D272-V276 WeakPolarHBondContact O-CG2 3.4Å; D272-V276 PolarHBondContact O-N 3.13Å; L273-V276 PolarHBondContact O-N 3.39Å; Y274-V276 PolarHBondContact O-N 2.83Å; V276-H278 PolarHBondContact O-N 3.03Å; V276-K279 PolarHBondContact O-N 3.18Å; V276-T280 HydrophobicContact CG1-CG2 4.5Å; V276-T280 PolarHBondContact O-N 3.29Å; V276-T280 PolarHBondContact O-OG1 3.26Å; V276-T280 VanDerWaalsContact O-OG1 3.07Å
277	L	91.4	Very high	90.8	Very high	22 Å²	22	77.8 Å²	77.8	12%	0.115	37%	0.367	C	S	.	.	H	α-helix	trans	-58.9	-49.3	178	-176	66.4	0	0	0	110.3	K115 L118 L122 L273 Y274 K279 T280 E281	K115-L277 HydrophobicContact CG-CD1 4.15Å; L118-L277 HydrophobicContact CB-CD1 4.34Å; L122-L277 HydrophobicContact CD2-CD2 4.41Å; L273-L277 VanDerWaalsContact O-CB 3.23Å; L273-L277 WeakPolarHBondContact O-CB 3.46Å; L273-L277 PolarHBondContact O-N 3.22Å; Y274-L277 PolarHBondContact O-N 2.95Å; L277-K279 PolarHBondContact O-N 3.36Å; L277-T280 VanDerWaalsContact CA-OG1 3.29Å; L277-T280 WeakPolarHBondContact CA-OG1 3.47Å; L277-T280 PolarHBondContact O-N 3.12Å; L277-T280 VanDerWaalsContact O-N 3.13Å; L277-T280 PolarHBondContact O-OG1 3.19Å; L277-E281 WeakPolarHBondContact O-CG 3.35Å; L277-E281 PolarHBondContact O-N 2.76Å
278	H	91.1	Very high	90.7	Very high	108 Å²	108	75 Å²	75	50%	0.5	35%	0.352	S	S	.	.	H	α-helix	trans	-58.9	-46.1	178.1	-167.2	56.4	0	0	0	111.8	Y274 V276 T280 E281 D282	Y274-H278 WeakPolarHBondContact O-CB 3.25Å; Y274-H278 PolarHBondContact O-N 3.4Å; V276-H278 PolarHBondContact O-N 3.03Å; H278-T280 VanDerWaalsContact C-N 3.34Å; H278-T280 PolarHBondContact O-N 3.45Å; H278-E281 PolarHBondContact O-N 2.91Å; H278-D282 IonicContact CD2-OD2 3.7Å; H278-D282 IonicContact CE1-OD1 3.7Å; H278-D282 IonicContact CE1-OD2 3.97Å; H278-D282 IonicContact NE2-OD2 2.79Å; H278-D282 VanDerWaalsContact O-CG 3.31Å; H278-D282 PolarHBondContact O-N 3.47Å
279	K	91.9	Very high	90.4	Very high	148 Å²	148	74 Å²	74	64%	0.643	35%	0.348	S	S	*	.	H	α-helix	trans	-60.8	-39.9	174.9	-73.7	175.2	-177.9	175.7	0	112.8	T275 V276 L277 Y283	T275-K279 VanDerWaalsContact O-CG 3.31Å; T275-K279 WeakPolarHBondContact O-CG 3.42Å; T275-K279 PolarHBondContact O-N 3.43Å; T275-K279 VanDerWaalsContact O-N 3.12Å; V276-K279 PolarHBondContact O-N 3.18Å; L277-K279 PolarHBondContact O-N 3.36Å; K279-Y283 WeakPolarHBondContact O-CB 3.46Å; K279-Y283 PolarHBondContact O-N 3.29Å
280	T	91.3	Very high	90	Very high	33 Å²	33	73.3 Å²	73.3	20%	0.202	35%	0.349	C	S	.	.	H	α-helix	trans	-69.4	-34.8	176.3	47.4	0	0	0	0	112.6	L118 V276 L277 H278 L284	L118-T280 HydrophobicContact CD1-CG2 4.11Å; V276-T280 HydrophobicContact CG1-CG2 4.5Å; V276-T280 PolarHBondContact O-N 3.29Å; V276-T280 PolarHBondContact O-OG1 3.26Å; V276-T280 VanDerWaalsContact O-OG1 3.07Å; L277-T280 VanDerWaalsContact CA-OG1 3.29Å; L277-T280 WeakPolarHBondContact CA-OG1 3.47Å; L277-T280 PolarHBondContact O-N 3.12Å; L277-T280 VanDerWaalsContact O-N 3.13Å; L277-T280 PolarHBondContact O-OG1 3.19Å; H278-T280 VanDerWaalsContact C-N 3.34Å; H278-T280 PolarHBondContact O-N 3.45Å; T280-L284 VanDerWaalsContact O-CB 3.29Å; T280-L284 WeakPolarHBondContact O-CB 3.42Å; T280-L284 PolarHBondContact O-N 3.39Å
281	E	87.9	Confident	89.7	Confident	50 Å²	50	72.7 Å²	72.7	23%	0.234	35%	0.347	C	S	.	.	H	α-helix	trans	-69.5	-40.7	175	-71.8	-166.3	145.4	0	0	112.1	K115 L277 H278 Y283 L284 R285	K115-E281 HydrophobicContact CD-CG 4.3Å; K115-E281 WeakPolarHBondContact CE-OE1 3.18Å; K115-E281 IonicContact NZ-OE1 3.18Å; K115-E281 PolarHBondContact NZ-OE1 3.49Å; L277-E281 WeakPolarHBondContact O-CG 3.35Å; L277-E281 PolarHBondContact O-N 2.76Å; H278-E281 PolarHBondContact O-N 2.91Å; E281-Y283 VanDerWaalsContact C-N 3.35Å; E281-L284 PolarHBondContact O-N 3.37Å; E281-R285 WeakPolarHBondContact O-CB 3.29Å; E281-R285 WeakPolarHBondContact O-CG 3.42Å; E281-R285 PolarHBondContact O-N 3.03Å
282	D	89.8	Confident	89.4	Confident	55 Å²	55	66.8 Å²	66.8	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-64.4	-42.5	174.7	-70	-22.2	0	0	0	111	H278 R285 Q286	H278-D282 IonicContact CD2-OD2 3.7Å; H278-D282 IonicContact CE1-OD1 3.7Å; H278-D282 IonicContact CE1-OD2 3.97Å; H278-D282 IonicContact NE2-OD2 2.79Å; H278-D282 VanDerWaalsContact O-CG 3.31Å; H278-D282 PolarHBondContact O-N 3.47Å; D282-R285 PolarHBondContact O-N 2.81Å; D282-Q286 WeakPolarHBondContact O-CB 3.42Å; D282-Q286 VanDerWaalsContact O-CG 3.26Å; D282-Q286 WeakPolarHBondContact O-CG 3.5Å; D282-Q286 PolarHBondContact O-N 3.22Å
283	Y	90.1	Very high	88.9	Confident	106 Å²	106	69 Å²	69	42%	0.416	33%	0.327	S	S	.	.	H	α-helix	trans	-60.2	-48.2	173.6	-174.3	-102	0	0	0	111.6	E107 V111 K279 E281 R285 Q286 V287	E107-Y283 PolarHBondContact OE1-OH 3.49Å; V111-Y283 HydrophobicContact CG1-CD1 4.45Å; V111-Y283 HydrophobicContact CG2-CD1 4.08Å; V111-Y283 HydrophobicContact CG2-CE1 3.96Å; K279-Y283 WeakPolarHBondContact O-CB 3.46Å; K279-Y283 PolarHBondContact O-N 3.29Å; E281-Y283 VanDerWaalsContact C-N 3.35Å; Y283-R285 PolarHBondContact O-N 2.89Å; Y283-Q286 PolarHBondContact O-N 3.49Å; Y283-V287 HydrophobicContact CD1-CG2 4.21Å; Y283-V287 HydrophobicContact CE1-CG2 3.79Å; Y283-V287 HydrophobicContact CE2-CG2 4.43Å; Y283-V287 WeakPolarHBondContact O-CG2 3.36Å; Y283-V287 PolarHBondContact O-N 3.47Å
284	L	88.8	Confident	88.4	Confident	15 Å²	15	68.8 Å²	68.8	8%	0.079	33%	0.328	C	S	.	.	H	α-helix	trans	-58.1	-47.3	177.2	178.1	62.2	0	0	0	111.4	L108 V111 K115 T280 E281 Q286 V287 L288	L108-L284 HydrophobicContact CD1-CD1 3.3Å; L108-L284 HydrophobicContact CG-CD1 4.46Å; V111-L284 HydrophobicContact CG1-CB 3.99Å; V111-L284 HydrophobicContact CG1-CD1 4Å; V111-L284 HydrophobicContact CG1-CG 4.48Å; K115-L284 HydrophobicContact CD-CD2 4.02Å; T280-L284 VanDerWaalsContact O-CB 3.29Å; T280-L284 WeakPolarHBondContact O-CB 3.42Å; T280-L284 PolarHBondContact O-N 3.39Å; E281-L284 PolarHBondContact O-N 3.37Å; L284-Q286 VanDerWaalsContact C-N 3.34Å; L284-Q286 PolarHBondContact O-N 2.94Å; L284-V287 PolarHBondContact O-N 3Å; L284-L288 HydrophobicContact CD1-CD1 4.08Å; L284-L288 HydrophobicContact CD1-CG 4.22Å; L284-L288 HydrophobicContact CG-CD1 3.92Å; L284-L288 HydrophobicContact CG-CG 4.46Å; L284-L288 WeakPolarHBondContact O-CB 3.03Å; L284-L288 VanDerWaalsContact O-CG 3.29Å; L284-L288 WeakPolarHBondContact O-CG 3.16Å; L284-L288 PolarHBondContact O-N 3.04Å
285	R	87.7	Confident	88	Confident	136 Å²	136	63.2 Å²	63.2	51%	0.513	31%	0.306	S	S	.	.	H	α-helix	trans	-60.5	-42.3	176.2	-79.8	-173.1	177.9	129.2	-0.8	111.9	E281 D282 Y283 V287 L288 C289	E281-R285 WeakPolarHBondContact O-CB 3.29Å; E281-R285 WeakPolarHBondContact O-CG 3.42Å; E281-R285 PolarHBondContact O-N 3.03Å; D282-R285 PolarHBondContact O-N 2.81Å; Y283-R285 PolarHBondContact O-N 2.89Å; R285-V287 PolarHBondContact O-N 2.91Å; R285-L288 PolarHBondContact O-N 3.48Å; R285-C289 WeakPolarHBondContact O-CB 3.45Å; R285-C289 PolarHBondContact O-N 3.26Å; R285-C289 PolarHBondContact O-SG 2.94Å
286	Q	88.8	Confident	87.5	Confident	115 Å²	115	61.3 Å²	61.3	54%	0.537	29%	0.291	S	S	.	.	H	α-helix	trans	-62.8	-42.4	177.5	-74	174.4	14.7	0	0	112.3	D282 Y283 L284 K290	D282-Q286 WeakPolarHBondContact O-CB 3.42Å; D282-Q286 VanDerWaalsContact O-CG 3.26Å; D282-Q286 WeakPolarHBondContact O-CG 3.5Å; D282-Q286 PolarHBondContact O-N 3.22Å; Y283-Q286 PolarHBondContact O-N 3.49Å; L284-Q286 VanDerWaalsContact C-N 3.34Å; L284-Q286 PolarHBondContact O-N 2.94Å; Q286-K290 WeakPolarHBondContact O-CG 3.43Å; Q286-K290 PolarHBondContact O-N 3.11Å; Q286-K290 VanDerWaalsContact O-N 3.12Å
287	V	87.2	Confident	87	Confident	16 Å²	16	60.2 Å²	60.2	10%	0.097	29%	0.286	C	S	.	.	H	α-helix	trans	-65.2	-44.3	175.9	174.5	0	0	0	0	110.6	L104 Y283 L284 R285 K290 A291	L104-V287 HydrophobicContact CD1-CG1 3.71Å; Y283-V287 HydrophobicContact CD1-CG2 4.21Å; Y283-V287 HydrophobicContact CE1-CG2 3.79Å; Y283-V287 HydrophobicContact CE2-CG2 4.43Å; Y283-V287 WeakPolarHBondContact O-CG2 3.36Å; Y283-V287 PolarHBondContact O-N 3.47Å; L284-V287 PolarHBondContact O-N 3Å; R285-V287 PolarHBondContact O-N 2.91Å; V287-K290 PolarHBondContact O-N 3.38Å; V287-A291 WeakPolarHBondContact O-CB 3.49Å; V287-A291 PolarHBondContact O-N 3.34Å
288	L	87.4	Confident	86.7	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-64	-39.8	177.4	-73	172.1	0	0	0	112.5	E71 I72 A75 I77 L108 L284 R285 A291 A292	E71-L288 HydrophobicContact CB-CD2 4.18Å; I72-L288 HydrophobicContact CG1-CD2 3.98Å; A75-L288 HydrophobicContact CB-CD1 3.89Å; I77-L288 HydrophobicContact CD1-CB 3.6Å; I77-L288 HydrophobicContact CD1-CD1 4.38Å; L108-L288 HydrophobicContact CD1-CD2 3.82Å; L108-L288 HydrophobicContact CD1-CG 4.15Å; L108-L288 HydrophobicContact CD2-CD2 4.07Å; L284-L288 HydrophobicContact CD1-CD1 4.08Å; L284-L288 HydrophobicContact CD1-CG 4.22Å; L284-L288 HydrophobicContact CG-CD1 3.92Å; L284-L288 HydrophobicContact CG-CG 4.46Å; L284-L288 WeakPolarHBondContact O-CB 3.03Å; L284-L288 VanDerWaalsContact O-CG 3.29Å; L284-L288 WeakPolarHBondContact O-CG 3.16Å; L284-L288 PolarHBondContact O-N 3.04Å; R285-L288 PolarHBondContact O-N 3.48Å; L288-A291 WeakPolarHBondContact O-CB 3.42Å; L288-A291 PolarHBondContact O-N 3.34Å; L288-A292 WeakPolarHBondContact O-CB 3.45Å; L288-A292 PolarHBondContact O-N 3.41Å
289	C	86.1	Confident	86.4	Confident	56 Å²	56	56.7 Å²	56.7	38%	0.378	27%	0.269	S	S	.	.	H	α-helix	trans	-62.1	-45.9	174.5	-72.3	0	0	0	0	111.5	R285 A291 A292 E293	R285-C289 WeakPolarHBondContact O-CB 3.45Å; R285-C289 PolarHBondContact O-N 3.26Å; R285-C289 PolarHBondContact O-SG 2.94Å; C289-A291 VanDerWaalsContact C-N 3.28Å; C289-A291 PolarHBondContact O-N 3.26Å; C289-A292 PolarHBondContact O-N 3.21Å; C289-E293 PolarHBondContact O-N 2.96Å
290	K	84.7	Confident	85.9	Confident	144 Å²	144	50.7 Å²	50.7	63%	0.626	24%	0.243	S	C	*	.	H	α-helix	trans	-62.6	-36.4	175.2	-71	175.9	-176.8	177.1	0	112.1	Q286 V287	Q286-K290 WeakPolarHBondContact O-CG 3.43Å; Q286-K290 PolarHBondContact O-N 3.11Å; Q286-K290 VanDerWaalsContact O-N 3.12Å; V287-K290 PolarHBondContact O-N 3.38Å
291	A	85.5	Confident	85.7	Confident	4 Å²	4	50.9 Å²	50.9	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-65.8	-48.6	174	0	0	0	0	0	110.7	L104 V287 L288 C289 E293 S294 V295	L104-A291 HydrophobicContact CD2-CB 3.9Å; V287-A291 WeakPolarHBondContact O-CB 3.49Å; V287-A291 PolarHBondContact O-N 3.34Å; L288-A291 WeakPolarHBondContact O-CB 3.42Å; L288-A291 PolarHBondContact O-N 3.34Å; C289-A291 VanDerWaalsContact C-N 3.28Å; C289-A291 PolarHBondContact O-N 3.26Å; A291-E293 VanDerWaalsContact C-N 3.26Å; A291-E293 PolarHBondContact O-N 2.97Å; A291-S294 PolarHBondContact O-N 3.22Å; A291-S294 PolarHBondContact O-OG 3.42Å; A291-V295 HydrophobicContact CB-CG2 4.22Å; A291-V295 WeakPolarHBondContact O-CB 3.26Å; A291-V295 WeakPolarHBondContact O-CG2 3.32Å; A291-V295 PolarHBondContact O-N 3.25Å
292	A	84.4	Confident	85.7	Confident	4 Å²	4	48.6 Å²	48.6	3%	0.033	23%	0.231	C	C	.	.	H	α-helix	trans	-56.3	-36.3	-176.6	0	0	0	0	0	113.3	I72 I77 L288 C289 S294	I72-A292 HydrophobicContact CD1-CB 4.12Å; I72-A292 HydrophobicContact CG2-CB 4.29Å; I77-A292 HydrophobicContact CG2-CB 4.15Å; L288-A292 WeakPolarHBondContact O-CB 3.45Å; L288-A292 PolarHBondContact O-N 3.41Å; C289-A292 PolarHBondContact O-N 3.21Å; A292-S294 VanDerWaalsContact C-N 3.28Å; A292-S294 PolarHBondContact O-N 3.32Å
293	E	83.3	Confident	85.6	Confident	150 Å²	150	48 Å²	48	70%	0.701	23%	0.226	S	C	*	.	H	α-helix	trans	-60.4	-34.3	175.9	-71.4	176.3	-172.9	0	0	113.3	C289 A291	C289-E293 PolarHBondContact O-N 2.96Å; A291-E293 VanDerWaalsContact C-N 3.26Å; A291-E293 PolarHBondContact O-N 2.97Å
294	S	81.7	Confident	85.4	Confident	26 Å²	26	43.1 Å²	43.1	18%	0.182	21%	0.207	C	C	.	.	H	α-helix	trans	-111.8	-14.4	-173.1	70.7	0	0	0	0	114.6	A291 A292 Y296 S297 R298	A291-S294 PolarHBondContact O-N 3.22Å; A291-S294 PolarHBondContact O-OG 3.42Å; A292-S294 VanDerWaalsContact C-N 3.28Å; A292-S294 PolarHBondContact O-N 3.32Å; S294-Y296 VanDerWaalsContact C-N 3.29Å; S294-Y296 PolarHBondContact O-N 3.22Å; S294-S297 PolarHBondContact O-N 2.97Å; S294-S297 PolarHBondContact O-OG 3.26Å; S294-R298 WeakPolarHBondContact O-CB 3.3Å; S294-R298 VanDerWaalsContact O-CG 3.23Å; S294-R298 WeakPolarHBondContact O-CG 3.45Å; S294-R298 PolarHBondContact O-N 2.89Å; S294-R298 PolarHBondContact OG-NE 3.5Å; S294-R298 PolarHBondContact OG-NH2 2.88Å; S294-R298 VanDerWaalsContact OG-NH2 3.12Å
295	V	83.6	Confident	85.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-38.9	-179.1	161.4	0	0	0	0	111.1	L68 V69 I72 A291 S297 R298 V299	L68-V295 HydrophobicContact CB-CG2 4.42Å; L68-V295 HydrophobicContact CD1-CG2 4.37Å; V69-V295 HydrophobicContact CG2-CG1 3.55Å; I72-V295 HydrophobicContact CD1-CB 4.4Å; I72-V295 HydrophobicContact CD1-CG1 4.47Å; I72-V295 HydrophobicContact CD1-CG2 4.09Å; A291-V295 HydrophobicContact CB-CG2 4.22Å; A291-V295 WeakPolarHBondContact O-CB 3.26Å; A291-V295 WeakPolarHBondContact O-CG2 3.32Å; A291-V295 PolarHBondContact O-N 3.25Å; V295-S297 PolarHBondContact O-N 3.23Å; V295-R298 PolarHBondContact O-N 3.41Å; V295-V299 HydrophobicContact CG1-CG2 4.42Å; V295-V299 WeakPolarHBondContact O-CG2 3.44Å; V295-V299 PolarHBondContact O-N 3.4Å
296	Y	80.6	Confident	85.4	Confident	32 Å²	32	38.8 Å²	38.8	13%	0.125	19%	0.191	C	C	.	.	H	α-helix	trans	-58.8	-50.3	179.5	-177.7	-87.5	0	0	0	112.1	G82 S294 I300 F849	G82-Y296 PolarHBondContact O-OH 2.55Å; S294-Y296 VanDerWaalsContact C-N 3.29Å; S294-Y296 PolarHBondContact O-N 3.22Å; Y296-I300 HydrophobicContact CD1-CD1 3.99Å; Y296-I300 HydrophobicContact CE1-CD1 3.36Å; Y296-I300 PolarHBondContact O-N 3.3Å; Y296-F849 AromaticContact CD2-CE2 3.28Å; Y296-F849 HydrophobicContact CD2-CE2 3.28Å; Y296-F849 AromaticContact CD2-CZ 3.29Å; Y296-F849 HydrophobicContact CD2-CZ 3.29Å; Y296-F849 AromaticContact CE2-CE2 3.51Å; Y296-F849 HydrophobicContact CE2-CE2 3.51Å; Y296-F849 AromaticContact CE2-CZ 3.86Å; Y296-F849 HydrophobicContact CE2-CZ 3.86Å; Y296-F849 HydrophobicContact CG-CE2 4.34Å; Y296-F849 AromaticContact CG-CZ 3.93Å; Y296-F849 HydrophobicContact CG-CZ 3.93Å
297	S	83	Confident	85.4	Confident	39 Å²	39	34.3 Å²	34.3	27%	0.273	17%	0.174	S	C	.	.	H	α-helix	trans	-66.7	-40.8	179.7	58.7	0	0	0	0	112.1	S294 V295 V299 I300 Q301	S294-S297 PolarHBondContact O-N 2.97Å; S294-S297 PolarHBondContact O-OG 3.26Å; V295-S297 PolarHBondContact O-N 3.23Å; S297-V299 PolarHBondContact O-N 2.84Å; S297-I300 PolarHBondContact O-N 2.81Å; S297-Q301 VanDerWaalsContact O-CG 3.32Å; S297-Q301 WeakPolarHBondContact O-CG 3.05Å; S297-Q301 PolarHBondContact O-N 3.03Å
298	R	85.2	Confident	85.5	Confident	41 Å²	41	33.5 Å²	33.5	16%	0.155	17%	0.169	C	C	.	.	H	α-helix	trans	-63.8	-38.4	-179.8	-70.5	177.3	-154.1	-115.1	1.6	112.1	L65 M97 S294 V295 Q301 V302	L65-R298 HydrophobicContact CD1-CB 4.49Å; L65-R298 HydrophobicContact CD2-CB 4.03Å; M97-R298 HydrophobicContact SD-CG 4.45Å; S294-R298 WeakPolarHBondContact O-CB 3.3Å; S294-R298 VanDerWaalsContact O-CG 3.23Å; S294-R298 WeakPolarHBondContact O-CG 3.45Å; S294-R298 PolarHBondContact O-N 2.89Å; S294-R298 PolarHBondContact OG-NE 3.5Å; S294-R298 PolarHBondContact OG-NH2 2.88Å; S294-R298 VanDerWaalsContact OG-NH2 3.12Å; V295-R298 PolarHBondContact O-N 3.41Å; R298-Q301 PolarHBondContact O-N 3.04Å; R298-V302 WeakPolarHBondContact O-CG2 3.44Å; R298-V302 PolarHBondContact O-N 2.85Å
299	V	84.8	Confident	85.6	Confident	16 Å²	16	33.8 Å²	33.8	10%	0.097	17%	0.17	C	C	.	.	H	α-helix	trans	-62.5	-45.7	176.1	166.9	0	0	0	0	111.7	L65 V295 S297 Q301 V302 K303 F849	L65-V299 HydrophobicContact CB-CG2 3.77Å; L65-V299 HydrophobicContact CD1-CG2 3.85Å; L65-V299 HydrophobicContact CD2-CG2 4.09Å; L65-V299 HydrophobicContact CG-CG2 4.13Å; V295-V299 HydrophobicContact CG1-CG2 4.42Å; V295-V299 WeakPolarHBondContact O-CG2 3.44Å; V295-V299 PolarHBondContact O-N 3.4Å; S297-V299 PolarHBondContact O-N 2.84Å; V299-Q301 VanDerWaalsContact C-N 3.32Å; V299-Q301 PolarHBondContact O-N 3.25Å; V299-V302 PolarHBondContact O-N 3.08Å; V299-K303 HydrophobicContact CG1-CD 4.12Å; V299-K303 WeakPolarHBondContact O-CB 3.37Å; V299-K303 WeakPolarHBondContact O-CG 3.5Å; V299-K303 PolarHBondContact O-N 3.07Å; V299-F849 HydrophobicContact CB-CD1 4.33Å; V299-F849 HydrophobicContact CB-CE1 3.54Å; V299-F849 HydrophobicContact CB-CZ 4.24Å; V299-F849 HydrophobicContact CG1-CD1 4.09Å; V299-F849 HydrophobicContact CG1-CE1 3.65Å; V299-F849 HydrophobicContact CG1-CZ 4.31Å; V299-F849 HydrophobicContact CG2-CD1 4.09Å; V299-F849 HydrophobicContact CG2-CE1 3.57Å
300	I	83.3	Confident	85.7	Confident	21 Å²	21	35.7 Å²	35.7	11%	0.108	17%	0.173	C	C	.	.	H	α-helix	trans	-63.1	-43	178	-63.6	171.8	0	0	0	110.3	P86 Y296 S297 K303 K304	P86-I300 HydrophobicContact CG-CB 4.08Å; P86-I300 HydrophobicContact CG-CG2 4.08Å; Y296-I300 HydrophobicContact CD1-CD1 3.99Å; Y296-I300 HydrophobicContact CE1-CD1 3.36Å; Y296-I300 PolarHBondContact O-N 3.3Å; S297-I300 PolarHBondContact O-N 2.81Å; I300-K303 PolarHBondContact O-N 3.24Å; I300-K304 HydrophobicContact CG2-CD 4.28Å; I300-K304 HydrophobicContact CG2-CG 4.35Å; I300-K304 WeakPolarHBondContact O-CB 3.42Å; I300-K304 WeakPolarHBondContact O-CG 3.27Å; I300-K304 PolarHBondContact O-N 2.8Å
301	Q	86.3	Confident	85.9	Confident	37 Å²	37	30.1 Å²	30.1	17%	0.173	15%	0.15	C	C	.	.	H	α-helix	trans	-61.2	-45.3	177.8	-74.1	176.7	-21.6	0	0	112.6	P86 P89 S297 R298 V299 K304 M305	P86-Q301 HydrophobicContact CB-CG 4.4Å; P86-Q301 HydrophobicContact CG-CG 4.16Å; P89-Q301 HydrophobicContact CG-CB 4.08Å; P89-Q301 HydrophobicContact CG-CG 4.48Å; S297-Q301 VanDerWaalsContact O-CG 3.32Å; S297-Q301 WeakPolarHBondContact O-CG 3.05Å; S297-Q301 PolarHBondContact O-N 3.03Å; R298-Q301 PolarHBondContact O-N 3.04Å; V299-Q301 VanDerWaalsContact C-N 3.32Å; V299-Q301 PolarHBondContact O-N 3.25Å; Q301-K304 PolarHBondContact O-N 3.48Å; Q301-M305 VanDerWaalsContact O-CB 3.3Å; Q301-M305 WeakPolarHBondContact O-CB 3.44Å; Q301-M305 PolarHBondContact O-N 3.25Å
302	V	87.9	Confident	86	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-65.1	-41.4	176.9	172	0	0	0	0	111.3	L61 E62 L65 M97 R298 V299 M305 K306	L61-V302 HydrophobicContact CB-CG1 4.12Å; L61-V302 HydrophobicContact CB-CG2 4.14Å; L61-V302 HydrophobicContact CD1-CG2 4.4Å; E62-V302 HydrophobicContact CB-CG1 4.31Å; L65-V302 HydrophobicContact CD1-CB 4.09Å; L65-V302 HydrophobicContact CD1-CG2 3.73Å; M97-V302 HydrophobicContact CE-CG2 3.53Å; M97-V302 HydrophobicContact SD-CG2 4.4Å; R298-V302 WeakPolarHBondContact O-CG2 3.44Å; R298-V302 PolarHBondContact O-N 2.85Å; V299-V302 PolarHBondContact O-N 3.08Å; V302-M305 PolarHBondContact O-N 3.12Å; V302-K306 WeakPolarHBondContact O-CB 3.33Å; V302-K306 PolarHBondContact O-N 3.21Å
303	K	86.6	Confident	86.3	Confident	44 Å²	44	30.6 Å²	30.6	19%	0.191	15%	0.151	C	C	.	.	H	α-helix	trans	-61.8	-46.3	175.1	-78.2	-179.3	171.9	177.6	0	112.1	V299 I300 M305 K306 A307 L845 S846 K848	V299-K303 HydrophobicContact CG1-CD 4.12Å; V299-K303 WeakPolarHBondContact O-CB 3.37Å; V299-K303 WeakPolarHBondContact O-CG 3.5Å; V299-K303 PolarHBondContact O-N 3.07Å; I300-K303 PolarHBondContact O-N 3.24Å; K303-M305 VanDerWaalsContact C-N 3.35Å; K303-M305 PolarHBondContact O-N 3.06Å; K303-K306 PolarHBondContact O-N 3.43Å; K303-A307 PolarHBondContact O-N 3.15Å; K303-L845 HydrophobicContact CB-CD2 4.37Å; K303-S846 PolarHBondContact NZ-O 3.44Å; K303-K848 PolarHBondContact NZ-O 3.03Å
304	K	87.2	Confident	86.4	Confident	3 Å²	3	25 Å²	25	1%	0.013	13%	0.125	C	C	.	.	H	α-helix	trans	-59.2	-45.8	174.8	-74	-173.2	175.7	-169.2	0	111.1	E31 P86 A88 I300 Q301 A307 I308 F842 L845	E31-K304 IonicContact OE1-NZ 3.87Å; E31-K304 PolarHBondContact OE1-NZ 3.46Å; E31-K304 IonicContact OE2-NZ 3.54Å; P86-K304 WeakPolarHBondContact O-CE 3.16Å; P86-K304 PolarHBondContact O-NZ 2.99Å; A88-K304 HydrophobicContact CB-CB 4.32Å; A88-K304 HydrophobicContact CB-CD 4.28Å; I300-K304 HydrophobicContact CG2-CD 4.28Å; I300-K304 HydrophobicContact CG2-CG 4.35Å; I300-K304 WeakPolarHBondContact O-CB 3.42Å; I300-K304 WeakPolarHBondContact O-CG 3.27Å; I300-K304 PolarHBondContact O-N 2.8Å; Q301-K304 PolarHBondContact O-N 3.48Å; K304-A307 WeakPolarHBondContact O-CB 3.48Å; K304-A307 PolarHBondContact O-N 3.14Å; K304-I308 WeakPolarHBondContact O-CG1 3.5Å; K304-I308 PolarHBondContact O-N 3.22Å; K304-F842 HydrophobicContact CB-CD1 4.18Å; K304-F842 HydrophobicContact CB-CE1 4.02Å; K304-F842 HydrophobicContact CB-CZ 4.36Å; K304-F842 HydrophobicContact CD-CB 4.37Å; K304-F842 HydrophobicContact CD-CD1 4.38Å; K304-F842 HydrophobicContact CD-CD2 4Å; K304-F842 HydrophobicContact CD-CE2 4.37Å; K304-F842 HydrophobicContact CD-CG 4.01Å; K304-F842 HydrophobicContact CG-CB 4.28Å; K304-F842 HydrophobicContact CG-CD1 3.77Å; K304-F842 HydrophobicContact CG-CD2 4.29Å; K304-F842 HydrophobicContact CG-CE1 4.12Å; K304-F842 HydrophobicContact CG-CG 3.87Å; K304-L845 HydrophobicContact CG-CD1 4.03Å
305	M	87	Confident	86.7	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.5	-46.2	178.6	179.5	170.5	76.5	0	0	112.6	Y23 C58 L61 V94 M97 Q301 V302 K303 A307 I308 Y309	Y23-M305 HydrophobicContact CE2-CG 4.39Å; C58-M305 HydrophobicContact CB-CE 4.32Å; C58-M305 WeakPolarHBondContact SG-CE 3.12Å; L61-M305 HydrophobicContact CD1-CE 3.93Å; V94-M305 HydrophobicContact CB-SD 4.14Å; V94-M305 HydrophobicContact CG1-CE 3.89Å; V94-M305 HydrophobicContact CG1-SD 3.37Å; V94-M305 WeakPolarHBondContact CG1-SD 3.41Å; V94-M305 HydrophobicContact CG2-SD 3.59Å; V94-M305 VanDerWaalsContact CG2-SD 3.59Å; M97-M305 HydrophobicContact CE-CE 4.42Å; Q301-M305 VanDerWaalsContact O-CB 3.3Å; Q301-M305 WeakPolarHBondContact O-CB 3.44Å; Q301-M305 PolarHBondContact O-N 3.25Å; V302-M305 PolarHBondContact O-N 3.12Å; K303-M305 VanDerWaalsContact C-N 3.35Å; K303-M305 PolarHBondContact O-N 3.06Å; M305-A307 VanDerWaalsContact C-N 3.3Å; M305-A307 PolarHBondContact O-N 3.07Å; M305-I308 PolarHBondContact O-N 2.95Å; M305-Y309 HydrophobicContact CG-CD2 3.69Å; M305-Y309 HydrophobicContact CG-CE2 3.38Å; M305-Y309 VanDerWaalsContact O-CD2 3.24Å; M305-Y309 WeakPolarHBondContact O-CD2 3.41Å; M305-Y309 PolarHBondContact O-N 2.91Å; M305-Y309 HydrophobicContact SD-CE2 3.99Å
306	K	88.6	Confident	86.8	Confident	59 Å²	59	25.5 Å²	25.5	26%	0.257	13%	0.129	S	C	.	.	H	α-helix	trans	-57.7	-44	175.3	-173.5	-179.5	-176.7	178.9	0	111.2	C58 E62 V302 K303 Y309 H310	C58-K306 HydrophobicContact CB-CB 3.99Å; C58-K306 HydrophobicContact CB-CG 4.27Å; E62-K306 IonicContact OE2-NZ 3.67Å; E62-K306 PolarHBondContact OE2-NZ 2.85Å; V302-K306 WeakPolarHBondContact O-CB 3.33Å; V302-K306 PolarHBondContact O-N 3.21Å; K303-K306 PolarHBondContact O-N 3.43Å; K306-Y309 PolarHBondContact O-N 3.37Å; K306-H310 WeakPolarHBondContact O-CB 3.42Å; K306-H310 PolarHBondContact O-N 2.77Å
307	A	88.4	Confident	86.8	Confident	21 Å²	21	28 Å²	28	17%	0.174	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-42.4	177.8	0	0	0	0	0	112.3	K303 K304 M305 H310 M311 F840 F842 L845	K303-A307 PolarHBondContact O-N 3.15Å; K304-A307 WeakPolarHBondContact O-CB 3.48Å; K304-A307 PolarHBondContact O-N 3.14Å; M305-A307 VanDerWaalsContact C-N 3.3Å; M305-A307 PolarHBondContact O-N 3.07Å; A307-H310 PolarHBondContact O-N 3.18Å; A307-M311 WeakPolarHBondContact O-CG 3.09Å; A307-M311 PolarHBondContact O-N 3.1Å; A307-F840 HydrophobicContact CB-CE2 4.05Å; A307-F842 HydrophobicContact CB-CE1 4.41Å; A307-L845 HydrophobicContact CB-CD1 4.43Å
308	I	89.8	Confident	86.6	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.8	-48.2	175.7	-65	163.4	0	0	0	111	Y23 L26 A88 K304 M305 H310 M311 L312 F840 F842	Y23-I308 HydrophobicContact CD2-CG2 3.61Å; Y23-I308 HydrophobicContact CE1-CD1 4.25Å; Y23-I308 HydrophobicContact CE2-CB 4.18Å; Y23-I308 HydrophobicContact CE2-CD1 4.13Å; Y23-I308 HydrophobicContact CE2-CG2 3.76Å; Y23-I308 HydrophobicContact CG-CG2 4.28Å; L26-I308 HydrophobicContact CB-CG2 3.93Å; L26-I308 HydrophobicContact CD1-CG2 4.19Å; A88-I308 HydrophobicContact CB-CD1 4.12Å; K304-I308 WeakPolarHBondContact O-CG1 3.5Å; K304-I308 PolarHBondContact O-N 3.22Å; M305-I308 PolarHBondContact O-N 2.95Å; I308-H310 VanDerWaalsContact C-N 3.29Å; I308-H310 PolarHBondContact O-N 3.49Å; I308-M311 PolarHBondContact O-N 2.81Å; I308-M311 VanDerWaalsContact O-N 3.16Å; I308-L312 HydrophobicContact CG2-CD1 4.21Å; I308-L312 PolarHBondContact O-N 3.49Å; I308-F840 HydrophobicContact CG1-CZ 4.35Å; I308-F842 HydrophobicContact CD1-CZ 3.86Å; I308-F842 HydrophobicContact CG1-CE1 4.1Å; I308-F842 HydrophobicContact CG1-CZ 3.74Å
309	Y	89.2	Confident	85.9	Confident	11 Å²	11	31.6 Å²	31.6	4%	0.043	16%	0.164	C	C	.	.	H	α-helix	trans	-66	-32.2	178.7	-73.4	-58.9	0	0	0	112.9	Y23 F51 E54 L91 M305 K306 L312 N313	Y23-Y309 HydrophobicContact CD2-CE1 4.16Å; Y23-Y309 HydrophobicContact CE2-CE1 4.28Å; Y23-Y309 HydrophobicContact CE2-CE2 4.06Å; Y23-Y309 AromaticContact CE2-CZ 3.86Å; F51-Y309 HydrophobicContact CB-CD1 4.5Å; F51-Y309 HydrophobicContact CD1-CD1 4.38Å; E54-Y309 HydrophobicContact CB-CD1 3.79Å; E54-Y309 HydrophobicContact CB-CD2 4.06Å; E54-Y309 HydrophobicContact CB-CE1 3.84Å; E54-Y309 HydrophobicContact CB-CE2 4.07Å; E54-Y309 HydrophobicContact CB-CG 3.92Å; E54-Y309 HydrophobicContact CG-CD1 4.28Å; E54-Y309 HydrophobicContact CG-CE1 3.93Å; L91-Y309 WeakPolarHBondContact CD1-OH 3.44Å; M305-Y309 HydrophobicContact CG-CD2 3.69Å; M305-Y309 HydrophobicContact CG-CE2 3.38Å; M305-Y309 VanDerWaalsContact O-CD2 3.24Å; M305-Y309 WeakPolarHBondContact O-CD2 3.41Å; M305-Y309 PolarHBondContact O-N 2.91Å; M305-Y309 HydrophobicContact SD-CE2 3.99Å; K306-Y309 PolarHBondContact O-N 3.37Å; Y309-L312 HydrophobicContact CD1-CD1 3.84Å; Y309-L312 HydrophobicContact CE1-CD1 4.25Å; Y309-L312 PolarHBondContact O-N 3.12Å; Y309-N313 PolarHBondContact O-N 3.17Å; Y309-N313 VanDerWaalsContact O-N 3.13Å; Y309-N313 PolarHBondContact O-ND2 3.17Å
310	H	88.8	Confident	85.1	Confident	95 Å²	95	36.1 Å²	36.1	44%	0.44	19%	0.192	S	C	.	.	H	α-helix	trans	-64.3	-42.6	172	-167.8	67.3	0	0	0	111.4	K306 A307 I308 N313 M314	K306-H310 WeakPolarHBondContact O-CB 3.42Å; K306-H310 PolarHBondContact O-N 2.77Å; A307-H310 PolarHBondContact O-N 3.18Å; I308-H310 VanDerWaalsContact C-N 3.29Å; I308-H310 PolarHBondContact O-N 3.49Å; H310-N313 WeakPolarHBondContact O-CB 3.32Å; H310-N313 PolarHBondContact O-N 3.36Å; H310-M314 WeakPolarHBondContact O-CG 3.2Å
311	M	88.7	Confident	84.2	Confident	28 Å²	28	40.4 Å²	40.4	14%	0.138	22%	0.215	C	C	.	.	H	α-helix	trans	-66.2	-39.2	174.4	-66.6	-57.9	95.2	0	0	112.9	F37 A307 I308 N313 M314 C315 F840	F37-M311 HydrophobicContact CB-SD 4.01Å; F37-M311 HydrophobicContact CD2-CG 4.14Å; F37-M311 HydrophobicContact CD2-SD 3.55Å; F37-M311 VanDerWaalsContact CD2-SD 3.55Å; F37-M311 HydrophobicContact CE2-CG 4.36Å; F37-M311 HydrophobicContact CE2-SD 4.33Å; F37-M311 HydrophobicContact CG-SD 3.92Å; A307-M311 WeakPolarHBondContact O-CG 3.09Å; A307-M311 PolarHBondContact O-N 3.1Å; I308-M311 PolarHBondContact O-N 2.81Å; I308-M311 VanDerWaalsContact O-N 3.16Å; M311-N313 PolarHBondContact O-N 2.87Å; M311-M314 HydrophobicContact CE-CG 4.42Å; M311-M314 WeakPolarHBondContact O-CB 2.97Å; M311-M314 PolarHBondContact O-N 3.26Å; M311-C315 PolarHBondContact O-SG 2.97Å; M311-C315 VanDerWaalsContact O-SG 3.36Å; M311-F840 HydrophobicContact CB-CE2 4.47Å; M311-F840 HydrophobicContact CG-CD1 4.35Å; M311-F840 HydrophobicContact CG-CD2 3.4Å; M311-F840 HydrophobicContact CG-CE1 4.23Å; M311-F840 HydrophobicContact CG-CE2 3.26Å; M311-F840 HydrophobicContact CG-CG 3.96Å; M311-F840 HydrophobicContact CG-CZ 3.71Å; M311-F840 HydrophobicContact SD-CD2 3.73Å; M311-F840 HydrophobicContact SD-CE2 4.19Å; M311-F840 HydrophobicContact SD-CG 4.21Å
312	L	88.7	Confident	83.7	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.037	24%	0.238	C	C	.	.	H	α-helix	trans	-59.4	-32.7	174.2	-77.2	170.6	0	0	0	112.6	A22 L26 F51 I308 Y309 M314 C315 L324	A22-L312 HydrophobicContact CB-CD2 3.9Å; L26-L312 HydrophobicContact CD1-CB 4.5Å; L26-L312 HydrophobicContact CD1-CD1 4.33Å; L26-L312 HydrophobicContact CD1-CD2 3.31Å; L26-L312 HydrophobicContact CD1-CG 3.4Å; L26-L312 VanDerWaalsContact CD1-CG 3.4Å; F51-L312 HydrophobicContact CD2-CB 3.73Å; F51-L312 HydrophobicContact CE2-CB 3.83Å; F51-L312 HydrophobicContact CG-CB 4.27Å; F51-L312 HydrophobicContact CZ-CB 4.45Å; F51-L312 HydrophobicContact CZ-CD1 4.5Å; I308-L312 HydrophobicContact CG2-CD1 4.21Å; I308-L312 PolarHBondContact O-N 3.49Å; Y309-L312 HydrophobicContact CD1-CD1 3.84Å; Y309-L312 HydrophobicContact CE1-CD1 4.25Å; Y309-L312 PolarHBondContact O-N 3.12Å; L312-M314 VanDerWaalsContact C-N 3.26Å; L312-M314 PolarHBondContact O-N 3.44Å; L312-C315 WeakPolarHBondContact O-CB 3.4Å; L312-C315 PolarHBondContact O-N 3.11Å; L312-L324 HydrophobicContact CD2-CD1 3.85Å
313	N	89.2	Confident	83.5	Confident	11 Å²	11	47.2 Å²	47.2	6%	0.059	25%	0.247	C	C	.	.	H	α-helix	trans	-69.6	-20.9	175.9	-85.3	-32.1	0	0	0	113.8	N41 R49 F51 Y309 H310 M311	N41-N313 PolarHBondContact ND2-O 3.29Å; R49-N313 HydrophobicContact CB-CB 4.45Å; F51-N313 WeakPolarHBondContact CA-OD1 3.46Å; F51-N313 VanDerWaalsContact CB-OD1 3.25Å; F51-N313 WeakPolarHBondContact CB-OD1 3.24Å; F51-N313 PolarHBondContact N-OD1 3.21Å; Y309-N313 PolarHBondContact O-N 3.17Å; Y309-N313 VanDerWaalsContact O-N 3.13Å; Y309-N313 PolarHBondContact O-ND2 3.17Å; H310-N313 WeakPolarHBondContact O-CB 3.32Å; H310-N313 PolarHBondContact O-N 3.36Å; M311-N313 PolarHBondContact O-N 2.87Å
314	M	86.1	Confident	83.6	Confident	31 Å²	31	45.3 Å²	45.3	15%	0.153	24%	0.239	C	C	.	.	H	α-helix	trans	-81.8	-18.5	176.4	-54.6	-65.1	-92.9	0	0	112.2	D39 L40 R49 H310 M311 L312	D39-M314 HydrophobicContact CB-CE 3.37Å; D39-M314 HydrophobicContact CB-SD 4.08Å; D39-M314 VanDerWaalsContact CG-SD 3.57Å; L40-M314 PolarHBondContact N-O 3.47Å; R49-M314 PolarHBondContact NH1-SD 2.9Å; H310-M314 WeakPolarHBondContact O-CG 3.2Å; M311-M314 HydrophobicContact CE-CG 4.42Å; M311-M314 WeakPolarHBondContact O-CB 2.97Å; M311-M314 PolarHBondContact O-N 3.26Å; L312-M314 VanDerWaalsContact C-N 3.26Å; L312-M314 PolarHBondContact O-N 3.44Å
315	C	87.8	Confident	83.7	Confident	6 Å²	6	46.3 Å²	46.3	4%	0.041	24%	0.244	C	C	.	.	S	Bend	trans	-77.3	143.5	-179.3	-57.4	0	0	0	0	110.9	N41 M311 L312 L324 I325 A326	N41-C315 PolarHBondContact ND2-O 2.97Å; M311-C315 PolarHBondContact O-SG 2.97Å; M311-C315 VanDerWaalsContact O-SG 3.36Å; L312-C315 WeakPolarHBondContact O-CB 3.4Å; L312-C315 PolarHBondContact O-N 3.11Å; C315-L324 HydrophobicContact CB-CB 4.46Å; C315-L324 HydrophobicContact CB-CD2 4.26Å; C315-I325 CarbonylContact C-O 3.49Å; C315-I325 WeakPolarHBondContact CA-O 3.45Å; C315-A326 HydrophobicContact CB-CB 4.49Å
316	S	85.9	Confident	83.9	Confident	31 Å²	31	46.4 Å²	46.4	22%	0.217	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	148.4	171.6	66.1	0	0	0	0	110.3	L324 I325	S316-L324 WeakPolarHBondContact O-CA 3.32Å; S316-I325 PolarHBondContact N-O 3.16Å; S316-I325 PolarHBondContact O-N 3.29Å
317	F	81	Confident	84	Confident	84 Å²	84	45 Å²	45	37%	0.368	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119	-179.7	-174.8	-99.1	0	0	0	109.8	V319 L324	F317-V319 HydrophobicContact CD1-CG2 4.11Å; F317-V319 HydrophobicContact CE1-CG2 4.24Å; F317-L324 HydrophobicContact CB-CD2 4.42Å; F317-L324 HydrophobicContact CD2-CD2 3.87Å; F317-L324 HydrophobicContact CD2-CG 4.44Å
318	D	77.9	Confident	84.2	Confident	39 Å²	39	44 Å²	44	21%	0.209	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	114.8	172.3	-177.2	8.6	0	0	0	109.7	T320 N321 K322 C323 I325	D318-T320 VanDerWaalsContact CG-OG1 3.23Å; D318-T320 PolarHBondContact O-N 2.84Å; D318-T320 PolarHBondContact OD1-N 2.97Å; D318-T320 PolarHBondContact OD1-OG1 3.28Å; D318-T320 PolarHBondContact OD2-OG1 3.16Å; D318-T320 VanDerWaalsContact OD2-OG1 3.05Å; D318-N321 PolarHBondContact OD2-ND2 3.35Å; D318-K322 PolarHBondContact O-N 2.62Å; D318-C323 PolarHBondContact N-O 2.92Å; D318-I325 HydrophobicContact CB-CD1 4.05Å
319	V	70.6	Confident	84.4	Confident	118 Å²	118	45.2 Å²	45.2	72%	0.715	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-28.7	-178.5	-175.6	0	0	0	0	111.2	F317	F317-V319 HydrophobicContact CD1-CG2 4.11Å; F317-V319 HydrophobicContact CE1-CG2 4.24Å
320	T	69.1	Low	84.4	Confident	111 Å²	111	44.7 Å²	44.7	68%	0.681	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-43.8	-173.5	62.7	0	0	0	0	112.2	D318	D318-T320 VanDerWaalsContact CG-OG1 3.23Å; D318-T320 PolarHBondContact O-N 2.84Å; D318-T320 PolarHBondContact OD1-N 2.97Å; D318-T320 PolarHBondContact OD1-OG1 3.28Å; D318-T320 PolarHBondContact OD2-OG1 3.16Å; D318-T320 VanDerWaalsContact OD2-OG1 3.05Å
321	N	63.9	Low	84.6	Confident	110 Å²	110	40.2 Å²	40.2	59%	0.588	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.2	2.1	-172.8	-65.7	-50	0	0	0	114.5	D318 C323	D318-N321 PolarHBondContact OD2-ND2 3.35Å; N321-C323 HydrophobicContact CB-CB 4.24Å; N321-C323 PolarHBondContact O-N 3.12Å; N321-C323 VanDerWaalsContact O-N 3.08Å; N321-C323 PolarHBondContact O-SG 3.06Å
322	K	76.3	Confident	84.5	Confident	152 Å²	152	44.4 Å²	44.4	66%	0.661	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	32	-172.2	-61.1	-178.1	178.6	177.2	0	112.8	S19 D318	S19-K322 PolarHBondContact N-O 3.02Å; S19-K322 PolarHBondContact OG-O 2.88Å; S19-K322 VanDerWaalsContact OG-O 3.05Å; D318-K322 PolarHBondContact O-N 2.62Å
323	C	83.9	Confident	84.4	Confident	30 Å²	30	47.4 Å²	47.4	20%	0.203	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	149.3	-178.9	-69.3	0	0	0	0	110.1	L17 D318 N321	L17-C323 CarbonylContact O-C 3.56Å; L17-C323 WeakPolarHBondContact O-CA 3.4Å; D318-C323 PolarHBondContact N-O 2.92Å; N321-C323 HydrophobicContact CB-CB 4.24Å; N321-C323 PolarHBondContact O-N 3.12Å; N321-C323 VanDerWaalsContact O-N 3.08Å; N321-C323 PolarHBondContact O-SG 3.06Å
324	L	87.6	Confident	84.3	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.6	169.6	-71.9	160.3	0	0	0	107.8	L17 A22 F51 L312 C315 S316 F317	L17-L324 HydrophobicContact CB-CB 4.21Å; L17-L324 PolarHBondContact N-O 2.51Å; L17-L324 PolarHBondContact O-N 3.36Å; A22-L324 HydrophobicContact CB-CD1 3.62Å; F51-L324 HydrophobicContact CE2-CD2 4.47Å; F51-L324 HydrophobicContact CZ-CD1 4.49Å; L312-L324 HydrophobicContact CD2-CD1 3.85Å; C315-L324 HydrophobicContact CB-CB 4.46Å; C315-L324 HydrophobicContact CB-CD2 4.26Å; S316-L324 WeakPolarHBondContact O-CA 3.32Å; F317-L324 HydrophobicContact CB-CD2 4.42Å; F317-L324 HydrophobicContact CD2-CD2 3.87Å; F317-L324 HydrophobicContact CD2-CG 4.44Å
325	I	90.1	Very high	84.3	Confident	25 Å²	25	47.3 Å²	47.3	13%	0.128	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.7	176.8	-59.6	174.6	0	0	0	107.2	Q14 L15 F16 L40 C315 S316 D318	Q14-I325 HydrophobicContact CG-CG2 3.65Å; L15-I325 WeakPolarHBondContact O-CA 3.39Å; F16-I325 HydrophobicContact CD1-CD1 4.45Å; F16-I325 HydrophobicContact CD1-CG1 3.95Å; F16-I325 HydrophobicContact CE1-CD1 3.94Å; F16-I325 HydrophobicContact CE1-CG1 3.88Å; L40-I325 WeakPolarHBondContact CD1-O 3.31Å; C315-I325 CarbonylContact C-O 3.49Å; C315-I325 WeakPolarHBondContact CA-O 3.45Å; S316-I325 PolarHBondContact N-O 3.16Å; S316-I325 PolarHBondContact O-N 3.29Å; D318-I325 HydrophobicContact CB-CD1 4.05Å
326	A	90.3	Very high	84.4	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	132	174.8	0	0	0	0	0	110.2	Q14 L15 F37 C315	Q14-A326 CarbonylContact C-O 3.47Å; Q14-A326 WeakPolarHBondContact CA-O 3.27Å; L15-A326 HydrophobicContact CB-CB 4.26Å; L15-A326 PolarHBondContact N-O 3.18Å; L15-A326 PolarHBondContact O-N 3.34Å; F37-A326 HydrophobicContact CD1-CB 4.1Å; F37-A326 HydrophobicContact CE1-CB 3.88Å; C315-A326 HydrophobicContact CB-CB 4.49Å
327	E	91.5	Very high	84.5	Confident	31 Å²	31	54.8 Å²	54.8	15%	0.145	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	127.7	168.4	-76.6	-178	-168.5	0	0	109.2	L12 R38 L40	L12-E327 HydrophobicContact CD1-CB 4.3Å; R38-E327 HydrophobicContact CB-CB 4.12Å; R38-E327 VanDerWaalsContact CD-OE2 3.29Å; R38-E327 WeakPolarHBondContact CD-OE2 3.22Å; R38-E327 IonicContact CZ-OE2 2.69Å; R38-E327 PolarHBondContact N-O 3.05Å; R38-E327 IonicContact NE-OE2 3.69Å; R38-E327 IonicContact NH1-OE2 3.09Å; R38-E327 PolarHBondContact NH1-OE2 3.38Å; L40-E327 HydrophobicContact CD1-CG 4.35Å; L40-E327 HydrophobicContact CD2-CB 4.05Å; L40-E327 HydrophobicContact CD2-CG 3.86Å; L40-E327 HydrophobicContact CG-CB 4.5Å
328	V	92.2	Very high	84.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	138.7	-177.7	-59.2	0	0	0	0	111.8	A13 L15 V35 Q36 F37	A13-V328 HydrophobicContact CB-CG2 3.94Å; A13-V328 PolarHBondContact N-O 3.01Å; A13-V328 PolarHBondContact O-N 3.41Å; L15-V328 HydrophobicContact CD1-CG1 3.79Å; L15-V328 HydrophobicContact CD1-CG2 3.94Å; L15-V328 HydrophobicContact CD2-CG2 4.24Å; L15-V328 HydrophobicContact CG-CG1 4.3Å; L15-V328 HydrophobicContact CG-CG2 3.89Å; V35-V328 HydrophobicContact CB-CB 4.08Å; V35-V328 HydrophobicContact CB-CG1 4.36Å; V35-V328 HydrophobicContact CB-CG2 4.38Å; V35-V328 HydrophobicContact CG1-CB 4.36Å; V35-V328 HydrophobicContact CG1-CG2 4.12Å; Q36-V328 CarbonylContact O-C 3.02Å; Q36-V328 VanDerWaalsContact O-CA 3.3Å; Q36-V328 WeakPolarHBondContact O-CA 3.39Å; F37-V328 HydrophobicContact CD1-CG1 3.6Å; F37-V328 HydrophobicContact CE1-CG1 3.58Å; F37-V328 HydrophobicContact CG-CG1 4.09Å; F37-V328 HydrophobicContact CZ-CG1 4.04Å
329	W	92.8	Very high	85.4	Confident	24 Å²	24	56.7 Å²	56.7	9%	0.091	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126	164.9	-69.3	108.8	0	0	0	109.3	M10 L12 V35 Q36 T362 P366 P367 F837	M10-W329 HydrophobicContact CB-CE3 4.18Å; L12-W329 HydrophobicContact CB-CE3 4.04Å; L12-W329 HydrophobicContact CB-CH2 4.05Å; L12-W329 HydrophobicContact CB-CZ3 3.7Å; L12-W329 HydrophobicContact CD1-CD2 3.97Å; L12-W329 HydrophobicContact CD1-CE3 4.23Å; L12-W329 HydrophobicContact CD1-CG 4.48Å; L12-W329 HydrophobicContact CD1-CH2 4.43Å; L12-W329 HydrophobicContact CD1-CZ2 4.15Å; L12-W329 HydrophobicContact CD1-CZ3 4.43Å; V35-W329 WeakPolarHBondContact CA-O 3.44Å; Q36-W329 HydrophobicContact CB-CB 4.36Å; Q36-W329 PolarHBondContact N-O 3Å; Q36-W329 PolarHBondContact O-N 3.41Å; W329-T362 HydrophobicContact CH2-CG2 3.46Å; W329-T362 VanDerWaalsContact CH2-CG2 3.46Å; W329-T362 HydrophobicContact CZ2-CG2 4.27Å; W329-T362 HydrophobicContact CZ3-CG2 4.12Å; W329-P366 HydrophobicContact CD2-CB 4.37Å; W329-P366 HydrophobicContact CE3-CB 3.85Å; W329-P366 HydrophobicContact CH2-CB 3.69Å; W329-P366 HydrophobicContact CZ2-CB 4.25Å; W329-P366 HydrophobicContact CZ3-CB 3.51Å; W329-P367 HydrophobicContact CB-CG 3.82Å; W329-P367 HydrophobicContact CD2-CG 4.29Å; W329-P367 HydrophobicContact CG-CG 3.75Å; W329-F837 HydrophobicContact CB-CE2 4.37Å
330	C	91.2	Very high	86.2	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	143.3	176.4	-170.7	0	0	0	0	109.2	C11 V35 L338	C11-C330 PolarHBondContact N-O 3.43Å; C11-C330 PolarHBondContact O-N 3.47Å; C11-C330 VanDerWaalsContact O-N 3.09Å; C11-C330 PolarHBondContact SG-O 3.32Å; V35-C330 HydrophobicContact CG1-CB 4.21Å; C330-L338 HydrophobicContact CB-CD2 3.97Å
331	P	91.1	Very high	87.1	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	143.2	168.5	-15.4	28.5	0	0	0	110.9	T9 M10 A333 D334 L335	T9-P331 WeakPolarHBondContact O-CA 3.26Å; M10-P331 HydrophobicContact CE-CG 4.06Å; M10-P331 HydrophobicContact SD-CB 4.22Å; M10-P331 HydrophobicContact SD-CG 3.92Å; P331-A333 PolarHBondContact O-N 3.41Å; P331-A333 VanDerWaalsContact O-N 3.13Å; P331-D334 PolarHBondContact O-N 2.91Å; P331-L335 PolarHBondContact O-N 2.89Å
332	E	87.1	Confident	88.2	Confident	116 Å²	116	46.6 Å²	46.6	54%	0.542	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-59.9	-29.6	-178.8	-157.4	174.5	-164.2	0	0	112.4	T9 L335	T9-E332 WeakPolarHBondContact CB-OE2 3.45Å; T9-E332 PolarHBondContact O-N 3.09Å; T9-E332 PolarHBondContact OG1-OE2 2.88Å; E332-L335 HydrophobicContact CG-CD1 4.08Å
333	A	86.1	Confident	88.6	Confident	71 Å²	71	43.7 Å²	43.7	59%	0.587	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-68.9	-30.4	175.8	0	0	0	0	0	113.7	P331	P331-A333 PolarHBondContact O-N 3.41Å; P331-A333 VanDerWaalsContact O-N 3.13Å
334	D	87	Confident	88.6	Confident	13 Å²	13	45.7 Å²	45.7	7%	0.07	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-97.7	1.1	-173.2	-60.6	-12.8	0	0	0	111.8	L34 P331 Q336 D337 L338 R369 R371	L34-D334 HydrophobicContact CD2-CB 4.26Å; P331-D334 PolarHBondContact O-N 2.91Å; D334-Q336 VanDerWaalsContact C-N 3.28Å; D334-Q336 PolarHBondContact O-N 2.79Å; D334-D337 PolarHBondContact O-N 2.79Å; D334-D337 VanDerWaalsContact O-N 3.11Å; D334-L338 PolarHBondContact O-N 3.12Å; D334-R369 IonicContact OD2-CZ 3.9Å; D334-R369 IonicContact OD2-NH1 2.87Å; D334-R369 PolarHBondContact OD2-NH1 2.96Å; D334-R369 IonicContact OD2-NH2 2.81Å; D334-R369 PolarHBondContact OD2-NH2 3.46Å; D334-R371 IonicContact OD1-CZ 2.76Å; D334-R371 IonicContact OD1-NH2 2.76Å; D334-R371 PolarHBondContact OD1-NH2 3.41Å; D334-R371 IonicContact OD2-NH2 3.12Å
335	L	87.4	Confident	88.4	Confident	26 Å²	26	45.5 Å²	45.5	14%	0.136	22%	0.215	C	C	.	.	H	α-helix	trans	-56.5	-37.3	-179.4	-84.5	172.5	0	0	0	113.7	C11 P331 E332 R339 M357 I359	C11-L335 VanDerWaalsContact SG-CD2 3.53Å; P331-L335 PolarHBondContact O-N 2.89Å; E332-L335 HydrophobicContact CG-CD1 4.08Å; L335-R339 PolarHBondContact O-N 2.78Å; L335-R339 VanDerWaalsContact O-N 3.11Å; L335-M357 HydrophobicContact CD2-CE 3.55Å; L335-M357 HydrophobicContact CD2-SD 4.06Å; L335-I359 HydrophobicContact CD1-CD1 4.1Å
336	Q	88.6	Confident	88.1	Confident	136 Å²	136	44.6 Å²	44.6	64%	0.636	21%	0.212	S	C	*	.	H	α-helix	trans	-69.2	-38.4	178.9	-66	-173.5	-1.5	0	0	111.6	D334 R339 R340	D334-Q336 VanDerWaalsContact C-N 3.28Å; D334-Q336 PolarHBondContact O-N 2.79Å; Q336-R339 PolarHBondContact O-N 3.11Å; Q336-R340 WeakPolarHBondContact O-CG 3.4Å; Q336-R340 PolarHBondContact O-N 3.07Å
337	D	88.7	Confident	87.7	Confident	59 Å²	59	53.6 Å²	53.6	32%	0.316	25%	0.245	S	C	.	.	H	α-helix	trans	-73.6	-32.6	179.8	-67.6	-34	0	0	0	111.7	L34 D334 R340 A341	L34-D337 HydrophobicContact CD1-CB 3.84Å; D334-D337 PolarHBondContact O-N 2.79Å; D334-D337 VanDerWaalsContact O-N 3.11Å; D337-R340 PolarHBondContact O-N 3.18Å; D337-R340 IonicContact OD1-CZ 3.93Å; D337-R340 IonicContact OD1-NH1 3.02Å; D337-R340 PolarHBondContact OD1-NH1 3.3Å; D337-A341 WeakPolarHBondContact O-CB 3.43Å; D337-A341 PolarHBondContact O-N 2.93Å
338	L	88.8	Confident	87.1	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.7	-48.3	168.9	175.7	54.6	0	0	0	111.5	L29 V35 C330 D334 R340 A341 L342 M357	L29-L338 HydrophobicContact CD2-CD1 3.18Å; V35-L338 HydrophobicContact CG1-CD1 3.63Å; V35-L338 HydrophobicContact CG1-CD2 3.68Å; V35-L338 HydrophobicContact CG1-CG 4.26Å; C330-L338 HydrophobicContact CB-CD2 3.97Å; D334-L338 PolarHBondContact O-N 3.12Å; L338-R340 PolarHBondContact O-N 3.4Å; L338-A341 PolarHBondContact O-N 2.67Å; L338-L342 HydrophobicContact CD1-CD1 4.37Å; L338-L342 HydrophobicContact CG-CD1 4.48Å; L338-L342 WeakPolarHBondContact O-CG 3.35Å; L338-L342 PolarHBondContact O-N 3.4Å; L338-L342 VanDerWaalsContact O-N 3.11Å; L338-M357 HydrophobicContact CD2-CE 4.13Å; L338-M357 HydrophobicContact CD2-SD 3.29Å; L338-M357 WeakPolarHBondContact CD2-SD 3.44Å; L338-M357 HydrophobicContact CG-CE 4.31Å; L338-M357 HydrophobicContact CG-SD 3.84Å
339	R	88.4	Confident	86.1	Confident	162 Å²	162	60.7 Å²	60.7	61%	0.611	28%	0.283	S	S	*	.	H	α-helix	trans	-60	-45.4	176.9	-174.1	177.9	-172.9	150.7	8.7	112	L335 Q336 A341 L342 E343	L335-R339 PolarHBondContact O-N 2.78Å; L335-R339 VanDerWaalsContact O-N 3.11Å; Q336-R339 PolarHBondContact O-N 3.11Å; R339-A341 VanDerWaalsContact C-N 3.33Å; R339-A341 PolarHBondContact O-N 3.3Å; R339-L342 PolarHBondContact O-N 3.12Å; R339-E343 WeakPolarHBondContact CG-OE1 3.33Å; R339-E343 IonicContact NE-OE1 3.24Å; R339-E343 PolarHBondContact NE-OE1 2.99Å; R339-E343 WeakPolarHBondContact O-CG 3.37Å; R339-E343 PolarHBondContact O-N 3.16Å
340	R	88.4	Confident	85	Confident	124 Å²	124	62.6 Å²	62.6	47%	0.468	31%	0.31	S	S	.	.	H	α-helix	trans	-60.7	-41.4	176.8	-70.7	174.6	-169.6	158.7	-1.7	112.2	Q336 D337 L338 L342 E343 E344	Q336-R340 WeakPolarHBondContact O-CG 3.4Å; Q336-R340 PolarHBondContact O-N 3.07Å; D337-R340 PolarHBondContact O-N 3.18Å; D337-R340 IonicContact OD1-CZ 3.93Å; D337-R340 IonicContact OD1-NH1 3.02Å; D337-R340 PolarHBondContact OD1-NH1 3.3Å; L338-R340 PolarHBondContact O-N 3.4Å; R340-L342 VanDerWaalsContact C-N 3.34Å; R340-L342 PolarHBondContact O-N 2.8Å; R340-E343 PolarHBondContact O-N 3.04Å; R340-E344 WeakPolarHBondContact O-CB 3.41Å; R340-E344 VanDerWaalsContact O-CG 3.27Å; R340-E344 WeakPolarHBondContact O-CG 3.35Å; R340-E344 PolarHBondContact O-N 2.97Å
341	A	86.9	Confident	84.1	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64.5	-37.2	178.4	0	0	0	0	0	112.6	L29 K32 D337 L338 R339 G345	L29-A341 HydrophobicContact CD2-CB 4.06Å; K32-A341 HydrophobicContact CD-CB 4.12Å; D337-A341 WeakPolarHBondContact O-CB 3.43Å; D337-A341 PolarHBondContact O-N 2.93Å; L338-A341 PolarHBondContact O-N 2.67Å; R339-A341 VanDerWaalsContact C-N 3.33Å; R339-A341 PolarHBondContact O-N 3.3Å; A341-G345 PolarHBondContact O-N 3.2Å
342	L	87.1	Confident	82.9	Confident	3 Å²	3	70.4 Å²	70.4	2%	0.016	36%	0.361	C	S	.	.	H	α-helix	trans	-67.5	-41	174.5	-68.4	167.3	0	0	0	112	L15 L17 C25 L29 L338 R339 R340 S346 M357	L15-L342 HydrophobicContact CD2-CD1 3.8Å; L17-L342 HydrophobicContact CD2-CD2 3.92Å; C25-L342 HydrophobicContact CB-CD2 4.39Å; L29-L342 HydrophobicContact CD1-CD2 4Å; L29-L342 HydrophobicContact CD2-CD2 4.38Å; L29-L342 HydrophobicContact CD2-CG 4.46Å; L29-L342 HydrophobicContact CG-CD2 4.4Å; L338-L342 HydrophobicContact CD1-CD1 4.37Å; L338-L342 HydrophobicContact CG-CD1 4.48Å; L338-L342 WeakPolarHBondContact O-CG 3.35Å; L338-L342 PolarHBondContact O-N 3.4Å; L338-L342 VanDerWaalsContact O-N 3.11Å; R339-L342 PolarHBondContact O-N 3.12Å; R340-L342 VanDerWaalsContact C-N 3.34Å; R340-L342 PolarHBondContact O-N 2.8Å; L342-S346 WeakPolarHBondContact O-CB 3.38Å; L342-S346 PolarHBondContact O-N 3.21Å; L342-M357 HydrophobicContact CD1-CB 4.25Å
343	E	85.3	Confident	82.2	Confident	92 Å²	92	69.8 Å²	69.8	43%	0.43	36%	0.36	S	S	.	.	H	α-helix	trans	-65.5	-40.9	175.8	-71.6	170.7	-172.5	0	0	111.6	R339 R340 S346 R347	R339-E343 WeakPolarHBondContact CG-OE1 3.33Å; R339-E343 IonicContact NE-OE1 3.24Å; R339-E343 PolarHBondContact NE-OE1 2.99Å; R339-E343 WeakPolarHBondContact O-CG 3.37Å; R339-E343 PolarHBondContact O-N 3.16Å; R340-E343 PolarHBondContact O-N 3.04Å; E343-S346 PolarHBondContact O-N 3.18Å; E343-R347 WeakPolarHBondContact O-CB 3.37Å; E343-R347 PolarHBondContact O-N 2.86Å
344	E	84.9	Confident	81.4	Confident	71 Å²	71	70 Å²	70	33%	0.332	36%	0.355	S	S	.	.	H	α-helix	trans	-60.2	-52.9	174.3	-76.7	164.9	176.3	0	0	111.2	K32 R340 S346 R347 E348	K32-E344 IonicContact NZ-OE2 3.54Å; K32-E344 PolarHBondContact NZ-OE2 3.33Å; K32-E344 VanDerWaalsContact NZ-OE2 3.16Å; R340-E344 WeakPolarHBondContact O-CB 3.41Å; R340-E344 VanDerWaalsContact O-CG 3.27Å; R340-E344 WeakPolarHBondContact O-CG 3.35Å; R340-E344 PolarHBondContact O-N 2.97Å; E344-S346 VanDerWaalsContact C-N 3.31Å; E344-S346 PolarHBondContact O-N 3.1Å; E344-R347 PolarHBondContact O-N 2.64Å; E344-R347 VanDerWaalsContact O-N 3.13Å; E344-E348 PolarHBondContact O-N 2.83Å; E344-E348 VanDerWaalsContact O-N 3.07Å
345	G	82	Confident	81.1	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-62.5	-35.8	178.6	0	0	0	0	0	113.2	A341 S349	A341-G345 PolarHBondContact O-N 3.2Å; G345-S349 PolarHBondContact O-N 3.18Å; G345-S349 PolarHBondContact O-OG 3.33Å
346	S	83.9	Confident	80.9	Confident	7 Å²	7	74.2 Å²	74.2	5%	0.049	37%	0.373	C	S	.	.	H	α-helix	trans	-69.8	-32.6	175.7	-170	0	0	0	0	112.9	L342 E343 E344 G350 A351	L342-S346 WeakPolarHBondContact O-CB 3.38Å; L342-S346 PolarHBondContact O-N 3.21Å; E343-S346 PolarHBondContact O-N 3.18Å; E344-S346 VanDerWaalsContact C-N 3.31Å; E344-S346 PolarHBondContact O-N 3.1Å; S346-G350 PolarHBondContact O-N 3.2Å; S346-A351 PolarHBondContact O-N 3.34Å
347	R	82.4	Confident	80.8	Confident	190 Å²	190	70 Å²	70	72%	0.717	35%	0.354	S	S	*	.	H	α-helix	trans	-72	-39.9	178.7	-175.1	178.7	67	-171.3	-2.2	111.4	E343 E344 S349 G350	E343-R347 WeakPolarHBondContact O-CB 3.37Å; E343-R347 PolarHBondContact O-N 2.86Å; E344-R347 PolarHBondContact O-N 2.64Å; E344-R347 VanDerWaalsContact O-N 3.13Å; R347-S349 VanDerWaalsContact C-N 3.31Å; R347-S349 PolarHBondContact O-N 3.27Å; R347-G350 PolarHBondContact O-N 3.45Å; R347-G350 VanDerWaalsContact O-N 3.17Å
348	E	78.8	Confident	80.8	Confident	141 Å²	141	71.4 Å²	71.4	66%	0.659	36%	0.362	S	S	*	.	H	α-helix	trans	-62.2	-38.5	177.1	-72.6	179.2	177.8	0	0	112	E344 G350	E344-E348 PolarHBondContact O-N 2.83Å; E344-E348 VanDerWaalsContact O-N 3.07Å; E348-G350 PolarHBondContact O-N 2.98Å
349	S	71.1	Confident	80.8	Confident	39 Å²	39	75.8 Å²	75.8	27%	0.273	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-11.2	176.6	-53.3	0	0	0	0	114.3	E24 G345 R347 A351	E24-S349 WeakPolarHBondContact OE2-CA 3.16Å; E24-S349 VanDerWaalsContact OE2-CB 3.27Å; E24-S349 WeakPolarHBondContact OE2-CB 3.47Å; E24-S349 PolarHBondContact OE2-N 2.9Å; E24-S349 PolarHBondContact OE2-OG 3.21Å; G345-S349 PolarHBondContact O-N 3.18Å; G345-S349 PolarHBondContact O-OG 3.33Å; R347-S349 VanDerWaalsContact C-N 3.31Å; R347-S349 PolarHBondContact O-N 3.27Å; S349-A351 VanDerWaalsContact C-N 3.27Å; S349-A351 PolarHBondContact O-N 2.92Å
350	G	70.5	Confident	80.8	Confident	64 Å²	64	70.3 Å²	70.3	66%	0.66	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	25.5	-174.2	0	0	0	0	0	114.4	S346 R347 E348	S346-G350 PolarHBondContact O-N 3.2Å; R347-G350 PolarHBondContact O-N 3.45Å; R347-G350 VanDerWaalsContact O-N 3.17Å; E348-G350 PolarHBondContact O-N 2.98Å
351	A	70.6	Confident	80.6	Confident	29 Å²	29	70.5 Å²	70.5	24%	0.24	38%	0.384	C	S	.	.			trans	-75.7	139.4	-177.9	0	0	0	0	0	112.4	T21 S346 S349 I353	T21-A351 HydrophobicContact CG2-CB 3.36Å; S346-A351 PolarHBondContact O-N 3.34Å; S349-A351 VanDerWaalsContact C-N 3.27Å; S349-A351 PolarHBondContact O-N 2.92Å; A351-I353 VanDerWaalsContact C-N 3.34Å
352	T	67.1	Low	80.4	Confident	136 Å²	136	73.1 Å²	73.1	83%	0.834	40%	0.4	S	S	*	.	S	Bend	trans	-75.4	-20.8	179.1	44.4	0	0	0	0	113.6
353	I	72.2	Confident	80.1	Confident	102 Å²	102	81.9 Å²	81.9	52%	0.523	44%	0.438	S	S	.	.	S	Bend	trans	-112.3	117.3	178.6	-56.5	173.1	0	0	0	107.9	A351	A351-I353 VanDerWaalsContact C-N 3.34Å
354	P	70.3	Confident	80	Confident	76 Å²	76	81.8 Å²	81.8	49%	0.494	44%	0.437	S	S	.	.			trans	-69.3	136	176.4	28.2	-32.7	0	0	0	110.6	F356	P354-F356 PolarHBondContact O-N 3.43Å
355	S	79.2	Confident	79.9	Confident	9 Å²	9	84.2 Å²	84.2	6%	0.063	46%	0.457	C	S	.	.			trans	-59.6	128.6	164.7	-59.8	0	0	0	0	109	F16	F16-S355 WeakPolarHBondContact O-CA 3.29Å; F16-S355 WeakPolarHBondContact O-CB 3.46Å
356	F	82.8	Confident	80.3	Confident	118 Å²	118	85 Å²	85	52%	0.518	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	162.7	-178.3	66.3	-89.3	0	0	0	111.6	F16 P354	F16-F356 HydrophobicContact CB-CD1 4.43Å; F16-F356 HydrophobicContact CB-CE1 4.09Å; F16-F356 HydrophobicContact CB-CE2 4.25Å; F16-F356 HydrophobicContact CB-CZ 3.98Å; F16-F356 AromaticContact CD2-CD2 3.99Å; F16-F356 HydrophobicContact CD2-CD2 3.99Å; F16-F356 AromaticContact CD2-CE2 3.45Å; F16-F356 HydrophobicContact CD2-CE2 3.45Å; F16-F356 VanDerWaalsContact CD2-CE2 3.45Å; F16-F356 AromaticContact CD2-CZ 3.88Å; F16-F356 HydrophobicContact CD2-CZ 3.88Å; F16-F356 HydrophobicContact CE2-CE2 4.01Å; F16-F356 AromaticContact CG-CE2 3.97Å; F16-F356 HydrophobicContact CG-CE2 3.97Å; F16-F356 AromaticContact CG-CZ 3.91Å; F16-F356 HydrophobicContact CG-CZ 3.91Å; F16-F356 PolarHBondContact N-O 3.46Å; F16-F356 PolarHBondContact O-N 3.45Å; P354-F356 PolarHBondContact O-N 3.43Å
357	M	86.8	Confident	80.6	Confident	47 Å²	47	84.9 Å²	84.9	23%	0.232	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.8	-176.3	174	176.3	66.9	0	0	110	A13 Q14 L15 L335 L338 L342	A13-M357 HydrophobicContact CB-CG 3.75Å; A13-M357 HydrophobicContact CB-SD 3.48Å; A13-M357 WeakPolarHBondContact CB-SD 3.48Å; Q14-M357 CarbonylContact O-C 3.34Å; Q14-M357 VanDerWaalsContact O-CA 3.31Å; Q14-M357 WeakPolarHBondContact O-CA 3.49Å; L15-M357 HydrophobicContact CD2-CB 3.77Å; L15-M357 HydrophobicContact CD2-CG 3.73Å; L15-M357 HydrophobicContact CD2-SD 3.92Å; L335-M357 HydrophobicContact CD2-CE 3.55Å; L335-M357 HydrophobicContact CD2-SD 4.06Å; L338-M357 HydrophobicContact CD2-CE 4.13Å; L338-M357 HydrophobicContact CD2-SD 3.29Å; L338-M357 WeakPolarHBondContact CD2-SD 3.44Å; L338-M357 HydrophobicContact CG-CE 4.31Å; L338-M357 HydrophobicContact CG-SD 3.84Å; L342-M357 HydrophobicContact CD1-CB 4.25Å
358	N	88.9	Confident	81	Confident	89 Å²	89	76.4 Å²	76.4	48%	0.476	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	149.4	170.9	-168.7	18.1	0	0	0	110.7	A13 Q14 F16	A13-N358 CarbonylContact C-O 3.56Å; A13-N358 VanDerWaalsContact CA-O 3.3Å; A13-N358 WeakPolarHBondContact CA-O 3.37Å; Q14-N358 PolarHBondContact N-O 3.16Å; Q14-N358 PolarHBondContact O-N 3.36Å; F16-N358 HydrophobicContact CE2-CB 4.38Å
359	I	88.4	Confident	81.4	Confident	93 Å²	93	72 Å²	72	48%	0.477	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	128.3	176.9	-58.3	173.4	0	0	0	108.4	C11 L335	C11-I359 HydrophobicContact CB-CG2 4.37Å; L335-I359 HydrophobicContact CD1-CD1 4.1Å
360	I	88.9	Confident	82.2	Confident	47 Å²	47	71.9 Å²	71.9	24%	0.241	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.9	-179.7	-58.4	-179.3	0	0	0	109.8	L12 Q14 T362	L12-I360 HydrophobicContact CD2-CB 4.45Å; L12-I360 PolarHBondContact O-N 3.06Å; Q14-I360 HydrophobicContact CB-CD1 3.63Å; Q14-I360 HydrophobicContact CB-CG1 4.14Å; Q14-I360 HydrophobicContact CG-CD1 4.19Å; I360-T362 PolarHBondContact O-N 3.31Å
361	P	84.1	Confident	82.9	Confident	128 Å²	128	73.3 Å²	73.3	83%	0.831	39%	0.39	S	S	*	.			trans	-72.1	117.8	168.4	29.6	-31.7	0	0	0	109.9
362	T	84.2	Confident	83.6	Confident	54 Å²	54	74.7 Å²	74.7	33%	0.331	40%	0.395	S	S	.	.			trans	-120	153.1	176.2	-177.4	0	0	0	0	111.7	L12 W329 I360 E364	L12-T362 HydrophobicContact CB-CG2 3.79Å; L12-T362 HydrophobicContact CD2-CG2 3.77Å; L12-T362 HydrophobicContact CG-CG2 4.4Å; W329-T362 HydrophobicContact CH2-CG2 3.46Å; W329-T362 VanDerWaalsContact CH2-CG2 3.46Å; W329-T362 HydrophobicContact CZ2-CG2 4.27Å; W329-T362 HydrophobicContact CZ3-CG2 4.12Å; I360-T362 PolarHBondContact O-N 3.31Å; T362-E364 PolarHBondContact OG1-N 2.98Å; T362-E364 VanDerWaalsContact OG1-N 3.17Å
363	K	79.1	Confident	84.6	Confident	188 Å²	188	73.8 Å²	73.8	82%	0.817	39%	0.385	S	S	*	.			trans	-96.8	-6.8	173.2	-65.9	-179.3	-178	174	0	112.7
364	E	83.1	Confident	85.2	Confident	89 Å²	89	75.2 Å²	75.2	42%	0.416	39%	0.388	S	S	.	.	S	Bend	trans	-68.7	150.4	178.4	-66.2	-179.5	-173.2	0	0	111.2	R38 T362 P366	R38-E364 IonicContact CZ-OE1 2.62Å; R38-E364 IonicContact CZ-OE2 3.54Å; R38-E364 VanDerWaalsContact CZ-OE2 3.23Å; R38-E364 IonicContact NE-OE2 3.78Å; R38-E364 IonicContact NH1-OE1 3.56Å; R38-E364 IonicContact NH1-OE2 2.85Å; R38-E364 PolarHBondContact NH1-OE2 3.49Å; R38-E364 VanDerWaalsContact NH2-CD 3.26Å; R38-E364 IonicContact NH2-OE1 3.63Å; R38-E364 PolarHBondContact NH2-OE1 3.46Å; R38-E364 IonicContact NH2-OE2 3.52Å; R38-E364 PolarHBondContact NH2-OE2 3.01Å; T362-E364 PolarHBondContact OG1-N 2.98Å; T362-E364 VanDerWaalsContact OG1-N 3.17Å; E364-P366 VanDerWaalsContact O-CD 3.27Å; E364-P366 WeakPolarHBondContact O-CD 3.38Å
365	T	83.9	Confident	86	Confident	122 Å²	122	75.4 Å²	75.4	75%	0.748	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-73.8	117.6	178.5	49.1	0	0	0	0	110.3
366	P	89.8	Confident	86.4	Confident	18 Å²	18	75.6 Å²	75.6	12%	0.117	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-71.1	158.5	178.1	27.6	-34.5	0	0	0	112.4	M10 W329 E364 Y391	M10-P366 HydrophobicContact CB-CB 3.67Å; M10-P366 HydrophobicContact CB-CG 4.31Å; M10-P366 HydrophobicContact CG-CB 4.18Å; W329-P366 HydrophobicContact CD2-CB 4.37Å; W329-P366 HydrophobicContact CE3-CB 3.85Å; W329-P366 HydrophobicContact CH2-CB 3.69Å; W329-P366 HydrophobicContact CZ2-CB 4.25Å; W329-P366 HydrophobicContact CZ3-CB 3.51Å; E364-P366 VanDerWaalsContact O-CD 3.27Å; E364-P366 WeakPolarHBondContact O-CD 3.38Å; P366-Y391 HydrophobicContact CB-CD2 4.27Å; P366-Y391 HydrophobicContact CB-CE2 4.23Å; P366-Y391 HydrophobicContact CG-CD1 3.44Å; P366-Y391 VanDerWaalsContact CG-CD1 3.44Å; P366-Y391 HydrophobicContact CG-CD2 3.51Å; P366-Y391 HydrophobicContact CG-CE1 3.48Å; P366-Y391 VanDerWaalsContact CG-CE1 3.48Å; P366-Y391 HydrophobicContact CG-CE2 3.55Å; P366-Y391 HydrophobicContact CG-CG 3.44Å; P366-Y391 VanDerWaalsContact CG-CG 3.44Å
367	P	91.1	Very high	86.6	Confident	3 Å²	3	74.7 Å²	74.7	2%	0.019	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-68.4	153	173.8	30	-35.9	0	0	0	111.9	M10 W329 T835 F837	M10-P367 WeakPolarHBondContact CG-O 3.42Å; W329-P367 HydrophobicContact CB-CG 3.82Å; W329-P367 HydrophobicContact CD2-CG 4.29Å; W329-P367 HydrophobicContact CG-CG 3.75Å; P367-T835 CarbonylContact C-O 3.57Å; P367-T835 WeakPolarHBondContact CA-O 3.38Å; P367-F837 HydrophobicContact CB-CB 4.11Å; P367-F837 HydrophobicContact CB-CD2 4.2Å; P367-F837 HydrophobicContact CG-CD2 3.77Å
368	T	89.9	Confident	86.7	Confident	13 Å²	13	73.1 Å²	73.1	8%	0.08	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-95.8	119.9	-179.5	59.4	0	0	0	0	111.7	V388 G389 T835 F837	T368-V388 WeakPolarHBondContact OG1-CG1 3.21Å; T368-G389 WeakPolarHBondContact CG2-O 3.42Å; T368-G389 PolarHBondContact OG1-O 3.34Å; T368-T835 PolarHBondContact N-O 3.41Å; T368-T835 PolarHBondContact OG1-O 3.02Å; T368-F837 VanDerWaalsContact O-CB 3.31Å; T368-F837 WeakPolarHBondContact O-CB 3.4Å; T368-F837 PolarHBondContact O-N 3.11Å
369	R	88.6	Confident	86.7	Confident	48 Å²	48	69 Å²	69	18%	0.181	35%	0.352	C	S	.	.			trans	-111.6	131.8	169.2	-171.5	-178.9	-178.7	179.6	-18.6	109.8	S7 E8 M10 D334 F837	S7-R369 WeakPolarHBondContact CA-O 3.34Å; E8-R369 PolarHBondContact N-O 3.44Å; M10-R369 HydrophobicContact CE-CB 3.17Å; M10-R369 HydrophobicContact CE-CG 4.23Å; D334-R369 IonicContact OD2-CZ 3.9Å; D334-R369 IonicContact OD2-NH1 2.87Å; D334-R369 PolarHBondContact OD2-NH1 2.96Å; D334-R369 IonicContact OD2-NH2 2.81Å; D334-R369 PolarHBondContact OD2-NH2 3.46Å; R369-F837 HydrophobicContact CB-CB 3.76Å; R369-F837 HydrophobicContact CB-CD1 3.85Å; R369-F837 HydrophobicContact CB-CG 3.9Å; R369-F837 HydrophobicContact CG-CB 4.41Å; R369-F837 HydrophobicContact CG-CD1 3.68Å; R369-F837 HydrophobicContact CG-CE1 4.3Å; R369-F837 HydrophobicContact CG-CG 4.26Å
370	I	86.8	Confident	86.8	Confident	36 Å²	36	65 Å²	65	19%	0.185	33%	0.331	C	S	.	.			trans	-123.6	121.2	172	-62.9	162.7	0	0	0	105.7	T372 N395	I370-T372 PolarHBondContact O-N 3.36Å; I370-N395 HydrophobicContact CD1-CB 4.4Å
371	R	84.8	Confident	86.8	Confident	95 Å²	95	66.2 Å²	66.2	36%	0.358	34%	0.339	S	S	.	.			trans	-71	115	176.1	-67.6	-176.8	-172.8	-158.8	-1.8	109	E8 D334	E8-R371 VanDerWaalsContact CD-NE 3.26Å; E8-R371 WeakPolarHBondContact OE1-CD 3.27Å; E8-R371 VanDerWaalsContact OE1-CG 3.27Å; E8-R371 WeakPolarHBondContact OE1-CG 3.26Å; E8-R371 IonicContact OE1-CZ 3.8Å; E8-R371 IonicContact OE1-NE 2.89Å; E8-R371 PolarHBondContact OE1-NE 3.31Å; E8-R371 IonicContact OE1-NH2 3.49Å; E8-R371 IonicContact OE2-CZ 3.74Å; E8-R371 IonicContact OE2-NE 3.4Å; E8-R371 PolarHBondContact OE2-NE 3.16Å; E8-R371 VanDerWaalsContact OE2-NE 3.09Å; E8-R371 IonicContact OE2-NH2 2.75Å; D334-R371 IonicContact OD1-CZ 2.76Å; D334-R371 IonicContact OD1-NH2 2.76Å; D334-R371 PolarHBondContact OD1-NH2 3.41Å; D334-R371 IonicContact OD2-NH2 3.12Å
372	T	85.7	Confident	87.2	Confident	58 Å²	58	61.8 Å²	61.8	36%	0.356	31%	0.308	S	S	.	.			trans	-99.9	140	175.8	50.6	0	0	0	0	110.2	I370 T376 Q380	I370-T372 PolarHBondContact O-N 3.36Å; T372-T376 WeakPolarHBondContact CA-OG1 3.02Å; T372-Q380 HydrophobicContact CG2-CB 3.71Å; T372-Q380 HydrophobicContact CG2-CG 3.84Å
373	N	87.3	Confident	87.5	Confident	116 Å²	116	59.2 Å²	59.2	62%	0.62	29%	0.292	S	S	*	.			trans	-93.2	167.9	163.9	-66	-15	0	0	0	109	F375 T376 E377	N373-F375 PolarHBondContact O-N 2.98Å; N373-T376 PolarHBondContact N-OG1 3.39Å; N373-T376 PolarHBondContact O-N 2.96Å; N373-T376 PolarHBondContact O-OG1 2.95Å; N373-E377 WeakPolarHBondContact O-CB 3.47Å; N373-E377 PolarHBondContact O-N 3.23Å
374	K	84.8	Confident	88	Confident	133 Å²	133	51.8 Å²	51.8	58%	0.578	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.9	-34.6	173.7	-64.7	-174.5	171.9	-165	0	113.7	E432 Y452	K374-E432 IonicContact NZ-OE1 3.56Å; K374-E432 PolarHBondContact NZ-OE1 3.45Å; K374-Y452 HydrophobicContact CB-CE2 4.37Å; K374-Y452 WeakPolarHBondContact O-CD2 3.45Å; K374-Y452 WeakPolarHBondContact O-CE2 3.38Å
375	F	87.7	Confident	88.3	Confident	79 Å²	79	51.1 Å²	51.1	35%	0.346	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-42.8	178.7	178.3	-101.1	0	0	0	113.6	N373 F379 I401 Y452 L456	N373-F375 PolarHBondContact O-N 2.98Å; F375-F379 HydrophobicContact CZ-CE2 4.41Å; F375-I401 HydrophobicContact CE1-CG2 3.71Å; F375-I401 HydrophobicContact CZ-CG2 3.97Å; F375-Y452 AromaticContact CD2-CD1 3.77Å; F375-Y452 HydrophobicContact CD2-CD1 3.77Å; F375-Y452 HydrophobicContact CD2-CD2 4.34Å; F375-Y452 AromaticContact CD2-CG 3.68Å; F375-Y452 HydrophobicContact CD2-CG 3.68Å; F375-Y452 HydrophobicContact CE2-CD1 4.37Å; F375-Y452 HydrophobicContact CE2-CG 4.34Å; F375-L456 HydrophobicContact CE2-CD1 4.16Å; F375-L456 HydrophobicContact CZ-CD1 3.75Å
376	T	87.7	Confident	88.6	Confident	14 Å²	14	50.1 Å²	50.1	9%	0.086	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-17.3	-172.9	58.1	0	0	0	0	113.2	L4 T372 N373 G378 F379 Q380 I401	L4-T376 HydrophobicContact CD1-CG2 3.91Å; T372-T376 WeakPolarHBondContact CA-OG1 3.02Å; N373-T376 PolarHBondContact N-OG1 3.39Å; N373-T376 PolarHBondContact O-N 2.96Å; N373-T376 PolarHBondContact O-OG1 2.95Å; T376-G378 PolarHBondContact O-N 3.34Å; T376-F379 PolarHBondContact O-N 2.94Å; T376-Q380 WeakPolarHBondContact O-CB 3.36Å; T376-Q380 PolarHBondContact O-N 3.2Å; T376-I401 HydrophobicContact CG2-CD1 3.96Å
377	E	87.5	Confident	88.5	Confident	99 Å²	99	50 Å²	50	46%	0.463	26%	0.256	S	S	.	.	H	α-helix	trans	-56.1	-46.9	-179.1	-175.9	-179.1	-176.8	0	0	112.5	N373 F379 Q380 N381	N373-E377 WeakPolarHBondContact O-CB 3.47Å; N373-E377 PolarHBondContact O-N 3.23Å; E377-F379 PolarHBondContact O-N 3.45Å; E377-Q380 PolarHBondContact O-N 3.14Å; E377-N381 WeakPolarHBondContact O-CB 2.99Å; E377-N381 VanDerWaalsContact O-CG 3.26Å; E377-N381 PolarHBondContact O-N 3.04Å; E377-N381 PolarHBondContact O-ND2 3.13Å
378	G	87.8	Confident	88.5	Confident	13 Å²	13	51.1 Å²	51.1	13%	0.134	26%	0.263	C	S	.	.	H	α-helix	trans	-59.6	-44.5	178.3	0	0	0	0	0	112.8	T376 N381 I382	T376-G378 PolarHBondContact O-N 3.34Å; G378-N381 PolarHBondContact O-N 3.4Å; G378-I382 PolarHBondContact O-N 2.9Å
379	F	90	Very high	88.3	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.009	27%	0.266	C	S	.	.	H	α-helix	trans	-68.8	-38.1	178	-68.9	-81.5	0	0	0	112.4	F375 T376 E377 I382 V383 I401 F404 P405 I453 L456	F375-F379 HydrophobicContact CZ-CE2 4.41Å; T376-F379 PolarHBondContact O-N 2.94Å; E377-F379 PolarHBondContact O-N 3.45Å; F379-I382 PolarHBondContact O-N 3.2Å; F379-V383 PolarHBondContact O-N 3.45Å; F379-I401 HydrophobicContact CB-CG1 4.07Å; F379-I401 HydrophobicContact CD1-CG1 4.28Å; F379-I401 HydrophobicContact CD2-CG1 3.8Å; F379-I401 HydrophobicContact CE2-CG1 4.29Å; F379-I401 HydrophobicContact CE2-CG2 4.47Å; F379-I401 HydrophobicContact CG-CG1 3.79Å; F379-F404 HydrophobicContact CE1-CD1 4.39Å; F379-P405 HydrophobicContact CE1-CG 4.15Å; F379-P405 HydrophobicContact CZ-CG 4.26Å; F379-I453 HydrophobicContact CD1-CG1 3.99Å; F379-I453 HydrophobicContact CD2-CG1 4Å; F379-I453 HydrophobicContact CE1-CB 4.37Å; F379-I453 HydrophobicContact CE1-CG1 3.68Å; F379-I453 HydrophobicContact CE1-CG2 4.27Å; F379-I453 HydrophobicContact CE2-CG1 3.68Å; F379-I453 HydrophobicContact CG-CG1 4.15Å; F379-I453 HydrophobicContact CZ-CB 4.11Å; F379-I453 HydrophobicContact CZ-CG1 3.51Å; F379-I453 HydrophobicContact CZ-CG2 4.41Å; F379-L456 HydrophobicContact CE2-CD1 4.22Å; F379-L456 HydrophobicContact CZ-CD1 3.84Å
380	Q	91	Very high	88.3	Confident	9 Å²	9	50.4 Å²	50.4	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-42.3	176.7	-171.1	63.7	46	0	0	111	T372 T376 E377 I382 V383 D384 N395	T372-Q380 HydrophobicContact CG2-CB 3.71Å; T372-Q380 HydrophobicContact CG2-CG 3.84Å; T376-Q380 WeakPolarHBondContact O-CB 3.36Å; T376-Q380 PolarHBondContact O-N 3.2Å; E377-Q380 PolarHBondContact O-N 3.14Å; Q380-I382 VanDerWaalsContact C-N 3.27Å; Q380-I382 PolarHBondContact O-N 3.45Å; Q380-V383 PolarHBondContact O-N 3.16Å; Q380-D384 PolarHBondContact NE2-OD1 3.1Å; Q380-D384 WeakPolarHBondContact O-CB 3.39Å; Q380-D384 PolarHBondContact O-N 3.49Å; Q380-N395 PolarHBondContact OE1-ND2 3.41Å; Q380-N395 PolarHBondContact OE1-OD1 3.43Å
381	N	89.2	Confident	88.4	Confident	73 Å²	73	51.2 Å²	51.2	39%	0.39	27%	0.269	S	S	.	.	H	α-helix	trans	-61.1	-35.3	177.5	-71.6	-22.7	0	0	0	112.4	E377 G378 A385	E377-N381 WeakPolarHBondContact O-CB 2.99Å; E377-N381 VanDerWaalsContact O-CG 3.26Å; E377-N381 PolarHBondContact O-N 3.04Å; E377-N381 PolarHBondContact O-ND2 3.13Å; G378-N381 PolarHBondContact O-N 3.4Å; N381-A385 WeakPolarHBondContact O-CB 3.37Å; N381-A385 PolarHBondContact O-N 3.41Å
382	I	90.8	Very high	88.6	Confident	35 Å²	35	51.1 Å²	51.1	18%	0.179	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-37.6	174.2	-68.6	172.8	0	0	0	111.7	G378 F379 Q380 I453 F814 I818 W822	G378-I382 PolarHBondContact O-N 2.9Å; F379-I382 PolarHBondContact O-N 3.2Å; Q380-I382 VanDerWaalsContact C-N 3.27Å; Q380-I382 PolarHBondContact O-N 3.45Å; I382-I453 HydrophobicContact CD1-CD1 3.54Å; I382-F814 HydrophobicContact CD1-CZ 4.34Å; I382-I818 HydrophobicContact CG2-CD1 4.19Å; I382-I818 HydrophobicContact CG2-CG1 4.46Å; I382-W822 HydrophobicContact CG2-CZ2 4.4Å; I382-W822 WeakPolarHBondContact O-CZ2 3.21Å; I382-W822 PolarHBondContact O-NE1 3.23Å
383	V	90.4	Very high	88.7	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-73.3	-45.9	177.9	175.2	0	0	0	0	110.7	F379 Q380 A385 Y386 G387 P396 A397 T400	F379-V383 PolarHBondContact O-N 3.45Å; Q380-V383 PolarHBondContact O-N 3.16Å; V383-A385 PolarHBondContact O-N 3.26Å; V383-Y386 PolarHBondContact O-N 3.46Å; V383-Y386 VanDerWaalsContact O-N 3.09Å; V383-G387 PolarHBondContact O-N 2.95Å; V383-P396 HydrophobicContact CG1-CB 4.13Å; V383-P396 HydrophobicContact CG1-CG 4.01Å; V383-P396 HydrophobicContact CG2-CB 4.44Å; V383-A397 HydrophobicContact CB-CB 4.44Å; V383-A397 HydrophobicContact CG2-CB 3.93Å; V383-T400 HydrophobicContact CG2-CG2 4.21Å
384	D	89.6	Confident	88.8	Confident	31 Å²	31	43.3 Å²	43.3	17%	0.166	22%	0.224	C	C	.	.	H	α-helix	trans	-59.8	-29.8	177.8	-72	0.9	0	0	0	112.2	Q380 Y386 G387 K836	Q380-D384 PolarHBondContact NE2-OD1 3.1Å; Q380-D384 WeakPolarHBondContact O-CB 3.39Å; Q380-D384 PolarHBondContact O-N 3.49Å; D384-Y386 VanDerWaalsContact C-N 3.28Å; D384-Y386 PolarHBondContact O-N 3.4Å; D384-G387 PolarHBondContact O-N 3.34Å; D384-K836 IonicContact OD2-NZ 3.77Å; D384-K836 PolarHBondContact OD2-NZ 3.04Å
385	A	89.7	Confident	89.1	Confident	75 Å²	75	37.2 Å²	37.2	62%	0.62	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.2	177.3	0	0	0	0	0	113.7	N381 V383 W822	N381-A385 WeakPolarHBondContact O-CB 3.37Å; N381-A385 PolarHBondContact O-N 3.41Å; V383-A385 PolarHBondContact O-N 3.26Å; A385-W822 HydrophobicContact CB-CZ2 4.3Å
386	Y	90.2	Very high	89.1	Confident	102 Å²	102	33.5 Å²	33.5	40%	0.4	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-40.5	172.6	-179.6	-109.7	0	0	0	111.6	V383 D384 W822 Q826 Y830	V383-Y386 PolarHBondContact O-N 3.46Å; V383-Y386 VanDerWaalsContact O-N 3.09Å; D384-Y386 VanDerWaalsContact C-N 3.28Å; D384-Y386 PolarHBondContact O-N 3.4Å; Y386-W822 HydrophobicContact CD2-CB 3.66Å; Y386-W822 AromaticContact CD2-CD2 3.93Å; Y386-W822 HydrophobicContact CD2-CD2 3.93Å; Y386-W822 HydrophobicContact CD2-CE3 4.23Å; Y386-W822 AromaticContact CD2-CG 3.71Å; Y386-W822 HydrophobicContact CD2-CG 3.71Å; Y386-W822 HydrophobicContact CE2-CB 3.88Å; Y386-W822 HydrophobicContact CE2-CG 4.43Å; Y386-W822 HydrophobicContact CG-CB 4.14Å; Y386-W822 HydrophobicContact CG-CD2 4.3Å; Y386-W822 AromaticContact CG-CG 3.92Å; Y386-W822 HydrophobicContact CG-CG 3.92Å; Y386-Q826 HydrophobicContact CE1-CB 4.41Å; Y386-Y830 HydrophobicContact CD1-CD1 4.24Å; Y386-Y830 HydrophobicContact CD1-CE1 4.23Å; Y386-Y830 HydrophobicContact CE1-CD1 4.4Å
387	G	89.1	Confident	89.2	Confident	16 Å²	16	33 Å²	33	17%	0.165	18%	0.179	C	C	.	.			trans	169.6	156.1	178.4	0	0	0	0	0	109.6	V383 D384 Y830	V383-G387 PolarHBondContact O-N 2.95Å; D384-G387 PolarHBondContact O-N 3.34Å; G387-Y830 PolarHBondContact O-OH 2.91Å
388	V	89.5	Confident	89.2	Confident	26 Å²	26	31.4 Å²	31.4	16%	0.158	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-89.7	133.2	-178.6	-179.8	0	0	0	0	109.6	T368 Y830 G832 A833 G834 K836	T368-V388 WeakPolarHBondContact OG1-CG1 3.21Å; V388-Y830 VanDerWaalsContact C-OH 3.3Å; V388-G832 CarbonylContact O-C 3.55Å; V388-G832 VanDerWaalsContact O-CA 3.31Å; V388-G832 WeakPolarHBondContact O-CA 3.46Å; V388-A833 PolarHBondContact O-N 3.46Å; V388-G834 PolarHBondContact O-N 2.77Å; V388-K836 HydrophobicContact CG1-CB 4.13Å; V388-K836 HydrophobicContact CG2-CB 3.92Å
389	G	86.9	Confident	89.4	Confident	14 Å²	14	32.8 Å²	32.8	14%	0.144	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-64.9	150.1	-174.1	0	0	0	0	0	111.4	T368 Y830 G834	T368-G389 WeakPolarHBondContact CG2-O 3.42Å; T368-G389 PolarHBondContact OG1-O 3.34Å; G389-Y830 VanDerWaalsContact CA-CE2 3.46Å; G389-Y830 VanDerWaalsContact CA-OH 3.24Å; G389-Y830 WeakPolarHBondContact CA-OH 3.45Å; G389-Y830 PolarHBondContact N-OH 2.68Å; G389-G834 WeakPolarHBondContact O-CA 3.41Å
390	S	88.4	Confident	89.4	Confident	32 Å²	32	33 Å²	33	22%	0.224	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-70.6	159	174.1	66.3	0	0	0	0	111.4	R392 E393	S390-R392 PolarHBondContact O-N 3.35Å; S390-E393 WeakPolarHBondContact CB-OE2 3.25Å; S390-E393 PolarHBondContact N-OE2 2.98Å; S390-E393 WeakPolarHBondContact O-CB 3.36Å; S390-E393 PolarHBondContact O-N 3.15Å; S390-E393 VanDerWaalsContact O-N 3.07Å; S390-E393 WeakPolarHBondContact OG-CB 3.45Å; S390-E393 VanDerWaalsContact OG-CD 3.27Å; S390-E393 PolarHBondContact OG-OE2 3.09Å
391	Y	89.4	Confident	89.5	Confident	52 Å²	52	33.6 Å²	33.6	20%	0.204	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	125.1	-175.2	179.9	-111.3	0	0	0	113	S7 E8 T9 M10 P366 E393 F577	S7-Y391 WeakPolarHBondContact OG-CD2 3.19Å; E8-Y391 WeakPolarHBondContact O-CE2 3.4Å; T9-Y391 VanDerWaalsContact CA-OH 3.3Å; T9-Y391 WeakPolarHBondContact CA-OH 3.13Å; M10-Y391 HydrophobicContact CB-CE2 4.05Å; M10-Y391 HydrophobicContact CG-CE2 3.99Å; M10-Y391 PolarHBondContact N-OH 3.47Å; P366-Y391 HydrophobicContact CB-CD2 4.27Å; P366-Y391 HydrophobicContact CB-CE2 4.23Å; P366-Y391 HydrophobicContact CG-CD1 3.44Å; P366-Y391 VanDerWaalsContact CG-CD1 3.44Å; P366-Y391 HydrophobicContact CG-CD2 3.51Å; P366-Y391 HydrophobicContact CG-CE1 3.48Å; P366-Y391 VanDerWaalsContact CG-CE1 3.48Å; P366-Y391 HydrophobicContact CG-CE2 3.55Å; P366-Y391 HydrophobicContact CG-CG 3.44Å; P366-Y391 VanDerWaalsContact CG-CG 3.44Å; Y391-E393 PolarHBondContact O-N 3.19Å; Y391-F577 WeakPolarHBondContact O-CZ 3.4Å
392	R	88.1	Confident	89.7	Confident	93 Å²	93	35.1 Å²	35.1	35%	0.351	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	27	-173.9	-51.7	-156.7	-58.2	161.1	-1.2	115.5	S7 S390 H576	S7-R392 WeakPolarHBondContact OG-CA 3.34Å; S7-R392 PolarHBondContact OG-N 3.03Å; S390-R392 PolarHBondContact O-N 3.35Å; R392-H576 VanDerWaalsContact CZ-CE1 3.47Å; R392-H576 PolarHBondContact O-ND1 3.19Å
393	E	88.7	Confident	89.8	Confident	10 Å²	10	34.9 Å²	34.9	5%	0.047	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-74	154.5	165.3	-164.6	167.6	-162	0	0	111.3	S390 Y391 N395 F829 Y830 V831	S390-E393 WeakPolarHBondContact CB-OE2 3.25Å; S390-E393 PolarHBondContact N-OE2 2.98Å; S390-E393 WeakPolarHBondContact O-CB 3.36Å; S390-E393 PolarHBondContact O-N 3.15Å; S390-E393 VanDerWaalsContact O-N 3.07Å; S390-E393 WeakPolarHBondContact OG-CB 3.45Å; S390-E393 VanDerWaalsContact OG-CD 3.27Å; S390-E393 PolarHBondContact OG-OE2 3.09Å; Y391-E393 PolarHBondContact O-N 3.19Å; E393-N395 PolarHBondContact O-N 3.27Å; E393-F829 VanDerWaalsContact OE1-O 3.05Å; E393-Y830 VanDerWaalsContact OE1-CA 3.32Å; E393-Y830 WeakPolarHBondContact OE1-CA 3.18Å; E393-V831 PolarHBondContact OE1-N 3.41Å
394	V	89.4	Confident	89.9	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-65.8	126	172.2	170	0	0	0	0	109.7	F5 R6 P396 F399 L569 N573	F5-V394 HydrophobicContact CD2-CG1 4.48Å; F5-V394 HydrophobicContact CE1-CG2 4.03Å; F5-V394 HydrophobicContact CE2-CG1 3.93Å; F5-V394 HydrophobicContact CE2-CG2 4.31Å; F5-V394 HydrophobicContact CZ-CG1 4.2Å; F5-V394 HydrophobicContact CZ-CG2 3.74Å; F5-V394 WeakPolarHBondContact O-CA 3.35Å; R6-V394 HydrophobicContact CG-CG2 4.47Å; V394-P396 WeakPolarHBondContact O-CD 3.45Å; V394-F399 HydrophobicContact CG1-CE2 4.03Å; V394-L569 HydrophobicContact CG1-CD2 4.49Å; V394-N573 VanDerWaalsContact CB-OD1 3.32Å; V394-N573 WeakPolarHBondContact CB-OD1 3.45Å; V394-N573 WeakPolarHBondContact CG2-OD1 3.4Å; V394-N573 PolarHBondContact N-OD1 3.45Å
395	N	89.7	Confident	90.2	Very high	6 Å²	6	33.6 Å²	33.6	3%	0.032	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-75.5	120.6	179.6	-176.2	9	0	0	0	111.1	L4 F5 I370 Q380 E393 A397	L4-N395 WeakPolarHBondContact O-CB 3.38Å; L4-N395 PolarHBondContact O-ND2 3.37Å; L4-N395 VanDerWaalsContact O-ND2 3.16Å; F5-N395 PolarHBondContact O-N 2.91Å; I370-N395 HydrophobicContact CD1-CB 4.4Å; Q380-N395 PolarHBondContact OE1-ND2 3.41Å; Q380-N395 PolarHBondContact OE1-OD1 3.43Å; E393-N395 PolarHBondContact O-N 3.27Å; N395-A397 PolarHBondContact O-N 3.28Å; N395-A397 VanDerWaalsContact OD1-CB 3.27Å; N395-A397 WeakPolarHBondContact OD1-CB 3.5Å; N395-A397 PolarHBondContact OD1-N 3.3Å
396	P	88.9	Confident	90.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-28.3	173.4	-19.8	30.8	0	0	0	113.1	V383 V394 L398 F399 T400 Q826 F829 Y830	V383-P396 HydrophobicContact CG1-CB 4.13Å; V383-P396 HydrophobicContact CG1-CG 4.01Å; V383-P396 HydrophobicContact CG2-CB 4.44Å; V394-P396 WeakPolarHBondContact O-CD 3.45Å; P396-L398 PolarHBondContact O-N 2.94Å; P396-L398 VanDerWaalsContact O-N 3.15Å; P396-F399 PolarHBondContact O-N 3.22Å; P396-T400 WeakPolarHBondContact O-CG2 3.22Å; P396-T400 PolarHBondContact O-N 2.94Å; P396-T400 VanDerWaalsContact O-N 3.09Å; P396-Q826 HydrophobicContact CB-CG 4.19Å; P396-Q826 HydrophobicContact CG-CG 4.18Å; P396-F829 HydrophobicContact CB-CE2 4.33Å; P396-F829 HydrophobicContact CB-CZ 4.01Å; P396-F829 HydrophobicContact CG-CE2 3.84Å; P396-F829 HydrophobicContact CG-CZ 3.95Å; P396-Y830 HydrophobicContact CG-CD2 3.47Å; P396-Y830 VanDerWaalsContact CG-CD2 3.47Å; P396-Y830 HydrophobicContact CG-CE2 3.73Å; P396-Y830 HydrophobicContact CG-CG 3.95Å
397	A	88.3	Confident	90.6	Very high	3 Å²	3	28.3 Å²	28.3	3%	0.025	15%	0.146	C	C	.	.	H	α-helix	trans	-60.3	-31.7	-169.5	0	0	0	0	0	113.4	V383 N395 F399 T400 I401	V383-A397 HydrophobicContact CB-CB 4.44Å; V383-A397 HydrophobicContact CG2-CB 3.93Å; N395-A397 PolarHBondContact O-N 3.28Å; N395-A397 VanDerWaalsContact OD1-CB 3.27Å; N395-A397 WeakPolarHBondContact OD1-CB 3.5Å; N395-A397 PolarHBondContact OD1-N 3.3Å; A397-F399 VanDerWaalsContact C-N 3.27Å; A397-F399 PolarHBondContact O-N 3.47Å; A397-T400 VanDerWaalsContact CA-OG1 3.27Å; A397-T400 WeakPolarHBondContact CA-OG1 3.36Å; A397-T400 PolarHBondContact O-N 3.48Å; A397-T400 PolarHBondContact O-OG1 2.93Å; A397-I401 VanDerWaalsContact O-CG1 3.29Å; A397-I401 WeakPolarHBondContact O-CG1 3.29Å; A397-I401 PolarHBondContact O-N 3.22Å
398	L	89.2	Confident	90.9	Very high	66 Å²	66	27.6 Å²	27.6	35%	0.346	14%	0.139	S	C	.	.	H	α-helix	trans	-59.5	-40.7	177.4	178.5	62.2	0	0	0	111.8	L4 F5 P396	L4-L398 HydrophobicContact CD2-CB 4.03Å; L4-L398 HydrophobicContact CD2-CD1 3.55Å; L4-L398 HydrophobicContact CD2-CG 4.33Å; F5-L398 HydrophobicContact CD2-CD2 4.01Å; P396-L398 PolarHBondContact O-N 2.94Å; P396-L398 VanDerWaalsContact O-N 3.15Å
399	F	90.5	Very high	91.2	Very high	42 Å²	42	26.3 Å²	26.3	18%	0.184	13%	0.131	C	C	.	.	H	α-helix	trans	-81.2	-38	-178.3	-55.6	-63	0	0	0	111.1	F5 V394 P396 A397 I401 I402 T403 F565 L569 F825	F5-F399 HydrophobicContact CE2-CZ 4.13Å; V394-F399 HydrophobicContact CG1-CE2 4.03Å; P396-F399 PolarHBondContact O-N 3.22Å; A397-F399 VanDerWaalsContact C-N 3.27Å; A397-F399 PolarHBondContact O-N 3.47Å; F399-I401 PolarHBondContact O-N 3.48Å; F399-I402 PolarHBondContact O-N 3.45Å; F399-I402 VanDerWaalsContact O-N 3.14Å; F399-T403 PolarHBondContact O-N 3.14Å; F399-T403 PolarHBondContact O-OG1 2.73Å; F399-F565 HydrophobicContact CB-CE1 4.17Å; F399-F565 AromaticContact CD1-CE1 3.72Å; F399-F565 HydrophobicContact CD1-CE1 3.72Å; F399-F565 AromaticContact CD1-CZ 3.53Å; F399-F565 HydrophobicContact CD1-CZ 3.53Å; F399-F565 HydrophobicContact CD2-CE1 4.3Å; F399-F565 HydrophobicContact CD2-CZ 4.43Å; F399-F565 HydrophobicContact CE1-CE1 4.19Å; F399-F565 AromaticContact CE1-CZ 3.54Å; F399-F565 HydrophobicContact CE1-CZ 3.54Å; F399-F565 HydrophobicContact CE2-CZ 4.43Å; F399-F565 AromaticContact CG-CE1 3.78Å; F399-F565 HydrophobicContact CG-CE1 3.78Å; F399-F565 HydrophobicContact CG-CZ 4Å; F399-F565 AromaticContact CZ-CZ 3.99Å; F399-F565 HydrophobicContact CZ-CZ 3.99Å; F399-L569 HydrophobicContact CD2-CD1 3.55Å; F399-L569 HydrophobicContact CD2-CD2 4.48Å; F399-L569 HydrophobicContact CE2-CD1 3.43Å; F399-L569 VanDerWaalsContact CE2-CD1 3.43Å; F399-L569 HydrophobicContact CE2-CD2 3.57Å; F399-L569 HydrophobicContact CE2-CG 4.16Å; F399-L569 HydrophobicContact CG-CD1 4.39Å; F399-L569 HydrophobicContact CZ-CD1 4.2Å; F399-L569 HydrophobicContact CZ-CD2 3.62Å; F399-F825 HydrophobicContact CB-CE1 4.5Å; F399-F825 HydrophobicContact CB-CZ 4.34Å
400	T	91.2	Very high	91.5	Very high	8 Å²	8	25.8 Å²	25.8	5%	0.049	13%	0.125	C	C	.	.	H	α-helix	trans	-60.3	-29.6	177.7	64.1	0	0	0	0	112.3	V383 P396 A397 I402 T403 F404 P405	V383-T400 HydrophobicContact CG2-CG2 4.21Å; P396-T400 WeakPolarHBondContact O-CG2 3.22Å; P396-T400 PolarHBondContact O-N 2.94Å; P396-T400 VanDerWaalsContact O-N 3.09Å; A397-T400 VanDerWaalsContact CA-OG1 3.27Å; A397-T400 WeakPolarHBondContact CA-OG1 3.36Å; A397-T400 PolarHBondContact O-N 3.48Å; A397-T400 PolarHBondContact O-OG1 2.93Å; T400-I402 PolarHBondContact O-N 3.16Å; T400-T403 WeakPolarHBondContact CA-OG1 3.49Å; T400-F404 WeakPolarHBondContact O-CB 3.4Å; T400-F404 PolarHBondContact O-N 3.47Å; T400-P405 WeakPolarHBondContact O-CD 3.45Å
401	I	92.1	Very high	91.8	Very high	20 Å²	20	24.3 Å²	24.3	10%	0.103	12%	0.115	C	C	.	.	H	α-helix	trans	-48.9	-37.8	175.2	-71.3	160.5	0	0	0	112.5	L4 F375 T376 F379 A397 F399 P405 L456	L4-I401 HydrophobicContact CD2-CD1 4.45Å; F375-I401 HydrophobicContact CE1-CG2 3.71Å; F375-I401 HydrophobicContact CZ-CG2 3.97Å; T376-I401 HydrophobicContact CG2-CD1 3.96Å; F379-I401 HydrophobicContact CB-CG1 4.07Å; F379-I401 HydrophobicContact CD1-CG1 4.28Å; F379-I401 HydrophobicContact CD2-CG1 3.8Å; F379-I401 HydrophobicContact CE2-CG1 4.29Å; F379-I401 HydrophobicContact CE2-CG2 4.47Å; F379-I401 HydrophobicContact CG-CG1 3.79Å; A397-I401 VanDerWaalsContact O-CG1 3.29Å; A397-I401 WeakPolarHBondContact O-CG1 3.29Å; A397-I401 PolarHBondContact O-N 3.22Å; F399-I401 PolarHBondContact O-N 3.48Å; I401-P405 WeakPolarHBondContact O-CD 3.33Å; I401-P405 WeakPolarHBondContact O-CG 3.42Å; I401-L456 HydrophobicContact CG2-CD1 4.28Å
402	I	92.9	Very high	91.9	Very high	105 Å²	105	22 Å²	22	54%	0.538	11%	0.105	S	C	.	.	H	α-helix	trans	-104.6	-46.1	-178.6	-61.7	176.1	0	0	0	111.4	F399 T400 F404 F406 F460	F399-I402 PolarHBondContact O-N 3.45Å; F399-I402 VanDerWaalsContact O-N 3.14Å; T400-I402 PolarHBondContact O-N 3.16Å; I402-F404 VanDerWaalsContact C-N 3.31Å; I402-F404 PolarHBondContact O-N 3.3Å; I402-F406 VanDerWaalsContact O-CB 3.28Å; I402-F406 WeakPolarHBondContact O-CB 3.44Å; I402-F406 PolarHBondContact O-N 3.35Å; I402-F460 HydrophobicContact CG2-CZ 4.16Å
403	T	93.3	Very high	91.9	Very high	31 Å²	31	17.8 Å²	17.8	19%	0.19	9%	0.091	C	C	.	.	H	α-helix	trans	-68.3	-32.8	-173.8	60.5	0	0	0	0	112.1	F399 T400 F406 L407 H821	F399-T403 PolarHBondContact O-N 3.14Å; F399-T403 PolarHBondContact O-OG1 2.73Å; T400-T403 WeakPolarHBondContact CA-OG1 3.49Å; T403-F406 PolarHBondContact O-N 3.06Å; T403-L407 WeakPolarHBondContact O-CG 3.31Å; T403-L407 PolarHBondContact O-N 2.93Å; T403-H821 PolarHBondContact OG1-NE2 3.32Å
404	F	93.9	Very high	92.1	Very high	5 Å²	5	17.4 Å²	17.4	2%	0.022	9%	0.089	C	C	.	.	H	α-helix	trans	-67	-56.4	-179.5	174.5	-95.7	0	0	0	112.6	F379 T400 I402 F406 L407 F408 I453 M457 F814 A817 I818 H821	F379-F404 HydrophobicContact CE1-CD1 4.39Å; T400-F404 WeakPolarHBondContact O-CB 3.4Å; T400-F404 PolarHBondContact O-N 3.47Å; I402-F404 VanDerWaalsContact C-N 3.31Å; I402-F404 PolarHBondContact O-N 3.3Å; F404-F406 PolarHBondContact O-N 3.27Å; F404-L407 PolarHBondContact O-N 3.24Å; F404-F408 PolarHBondContact O-N 2.82Å; F404-F408 VanDerWaalsContact O-N 3.08Å; F404-I453 HydrophobicContact CD1-CG2 4.15Å; F404-I453 HydrophobicContact CE1-CG2 3.74Å; F404-M457 HydrophobicContact CE1-SD 4.06Å; F404-F814 AromaticContact CE1-CD2 3.84Å; F404-F814 HydrophobicContact CE1-CD2 3.84Å; F404-F814 AromaticContact CE1-CE2 3.56Å; F404-F814 HydrophobicContact CE1-CE2 3.56Å; F404-F814 HydrophobicContact CE1-CZ 4.5Å; F404-F814 AromaticContact CZ-CD2 3.41Å; F404-F814 HydrophobicContact CZ-CD2 3.41Å; F404-F814 VanDerWaalsContact CZ-CD2 3.41Å; F404-F814 AromaticContact CZ-CE2 3.34Å; F404-F814 HydrophobicContact CZ-CE2 3.34Å; F404-F814 HydrophobicContact CZ-CG 4.18Å; F404-F814 HydrophobicContact CZ-CZ 4.07Å; F404-A817 HydrophobicContact CD2-CB 4.1Å; F404-A817 HydrophobicContact CE2-CB 3.67Å; F404-A817 HydrophobicContact CZ-CB 4.4Å; F404-I818 HydrophobicContact CD2-CG1 4.27Å; F404-I818 HydrophobicContact CE2-CB 4.18Å; F404-I818 HydrophobicContact CE2-CD1 4.41Å; F404-I818 HydrophobicContact CE2-CG1 3.29Å; F404-I818 HydrophobicContact CZ-CD1 4.37Å; F404-I818 HydrophobicContact CZ-CG1 3.66Å; F404-H821 WeakPolarHBondContact CA-CE1 3.36Å; F404-H821 AromaticContact CD2-CE1 3.93Å; F404-H821 AromaticContact CD2-ND1 3.79Å; F404-H821 PolarHBondContact N-NE2 3.07Å
405	P	94.9	Very high	92.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59	-33.5	174.1	-29	39.8	0	0	0	113.7	F379 T400 I401 A409 L456 M457 F460	F379-P405 HydrophobicContact CE1-CG 4.15Å; F379-P405 HydrophobicContact CZ-CG 4.26Å; T400-P405 WeakPolarHBondContact O-CD 3.45Å; I401-P405 WeakPolarHBondContact O-CD 3.33Å; I401-P405 WeakPolarHBondContact O-CG 3.42Å; P405-A409 VanDerWaalsContact O-CB 3.3Å; P405-A409 WeakPolarHBondContact O-CB 3.5Å; P405-A409 PolarHBondContact O-N 3.32Å; P405-L456 HydrophobicContact CB-CB 3.9Å; P405-L456 HydrophobicContact CG-CB 3.72Å; P405-L456 HydrophobicContact CG-CD1 4.32Å; P405-M457 HydrophobicContact CB-CG 4.08Å; P405-M457 HydrophobicContact CG-CG 4.43Å; P405-F460 HydrophobicContact CB-CD2 3.5Å; P405-F460 HydrophobicContact CB-CE2 4.04Å; P405-F460 HydrophobicContact CB-CG 4.44Å
406	F	94.9	Very high	92.3	Very high	60 Å²	60	20.6 Å²	20.6	26%	0.263	10%	0.104	S	C	.	.	H	α-helix	trans	-68	-47.7	178.6	178.3	-101.4	0	0	0	112.9	I402 T403 F404 F408 A409 V410 F460 L558	I402-F406 VanDerWaalsContact O-CB 3.28Å; I402-F406 WeakPolarHBondContact O-CB 3.44Å; I402-F406 PolarHBondContact O-N 3.35Å; T403-F406 PolarHBondContact O-N 3.06Å; F404-F406 PolarHBondContact O-N 3.27Å; F406-F408 VanDerWaalsContact C-N 3.3Å; F406-F408 PolarHBondContact O-N 3.46Å; F406-A409 WeakPolarHBondContact O-CB 3.34Å; F406-A409 PolarHBondContact O-N 2.85Å; F406-A409 VanDerWaalsContact O-N 3.14Å; F406-V410 HydrophobicContact CE1-CG2 4.24Å; F406-V410 HydrophobicContact CZ-CG2 4.24Å; F406-V410 WeakPolarHBondContact O-CG2 3.33Å; F406-V410 PolarHBondContact O-N 3.21Å; F406-V410 VanDerWaalsContact O-N 3.08Å; F406-F460 HydrophobicContact CD2-CD1 4.33Å; F406-L558 HydrophobicContact CE1-CD1 4Å; F406-L558 HydrophobicContact CE1-CD2 3.88Å; F406-L558 HydrophobicContact CZ-CD1 4.41Å; F406-L558 HydrophobicContact CZ-CD2 4.3Å
407	L	94.3	Very high	92.5	Very high	5 Å²	5	20.6 Å²	20.6	3%	0.026	10%	0.104	C	C	.	.	H	α-helix	trans	-65	-36.5	177.1	-71.1	-173.8	0	0	0	111.8	T403 F404 V410 M411 Y753 L756 L820	T403-L407 WeakPolarHBondContact O-CG 3.31Å; T403-L407 PolarHBondContact O-N 2.93Å; F404-L407 PolarHBondContact O-N 3.24Å; L407-V410 PolarHBondContact O-N 3.33Å; L407-M411 PolarHBondContact O-N 2.95Å; L407-Y753 HydrophobicContact CD1-CE1 4.44Å; L407-L756 HydrophobicContact CB-CD2 4.27Å; L407-L756 HydrophobicContact CD2-CD1 4.04Å; L407-L756 HydrophobicContact CD2-CD2 4.21Å; L407-L820 HydrophobicContact CD1-CB 4.49Å
408	F	95.3	Very high	92.7	Very high	1 Å²	1	20.5 Å²	20.5	0%	0.004	10%	0.103	C	C	.	.	H	α-helix	trans	-58.8	-47.7	169.9	170.4	-94.2	0	0	0	111.6	F404 F406 V410 M411 F412 M421 M457 G810 A813 F814 A817	F404-F408 PolarHBondContact O-N 2.82Å; F404-F408 VanDerWaalsContact O-N 3.08Å; F406-F408 VanDerWaalsContact C-N 3.3Å; F406-F408 PolarHBondContact O-N 3.46Å; F408-V410 VanDerWaalsContact C-N 3.25Å; F408-V410 PolarHBondContact O-N 3.25Å; F408-M411 WeakPolarHBondContact O-CB 3.44Å; F408-M411 PolarHBondContact O-N 3.43Å; F408-M411 VanDerWaalsContact O-N 3.09Å; F408-F412 HydrophobicContact CD1-CB 4.38Å; F408-F412 HydrophobicContact CE1-CB 3.8Å; F408-F412 HydrophobicContact CE1-CD1 4.06Å; F408-F412 HydrophobicContact CE1-CG 4.16Å; F408-F412 HydrophobicContact CE2-CB 4.04Å; F408-F412 HydrophobicContact CE2-CG 4.42Å; F408-F412 HydrophobicContact CZ-CB 3.62Å; F408-F412 AromaticContact CZ-CD1 3.91Å; F408-F412 HydrophobicContact CZ-CD1 3.91Å; F408-F412 HydrophobicContact CZ-CD2 4.48Å; F408-F412 AromaticContact CZ-CG 3.75Å; F408-F412 HydrophobicContact CZ-CG 3.75Å; F408-F412 WeakPolarHBondContact O-CB 3.32Å; F408-F412 PolarHBondContact O-N 3.14Å; F408-M421 HydrophobicContact CE1-CE 3.54Å; F408-M421 HydrophobicContact CE1-SD 4.14Å; F408-M421 HydrophobicContact CZ-CE 4.05Å; F408-M421 HydrophobicContact CZ-SD 4.19Å; F408-M457 HydrophobicContact CB-CE 4.48Å; F408-M457 HydrophobicContact CB-CG 4.4Å; F408-M457 HydrophobicContact CD1-CB 3.64Å; F408-M457 HydrophobicContact CD1-CE 3.52Å; F408-M457 HydrophobicContact CD1-CG 3.68Å; F408-M457 HydrophobicContact CD1-SD 4.42Å; F408-M457 HydrophobicContact CD2-CE 3.45Å; F408-M457 VanDerWaalsContact CD2-CE 3.45Å; F408-M457 HydrophobicContact CE1-CB 3.79Å; F408-M457 HydrophobicContact CE1-CE 3.45Å; F408-M457 VanDerWaalsContact CE1-CE 3.45Å; F408-M457 HydrophobicContact CE1-CG 4.22Å; F408-M457 HydrophobicContact CE2-CE 3.34Å; F408-M457 HydrophobicContact CG-CB 4.5Å; F408-M457 HydrophobicContact CG-CE 3.52Å; F408-M457 HydrophobicContact CG-CG 4.07Å; F408-M457 HydrophobicContact CG-SD 4.47Å; F408-M457 HydrophobicContact CZ-CE 3.34Å; F408-G810 WeakPolarHBondContact CE2-O 3.28Å; F408-A813 HydrophobicContact CD2-CB 3.85Å; F408-A813 HydrophobicContact CE2-CB 3.65Å; F408-F814 HydrophobicContact CD2-CB 4.34Å; F408-F814 HydrophobicContact CE2-CB 4.35Å; F408-A817 HydrophobicContact CB-CB 4.16Å
409	A	94.5	Very high	92.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.2	-28.9	-179.6	0	0	0	0	0	113.7	P405 F406 F412 G413 F460 T464	P405-A409 VanDerWaalsContact O-CB 3.3Å; P405-A409 WeakPolarHBondContact O-CB 3.5Å; P405-A409 PolarHBondContact O-N 3.32Å; F406-A409 WeakPolarHBondContact O-CB 3.34Å; F406-A409 PolarHBondContact O-N 2.85Å; F406-A409 VanDerWaalsContact O-N 3.14Å; A409-F412 CarbonylContact O-C 3.27Å; A409-F412 VanDerWaalsContact O-C 3.27Å; A409-G413 VanDerWaalsContact O-CA 3.29Å; A409-G413 WeakPolarHBondContact O-CA 3.33Å; A409-G413 PolarHBondContact O-N 3.14Å; A409-G413 VanDerWaalsContact O-N 3.16Å; A409-F460 HydrophobicContact CB-CB 3.56Å; A409-F460 WeakPolarHBondContact CB-O 3.44Å; A409-T464 HydrophobicContact CB-CG2 3.71Å; A409-T464 WeakPolarHBondContact O-CB 3.32Å; A409-T464 PolarHBondContact O-OG1 3.49Å
410	V	94	Very high	93.1	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.012	12%	0.118	C	C	.	.	H	α-helix	trans	-67.6	-39.4	174	169	0	0	0	0	111.5	F406 L407 F408 T464 Y468 M554 L558 L756 S760	F406-V410 HydrophobicContact CE1-CG2 4.24Å; F406-V410 HydrophobicContact CZ-CG2 4.24Å; F406-V410 WeakPolarHBondContact O-CG2 3.33Å; F406-V410 PolarHBondContact O-N 3.21Å; F406-V410 VanDerWaalsContact O-N 3.08Å; L407-V410 PolarHBondContact O-N 3.33Å; F408-V410 VanDerWaalsContact C-N 3.25Å; F408-V410 PolarHBondContact O-N 3.25Å; V410-T464 HydrophobicContact CG2-CG2 4.39Å; V410-Y468 PolarHBondContact O-OH 2.97Å; V410-M554 HydrophobicContact CB-CE 4.38Å; V410-M554 HydrophobicContact CG1-CE 3.73Å; V410-M554 HydrophobicContact CG1-SD 3.83Å; V410-M554 HydrophobicContact CG2-CE 3.79Å; V410-L558 HydrophobicContact CG1-CD1 4.33Å; V410-L558 HydrophobicContact CG2-CD1 3.89Å; V410-L756 HydrophobicContact CG1-CB 4.16Å; V410-L756 HydrophobicContact CG1-CD2 4.46Å; V410-S760 VanDerWaalsContact O-CB 3.29Å; V410-S760 WeakPolarHBondContact O-CB 3.38Å; V410-S760 PolarHBondContact O-OG 3.32Å; V410-S760 VanDerWaalsContact O-OG 3.04Å
411	M	94.1	Very high	93.2	Very high	2 Å²	2	24 Å²	24	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-71.4	-42.1	173.9	-72.7	172.8	148.7	0	0	111.7	L407 F408 R755 L756 L759 S760 A813 H816 L820	L407-M411 PolarHBondContact O-N 2.95Å; F408-M411 WeakPolarHBondContact O-CB 3.44Å; F408-M411 PolarHBondContact O-N 3.43Å; F408-M411 VanDerWaalsContact O-N 3.09Å; M411-R755 HydrophobicContact CE-CB 3.78Å; M411-L756 HydrophobicContact CE-CD2 3.88Å; M411-L756 HydrophobicContact CE-CG 4.4Å; M411-L756 HydrophobicContact CG-CD2 3.76Å; M411-L756 HydrophobicContact SD-CD2 3.99Å; M411-L759 HydrophobicContact CB-CB 4.34Å; M411-L759 HydrophobicContact CB-CD2 4.3Å; M411-L759 HydrophobicContact CE-CB 4.47Å; M411-L759 HydrophobicContact CE-CD2 4.31Å; M411-L759 HydrophobicContact CG-CB 4.21Å; M411-L759 HydrophobicContact CG-CD2 4.37Å; M411-L759 HydrophobicContact SD-CD2 4.07Å; M411-S760 VanDerWaalsContact O-CA 3.24Å; M411-S760 WeakPolarHBondContact O-CA 3.45Å; M411-A813 HydrophobicContact CB-CB 4.01Å; M411-H816 HydrophobicContact CE-CB 3.62Å; M411-H816 HydrophobicContact SD-CB 3.96Å; M411-L820 HydrophobicContact CE-CD1 4.25Å
412	F	91.9	Very high	93.3	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.009	13%	0.126	C	C	.	.	S	Bend	trans	-108.5	57.6	-176.1	-160.8	-100.2	0	0	0	111.1	F408 A409 D414 H417 M421 S461 H763 L805 L806 A813	F408-F412 HydrophobicContact CD1-CB 4.38Å; F408-F412 HydrophobicContact CE1-CB 3.8Å; F408-F412 HydrophobicContact CE1-CD1 4.06Å; F408-F412 HydrophobicContact CE1-CG 4.16Å; F408-F412 HydrophobicContact CE2-CB 4.04Å; F408-F412 HydrophobicContact CE2-CG 4.42Å; F408-F412 HydrophobicContact CZ-CB 3.62Å; F408-F412 AromaticContact CZ-CD1 3.91Å; F408-F412 HydrophobicContact CZ-CD1 3.91Å; F408-F412 HydrophobicContact CZ-CD2 4.48Å; F408-F412 AromaticContact CZ-CG 3.75Å; F408-F412 HydrophobicContact CZ-CG 3.75Å; F408-F412 WeakPolarHBondContact O-CB 3.32Å; F408-F412 PolarHBondContact O-N 3.14Å; A409-F412 CarbonylContact O-C 3.27Å; A409-F412 VanDerWaalsContact O-C 3.27Å; F412-D414 PolarHBondContact O-N 3.42Å; F412-H417 HydrophobicContact CE1-CB 3.58Å; F412-H417 HydrophobicContact CZ-CB 3.65Å; F412-M421 HydrophobicContact CD1-CE 4.11Å; F412-M421 HydrophobicContact CE1-CE 4.27Å; F412-S461 WeakPolarHBondContact O-CB 3.45Å; F412-S461 PolarHBondContact O-OG 2.91Å; F412-H763 AromaticContact CD2-CE1 3.7Å; F412-H763 AromaticContact CD2-ND1 3.83Å; F412-H763 AromaticContact CE2-CE1 3.13Å; F412-H763 WeakPolarHBondContact CE2-CE1 3.33Å; F412-H763 AromaticContact CE2-ND1 3.56Å; F412-H763 AromaticContact CE2-NE2 3.81Å; F412-H763 AromaticContact CZ-CE1 3.64Å; F412-L805 WeakPolarHBondContact CE2-O 3.43Å; F412-L805 WeakPolarHBondContact CZ-O 3.49Å; F412-L806 HydrophobicContact CE1-CD2 4.39Å; F412-L806 HydrophobicContact CZ-CD2 4.25Å; F412-L806 HydrophobicContact CZ-CG 4.47Å; F412-A813 HydrophobicContact CB-CB 4.45Å
413	G	88.2	Confident	93.4	Very high	5 Å²	5	24.4 Å²	24.4	5%	0.052	12%	0.121	C	C	.	.			trans	-93.1	80.9	-175.4	0	0	0	0	0	112.4	A409	A409-G413 VanDerWaalsContact O-CA 3.29Å; A409-G413 WeakPolarHBondContact O-CA 3.33Å; A409-G413 PolarHBondContact O-N 3.14Å; A409-G413 VanDerWaalsContact O-N 3.16Å
414	D	92.5	Very high	93.3	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.011	13%	0.132	C	C	.	.			trans	-137.5	127.4	169.7	-172.7	-32.6	0	0	0	108.6	F412 G416 H417 G418 C471 F472	F412-D414 PolarHBondContact O-N 3.42Å; D414-G416 VanDerWaalsContact C-N 3.32Å; D414-G416 PolarHBondContact O-N 3.13Å; D414-G416 PolarHBondContact OD1-N 3.47Å; D414-H417 HydrophobicContact CB-CB 4.2Å; D414-H417 IonicContact OD2-CE1 3.55Å; D414-H417 PolarHBondContact OD2-CE1 3.03Å; D414-H417 VanDerWaalsContact OD2-CE1 3.22Å; D414-H417 IonicContact OD2-CG 3.54Å; D414-H417 IonicContact OD2-ND1 3.16Å; D414-H417 PolarHBondContact OD2-ND1 3.41Å; D414-H417 VanDerWaalsContact OD2-ND1 3.12Å; D414-G418 PolarHBondContact O-N 3.2Å; D414-C471 WeakPolarHBondContact OD1-CA 3.22Å; D414-F472 PolarHBondContact OD1-N 3.09Å; D414-F472 PolarHBondContact OD2-N 3.23Å
415	F	92.5	Very high	93.2	Very high	69 Å²	69	27.2 Å²	27.2	30%	0.303	13%	0.131	S	C	.	.	H	α-helix	trans	-61.6	-40.9	-179.9	175.3	-99.2	0	0	0	112.1	F419 V462 L466 D470 C471	F415-F419 VanDerWaalsContact O-CB 3.28Å; F415-F419 WeakPolarHBondContact O-CB 3.47Å; F415-F419 PolarHBondContact O-N 3.41Å; F415-V462 HydrophobicContact CD2-CG1 3.74Å; F415-V462 HydrophobicContact CE2-CG1 3.67Å; F415-L466 HydrophobicContact CD2-CD1 4.36Å; F415-L466 HydrophobicContact CD2-CD2 3.63Å; F415-L466 HydrophobicContact CD2-CG 3.71Å; F415-L466 HydrophobicContact CE2-CD1 4.32Å; F415-L466 HydrophobicContact CE2-CD2 3.84Å; F415-L466 HydrophobicContact CE2-CG 4.09Å; F415-L466 HydrophobicContact CG-CD2 4.3Å; F415-D470 WeakPolarHBondContact CB-O 3.44Å; F415-D470 PolarHBondContact N-O 2.57Å; F415-C471 HydrophobicContact CB-CB 4.28Å; F415-C471 HydrophobicContact CD1-CB 4.23Å
416	G	91.6	Very high	93.2	Very high	4 Å²	4	30.1 Å²	30.1	4%	0.041	15%	0.146	C	C	.	.	H	α-helix	trans	-69.4	-53.2	-176.7	0	0	0	0	0	112	D414 G418 F419 V420	D414-G416 VanDerWaalsContact C-N 3.32Å; D414-G416 PolarHBondContact O-N 3.13Å; D414-G416 PolarHBondContact OD1-N 3.47Å; G416-G418 PolarHBondContact O-N 3.09Å; G416-F419 PolarHBondContact O-N 3.3Å; G416-V420 WeakPolarHBondContact O-CG2 3.34Å; G416-V420 PolarHBondContact O-N 3.11Å; G416-V420 VanDerWaalsContact O-N 3.15Å
417	H	92	Very high	92.9	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-42.5	177.7	-57.1	140.3	0	0	0	111.7	F412 D414 F419 V420 M421 F472 H763 L806	F412-H417 HydrophobicContact CE1-CB 3.58Å; F412-H417 HydrophobicContact CZ-CB 3.65Å; D414-H417 HydrophobicContact CB-CB 4.2Å; D414-H417 IonicContact OD2-CE1 3.55Å; D414-H417 PolarHBondContact OD2-CE1 3.03Å; D414-H417 VanDerWaalsContact OD2-CE1 3.22Å; D414-H417 IonicContact OD2-CG 3.54Å; D414-H417 IonicContact OD2-ND1 3.16Å; D414-H417 PolarHBondContact OD2-ND1 3.41Å; D414-H417 VanDerWaalsContact OD2-ND1 3.12Å; H417-F419 VanDerWaalsContact C-N 3.28Å; H417-F419 PolarHBondContact O-N 3.5Å; H417-V420 PolarHBondContact O-N 2.8Å; H417-M421 PolarHBondContact O-N 2.92Å; H417-F472 AromaticContact CD2-CD1 3.87Å; H417-F472 AromaticContact CD2-CE1 3.58Å; H417-F472 AromaticContact NE2-CD1 3.62Å; H417-F472 AromaticContact NE2-CE1 3.79Å; H417-H763 AromaticContact CE1-CE1 3.93Å; H417-H763 AromaticContact CE1-NE2 3.85Å; H417-H763 AromaticContact ND1-CE1 3.34Å; H417-H763 PolarHBondContact ND1-CE1 3.3Å; H417-H763 VanDerWaalsContact ND1-CE1 3.34Å; H417-H763 AromaticContact ND1-NE2 3.11Å; H417-H763 PolarHBondContact ND1-NE2 2.85Å; H417-H763 VanDerWaalsContact ND1-NE2 3.11Å; H417-L806 HydrophobicContact CB-CD2 4.22Å; H417-L806 HydrophobicContact CB-CG 4.24Å
418	G	93.4	Very high	92.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-57.5	-40.9	176	0	0	0	0	0	112.6	D414 G416 M421 F422 S461	D414-G418 PolarHBondContact O-N 3.2Å; G416-G418 PolarHBondContact O-N 3.09Å; G418-M421 PolarHBondContact O-N 3.23Å; G418-F422 VanDerWaalsContact O-CB 3.32Å; G418-F422 WeakPolarHBondContact O-CB 3.33Å; G418-F422 PolarHBondContact O-N 3.14Å; G418-S461 VanDerWaalsContact CA-OG 3.3Å; G418-S461 WeakPolarHBondContact CA-OG 3.38Å
419	F	94.1	Very high	92.3	Very high	109 Å²	109	33.2 Å²	33.2	48%	0.478	17%	0.166	S	C	.	.	H	α-helix	trans	-66.6	-41.5	177.7	-174.7	-102.1	0	0	0	112.8	F415 G416 H417 F422 L423 V462	F415-F419 VanDerWaalsContact O-CB 3.28Å; F415-F419 WeakPolarHBondContact O-CB 3.47Å; F415-F419 PolarHBondContact O-N 3.41Å; G416-F419 PolarHBondContact O-N 3.3Å; H417-F419 VanDerWaalsContact C-N 3.28Å; H417-F419 PolarHBondContact O-N 3.5Å; F419-F422 PolarHBondContact O-N 2.89Å; F419-L423 WeakPolarHBondContact O-CB 3.42Å; F419-L423 PolarHBondContact O-N 3.49Å; F419-V462 HydrophobicContact CB-CG2 4.18Å
420	V	93.8	Very high	92	Very high	59 Å²	59	39.1 Å²	39.1	36%	0.358	20%	0.197	S	C	.	.	H	α-helix	trans	-62.8	-45.3	176	174.2	0	0	0	0	111.1	G416 H417 L423 F424 L806	G416-V420 WeakPolarHBondContact O-CG2 3.34Å; G416-V420 PolarHBondContact O-N 3.11Å; G416-V420 VanDerWaalsContact O-N 3.15Å; H417-V420 PolarHBondContact O-N 2.8Å; V420-L423 PolarHBondContact O-N 2.98Å; V420-F424 PolarHBondContact O-N 3.16Å; V420-L806 HydrophobicContact CB-CD1 4.13Å; V420-L806 HydrophobicContact CG1-CD1 3.81Å
421	M	93.3	Very high	91.6	Very high	21 Å²	21	43.3 Å²	43.3	10%	0.103	22%	0.219	C	C	.	.	H	α-helix	trans	-63.2	-41.6	175.9	173.5	173.1	58.9	0	0	112	F408 F412 H417 G418 F424 A425 M457 L806	F408-M421 HydrophobicContact CE1-CE 3.54Å; F408-M421 HydrophobicContact CE1-SD 4.14Å; F408-M421 HydrophobicContact CZ-CE 4.05Å; F408-M421 HydrophobicContact CZ-SD 4.19Å; F412-M421 HydrophobicContact CD1-CE 4.11Å; F412-M421 HydrophobicContact CE1-CE 4.27Å; H417-M421 PolarHBondContact O-N 2.92Å; G418-M421 PolarHBondContact O-N 3.23Å; M421-F424 PolarHBondContact O-N 3.11Å; M421-A425 WeakPolarHBondContact O-CB 3.49Å; M421-A425 PolarHBondContact O-N 3.35Å; M421-M457 HydrophobicContact CE-CB 4.26Å; M421-M457 HydrophobicContact SD-CB 4.42Å; M421-L806 HydrophobicContact CB-CD2 3.96Å
422	F	94.8	Very high	90.9	Very high	51 Å²	51	45.4 Å²	45.4	22%	0.224	23%	0.229	C	C	.	.	H	α-helix	trans	-61	-44.8	175.2	175.1	-100.7	0	0	0	111.8	G418 F419 A425 L426 L455 L459	G418-F422 VanDerWaalsContact O-CB 3.32Å; G418-F422 WeakPolarHBondContact O-CB 3.33Å; G418-F422 PolarHBondContact O-N 3.14Å; F419-F422 PolarHBondContact O-N 2.89Å; F422-A425 PolarHBondContact O-N 3.18Å; F422-L426 HydrophobicContact CE1-CD2 4.48Å; F422-L426 WeakPolarHBondContact O-CB 3.46Å; F422-L426 PolarHBondContact O-N 2.85Å; F422-L455 HydrophobicContact CD2-CG 4.42Å; F422-L455 HydrophobicContact CE2-CD2 4.36Å; F422-L455 HydrophobicContact CE2-CG 4.14Å; F422-L459 HydrophobicContact CD2-CB 4.29Å; F422-L459 HydrophobicContact CE2-CB 4.44Å; F422-L459 HydrophobicContact CE2-CD1 4.43Å
423	L	94.7	Very high	90	Very high	84 Å²	84	52.7 Å²	52.7	44%	0.44	27%	0.268	S	S	.	.	H	α-helix	trans	-63.1	-44.2	177.8	-176.5	67.1	0	0	0	111.6	F419 V420 L426 L427	F419-L423 WeakPolarHBondContact O-CB 3.42Å; F419-L423 PolarHBondContact O-N 3.49Å; V420-L423 PolarHBondContact O-N 2.98Å; L423-L426 PolarHBondContact O-N 3.5Å; L423-L427 WeakPolarHBondContact O-CG 3.43Å; L423-L427 PolarHBondContact O-N 2.98Å
424	F	91.6	Very high	89.1	Confident	94 Å²	94	56.8 Å²	56.8	41%	0.412	29%	0.286	S	S	.	.	H	α-helix	trans	-60.4	-45.6	175.7	175.8	-107	0	0	0	111.9	V420 M421 L426 L427 L428	V420-F424 PolarHBondContact O-N 3.16Å; M421-F424 PolarHBondContact O-N 3.11Å; F424-L426 VanDerWaalsContact C-N 3.35Å; F424-L426 PolarHBondContact O-N 3.15Å; F424-L427 PolarHBondContact O-N 3.03Å; F424-L428 HydrophobicContact CD1-CD1 4.24Å; F424-L428 HydrophobicContact CE1-CD1 3.64Å; F424-L428 HydrophobicContact CE1-CG 4.42Å; F424-L428 HydrophobicContact CZ-CD1 3.85Å; F424-L428 HydrophobicContact CZ-CG 4.3Å; F424-L428 PolarHBondContact O-N 3.48Å; F424-L428 VanDerWaalsContact O-N 3.14Å
425	A	92	Very high	87.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-39.8	176.7	0	0	0	0	0	112.2	M421 F422 L427 L428 V429 L454 L455	M421-A425 WeakPolarHBondContact O-CB 3.49Å; M421-A425 PolarHBondContact O-N 3.35Å; F422-A425 PolarHBondContact O-N 3.18Å; A425-L427 VanDerWaalsContact C-N 3.34Å; A425-L427 PolarHBondContact O-N 3.43Å; A425-L428 PolarHBondContact O-N 2.99Å; A425-V429 WeakPolarHBondContact O-CG2 3.07Å; A425-V429 PolarHBondContact O-N 3.09Å; A425-L454 HydrophobicContact CB-CB 3.8Å; A425-L455 HydrophobicContact CB-CB 3.97Å
426	L	93.1	Very high	86	Confident	61 Å²	61	66.1 Å²	66.1	32%	0.319	33%	0.329	S	S	.	.	H	α-helix	trans	-61.9	-41.9	175.6	-174.4	69.7	0	0	0	111.4	F422 L423 F424 L428 V429 L430	F422-L426 HydrophobicContact CE1-CD2 4.48Å; F422-L426 WeakPolarHBondContact O-CB 3.46Å; F422-L426 PolarHBondContact O-N 2.85Å; L423-L426 PolarHBondContact O-N 3.5Å; F424-L426 VanDerWaalsContact C-N 3.35Å; F424-L426 PolarHBondContact O-N 3.15Å; L426-L428 VanDerWaalsContact C-N 3.33Å; L426-L428 PolarHBondContact O-N 3.4Å; L426-V429 PolarHBondContact O-N 3.45Å; L426-L430 HydrophobicContact CG-CD1 4.12Å; L426-L430 HydrophobicContact CG-CG 4.42Å; L426-L430 WeakPolarHBondContact O-CG 3.49Å; L426-L430 PolarHBondContact O-N 3.4Å
427	L	90.6	Very high	84.4	Confident	90 Å²	90	67.5 Å²	67.5	47%	0.471	34%	0.336	S	S	.	.	H	α-helix	trans	-61.3	-39.9	175.5	-72.3	171.6	0	0	0	112.3	L423 F424 A425 V429 L430 N431	L423-L427 WeakPolarHBondContact O-CG 3.43Å; L423-L427 PolarHBondContact O-N 2.98Å; F424-L427 PolarHBondContact O-N 3.03Å; A425-L427 VanDerWaalsContact C-N 3.34Å; A425-L427 PolarHBondContact O-N 3.43Å; L427-V429 VanDerWaalsContact C-N 3.34Å; L427-L430 PolarHBondContact O-N 3.16Å; L427-N431 WeakPolarHBondContact O-CB 3.43Å; L427-N431 PolarHBondContact O-N 2.94Å; L427-N431 VanDerWaalsContact O-N 3.1Å
428	L	87.4	Confident	82.7	Confident	9 Å²	9	72 Å²	72	5%	0.047	36%	0.36	C	S	.	.	H	α-helix	trans	-65.5	-36.2	175	-69.8	176.6	0	0	0	112.5	F424 A425 L426 L437 R451	F424-L428 HydrophobicContact CD1-CD1 4.24Å; F424-L428 HydrophobicContact CE1-CD1 3.64Å; F424-L428 HydrophobicContact CE1-CG 4.42Å; F424-L428 HydrophobicContact CZ-CD1 3.85Å; F424-L428 HydrophobicContact CZ-CG 4.3Å; F424-L428 PolarHBondContact O-N 3.48Å; F424-L428 VanDerWaalsContact O-N 3.14Å; A425-L428 PolarHBondContact O-N 2.99Å; L426-L428 VanDerWaalsContact C-N 3.33Å; L426-L428 PolarHBondContact O-N 3.4Å; L428-L437 HydrophobicContact CD2-CD2 4.18Å; L428-R451 HydrophobicContact CB-CB 4.32Å
429	V	89.2	Confident	81	Confident	33 Å²	33	77.4 Å²	77.4	20%	0.2	39%	0.385	C	S	.	.	H	α-helix	trans	-72.6	-39.8	177.5	173.7	0	0	0	0	111.5	A425 L426 L427 N431 R451 Y452 L455	A425-V429 WeakPolarHBondContact O-CG2 3.07Å; A425-V429 PolarHBondContact O-N 3.09Å; L426-V429 PolarHBondContact O-N 3.45Å; L427-V429 VanDerWaalsContact C-N 3.34Å; V429-N431 VanDerWaalsContact C-N 3.33Å; V429-N431 PolarHBondContact O-N 3.18Å; V429-R451 HydrophobicContact CG2-CB 4.1Å; V429-R451 HydrophobicContact CG2-CG 4.04Å; V429-Y452 HydrophobicContact CG1-CE1 4.3Å; V429-Y452 HydrophobicContact CG2-CD1 4.41Å; V429-Y452 HydrophobicContact CG2-CE1 4.28Å; V429-L455 HydrophobicContact CG2-CD1 4Å
430	L	88.4	Confident	79.3	Confident	123 Å²	123	73.8 Å²	73.8	64%	0.644	37%	0.373	S	S	*	.	H	α-helix	trans	-67.3	-33.6	177.8	-70.1	174.1	0	0	0	112.5	L426 L427 E432	L426-L430 HydrophobicContact CG-CD1 4.12Å; L426-L430 HydrophobicContact CG-CG 4.42Å; L426-L430 WeakPolarHBondContact O-CG 3.49Å; L426-L430 PolarHBondContact O-N 3.4Å; L427-L430 PolarHBondContact O-N 3.16Å; L430-E432 PolarHBondContact O-N 3.24Å
431	N	84.2	Confident	78.3	Confident	90 Å²	90	78.4 Å²	78.4	48%	0.481	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	24.3	-178	-67.3	-19.9	0	0	0	114.1	L427 V429 N433 H434 L437	L427-N431 WeakPolarHBondContact O-CB 3.43Å; L427-N431 PolarHBondContact O-N 2.94Å; L427-N431 VanDerWaalsContact O-N 3.1Å; V429-N431 VanDerWaalsContact C-N 3.33Å; V429-N431 PolarHBondContact O-N 3.18Å; N431-N433 PolarHBondContact O-N 2.95Å; N431-N433 VanDerWaalsContact O-N 3.1Å; N431-H434 PolarHBondContact O-N 3.17Å; N431-L437 HydrophobicContact CB-CD1 3.85Å; N431-L437 WeakPolarHBondContact O-CD1 3.07Å
432	E	79.6	Confident	77.7	Confident	47 Å²	47	85.7 Å²	85.7	22%	0.22	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-32.9	-175	-178.8	170.9	155.2	0	0	114	K374 L430 H434 F448 R451 Y452	K374-E432 IonicContact NZ-OE1 3.56Å; K374-E432 PolarHBondContact NZ-OE1 3.45Å; L430-E432 PolarHBondContact O-N 3.24Å; E432-H434 PolarHBondContact O-N 3.03Å; E432-F448 HydrophobicContact CG-CZ 4.37Å; E432-R451 IonicContact OE1-NH2 3.07Å; E432-R451 PolarHBondContact OE1-NH2 3.09Å; E432-R451 VanDerWaalsContact OE1-NH2 3.12Å; E432-R451 IonicContact OE2-CZ 3.57Å; E432-R451 IonicContact OE2-NE 3.13Å; E432-R451 IonicContact OE2-NH2 2.73Å; E432-R451 PolarHBondContact OE2-NH2 3.12Å; E432-Y452 PolarHBondContact OE2-OH 3.02Å
433	N	72.4	Confident	77	Confident	154 Å²	154	88.6 Å²	88.6	82%	0.824	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-2.4	-173.6	-62.1	-20.4	0	0	0	114.2	N431 P435	N431-N433 PolarHBondContact O-N 2.95Å; N431-N433 VanDerWaalsContact O-N 3.1Å; N433-P435 WeakPolarHBondContact O-CD 3.5Å
434	H	70.9	Confident	76.4	Confident	92 Å²	92	87.5 Å²	87.5	43%	0.426	44%	0.435	S	S	.	.			trans	-83.9	118.6	-173.4	-162.5	-75.1	0	0	0	111.7	N431 E432 R436 L437	N431-H434 PolarHBondContact O-N 3.17Å; E432-H434 PolarHBondContact O-N 3.03Å; H434-R436 VanDerWaalsContact C-N 3.28Å; H434-R436 PolarHBondContact ND1-N 3.19Å; H434-R436 PolarHBondContact O-N 3.35Å; H434-R436 VanDerWaalsContact O-N 3.16Å; H434-L437 HydrophobicContact CB-CD1 4.29Å; H434-L437 PolarHBondContact O-N 3.49Å; H434-L437 VanDerWaalsContact O-N 3.13Å
435	P	58.4	Low	75.9	Confident	79 Å²	79	88.8 Å²	88.8	51%	0.513	44%	0.437	S	S	.	.	H	α-helix	trans	-62.7	-29.7	-170.4	21.7	-32.4	0	0	0	114	N433 L437 N438 Q439	N433-P435 WeakPolarHBondContact O-CD 3.5Å; P435-L437 PolarHBondContact O-N 2.9Å; P435-L437 VanDerWaalsContact O-N 3.17Å; P435-N438 PolarHBondContact O-N 3.06Å; P435-N438 VanDerWaalsContact O-N 3.11Å; P435-Q439 PolarHBondContact O-N 3.49Å
436	R	60.5	Low	75.5	Confident	188 Å²	188	95.2 Å²	95.2	71%	0.709	47%	0.468	S	S	*	.	H	α-helix	trans	-61	-23.4	177.3	-65.5	-174	-175.4	145.5	-3.1	114.6	H434 S440	H434-R436 VanDerWaalsContact C-N 3.28Å; H434-R436 PolarHBondContact ND1-N 3.19Å; H434-R436 PolarHBondContact O-N 3.35Å; H434-R436 VanDerWaalsContact O-N 3.16Å; R436-S440 PolarHBondContact O-N 3.08Å
437	L	57.9	Low	75	Confident	33 Å²	33	96 Å²	96	17%	0.173	47%	0.469	C	S	.	.	H	α-helix	trans	-75.5	-31.3	177.7	-77	159.3	0	0	0	111.6	L428 N431 H434 P435 S440 F448	L428-L437 HydrophobicContact CD2-CD2 4.18Å; N431-L437 HydrophobicContact CB-CD1 3.85Å; N431-L437 WeakPolarHBondContact O-CD1 3.07Å; H434-L437 HydrophobicContact CB-CD1 4.29Å; H434-L437 PolarHBondContact O-N 3.49Å; H434-L437 VanDerWaalsContact O-N 3.13Å; P435-L437 PolarHBondContact O-N 2.9Å; P435-L437 VanDerWaalsContact O-N 3.17Å; L437-S440 WeakPolarHBondContact O-CB 3.22Å; L437-S440 PolarHBondContact O-OG 3.05Å; L437-F448 HydrophobicContact CB-CD2 4.38Å; L437-F448 HydrophobicContact CB-CE2 4.38Å
438	N	56.3	Low	74.7	Confident	95 Å²	95	92.4 Å²	92.4	51%	0.508	45%	0.45	S	S	.	.	H	α-helix	trans	-76.8	-26.3	175.8	-103.5	-8	0	0	0	113.5	P435 S440	P435-N438 PolarHBondContact O-N 3.06Å; P435-N438 VanDerWaalsContact O-N 3.11Å; N438-S440 VanDerWaalsContact C-N 3.32Å
439	Q	57.5	Low	74.6	Confident	113 Å²	113	96.4 Å²	96.4	53%	0.528	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	1.2	176.7	-70	173.2	-12.4	0	0	113.3	E81 P435	E81-Q439 PolarHBondContact OE1-NE2 3Å; E81-Q439 PolarHBondContact OE2-NE2 3.12Å; P435-Q439 PolarHBondContact O-N 3.49Å
440	S	59.6	Low	74.4	Confident	33 Å²	33	95.5 Å²	95.5	23%	0.231	47%	0.469	C	S	.	.	S	Bend	trans	-74.4	165.8	-175.8	68.1	0	0	0	0	113.3	R436 L437 N438 M444	R436-S440 PolarHBondContact O-N 3.08Å; L437-S440 WeakPolarHBondContact O-CB 3.22Å; L437-S440 PolarHBondContact O-OG 3.05Å; N438-S440 VanDerWaalsContact C-N 3.32Å; S440-M444 WeakPolarHBondContact OG-CB 3.32Å
441	Q	72.9	Confident	74.5	Confident	156 Å²	156	90.6 Å²	90.6	73%	0.729	44%	0.442	S	S	*	.			trans	-51.5	154.5	176.7	-67.1	176.8	-28.2	0	0	112.3	I443 M444 R445	Q441-I443 PolarHBondContact O-N 3Å; Q441-I443 VanDerWaalsContact O-N 3.09Å; Q441-M444 PolarHBondContact O-N 2.88Å; Q441-R445 PolarHBondContact O-N 2.96Å
442	E	79.1	Confident	74.8	Confident	175 Å²	175	88.6 Å²	88.6	82%	0.818	43%	0.428	S	S	*	.	H	α-helix	trans	-51	-39.8	-175.8	-64.5	-172.8	155.4	0	0	113.9	R445 M446	E442-R445 WeakPolarHBondContact O-CB 3.36Å; E442-R445 PolarHBondContact O-N 3.33Å; E442-M446 PolarHBondContact O-N 3.47Å
443	I	81.5	Confident	75.4	Confident	111 Å²	111	86.8 Å²	86.8	57%	0.569	42%	0.419	S	S	*	.	H	α-helix	trans	-62.6	-45.4	178.3	-62.6	168.8	0	0	0	111.1	Q441 R445 M446 F447	Q441-I443 PolarHBondContact O-N 3Å; Q441-I443 VanDerWaalsContact O-N 3.09Å; I443-R445 VanDerWaalsContact C-N 3.31Å; I443-R445 PolarHBondContact O-N 3.41Å; I443-M446 WeakPolarHBondContact O-CB 3.45Å; I443-M446 PolarHBondContact O-N 3.2Å; I443-F447 HydrophobicContact CG2-CD2 3.87Å; I443-F447 HydrophobicContact CG2-CE2 3.49Å; I443-F447 VanDerWaalsContact CG2-CE2 3.49Å; I443-F447 WeakPolarHBondContact O-CD2 3.43Å; I443-F447 PolarHBondContact O-N 2.99Å
444	M	80.7	Confident	76.4	Confident	62 Å²	62	80.6 Å²	80.6	31%	0.305	39%	0.386	S	S	.	.	H	α-helix	trans	-67.1	-35.2	177.8	-74.1	-58.2	-60.9	0	0	111.5	S440 Q441 M446 F447 F448	S440-M444 WeakPolarHBondContact OG-CB 3.32Å; Q441-M444 PolarHBondContact O-N 2.88Å; M444-M446 VanDerWaalsContact C-N 3.34Å; M444-F447 PolarHBondContact O-N 3.44Å; M444-F447 HydrophobicContact SD-CD2 4.48Å; M444-F448 WeakPolarHBondContact O-CB 3.23Å; M444-F448 PolarHBondContact O-N 3.49Å
445	R	81.4	Confident	77.5	Confident	120 Å²	120	78 Å²	78	45%	0.453	38%	0.375	S	S	.	.	H	α-helix	trans	-63.2	-39.9	172.3	-169.1	178	-177.8	-167.1	-0.6	111.9	Q441 E442 I443 F448 N449	Q441-R445 PolarHBondContact O-N 2.96Å; E442-R445 WeakPolarHBondContact O-CB 3.36Å; E442-R445 PolarHBondContact O-N 3.33Å; I443-R445 VanDerWaalsContact C-N 3.31Å; I443-R445 PolarHBondContact O-N 3.41Å; R445-F448 PolarHBondContact O-N 2.88Å; R445-N449 WeakPolarHBondContact O-CB 3.33Å; R445-N449 VanDerWaalsContact O-CG 3.27Å; R445-N449 PolarHBondContact O-N 3.14Å
446	M	84	Confident	79.2	Confident	136 Å²	136	75.5 Å²	75.5	67%	0.67	36%	0.357	S	S	*	.	H	α-helix	trans	-62	-46.3	174.9	-172	-179.7	-179.3	0	0	111.5	E442 I443 M444 F448 N449 G450	E442-M446 PolarHBondContact O-N 3.47Å; I443-M446 WeakPolarHBondContact O-CB 3.45Å; I443-M446 PolarHBondContact O-N 3.2Å; M444-M446 VanDerWaalsContact C-N 3.34Å; M446-F448 VanDerWaalsContact C-N 3.33Å; M446-F448 PolarHBondContact O-N 3.19Å; M446-N449 PolarHBondContact O-N 3.26Å; M446-G450 PolarHBondContact O-N 2.96Å
447	F	83.4	Confident	80.8	Confident	76 Å²	76	66.7 Å²	66.7	33%	0.333	33%	0.325	S	S	.	.	H	α-helix	trans	-64.2	-36.8	175.4	-72.2	-58.2	0	0	0	112.8	I443 M444 G450 R451 L454	I443-F447 HydrophobicContact CG2-CD2 3.87Å; I443-F447 HydrophobicContact CG2-CE2 3.49Å; I443-F447 VanDerWaalsContact CG2-CE2 3.49Å; I443-F447 WeakPolarHBondContact O-CD2 3.43Å; I443-F447 PolarHBondContact O-N 2.99Å; M444-F447 PolarHBondContact O-N 3.44Å; M444-F447 HydrophobicContact SD-CD2 4.48Å; F447-G450 CarbonylContact O-C 3.59Å; F447-G450 PolarHBondContact O-N 3.29Å; F447-R451 PolarHBondContact O-N 3.03Å; F447-R451 VanDerWaalsContact O-N 3.12Å; F447-L454 HydrophobicContact CB-CD1 4.42Å; F447-L454 HydrophobicContact CD1-CD1 3.89Å
448	F	84.2	Confident	82.6	Confident	15 Å²	15	65.1 Å²	65.1	7%	0.066	32%	0.316	C	S	.	.	H	α-helix	trans	-67.4	-42.6	178	-175.3	-102.1	0	0	0	112.7	E432 L437 M444 R445 M446 G450 R451	E432-F448 HydrophobicContact CG-CZ 4.37Å; L437-F448 HydrophobicContact CB-CD2 4.38Å; L437-F448 HydrophobicContact CB-CE2 4.38Å; M444-F448 WeakPolarHBondContact O-CB 3.23Å; M444-F448 PolarHBondContact O-N 3.49Å; R445-F448 PolarHBondContact O-N 2.88Å; M446-F448 VanDerWaalsContact C-N 3.33Å; M446-F448 PolarHBondContact O-N 3.19Å; F448-G450 PolarHBondContact O-N 3.05Å; F448-R451 WeakPolarHBondContact O-CB 3.31Å; F448-R451 WeakPolarHBondContact O-CG 3.47Å; F448-R451 PolarHBondContact O-N 3.45Å; F448-R451 PolarHBondContact O-NH1 3.2Å
449	N	83.6	Confident	84.4	Confident	93 Å²	93	64.8 Å²	64.8	50%	0.497	31%	0.314	S	S	.	.	H	α-helix	trans	-63.5	-32	173.3	-70.4	-9.4	0	0	0	111.3	R445 M446	R445-N449 WeakPolarHBondContact O-CB 3.33Å; R445-N449 VanDerWaalsContact O-CG 3.27Å; R445-N449 PolarHBondContact O-N 3.14Å; M446-N449 PolarHBondContact O-N 3.26Å
450	G	85.8	Confident	86.2	Confident	14 Å²	14	61.7 Å²	61.7	14%	0.144	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	11	178.4	0	0	0	0	0	116.2	M446 F447 F448 Y452 I453 L454	M446-G450 PolarHBondContact O-N 2.96Å; F447-G450 CarbonylContact O-C 3.59Å; F447-G450 PolarHBondContact O-N 3.29Å; F448-G450 PolarHBondContact O-N 3.05Å; G450-Y452 VanDerWaalsContact C-N 3.34Å; G450-Y452 PolarHBondContact O-N 3.25Å; G450-I453 WeakPolarHBondContact O-CA 3.41Å; G450-I453 WeakPolarHBondContact O-CB 3.49Å; G450-I453 PolarHBondContact O-N 3.07Å; G450-L454 PolarHBondContact O-N 3.49Å; G450-L454 VanDerWaalsContact O-N 3.09Å
451	R	90.1	Very high	87.9	Confident	21 Å²	21	60.1 Å²	60.1	8%	0.079	29%	0.288	C	S	.	.	H	α-helix	trans	-55.8	-40.7	-168.8	64.8	-175.5	178.9	-95.7	5.2	114.9	L428 V429 E432 F447 F448 I453 L455	L428-R451 HydrophobicContact CB-CB 4.32Å; V429-R451 HydrophobicContact CG2-CB 4.1Å; V429-R451 HydrophobicContact CG2-CG 4.04Å; E432-R451 IonicContact OE1-NH2 3.07Å; E432-R451 PolarHBondContact OE1-NH2 3.09Å; E432-R451 VanDerWaalsContact OE1-NH2 3.12Å; E432-R451 IonicContact OE2-CZ 3.57Å; E432-R451 IonicContact OE2-NE 3.13Å; E432-R451 IonicContact OE2-NH2 2.73Å; E432-R451 PolarHBondContact OE2-NH2 3.12Å; F447-R451 PolarHBondContact O-N 3.03Å; F447-R451 VanDerWaalsContact O-N 3.12Å; F448-R451 WeakPolarHBondContact O-CB 3.31Å; F448-R451 WeakPolarHBondContact O-CG 3.47Å; F448-R451 PolarHBondContact O-N 3.45Å; F448-R451 PolarHBondContact O-NH1 3.2Å; R451-I453 VanDerWaalsContact C-N 3.34Å; R451-L455 WeakPolarHBondContact O-CB 3.3Å; R451-L455 PolarHBondContact O-N 2.96Å
452	Y	91.2	Very high	88.9	Confident	47 Å²	47	53.9 Å²	53.9	18%	0.184	26%	0.26	C	S	.	.	H	α-helix	trans	-72.4	-29.1	178.6	-62.6	-67.9	0	0	0	112.8	K374 F375 V429 E432 G450 L456	K374-Y452 HydrophobicContact CB-CE2 4.37Å; K374-Y452 WeakPolarHBondContact O-CD2 3.45Å; K374-Y452 WeakPolarHBondContact O-CE2 3.38Å; F375-Y452 AromaticContact CD2-CD1 3.77Å; F375-Y452 HydrophobicContact CD2-CD1 3.77Å; F375-Y452 HydrophobicContact CD2-CD2 4.34Å; F375-Y452 AromaticContact CD2-CG 3.68Å; F375-Y452 HydrophobicContact CD2-CG 3.68Å; F375-Y452 HydrophobicContact CE2-CD1 4.37Å; F375-Y452 HydrophobicContact CE2-CG 4.34Å; V429-Y452 HydrophobicContact CG1-CE1 4.3Å; V429-Y452 HydrophobicContact CG2-CD1 4.41Å; V429-Y452 HydrophobicContact CG2-CE1 4.28Å; E432-Y452 PolarHBondContact OE2-OH 3.02Å; G450-Y452 VanDerWaalsContact C-N 3.34Å; G450-Y452 PolarHBondContact O-N 3.25Å; Y452-L456 PolarHBondContact O-N 3.32Å; Y452-L456 VanDerWaalsContact O-N 3.12Å
453	I	92.4	Very high	89.6	Confident	9 Å²	9	51.7 Å²	51.7	5%	0.046	25%	0.245	C	C	.	.	H	α-helix	trans	-67.3	-49	175.3	-61.9	159.3	0	0	0	109.2	F379 I382 F404 G450 R451 L455 L456 M457 F814	F379-I453 HydrophobicContact CD1-CG1 3.99Å; F379-I453 HydrophobicContact CD2-CG1 4Å; F379-I453 HydrophobicContact CE1-CB 4.37Å; F379-I453 HydrophobicContact CE1-CG1 3.68Å; F379-I453 HydrophobicContact CE1-CG2 4.27Å; F379-I453 HydrophobicContact CE2-CG1 3.68Å; F379-I453 HydrophobicContact CG-CG1 4.15Å; F379-I453 HydrophobicContact CZ-CB 4.11Å; F379-I453 HydrophobicContact CZ-CG1 3.51Å; F379-I453 HydrophobicContact CZ-CG2 4.41Å; I382-I453 HydrophobicContact CD1-CD1 3.54Å; F404-I453 HydrophobicContact CD1-CG2 4.15Å; F404-I453 HydrophobicContact CE1-CG2 3.74Å; G450-I453 WeakPolarHBondContact O-CA 3.41Å; G450-I453 WeakPolarHBondContact O-CB 3.49Å; G450-I453 PolarHBondContact O-N 3.07Å; R451-I453 VanDerWaalsContact C-N 3.34Å; I453-L455 VanDerWaalsContact C-N 3.3Å; I453-L455 PolarHBondContact O-N 2.88Å; I453-L456 PolarHBondContact O-N 3.46Å; I453-M457 HydrophobicContact CG2-CG 4.38Å; I453-M457 HydrophobicContact CG2-SD 3.63Å; I453-M457 WeakPolarHBondContact O-CB 3.43Å; I453-M457 VanDerWaalsContact O-CG 3.25Å; I453-M457 WeakPolarHBondContact O-CG 3.44Å; I453-M457 PolarHBondContact O-N 3.47Å; I453-F814 HydrophobicContact CG2-CE2 4.27Å
454	L	92.3	Very high	90.2	Very high	25 Å²	25	46.8 Å²	46.8	13%	0.131	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-39.7	176.4	-65.1	172.3	0	0	0	112.2	A425 F447 G450 M457 G458	A425-L454 HydrophobicContact CB-CB 3.8Å; F447-L454 HydrophobicContact CB-CD1 4.42Å; F447-L454 HydrophobicContact CD1-CD1 3.89Å; G450-L454 PolarHBondContact O-N 3.49Å; G450-L454 VanDerWaalsContact O-N 3.09Å; L454-M457 HydrophobicContact CD2-SD 4.5Å; L454-M457 PolarHBondContact O-N 3.26Å; L454-G458 PolarHBondContact O-N 3.03Å
455	L	94.1	Very high	90.7	Very high	36 Å²	36	43.8 Å²	43.8	19%	0.188	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-46.8	178.5	-174.6	148.8	0	0	0	111.3	F422 A425 V429 R451 I453 G458 L459	F422-L455 HydrophobicContact CD2-CG 4.42Å; F422-L455 HydrophobicContact CE2-CD2 4.36Å; F422-L455 HydrophobicContact CE2-CG 4.14Å; A425-L455 HydrophobicContact CB-CB 3.97Å; V429-L455 HydrophobicContact CG2-CD1 4Å; R451-L455 WeakPolarHBondContact O-CB 3.3Å; R451-L455 PolarHBondContact O-N 2.96Å; I453-L455 VanDerWaalsContact C-N 3.3Å; I453-L455 PolarHBondContact O-N 2.88Å; L455-G458 PolarHBondContact O-N 3.35Å; L455-L459 WeakPolarHBondContact O-CB 3.24Å; L455-L459 PolarHBondContact O-N 3.14Å
456	L	94.4	Very high	91.2	Very high	27 Å²	27	41.5 Å²	41.5	14%	0.141	20%	0.202	C	C	.	.	H	α-helix	trans	-67.2	-41.2	176.4	-74.9	178.5	0	0	0	112	F375 F379 I401 P405 Y452 I453 G458 L459 F460	F375-L456 HydrophobicContact CE2-CD1 4.16Å; F375-L456 HydrophobicContact CZ-CD1 3.75Å; F379-L456 HydrophobicContact CE2-CD1 4.22Å; F379-L456 HydrophobicContact CZ-CD1 3.84Å; I401-L456 HydrophobicContact CG2-CD1 4.28Å; P405-L456 HydrophobicContact CB-CB 3.9Å; P405-L456 HydrophobicContact CG-CB 3.72Å; P405-L456 HydrophobicContact CG-CD1 4.32Å; Y452-L456 PolarHBondContact O-N 3.32Å; Y452-L456 VanDerWaalsContact O-N 3.12Å; I453-L456 PolarHBondContact O-N 3.46Å; L456-G458 VanDerWaalsContact C-N 3.31Å; L456-G458 PolarHBondContact O-N 3.28Å; L456-L459 PolarHBondContact O-N 3.21Å; L456-F460 HydrophobicContact CB-CD2 4.42Å; L456-F460 HydrophobicContact CD2-CE2 4.35Å; L456-F460 WeakPolarHBondContact O-CD2 3.38Å; L456-F460 PolarHBondContact O-N 3Å
457	M	94.3	Very high	91.5	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.02	18%	0.182	C	C	.	.	H	α-helix	trans	-58.3	-44.3	175.7	-75.5	166	64.2	0	0	111.5	F404 P405 F408 M421 I453 L454 S461 F814	F404-M457 HydrophobicContact CE1-SD 4.06Å; P405-M457 HydrophobicContact CB-CG 4.08Å; P405-M457 HydrophobicContact CG-CG 4.43Å; F408-M457 HydrophobicContact CB-CE 4.48Å; F408-M457 HydrophobicContact CB-CG 4.4Å; F408-M457 HydrophobicContact CD1-CB 3.64Å; F408-M457 HydrophobicContact CD1-CE 3.52Å; F408-M457 HydrophobicContact CD1-CG 3.68Å; F408-M457 HydrophobicContact CD1-SD 4.42Å; F408-M457 HydrophobicContact CD2-CE 3.45Å; F408-M457 VanDerWaalsContact CD2-CE 3.45Å; F408-M457 HydrophobicContact CE1-CB 3.79Å; F408-M457 HydrophobicContact CE1-CE 3.45Å; F408-M457 VanDerWaalsContact CE1-CE 3.45Å; F408-M457 HydrophobicContact CE1-CG 4.22Å; F408-M457 HydrophobicContact CE2-CE 3.34Å; F408-M457 HydrophobicContact CG-CB 4.5Å; F408-M457 HydrophobicContact CG-CE 3.52Å; F408-M457 HydrophobicContact CG-CG 4.07Å; F408-M457 HydrophobicContact CG-SD 4.47Å; F408-M457 HydrophobicContact CZ-CE 3.34Å; M421-M457 HydrophobicContact CE-CB 4.26Å; M421-M457 HydrophobicContact SD-CB 4.42Å; I453-M457 HydrophobicContact CG2-CG 4.38Å; I453-M457 HydrophobicContact CG2-SD 3.63Å; I453-M457 WeakPolarHBondContact O-CB 3.43Å; I453-M457 VanDerWaalsContact O-CG 3.25Å; I453-M457 WeakPolarHBondContact O-CG 3.44Å; I453-M457 PolarHBondContact O-N 3.47Å; L454-M457 HydrophobicContact CD2-SD 4.5Å; L454-M457 PolarHBondContact O-N 3.26Å; M457-S461 WeakPolarHBondContact O-CB 3.4Å; M457-S461 PolarHBondContact O-N 3.07Å; M457-F814 HydrophobicContact CE-CB 4.31Å; M457-F814 HydrophobicContact CE-CD2 3.66Å; M457-F814 HydrophobicContact CE-CG 4.47Å; M457-F814 HydrophobicContact SD-CD2 3.82Å; M457-F814 HydrophobicContact SD-CE2 4.16Å
458	G	94.6	Very high	91.9	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.1	-48.1	175.2	0	0	0	0	0	112.2	L454 L455 L456 F460 S461 V462	L454-G458 PolarHBondContact O-N 3.03Å; L455-G458 PolarHBondContact O-N 3.35Å; L456-G458 VanDerWaalsContact C-N 3.31Å; L456-G458 PolarHBondContact O-N 3.28Å; G458-F460 PolarHBondContact O-N 3.09Å; G458-S461 PolarHBondContact O-N 3.04Å; G458-V462 WeakPolarHBondContact O-CG2 3.07Å; G458-V462 PolarHBondContact O-N 2.95Å
459	L	95.2	Very high	92.2	Very high	87 Å²	87	34 Å²	34	46%	0.455	17%	0.168	S	C	.	.	H	α-helix	trans	-61.4	-45.9	179.2	-175.4	69	0	0	0	112.4	F422 L455 L456 V462 Y463	F422-L459 HydrophobicContact CD2-CB 4.29Å; F422-L459 HydrophobicContact CE2-CB 4.44Å; F422-L459 HydrophobicContact CE2-CD1 4.43Å; L455-L459 WeakPolarHBondContact O-CB 3.24Å; L455-L459 PolarHBondContact O-N 3.14Å; L456-L459 PolarHBondContact O-N 3.21Å; L459-V462 PolarHBondContact O-N 3.09Å; L459-Y463 PolarHBondContact O-N 2.99Å; L459-Y463 VanDerWaalsContact O-N 3.11Å
460	F	95.4	Very high	92.4	Very high	48 Å²	48	30.5 Å²	30.5	21%	0.211	15%	0.149	C	C	.	.	H	α-helix	trans	-70	-34.4	177.5	-77.3	-66.9	0	0	0	112.2	I402 P405 F406 A409 L456 G458 Y463 T464	I402-F460 HydrophobicContact CG2-CZ 4.16Å; P405-F460 HydrophobicContact CB-CD2 3.5Å; P405-F460 HydrophobicContact CB-CE2 4.04Å; P405-F460 HydrophobicContact CB-CG 4.44Å; F406-F460 HydrophobicContact CD2-CD1 4.33Å; A409-F460 HydrophobicContact CB-CB 3.56Å; A409-F460 WeakPolarHBondContact CB-O 3.44Å; L456-F460 HydrophobicContact CB-CD2 4.42Å; L456-F460 HydrophobicContact CD2-CE2 4.35Å; L456-F460 WeakPolarHBondContact O-CD2 3.38Å; L456-F460 PolarHBondContact O-N 3Å; G458-F460 PolarHBondContact O-N 3.09Å; F460-Y463 WeakPolarHBondContact O-CB 3.47Å; F460-Y463 PolarHBondContact O-N 3.47Å; F460-T464 PolarHBondContact O-N 3.03Å; F460-T464 PolarHBondContact O-OG1 2.99Å
461	S	94.8	Very high	92.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.5	-38.8	174.8	175.8	0	0	0	0	111.9	F412 G418 M457 G458 T464 G465	F412-S461 WeakPolarHBondContact O-CB 3.45Å; F412-S461 PolarHBondContact O-OG 2.91Å; G418-S461 VanDerWaalsContact CA-OG 3.3Å; G418-S461 WeakPolarHBondContact CA-OG 3.38Å; M457-S461 WeakPolarHBondContact O-CB 3.4Å; M457-S461 PolarHBondContact O-N 3.07Å; G458-S461 PolarHBondContact O-N 3.04Å; S461-T464 WeakPolarHBondContact CA-OG1 3.47Å; S461-T464 PolarHBondContact O-N 3.48Å; S461-T464 PolarHBondContact O-OG1 3.22Å; S461-G465 WeakPolarHBondContact O-CA 3.4Å; S461-G465 PolarHBondContact O-N 3.26Å
462	V	94.8	Very high	92.5	Very high	25 Å²	25	33.3 Å²	33.3	15%	0.152	16%	0.162	C	C	.	.	H	α-helix	trans	-60.5	-46	170.3	168.4	0	0	0	0	110.6	F415 F419 G458 L459 G465 L466	F415-V462 HydrophobicContact CD2-CG1 3.74Å; F415-V462 HydrophobicContact CE2-CG1 3.67Å; F419-V462 HydrophobicContact CB-CG2 4.18Å; G458-V462 WeakPolarHBondContact O-CG2 3.07Å; G458-V462 PolarHBondContact O-N 2.95Å; L459-V462 PolarHBondContact O-N 3.09Å; V462-G465 PolarHBondContact O-N 3Å; V462-L466 WeakPolarHBondContact O-CG 3.35Å; V462-L466 PolarHBondContact O-N 3.11Å
463	Y	94.1	Very high	92.2	Very high	129 Å²	129	31.2 Å²	31.2	51%	0.506	15%	0.154	S	C	.	.	H	α-helix	trans	-61.2	-50.1	177.4	169.9	-100.5	0	0	0	112.4	L459 F460 G465 L466 I467	L459-Y463 PolarHBondContact O-N 2.99Å; L459-Y463 VanDerWaalsContact O-N 3.11Å; F460-Y463 WeakPolarHBondContact O-CB 3.47Å; F460-Y463 PolarHBondContact O-N 3.47Å; Y463-G465 VanDerWaalsContact C-N 3.34Å; Y463-G465 PolarHBondContact O-N 3.41Å; Y463-L466 PolarHBondContact O-N 3.48Å; Y463-I467 HydrophobicContact CE1-CG1 4.3Å; Y463-I467 HydrophobicContact CE2-CD1 4.45Å; Y463-I467 HydrophobicContact CE2-CG1 4.34Å; Y463-I467 WeakPolarHBondContact O-CG1 3.37Å; Y463-I467 PolarHBondContact O-N 3.05Å; Y463-I467 VanDerWaalsContact O-N 3.14Å
464	T	92.4	Very high	92	Very high	8 Å²	8	34.3 Å²	34.3	5%	0.049	17%	0.167	C	C	.	.	H	α-helix	trans	-68.7	-33.3	179.1	55.7	0	0	0	0	112.2	A409 V410 F460 S461 L466 I467 Y468	A409-T464 HydrophobicContact CB-CG2 3.71Å; A409-T464 WeakPolarHBondContact O-CB 3.32Å; A409-T464 PolarHBondContact O-OG1 3.49Å; V410-T464 HydrophobicContact CG2-CG2 4.39Å; F460-T464 PolarHBondContact O-N 3.03Å; F460-T464 PolarHBondContact O-OG1 2.99Å; S461-T464 WeakPolarHBondContact CA-OG1 3.47Å; S461-T464 PolarHBondContact O-N 3.48Å; S461-T464 PolarHBondContact O-OG1 3.22Å; T464-L466 VanDerWaalsContact C-N 3.34Å; T464-L466 PolarHBondContact O-N 2.85Å; T464-I467 PolarHBondContact O-N 3.21Å; T464-I467 VanDerWaalsContact O-N 3.16Å; T464-Y468 PolarHBondContact O-N 3.33Å
465	G	92.1	Very high	91.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.7	-40.4	172.6	0	0	0	0	0	112.6	S461 V462 Y463 Y468 N469 D470	S461-G465 WeakPolarHBondContact O-CA 3.4Å; S461-G465 PolarHBondContact O-N 3.26Å; V462-G465 PolarHBondContact O-N 3Å; Y463-G465 VanDerWaalsContact C-N 3.34Å; Y463-G465 PolarHBondContact O-N 3.41Å; G465-Y468 PolarHBondContact O-N 2.92Å; G465-N469 WeakPolarHBondContact O-CA 3.27Å; G465-N469 PolarHBondContact O-N 3.44Å; G465-D470 PolarHBondContact O-N 3.36Å
466	L	91.1	Very high	91.3	Very high	71 Å²	71	36.2 Å²	36.2	37%	0.372	18%	0.183	S	C	.	.	H	α-helix	trans	-65.7	-38	172	-70.2	172.2	0	0	0	112.4	F415 V462 Y463 T464 N469	F415-L466 HydrophobicContact CD2-CD1 4.36Å; F415-L466 HydrophobicContact CD2-CD2 3.63Å; F415-L466 HydrophobicContact CD2-CG 3.71Å; F415-L466 HydrophobicContact CE2-CD1 4.32Å; F415-L466 HydrophobicContact CE2-CD2 3.84Å; F415-L466 HydrophobicContact CE2-CG 4.09Å; F415-L466 HydrophobicContact CG-CD2 4.3Å; V462-L466 WeakPolarHBondContact O-CG 3.35Å; V462-L466 PolarHBondContact O-N 3.11Å; Y463-L466 PolarHBondContact O-N 3.48Å; T464-L466 VanDerWaalsContact C-N 3.34Å; T464-L466 PolarHBondContact O-N 2.85Å; L466-N469 PolarHBondContact O-N 3.16Å
467	I	91.9	Very high	90.9	Very high	47 Å²	47	40 Å²	40	24%	0.241	20%	0.203	C	C	.	.	H	α-helix	trans	-67.9	-40.4	176.4	-64.2	-65	0	0	0	111.6	Y463 T464 N469 L531 G532 I533	Y463-I467 HydrophobicContact CE1-CG1 4.3Å; Y463-I467 HydrophobicContact CE2-CD1 4.45Å; Y463-I467 HydrophobicContact CE2-CG1 4.34Å; Y463-I467 WeakPolarHBondContact O-CG1 3.37Å; Y463-I467 PolarHBondContact O-N 3.05Å; Y463-I467 VanDerWaalsContact O-N 3.14Å; T464-I467 PolarHBondContact O-N 3.21Å; T464-I467 VanDerWaalsContact O-N 3.16Å; I467-N469 PolarHBondContact O-N 2.95Å; I467-L531 HydrophobicContact CD1-CD1 3.88Å; I467-G532 CarbonylContact O-C 3.43Å; I467-G532 WeakPolarHBondContact O-CA 3.47Å; I467-I533 PolarHBondContact O-N 2.92Å
468	Y	90.9	Very high	90.3	Very high	9 Å²	9	44.8 Å²	44.8	4%	0.035	23%	0.228	C	C	.	.	H	α-helix	trans	-73.1	-18	173.1	-67.1	-21.2	0	0	0	112.9	V410 T464 G465 D470 I533 F550 M554 S760	V410-Y468 PolarHBondContact O-OH 2.97Å; T464-Y468 PolarHBondContact O-N 3.33Å; G465-Y468 PolarHBondContact O-N 2.92Å; Y468-D470 VanDerWaalsContact C-N 3.28Å; Y468-I533 HydrophobicContact CD1-CD1 4.31Å; Y468-F550 HydrophobicContact CE1-CE1 4.31Å; Y468-M554 HydrophobicContact CE1-CE 4.42Å; Y468-S760 WeakPolarHBondContact CE2-OG 3.45Å
469	N	90.2	Very high	89.7	Confident	13 Å²	13	50.9 Å²	50.9	7%	0.07	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	43.2	-175	-164.5	10.8	0	0	0	111.9	G465 L466 I467 S475 V476 I533 P535	G465-N469 WeakPolarHBondContact O-CA 3.27Å; G465-N469 PolarHBondContact O-N 3.44Å; L466-N469 PolarHBondContact O-N 3.16Å; I467-N469 PolarHBondContact O-N 2.95Å; N469-S475 VanDerWaalsContact O-CA 3.24Å; N469-S475 WeakPolarHBondContact O-CA 3.21Å; N469-S475 WeakPolarHBondContact O-CB 3.32Å; N469-V476 PolarHBondContact ND2-O 3.25Å; N469-V476 PolarHBondContact OD1-N 3.24Å; N469-V476 PolarHBondContact OD1-O 3.12Å; N469-I533 WeakPolarHBondContact CB-O 3.4Å; N469-I533 PolarHBondContact ND2-O 3.12Å; N469-P535 WeakPolarHBondContact ND2-CG 3.37Å
470	D	88.5	Confident	89.1	Confident	20 Å²	20	48.4 Å²	48.4	11%	0.107	25%	0.251	C	S	.	.			trans	-119.7	121.8	177.2	-79.4	-29.6	0	0	0	109.5	F415 G465 Y468	F415-D470 WeakPolarHBondContact CB-O 3.44Å; F415-D470 PolarHBondContact N-O 2.57Å; G465-D470 PolarHBondContact O-N 3.36Å; Y468-D470 VanDerWaalsContact C-N 3.28Å
471	C	90.1	Very high	88.5	Confident	32 Å²	32	48.1 Å²	48.1	22%	0.216	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-130.4	105.7	174.9	177.2	0	0	0	0	108.4	D414 F415 S473 K474 V476	D414-C471 WeakPolarHBondContact OD1-CA 3.22Å; F415-C471 HydrophobicContact CB-CB 4.28Å; F415-C471 HydrophobicContact CD1-CB 4.23Å; C471-S473 VanDerWaalsContact C-N 3.25Å; C471-S473 PolarHBondContact O-N 3.4Å; C471-K474 PolarHBondContact N-O 3.07Å; C471-K474 WeakPolarHBondContact O-CA 3.39Å; C471-K474 PolarHBondContact O-N 3.22Å; C471-V476 HydrophobicContact CB-CG2 4.36Å
472	F	87.3	Confident	88	Confident	63 Å²	63	48.7 Å²	48.7	28%	0.276	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	46.9	-174.4	-61.7	-69.2	0	0	0	112.6	D414 H417 K474 W771	D414-F472 PolarHBondContact OD1-N 3.09Å; D414-F472 PolarHBondContact OD2-N 3.23Å; H417-F472 AromaticContact CD2-CD1 3.87Å; H417-F472 AromaticContact CD2-CE1 3.58Å; H417-F472 AromaticContact NE2-CD1 3.62Å; H417-F472 AromaticContact NE2-CE1 3.79Å; F472-K474 VanDerWaalsContact C-N 3.26Å; F472-K474 PolarHBondContact O-N 3.34Å; F472-W771 HydrophobicContact CB-CE3 4.4Å; F472-W771 HydrophobicContact CB-CZ3 4.36Å
473	S	85.4	Confident	87.5	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.021	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	2	-173.6	79.9	0	0	0	0	117.4	C471 N538 D768 W771	C471-S473 VanDerWaalsContact C-N 3.25Å; C471-S473 PolarHBondContact O-N 3.4Å; S473-N538 PolarHBondContact O-ND2 3.47Å; S473-D768 VanDerWaalsContact CB-CA 3.45Å; S473-W771 VanDerWaalsContact OG-CB 3.32Å; S473-W771 WeakPolarHBondContact OG-CB 3.22Å
474	K	87.9	Confident	86.9	Confident	74 Å²	74	45.9 Å²	45.9	32%	0.322	25%	0.25	S	C	.	.	B	Isolated β-bridge	trans	-110.7	147.6	178.5	-61.2	-58.6	170.8	-146.2	0	112.2	C471 F472 N538 D768 W771	C471-K474 PolarHBondContact N-O 3.07Å; C471-K474 WeakPolarHBondContact O-CA 3.39Å; C471-K474 PolarHBondContact O-N 3.22Å; F472-K474 VanDerWaalsContact C-N 3.26Å; F472-K474 PolarHBondContact O-N 3.34Å; K474-N538 WeakPolarHBondContact CA-ND2 3.47Å; K474-D768 IonicContact NZ-OD1 2.72Å; K474-W771 VanDerWaalsContact CE-CD1 3.47Å; K474-W771 HydrophobicContact CG-CZ2 4.4Å
475	S	87.2	Confident	86.3	Confident	35 Å²	35	48.3 Å²	48.3	25%	0.245	27%	0.265	C	S	.	.			trans	-100.5	143.3	-176.7	53.3	0	0	0	0	110.4	N469 P535 N538	N469-S475 VanDerWaalsContact O-CA 3.24Å; N469-S475 WeakPolarHBondContact O-CA 3.21Å; N469-S475 WeakPolarHBondContact O-CB 3.32Å; S475-P535 PolarHBondContact OG-O 3.48Å; S475-N538 PolarHBondContact N-ND2 3.34Å; S475-N538 WeakPolarHBondContact OG-CB 3.39Å; S475-N538 PolarHBondContact OG-ND2 2.86Å; S475-N538 VanDerWaalsContact OG-ND2 3.09Å
476	V	84.3	Confident	85.6	Confident	66 Å²	66	51.1 Å²	51.1	40%	0.4	28%	0.284	S	S	.	.			trans	-102.9	126.2	-179.1	-171.4	0	0	0	0	109.2	N469 C471 L478 P535	N469-V476 PolarHBondContact ND2-O 3.25Å; N469-V476 PolarHBondContact OD1-N 3.24Å; N469-V476 PolarHBondContact OD1-O 3.12Å; C471-V476 HydrophobicContact CB-CG2 4.36Å; V476-L478 HydrophobicContact CB-CG 4.44Å; V476-L478 HydrophobicContact CG1-CD2 3.84Å; V476-L478 HydrophobicContact CG1-CG 3.87Å; V476-L478 PolarHBondContact O-N 2.97Å; V476-P535 WeakPolarHBondContact O-CG 3.37Å
477	N	86.4	Confident	84.5	Confident	106 Å²	106	48.7 Å²	48.7	57%	0.567	27%	0.274	S	S	*	.			trans	-88.2	92.4	175.5	-174.7	16.3	0	0	0	110.3	G480 P535	N477-G480 VanDerWaalsContact OD1-CA 3.22Å; N477-G480 WeakPolarHBondContact OD1-CA 3.19Å; N477-G480 PolarHBondContact OD1-N 2.97Å; N477-G480 VanDerWaalsContact OD1-N 3.13Å; N477-P535 HydrophobicContact CB-CG 4.25Å
478	L	82.1	Confident	83.5	Confident	105 Å²	105	47 Å²	47	55%	0.55	27%	0.266	S	S	.	.	S	Bend	trans	-92.5	-43.3	-177.1	-67.3	168.6	0	0	0	113.2	V476 Y529	V476-L478 HydrophobicContact CB-CG 4.44Å; V476-L478 HydrophobicContact CG1-CD2 3.84Å; V476-L478 HydrophobicContact CG1-CG 3.87Å; V476-L478 PolarHBondContact O-N 2.97Å; L478-Y529 PolarHBondContact N-OH 2.91Å
479	F	82.4	Confident	82.5	Confident	127 Å²	127	51.8 Å²	51.8	56%	0.557	28%	0.284	S	S	*	.	S	Bend	trans	-112.4	1.6	-171.5	-62.4	-76.4	0	0	0	114.4	Y529 P530 L531	F479-Y529 HydrophobicContact CB-CE2 3.73Å; F479-Y529 HydrophobicContact CD2-CE1 4.32Å; F479-Y529 HydrophobicContact CD2-CE2 4.44Å; F479-Y529 AromaticContact CD2-CZ 3.89Å; F479-Y529 PolarHBondContact N-OH 2.79Å; F479-P530 HydrophobicContact CB-CG 4.16Å; F479-P530 HydrophobicContact CG-CB 4.49Å; F479-P530 HydrophobicContact CG-CG 4.35Å; F479-L531 HydrophobicContact CD2-CB 4.44Å; F479-L531 HydrophobicContact CE2-CB 3.92Å; F479-L531 HydrophobicContact CE2-CD2 4.29Å
480	G	81.3	Confident	81.1	Confident	36 Å²	36	54.7 Å²	54.7	37%	0.371	30%	0.302	S	S	.	.			trans	83.7	142.3	-169.4	0	0	0	0	0	112.2	N477 Y529	N477-G480 VanDerWaalsContact OD1-CA 3.22Å; N477-G480 WeakPolarHBondContact OD1-CA 3.19Å; N477-G480 PolarHBondContact OD1-N 2.97Å; N477-G480 VanDerWaalsContact OD1-N 3.13Å; G480-Y529 WeakPolarHBondContact O-CD2 3.23Å; G480-Y529 WeakPolarHBondContact O-CE2 3.23Å
481	S	84.4	Confident	79.4	Confident	42 Å²	42	58.5 Å²	58.5	29%	0.294	33%	0.331	S	S	.	.			trans	-67.4	137.4	178.8	160.4	0	0	0	0	110.9	W483	S481-W483 PolarHBondContact O-N 3.03Å; S481-W483 WeakPolarHBondContact OG-CB 3.24Å; S481-W483 PolarHBondContact OG-N 3.1Å; S481-W483 PolarHBondContact OG-O 2.88Å
482	G	82.7	Confident	77.5	Confident	11 Å²	11	61.1 Å²	61.1	11%	0.113	35%	0.349	C	S	.	.	S	Bend	trans	-72.6	-11.6	172.3	0	0	0	0	0	112.8	Q526 D534	G482-Q526 PolarHBondContact O-N 3.39Å; G482-D534 PolarHBondContact N-OD2 3.01Å
483	W	85.3	Confident	75.7	Confident	45 Å²	45	62.2 Å²	62.2	17%	0.17	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-95.1	129.8	174.1	-65.2	81.1	0	0	0	111.7	S481 L517 P519 V524 F525 D534 I536 W537	S481-W483 PolarHBondContact O-N 3.03Å; S481-W483 WeakPolarHBondContact OG-CB 3.24Å; S481-W483 PolarHBondContact OG-N 3.1Å; S481-W483 PolarHBondContact OG-O 2.88Å; W483-L517 HydrophobicContact CE3-CB 4.29Å; W483-L517 HydrophobicContact CE3-CD1 4.19Å; W483-L517 HydrophobicContact CZ3-CB 4.12Å; W483-P519 HydrophobicContact CH2-CB 3.92Å; W483-P519 HydrophobicContact CZ3-CB 4.22Å; W483-V524 WeakPolarHBondContact CA-O 3.2Å; W483-V524 HydrophobicContact CE3-CG1 3.91Å; W483-V524 HydrophobicContact CZ3-CG1 4.02Å; W483-F525 HydrophobicContact CD2-CD2 4.2Å; W483-F525 AromaticContact CE2-CD2 3.79Å; W483-F525 HydrophobicContact CZ2-CD2 4.01Å; W483-F525 AromaticContact NE1-CD2 3.94Å; W483-D534 VanDerWaalsContact CD1-OD2 3.3Å; W483-I536 HydrophobicContact CB-CG1 4.5Å; W483-I536 HydrophobicContact CB-CG2 4.28Å; W483-I536 VanDerWaalsContact CD1-CG2 3.47Å; W483-I536 HydrophobicContact CG-CG2 3.94Å; W483-W537 HydrophobicContact CZ2-CZ2 4.22Å
484	N	82.3	Confident	74.1	Confident	50 Å²	50	66 Å²	66	27%	0.267	38%	0.379	S	S	.	.			trans	-120.6	113.8	177.6	-173.8	0.4	0	0	0	111.4	S486 V524 Q526	N484-S486 VanDerWaalsContact C-N 3.34Å; N484-S486 PolarHBondContact ND2-OG 3.15Å; N484-S486 VanDerWaalsContact ND2-OG 3.08Å; N484-S486 WeakPolarHBondContact OD1-CB 3.34Å; N484-S486 PolarHBondContact OD1-N 3.25Å; N484-S486 PolarHBondContact OD1-OG 3.47Å; N484-V524 PolarHBondContact N-O 3.31Å; N484-Q526 PolarHBondContact ND2-NE2 2.95Å
485	V	79.8	Confident	72.3	Confident	60 Å²	60	67.3 Å²	67.3	36%	0.364	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-73.4	-26.7	179.5	-175.9	0	0	0	0	111.9	A487 M488 Y489 W504 L517	V485-A487 PolarHBondContact O-N 3.42Å; V485-M488 WeakPolarHBondContact O-CB 3.3Å; V485-M488 PolarHBondContact O-N 3.18Å; V485-Y489 HydrophobicContact CG1-CE2 4.17Å; V485-W504 HydrophobicContact CG1-CE3 4.42Å; V485-W504 HydrophobicContact CG1-CZ3 3.74Å; V485-L517 HydrophobicContact CG2-CD1 4.42Å; V485-L517 HydrophobicContact CG2-CD2 4.43Å
486	S	75.4	Confident	70.5	Confident	59 Å²	59	70 Å²	70	41%	0.413	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-64.7	-25.7	-177.8	65.8	0	0	0	0	113.3	N484 M488 Y489 T490	N484-S486 VanDerWaalsContact C-N 3.34Å; N484-S486 PolarHBondContact ND2-OG 3.15Å; N484-S486 VanDerWaalsContact ND2-OG 3.08Å; N484-S486 WeakPolarHBondContact OD1-CB 3.34Å; N484-S486 PolarHBondContact OD1-N 3.25Å; N484-S486 PolarHBondContact OD1-OG 3.47Å; S486-M488 PolarHBondContact O-N 3.24Å; S486-Y489 PolarHBondContact O-N 2.92Å; S486-Y489 VanDerWaalsContact O-N 3.11Å; S486-T490 PolarHBondContact O-N 3.26Å; S486-T490 PolarHBondContact O-OG1 3.38Å
487	A	69.8	Low	69	Low	20 Å²	20	71.5 Å²	71.5	17%	0.165	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-64.3	-25.4	174.6	0	0	0	0	0	112.7	V485 Y489 V524	V485-A487 PolarHBondContact O-N 3.42Å; A487-Y489 VanDerWaalsContact C-N 3.31Å; A487-Y489 PolarHBondContact O-N 2.9Å; A487-V524 HydrophobicContact CB-CG2 3.87Å
488	M	70.3	Confident	67.1	Low	11 Å²	11	74.7 Å²	74.7	5%	0.054	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-74.8	-20.9	175.3	-64	-67	-76.4	0	0	113.2	V485 S486 W504 L517 V524	V485-M488 WeakPolarHBondContact O-CB 3.3Å; V485-M488 PolarHBondContact O-N 3.18Å; S486-M488 PolarHBondContact O-N 3.24Å; M488-W504 HydrophobicContact CB-CD2 3.9Å; M488-W504 HydrophobicContact CB-CE3 3.92Å; M488-W504 HydrophobicContact CB-CG 4.21Å; M488-W504 HydrophobicContact CB-CZ3 4.43Å; M488-W504 HydrophobicContact CE-CD2 4.12Å; M488-W504 VanDerWaalsContact CE-CE2 3.48Å; M488-W504 HydrophobicContact CE-CG 4.33Å; M488-W504 HydrophobicContact CE-CZ2 3.83Å; M488-W504 VanDerWaalsContact CE-NE1 3.29Å; M488-W504 HydrophobicContact CG-CD2 4.43Å; M488-W504 HydrophobicContact CG-CE3 4.48Å; M488-W504 PolarHBondContact O-N 3.24Å; M488-L517 HydrophobicContact CG-CD2 3.75Å; M488-V524 HydrophobicContact CG-CG2 3.96Å; M488-V524 HydrophobicContact SD-CG2 3.56Å; M488-V524 VanDerWaalsContact SD-CG2 3.56Å
489	Y	69.1	Low	65.4	Low	110 Å²	110	79.4 Å²	79.4	43%	0.431	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-23.6	176.4	-71.7	-85.8	0	0	0	113	V485 S486 A487 W504 V509	V485-Y489 HydrophobicContact CG1-CE2 4.17Å; S486-Y489 PolarHBondContact O-N 2.92Å; S486-Y489 VanDerWaalsContact O-N 3.11Å; A487-Y489 VanDerWaalsContact C-N 3.31Å; A487-Y489 PolarHBondContact O-N 2.9Å; Y489-W504 HydrophobicContact CE1-CB 4.46Å; Y489-W504 HydrophobicContact CE2-CE3 4.04Å; Y489-V509 HydrophobicContact CE1-CG2 4.47Å; Y489-V509 WeakPolarHBondContact OH-CG2 3.36Å
490	T	61.9	Low	63.8	Low	73 Å²	73	83.1 Å²	83.1	45%	0.448	46%	0.459	S	S	.	.			trans	-86.7	120.1	-168.4	-54.4	0	0	0	0	112.1	S486 S492	S486-T490 PolarHBondContact O-N 3.26Å; S486-T490 PolarHBondContact O-OG1 3.38Å; T490-S492 PolarHBondContact O-N 2.88Å
491	S	52.3	Low	62.4	Low	100 Å²	100	84.7 Å²	84.7	70%	0.699	46%	0.458	S	S	*	.			trans	-89.6	33.8	-174.7	41.8	0	0	0	0	114.5	H493	S491-H493 PolarHBondContact O-N 2.88Å
492	S	49.4	Very low	61	Low	87 Å²	87	88.5 Å²	88.5	61%	0.608	48%	0.479	S	S	*	.			trans	-99.9	43.1	-172.4	64.1	0	0	0	0	114.7	T490	T490-S492 PolarHBondContact O-N 2.88Å
493	H	50.3	Low	60.1	Low	86 Å²	86	91.6 Å²	91.6	40%	0.398	49%	0.493	S	S	.	.	S	Bend	trans	-129.8	149.3	172.7	-74	-64.6	0	0	0	112.5	S491	S491-H493 PolarHBondContact O-N 2.88Å
494	P	51.6	Low	59.3	Low	82 Å²	82	90.9 Å²	90.9	53%	0.532	49%	0.49	S	S	.	.			trans	-60.2	154.4	-170.1	20.2	-30.8	0	0	0	114.2	A496 E497	P494-A496 PolarHBondContact O-N 3.47Å; P494-E497 PolarHBondContact O-N 2.73Å
495	P	51.1	Low	58.9	Low	102 Å²	102	92.9 Å²	92.9	66%	0.662	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-13.1	-165.7	22.9	-33.1	0	0	0	116.1
496	A	49.7	Very low	58.5	Low	93 Å²	93	94.4 Å²	94.4	77%	0.769	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-28.4	179.4	0	0	0	0	0	113.7	P494	P494-A496 PolarHBondContact O-N 3.47Å
497	E	50.8	Low	58.4	Low	97 Å²	97	94.7 Å²	94.7	45%	0.453	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-88	-14.4	-178.5	-72.8	174.7	163.9	0	0	113.1	P494 K499 K500	P494-E497 PolarHBondContact O-N 2.73Å; E497-K499 PolarHBondContact O-N 2.99Å; E497-K499 VanDerWaalsContact O-N 3.12Å; E497-K500 PolarHBondContact O-N 3.49Å
498	R	48	Very low	58.6	Low	173 Å²	173	95.6 Å²	95.6	65%	0.653	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-60.9	-21.7	-179.5	-117.8	-178.6	-83.2	-176.1	-6.8	114.7
499	K	45.9	Very low	59	Low	204 Å²	204	97.6 Å²	97.6	89%	0.887	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-82.7	-11	179.8	-86.7	-177.1	176.6	178.1	0	114.4	E497	E497-K499 PolarHBondContact O-N 2.99Å; E497-K499 VanDerWaalsContact O-N 3.12Å
500	K	47.8	Very low	59.4	Low	204 Å²	204	101.5 Å²	101.5	89%	0.887	54%	0.539	S	S	*	.	S	Bend	trans	-108	-5.3	-179.3	-81.2	-179.7	176.3	177.2	0	114.2	E497	E497-K500 PolarHBondContact O-N 3.49Å
501	M	51.9	Low	60.2	Low	69 Å²	69	105.5 Å²	105.5	34%	0.34	55%	0.552	S	S	.	*			trans	-109.5	135.4	-169.2	-70.4	175.6	150.4	0	0	112.9	L503 V521	M501-L503 PolarHBondContact O-N 3.05Å; M501-V521 HydrophobicContact CE-CG1 4.05Å; M501-V521 HydrophobicContact CE-CG2 4.4Å
502	V	55.4	Low	61.6	Low	123 Å²	123	104.8 Å²	104.8	75%	0.745	54%	0.54	S	S	*	.			trans	-90.8	90.8	167.6	-178.2	0	0	0	0	107.8
503	L	63.2	Low	62.9	Low	76 Å²	76	106.5 Å²	106.5	40%	0.398	55%	0.552	S	S	.	*			trans	-69.6	136.6	174.1	-158.3	82.8	0	0	0	109.7	M501 N505	M501-L503 PolarHBondContact O-N 3.05Å; L503-N505 PolarHBondContact O-N 3.33Å
504	W	69.9	Low	64.5	Low	29 Å²	29	107.9 Å²	107.9	11%	0.11	56%	0.561	C	S	.	*			trans	-75.5	112	176.1	-73.2	3.2	0	0	0	110.2	V485 M488 Y489 L515 L517	V485-W504 HydrophobicContact CG1-CE3 4.42Å; V485-W504 HydrophobicContact CG1-CZ3 3.74Å; M488-W504 HydrophobicContact CB-CD2 3.9Å; M488-W504 HydrophobicContact CB-CE3 3.92Å; M488-W504 HydrophobicContact CB-CG 4.21Å; M488-W504 HydrophobicContact CB-CZ3 4.43Å; M488-W504 HydrophobicContact CE-CD2 4.12Å; M488-W504 VanDerWaalsContact CE-CE2 3.48Å; M488-W504 HydrophobicContact CE-CG 4.33Å; M488-W504 HydrophobicContact CE-CZ2 3.83Å; M488-W504 VanDerWaalsContact CE-NE1 3.29Å; M488-W504 HydrophobicContact CG-CD2 4.43Å; M488-W504 HydrophobicContact CG-CE3 4.48Å; M488-W504 PolarHBondContact O-N 3.24Å; Y489-W504 HydrophobicContact CE1-CB 4.46Å; Y489-W504 HydrophobicContact CE2-CE3 4.04Å; W504-L515 HydrophobicContact CD2-CD1 4.43Å; W504-L515 HydrophobicContact CE3-CD1 4.43Å; W504-L515 HydrophobicContact CH2-CB 3.94Å; W504-L515 HydrophobicContact CH2-CD1 4.35Å; W504-L515 HydrophobicContact CZ2-CB 3.71Å; W504-L515 HydrophobicContact CZ2-CD1 4.37Å; W504-L515 HydrophobicContact CZ2-CG 4.44Å; W504-L515 HydrophobicContact CZ3-CD1 4.38Å; W504-L517 HydrophobicContact CH2-CD2 3.36Å; W504-L517 HydrophobicContact CH2-CG 4.1Å; W504-L517 HydrophobicContact CZ2-CD2 3.87Å; W504-L517 HydrophobicContact CZ3-CD2 4.05Å
505	N	73.3	Confident	66	Low	92 Å²	92	106.9 Å²	106.9	49%	0.492	55%	0.551	S	S	.	*			trans	-92.1	156	168.6	-75.6	-12.4	0	0	0	110.5	L503 S507 V508 V509	L503-N505 PolarHBondContact O-N 3.33Å; N505-S507 PolarHBondContact O-N 2.96Å; N505-S507 VanDerWaalsContact O-N 3.09Å; N505-V508 HydrophobicContact CB-CG2 4.36Å; N505-V508 WeakPolarHBondContact O-CB 3.49Å; N505-V508 PolarHBondContact O-N 3.39Å; N505-V509 PolarHBondContact O-N 2.87Å
506	D	71.1	Confident	67.5	Low	93 Å²	93	109.4 Å²	109.4	50%	0.497	55%	0.554	S	S	.	*	H	α-helix	trans	-55.5	-28.9	176.1	-171.1	45.2	0	0	0	112.4	R510	D506-R510 VanDerWaalsContact O-CG 3.3Å; D506-R510 WeakPolarHBondContact O-CG 3.41Å; D506-R510 PolarHBondContact O-N 3.18Å; D506-R510 IonicContact OD1-NE 3.02Å; D506-R510 IonicContact OD1-NH2 2.71Å; D506-R510 IonicContact OD2-CZ 3.66Å; D506-R510 IonicContact OD2-NE 3.77Å; D506-R510 PolarHBondContact OD2-NE 2.96Å; D506-R510 IonicContact OD2-NH2 3.96Å; D506-R510 PolarHBondContact OD2-NH2 3.35Å
507	S	72.9	Confident	69	Low	64 Å²	64	106.9 Å²	106.9	45%	0.448	53%	0.528	S	S	.	.	H	α-helix	trans	-65.5	-39.8	171.9	54.8	0	0	0	0	113.3	N505 R510 H511	N505-S507 PolarHBondContact O-N 2.96Å; N505-S507 VanDerWaalsContact O-N 3.09Å; S507-R510 PolarHBondContact O-N 3.35Å; S507-H511 PolarHBondContact O-N 2.85Å; S507-H511 PolarHBondContact O-ND1 3.3Å
508	V	74.9	Confident	70.3	Confident	40 Å²	40	105.7 Å²	105.7	24%	0.242	52%	0.524	C	S	.	.	H	α-helix	trans	-68.2	-38.5	-178.7	177.9	0	0	0	0	110.8	N505 H511 N512 L515	N505-V508 HydrophobicContact CB-CG2 4.36Å; N505-V508 WeakPolarHBondContact O-CB 3.49Å; N505-V508 PolarHBondContact O-N 3.39Å; V508-H511 PolarHBondContact O-N 3.23Å; V508-N512 WeakPolarHBondContact O-CB 3.21Å; V508-N512 PolarHBondContact O-N 3.48Å; V508-L515 HydrophobicContact CG1-CD2 3.93Å
509	V	77.8	Confident	71.8	Confident	52 Å²	52	100 Å²	100	32%	0.315	51%	0.51	S	S	.	.	H	α-helix	trans	-68.9	-36.7	179	179.8	0	0	0	0	111.8	Y489 N505 L515	Y489-V509 HydrophobicContact CE1-CG2 4.47Å; Y489-V509 WeakPolarHBondContact OH-CG2 3.36Å; N505-V509 PolarHBondContact O-N 2.87Å; V509-L515 HydrophobicContact CG2-CD1 4.22Å
510	R	78.3	Confident	73.3	Confident	193 Å²	193	93.1 Å²	93.1	73%	0.728	49%	0.487	S	S	*	.	H	α-helix	trans	-73.9	-29.3	178.1	-69.1	178.8	-167.2	-154.8	6.5	113.6	D506 S507	D506-R510 VanDerWaalsContact O-CG 3.3Å; D506-R510 WeakPolarHBondContact O-CG 3.41Å; D506-R510 PolarHBondContact O-N 3.18Å; D506-R510 IonicContact OD1-NE 3.02Å; D506-R510 IonicContact OD1-NH2 2.71Å; D506-R510 IonicContact OD2-CZ 3.66Å; D506-R510 IonicContact OD2-NE 3.77Å; D506-R510 PolarHBondContact OD2-NE 2.96Å; D506-R510 IonicContact OD2-NH2 3.96Å; D506-R510 PolarHBondContact OD2-NH2 3.35Å; S507-R510 PolarHBondContact O-N 3.35Å
511	H	79.7	Confident	74.7	Confident	157 Å²	157	84.7 Å²	84.7	73%	0.727	45%	0.453	S	S	*	.	H	α-helix	trans	-92	-30.5	-176.9	-70.8	79.1	0	0	0	113.4	S507 V508	S507-H511 PolarHBondContact O-N 2.85Å; S507-H511 PolarHBondContact O-ND1 3.3Å; V508-H511 PolarHBondContact O-N 3.23Å
512	N	79.7	Confident	75.7	Confident	84 Å²	84	84.4 Å²	84.4	45%	0.449	46%	0.456	S	S	.	.			trans	-103.8	120	-176.1	-66.2	-19.6	0	0	0	111.4	V508 I514 L515	V508-N512 WeakPolarHBondContact O-CB 3.21Å; V508-N512 PolarHBondContact O-N 3.48Å; N512-I514 VanDerWaalsContact C-N 3.34Å; N512-L515 HydrophobicContact CB-CD2 3.95Å; N512-L515 HydrophobicContact CB-CG 4.3Å
513	S	78.1	Confident	76.5	Confident	123 Å²	123	80.1 Å²	80.1	86%	0.86	44%	0.437	S	S	*	.	S	Bend	trans	-75	-22.6	175.5	57	0	0	0	0	113.7
514	I	83.2	Confident	77.4	Confident	116 Å²	116	76.5 Å²	76.5	60%	0.595	42%	0.418	S	S	*	.			trans	-127.8	124.3	179.4	-57.9	170.1	0	0	0	108	N512	N512-I514 VanDerWaalsContact C-N 3.34Å
515	L	83.1	Confident	78	Confident	60 Å²	60	79.6 Å²	79.6	31%	0.314	43%	0.432	S	S	.	.			trans	-123.5	143.7	177.6	-72.1	167.3	0	0	0	109.9	W504 V508 V509 N512	W504-L515 HydrophobicContact CD2-CD1 4.43Å; W504-L515 HydrophobicContact CE3-CD1 4.43Å; W504-L515 HydrophobicContact CH2-CB 3.94Å; W504-L515 HydrophobicContact CH2-CD1 4.35Å; W504-L515 HydrophobicContact CZ2-CB 3.71Å; W504-L515 HydrophobicContact CZ2-CD1 4.37Å; W504-L515 HydrophobicContact CZ2-CG 4.44Å; W504-L515 HydrophobicContact CZ3-CD1 4.38Å; V508-L515 HydrophobicContact CG1-CD2 3.93Å; V509-L515 HydrophobicContact CG2-CD1 4.22Å; N512-L515 HydrophobicContact CB-CD2 3.95Å; N512-L515 HydrophobicContact CB-CG 4.3Å
516	Q	82.1	Confident	78.3	Confident	156 Å²	156	81.5 Å²	81.5	73%	0.729	44%	0.438	S	S	*	.			trans	-107.5	129.4	176.5	-176.1	174.5	-7.1	0	0	109.9
517	L	81.4	Confident	78.8	Confident	40 Å²	40	78 Å²	78	21%	0.209	42%	0.424	C	S	.	.			trans	-78.2	125.9	169.8	-65.4	168.1	0	0	0	108.7	W483 V485 M488 W504 P519 V524	W483-L517 HydrophobicContact CE3-CB 4.29Å; W483-L517 HydrophobicContact CE3-CD1 4.19Å; W483-L517 HydrophobicContact CZ3-CB 4.12Å; V485-L517 HydrophobicContact CG2-CD1 4.42Å; V485-L517 HydrophobicContact CG2-CD2 4.43Å; M488-L517 HydrophobicContact CG-CD2 3.75Å; W504-L517 HydrophobicContact CH2-CD2 3.36Å; W504-L517 HydrophobicContact CH2-CG 4.1Å; W504-L517 HydrophobicContact CZ2-CD2 3.87Å; W504-L517 HydrophobicContact CZ3-CD2 4.05Å; L517-P519 WeakPolarHBondContact O-CD 3.25Å; L517-V524 HydrophobicContact CB-CG1 4.22Å
518	D	79.3	Confident	79.4	Confident	72 Å²	72	80.5 Å²	80.5	39%	0.385	44%	0.439	S	S	.	.			trans	-88.6	114.2	177.3	-169.9	-18.5	0	0	0	109.8	S520 V521	D518-S520 PolarHBondContact O-N 3Å; D518-S520 WeakPolarHBondContact OD1-CB 3.44Å; D518-S520 PolarHBondContact OD1-N 3.4Å; D518-S520 PolarHBondContact OD1-OG 3.02Å; D518-S520 PolarHBondContact OD2-OG 3.27Å; D518-V521 HydrophobicContact CB-CG2 4.07Å; D518-V521 PolarHBondContact O-N 3.45Å
519	P	78.9	Confident	80	Confident	53 Å²	53	79.8 Å²	79.8	34%	0.344	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-12.7	179.8	28.7	-34.4	0	0	0	113.9	W483 L517 V521 A614	W483-P519 HydrophobicContact CH2-CB 3.92Å; W483-P519 HydrophobicContact CZ3-CB 4.22Å; L517-P519 WeakPolarHBondContact O-CD 3.25Å; P519-V521 VanDerWaalsContact C-N 3.28Å; P519-A614 HydrophobicContact CB-CB 3.86Å; P519-A614 HydrophobicContact CG-CB 3.86Å
520	S	78	Confident	80.4	Confident	59 Å²	59	82.1 Å²	82.1	41%	0.413	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-14.2	177.2	68.2	0	0	0	0	113.4	D518	D518-S520 PolarHBondContact O-N 3Å; D518-S520 WeakPolarHBondContact OD1-CB 3.44Å; D518-S520 PolarHBondContact OD1-N 3.4Å; D518-S520 PolarHBondContact OD1-OG 3.02Å; D518-S520 PolarHBondContact OD2-OG 3.27Å
521	V	76.3	Confident	80.9	Confident	27 Å²	27	76.6 Å²	76.6	16%	0.164	43%	0.433	C	S	.	.	S	Bend	trans	-78.4	126.1	177.2	176.7	0	0	0	0	109.4	M501 D518 P519 G523 V524	M501-V521 HydrophobicContact CE-CG1 4.05Å; M501-V521 HydrophobicContact CE-CG2 4.4Å; D518-V521 HydrophobicContact CB-CG2 4.07Å; D518-V521 PolarHBondContact O-N 3.45Å; P519-V521 VanDerWaalsContact C-N 3.28Å; V521-G523 PolarHBondContact O-N 3.42Å; V521-V524 HydrophobicContact CB-CB 4.49Å; V521-V524 HydrophobicContact CB-CG2 3.73Å; V521-V524 HydrophobicContact CG1-CG2 3.74Å; V521-V524 PolarHBondContact O-N 2.87Å
522	P	72.6	Confident	81.2	Confident	64 Å²	64	70.6 Å²	70.6	42%	0.416	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	134.4	-178.8	25.6	-33.8	0	0	0	110.8	V524	P522-V524 VanDerWaalsContact C-N 3.35Å; P522-V524 PolarHBondContact O-N 3.12Å
523	G	73.7	Confident	81.7	Confident	33 Å²	33	67.5 Å²	67.5	34%	0.34	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	-12.1	178.8	0	0	0	0	0	115.8	V521	V521-G523 PolarHBondContact O-N 3.42Å
524	V	80.6	Confident	82.2	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-41.4	173.6	174.9	0	0	0	0	111.2	W483 N484 A487 M488 L517 V521 P522	W483-V524 WeakPolarHBondContact CA-O 3.2Å; W483-V524 HydrophobicContact CE3-CG1 3.91Å; W483-V524 HydrophobicContact CZ3-CG1 4.02Å; N484-V524 PolarHBondContact N-O 3.31Å; A487-V524 HydrophobicContact CB-CG2 3.87Å; M488-V524 HydrophobicContact CG-CG2 3.96Å; M488-V524 HydrophobicContact SD-CG2 3.56Å; M488-V524 VanDerWaalsContact SD-CG2 3.56Å; L517-V524 HydrophobicContact CB-CG1 4.22Å; V521-V524 HydrophobicContact CB-CB 4.49Å; V521-V524 HydrophobicContact CB-CG2 3.73Å; V521-V524 HydrophobicContact CG1-CG2 3.74Å; V521-V524 PolarHBondContact O-N 2.87Å; P522-V524 VanDerWaalsContact C-N 3.35Å; P522-V524 PolarHBondContact O-N 3.12Å
525	F	83.6	Confident	82.4	Confident	93 Å²	93	57.3 Å²	57.3	41%	0.408	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-113.5	110.5	171.6	-177.8	-109.2	0	0	0	109	W483 G527	W483-F525 HydrophobicContact CD2-CD2 4.2Å; W483-F525 AromaticContact CE2-CD2 3.79Å; W483-F525 HydrophobicContact CZ2-CD2 4.01Å; W483-F525 AromaticContact NE1-CD2 3.94Å; F525-G527 VanDerWaalsContact CE2-O 3.27Å; F525-G527 WeakPolarHBondContact CE2-O 3.39Å; F525-G527 VanDerWaalsContact CZ-C 3.41Å; F525-G527 WeakPolarHBondContact CZ-O 3.4Å
526	Q	79	Confident	82.7	Confident	133 Å²	133	56.6 Å²	56.6	62%	0.621	33%	0.33	S	S	*	.			trans	-93.9	-7.4	-174.7	-61.9	-172.8	-9.9	0	0	113.1	G482 N484	G482-Q526 PolarHBondContact O-N 3.39Å; N484-Q526 PolarHBondContact ND2-NE2 2.95Å
527	G	82.1	Confident	82.9	Confident	20 Å²	20	51.3 Å²	51.3	21%	0.206	30%	0.304	C	S	.	.			trans	145.9	170.6	178	0	0	0	0	0	112.7	F525	F525-G527 VanDerWaalsContact CE2-O 3.27Å; F525-G527 WeakPolarHBondContact CE2-O 3.39Å; F525-G527 VanDerWaalsContact CZ-C 3.41Å; F525-G527 WeakPolarHBondContact CZ-O 3.4Å
528	P	85.3	Confident	83.2	Confident	115 Å²	115	50.7 Å²	50.7	75%	0.747	30%	0.301	S	S	*	.			trans	-68.6	147.3	176	29.7	-34.1	0	0	0	111.5
529	Y	87.3	Confident	83.4	Confident	25 Å²	25	54.5 Å²	54.5	10%	0.098	32%	0.32	C	S	.	.			trans	-65.8	134.6	175.8	-169.4	-114.6	0	0	0	110.5	L478 F479 G480 L531 P535	L478-Y529 PolarHBondContact N-OH 2.91Å; F479-Y529 HydrophobicContact CB-CE2 3.73Å; F479-Y529 HydrophobicContact CD2-CE1 4.32Å; F479-Y529 HydrophobicContact CD2-CE2 4.44Å; F479-Y529 AromaticContact CD2-CZ 3.89Å; F479-Y529 PolarHBondContact N-OH 2.79Å; G480-Y529 WeakPolarHBondContact O-CD2 3.23Å; G480-Y529 WeakPolarHBondContact O-CE2 3.23Å; Y529-L531 VanDerWaalsContact C-N 3.34Å; Y529-L531 WeakPolarHBondContact CD1-O 3.28Å; Y529-L531 WeakPolarHBondContact CE1-O 3.34Å; Y529-L531 PolarHBondContact O-N 3.36Å; Y529-P535 HydrophobicContact CE2-CG 4.43Å
530	P	86.4	Confident	83.8	Confident	101 Å²	101	53.4 Å²	53.4	66%	0.656	32%	0.316	S	S	*	.	S	Bend	trans	-61.9	-32.5	-171.8	-27.9	35.7	0	0	0	115.8	F479	F479-P530 HydrophobicContact CB-CG 4.16Å; F479-P530 HydrophobicContact CG-CB 4.49Å; F479-P530 HydrophobicContact CG-CG 4.35Å
531	L	88	Confident	84.3	Confident	78 Å²	78	56.2 Å²	56.2	41%	0.408	33%	0.33	S	S	.	.	S	Bend	trans	-141.5	110.7	-177.1	-178.2	70.7	0	0	0	111.3	I467 F479 Y529	I467-L531 HydrophobicContact CD1-CD1 3.88Å; F479-L531 HydrophobicContact CD2-CB 4.44Å; F479-L531 HydrophobicContact CE2-CB 3.92Å; F479-L531 HydrophobicContact CE2-CD2 4.29Å; Y529-L531 VanDerWaalsContact C-N 3.34Å; Y529-L531 WeakPolarHBondContact CD1-O 3.28Å; Y529-L531 WeakPolarHBondContact CE1-O 3.34Å; Y529-L531 PolarHBondContact O-N 3.36Å
532	G	87.1	Confident	84.9	Confident	31 Å²	31	58.5 Å²	58.5	32%	0.32	34%	0.342	S	S	.	.	S	Bend	trans	80.9	-154.9	175.6	0	0	0	0	0	114	I467	I467-G532 CarbonylContact O-C 3.43Å; I467-G532 WeakPolarHBondContact O-CA 3.47Å
533	I	89	Confident	85.6	Confident	18 Å²	18	57.3 Å²	57.3	9%	0.092	33%	0.329	C	S	.	.	S	Bend	trans	-89.3	139.8	-177.1	-54.8	176.7	0	0	0	110.4	I467 Y468 N469 W537 F546 L547 F550	I467-I533 PolarHBondContact O-N 2.92Å; Y468-I533 HydrophobicContact CD1-CD1 4.31Å; N469-I533 WeakPolarHBondContact CB-O 3.4Å; N469-I533 PolarHBondContact ND2-O 3.12Å; I533-W537 HydrophobicContact CG2-CG 4.41Å; I533-F546 HydrophobicContact CG2-CE1 3.95Å; I533-L547 HydrophobicContact CD1-CD2 3.5Å; I533-F550 HydrophobicContact CD1-CD1 4.23Å; I533-F550 HydrophobicContact CD1-CE1 4.16Å
534	D	89.6	Confident	86.2	Confident	13 Å²	13	59.5 Å²	59.5	7%	0.07	33%	0.333	C	S	.	.			trans	-60.2	128.9	179.4	-165.5	-42.1	0	0	0	111.4	G482 W483 I536 W537	G482-D534 PolarHBondContact N-OD2 3.01Å; W483-D534 VanDerWaalsContact CD1-OD2 3.3Å; D534-I536 HydrophobicContact CB-CG2 4.21Å; D534-I536 PolarHBondContact O-N 3.18Å; D534-I536 VanDerWaalsContact O-N 3.1Å; D534-I536 WeakPolarHBondContact OD1-CG2 3.47Å; D534-I536 PolarHBondContact OD1-N 3.48Å; D534-W537 VanDerWaalsContact O-CD1 3.3Å; D534-W537 PolarHBondContact O-N 2.9Å
535	P	87.5	Confident	86.7	Confident	12 Å²	12	64.8 Å²	64.8	8%	0.078	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-54.4	-27.4	178.6	-20.1	23.3	0	0	0	115	N469 S475 V476 N477 Y529 W537 N538	N469-P535 WeakPolarHBondContact ND2-CG 3.37Å; S475-P535 PolarHBondContact OG-O 3.48Å; V476-P535 WeakPolarHBondContact O-CG 3.37Å; N477-P535 HydrophobicContact CB-CG 4.25Å; Y529-P535 HydrophobicContact CE2-CG 4.43Å; P535-W537 PolarHBondContact O-N 3.27Å; P535-W537 VanDerWaalsContact O-N 3.15Å; P535-N538 WeakPolarHBondContact O-CB 3.49Å; P535-N538 PolarHBondContact O-N 2.91Å; P535-N538 VanDerWaalsContact O-N 3.1Å
536	I	88.3	Confident	87	Confident	46 Å²	46	64 Å²	64	24%	0.236	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-59.7	-29.2	-177.1	-165.5	60.1	0	0	0	112.5	W483 D534 N538 L539 A540	W483-I536 HydrophobicContact CB-CG1 4.5Å; W483-I536 HydrophobicContact CB-CG2 4.28Å; W483-I536 VanDerWaalsContact CD1-CG2 3.47Å; W483-I536 HydrophobicContact CG-CG2 3.94Å; D534-I536 HydrophobicContact CB-CG2 4.21Å; D534-I536 PolarHBondContact O-N 3.18Å; D534-I536 VanDerWaalsContact O-N 3.1Å; D534-I536 WeakPolarHBondContact OD1-CG2 3.47Å; D534-I536 PolarHBondContact OD1-N 3.48Å; I536-N538 PolarHBondContact O-N 2.95Å; I536-L539 HydrophobicContact CD1-CD1 4.42Å; I536-L539 PolarHBondContact O-N 3.37Å; I536-L539 VanDerWaalsContact O-N 3.08Å; I536-A540 PolarHBondContact O-N 2.76Å
537	W	88	Confident	87.4	Confident	44 Å²	44	58.4 Å²	58.4	17%	0.167	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-62.2	-26.4	-179.6	-70.4	109.5	0	0	0	112.2	W483 I533 D534 P535 L539 A540 R543 F546	W483-W537 HydrophobicContact CZ2-CZ2 4.22Å; I533-W537 HydrophobicContact CG2-CG 4.41Å; D534-W537 VanDerWaalsContact O-CD1 3.3Å; D534-W537 PolarHBondContact O-N 2.9Å; P535-W537 PolarHBondContact O-N 3.27Å; P535-W537 VanDerWaalsContact O-N 3.15Å; W537-L539 VanDerWaalsContact C-N 3.26Å; W537-L539 PolarHBondContact O-N 3.4Å; W537-A540 HydrophobicContact CE3-CB 4.19Å; W537-A540 PolarHBondContact O-N 3.43Å; W537-R543 HydrophobicContact CB-CG 4.5Å; W537-R543 WeakPolarHBondContact O-CB 3.47Å; W537-R543 WeakPolarHBondContact O-CD 3.49Å; W537-R543 VanDerWaalsContact O-CG 3.28Å; W537-R543 WeakPolarHBondContact O-CG 3.46Å; W537-F546 AromaticContact CD2-CD1 3.93Å; W537-F546 HydrophobicContact CD2-CD1 3.93Å; W537-F546 HydrophobicContact CD2-CE1 4.35Å; W537-F546 HydrophobicContact CD2-CG 4.23Å; W537-F546 HydrophobicContact CE3-CB 4.16Å; W537-F546 HydrophobicContact CE3-CD1 4.3Å; W537-F546 HydrophobicContact CE3-CG 4.25Å; W537-F546 HydrophobicContact CG-CD1 4.19Å; W537-F546 HydrophobicContact CG-CE1 4.36Å; W537-F546 HydrophobicContact CH2-CB 4.34Å; W537-F546 HydrophobicContact CH2-CD2 4.24Å; W537-F546 HydrophobicContact CH2-CG 4.22Å; W537-F546 HydrophobicContact CZ2-CD1 4.49Å; W537-F546 HydrophobicContact CZ2-CD2 4.08Å; W537-F546 HydrophobicContact CZ2-CE2 4.28Å; W537-F546 HydrophobicContact CZ2-CG 4.19Å; W537-F546 HydrophobicContact CZ3-CB 4.01Å; W537-F546 HydrophobicContact CZ3-CG 4.25Å; W537-F546 AromaticContact NE1-CE1 3.96Å
538	N	86.3	Confident	87.9	Confident	28 Å²	28	60.1 Å²	60.1	15%	0.15	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-65.1	-30.5	177	-160.4	5.5	0	0	0	113.2	S473 K474 S475 P535 I536 R543	S473-N538 PolarHBondContact O-ND2 3.47Å; K474-N538 WeakPolarHBondContact CA-ND2 3.47Å; S475-N538 PolarHBondContact N-ND2 3.34Å; S475-N538 WeakPolarHBondContact OG-CB 3.39Å; S475-N538 PolarHBondContact OG-ND2 2.86Å; S475-N538 VanDerWaalsContact OG-ND2 3.09Å; P535-N538 WeakPolarHBondContact O-CB 3.49Å; P535-N538 PolarHBondContact O-N 2.91Å; P535-N538 VanDerWaalsContact O-N 3.1Å; I536-N538 PolarHBondContact O-N 2.95Å; N538-R543 PolarHBondContact OD1-NH1 3.08Å
539	L	84.5	Confident	88.1	Confident	152 Å²	152	57 Å²	57	80%	0.796	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-16.2	177.6	-62.1	174.8	0	0	0	112.7	I536 W537	I536-L539 HydrophobicContact CD1-CD1 4.42Å; I536-L539 PolarHBondContact O-N 3.37Å; I536-L539 VanDerWaalsContact O-N 3.08Å; W537-L539 VanDerWaalsContact C-N 3.26Å; W537-L539 PolarHBondContact O-N 3.4Å
540	A	87.5	Confident	88.3	Confident	30 Å²	30	58.6 Å²	58.6	25%	0.248	33%	0.329	C	S	.	.			trans	-80.3	139.2	-172	0	0	0	0	0	112.4	I536 W537 N542 R543	I536-A540 PolarHBondContact O-N 2.76Å; W537-A540 HydrophobicContact CE3-CB 4.19Å; W537-A540 PolarHBondContact O-N 3.43Å; A540-N542 VanDerWaalsContact C-N 3.28Å; A540-N542 WeakPolarHBondContact CB-OD1 3.37Å; A540-N542 PolarHBondContact O-N 3.4Å; A540-R543 WeakPolarHBondContact O-CB 3.41Å; A540-R543 PolarHBondContact O-N 3.05Å
541	T	86.8	Confident	88.5	Confident	117 Å²	117	54.1 Å²	54.1	72%	0.718	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-27.7	176.5	54.3	0	0	0	0	112.6
542	N	88.9	Confident	88.7	Confident	75 Å²	75	53.9 Å²	53.9	40%	0.401	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	13.2	179.5	65.1	-16.3	0	0	0	114	A540 L544 T545 F546	A540-N542 VanDerWaalsContact C-N 3.28Å; A540-N542 WeakPolarHBondContact CB-OD1 3.37Å; A540-N542 PolarHBondContact O-N 3.4Å; N542-L544 VanDerWaalsContact C-N 3.3Å; N542-L544 PolarHBondContact O-N 3.47Å; N542-T545 PolarHBondContact O-N 3.01Å; N542-F546 PolarHBondContact O-N 2.78Å
543	R	87.6	Confident	89	Confident	39 Å²	39	53.9 Å²	53.9	15%	0.147	29%	0.288	C	S	.	.	H	α-helix	trans	-50.6	-46.1	177.8	-177.5	177.1	60.6	168.6	-3.5	113.3	W537 N538 A540 T545 F546 L547 D768	W537-R543 HydrophobicContact CB-CG 4.5Å; W537-R543 WeakPolarHBondContact O-CB 3.47Å; W537-R543 WeakPolarHBondContact O-CD 3.49Å; W537-R543 VanDerWaalsContact O-CG 3.28Å; W537-R543 WeakPolarHBondContact O-CG 3.46Å; N538-R543 PolarHBondContact OD1-NH1 3.08Å; A540-R543 WeakPolarHBondContact O-CB 3.41Å; A540-R543 PolarHBondContact O-N 3.05Å; R543-T545 VanDerWaalsContact C-N 3.34Å; R543-T545 PolarHBondContact O-N 2.95Å; R543-F546 PolarHBondContact O-N 3.31Å; R543-L547 HydrophobicContact CG-CD1 3.6Å; R543-L547 HydrophobicContact CG-CG 4.11Å; R543-L547 WeakPolarHBondContact O-CB 3.39Å; R543-L547 PolarHBondContact O-N 3.39Å; R543-D768 IonicContact CZ-OD2 2.78Å; R543-D768 IonicContact NH1-OD2 3.97Å; R543-D768 IonicContact NH2-OD2 3.6Å; R543-D768 PolarHBondContact NH2-OD2 3.26Å
544	L	87.7	Confident	89.2	Confident	80 Å²	80	54.8 Å²	54.8	42%	0.419	29%	0.292	S	S	.	.	H	α-helix	trans	-64.6	-39.8	-173	-171.2	65.9	0	0	0	111.6	N542 N548 L761	N542-L544 VanDerWaalsContact C-N 3.3Å; N542-L544 PolarHBondContact O-N 3.47Å; L544-N548 WeakPolarHBondContact O-CB 3.24Å; L544-N548 PolarHBondContact O-N 3.37Å; L544-L761 HydrophobicContact CD1-CD1 4.02Å; L544-L761 HydrophobicContact CD1-CD2 4.36Å; L544-L761 HydrophobicContact CD1-CG 4.29Å
545	T	89.9	Confident	89.3	Confident	111 Å²	111	54.2 Å²	54.2	68%	0.681	29%	0.289	S	S	*	.	H	α-helix	trans	-64.3	-41.9	178.1	-51.9	0	0	0	0	111.5	N542 R543 S549	N542-T545 PolarHBondContact O-N 3.01Å; R543-T545 VanDerWaalsContact C-N 3.34Å; R543-T545 PolarHBondContact O-N 2.95Å; T545-S549 PolarHBondContact O-N 2.92Å
546	F	89.7	Confident	89.6	Confident	75 Å²	75	54.6 Å²	54.6	33%	0.329	29%	0.291	S	S	.	.	H	α-helix	trans	-66.2	-53.7	176.7	173.4	-102	0	0	0	111.8	I533 W537 N542 R543 N548 S549 F550	I533-F546 HydrophobicContact CG2-CE1 3.95Å; W537-F546 AromaticContact CD2-CD1 3.93Å; W537-F546 HydrophobicContact CD2-CD1 3.93Å; W537-F546 HydrophobicContact CD2-CE1 4.35Å; W537-F546 HydrophobicContact CD2-CG 4.23Å; W537-F546 HydrophobicContact CE3-CB 4.16Å; W537-F546 HydrophobicContact CE3-CD1 4.3Å; W537-F546 HydrophobicContact CE3-CG 4.25Å; W537-F546 HydrophobicContact CG-CD1 4.19Å; W537-F546 HydrophobicContact CG-CE1 4.36Å; W537-F546 HydrophobicContact CH2-CB 4.34Å; W537-F546 HydrophobicContact CH2-CD2 4.24Å; W537-F546 HydrophobicContact CH2-CG 4.22Å; W537-F546 HydrophobicContact CZ2-CD1 4.49Å; W537-F546 HydrophobicContact CZ2-CD2 4.08Å; W537-F546 HydrophobicContact CZ2-CE2 4.28Å; W537-F546 HydrophobicContact CZ2-CG 4.19Å; W537-F546 HydrophobicContact CZ3-CB 4.01Å; W537-F546 HydrophobicContact CZ3-CG 4.25Å; W537-F546 AromaticContact NE1-CE1 3.96Å; N542-F546 PolarHBondContact O-N 2.78Å; R543-F546 PolarHBondContact O-N 3.31Å; F546-N548 VanDerWaalsContact C-N 3.31Å; F546-N548 PolarHBondContact O-N 3.46Å; F546-S549 PolarHBondContact O-N 2.93Å; F546-F550 PolarHBondContact O-N 3.24Å
547	L	88.8	Confident	89.9	Confident	16 Å²	16	53.1 Å²	53.1	8%	0.084	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-37.9	-178.9	-73.8	179.8	0	0	0	112.4	I533 R543 F550 K551	I533-L547 HydrophobicContact CD1-CD2 3.5Å; R543-L547 HydrophobicContact CG-CD1 3.6Å; R543-L547 HydrophobicContact CG-CG 4.11Å; R543-L547 WeakPolarHBondContact O-CB 3.39Å; R543-L547 PolarHBondContact O-N 3.39Å; L547-F550 PolarHBondContact O-N 2.92Å; L547-K551 VanDerWaalsContact O-CB 3.31Å; L547-K551 WeakPolarHBondContact O-CB 3.28Å; L547-K551 WeakPolarHBondContact O-CG 3.35Å; L547-K551 PolarHBondContact O-N 3.46Å
548	N	91.1	Very high	90.1	Very high	57 Å²	57	52.8 Å²	52.8	31%	0.305	29%	0.285	S	S	.	.	H	α-helix	trans	-61.5	-50	176.4	-176.3	-5.8	0	0	0	110.9	L544 F546 F550 M552 W757 L761	L544-N548 WeakPolarHBondContact O-CB 3.24Å; L544-N548 PolarHBondContact O-N 3.37Å; F546-N548 VanDerWaalsContact C-N 3.31Å; F546-N548 PolarHBondContact O-N 3.46Å; N548-F550 VanDerWaalsContact C-N 3.32Å; N548-F550 PolarHBondContact O-N 3.49Å; N548-M552 WeakPolarHBondContact O-CB 3.24Å; N548-M552 PolarHBondContact O-N 2.79Å; N548-W757 WeakPolarHBondContact OD1-CZ2 3.22Å; N548-W757 PolarHBondContact OD1-NE1 3.29Å; N548-L761 HydrophobicContact CB-CD1 4.3Å
549	S	90.5	Very high	90.4	Very high	50 Å²	50	51.5 Å²	51.5	35%	0.35	28%	0.278	S	S	.	.	H	α-helix	trans	-61.1	-40.7	178.3	-163.3	0	0	0	0	112.6	T545 F546 K553	T545-S549 PolarHBondContact O-N 2.92Å; F546-S549 PolarHBondContact O-N 2.93Å; S549-K553 WeakPolarHBondContact O-CD 3.16Å; S549-K553 VanDerWaalsContact O-CG 3.28Å; S549-K553 WeakPolarHBondContact O-CG 3.43Å; S549-K553 PolarHBondContact O-N 2.91Å
550	F	90.7	Very high	90.9	Very high	58 Å²	58	44.3 Å²	44.3	25%	0.254	24%	0.24	S	C	.	.	H	α-helix	trans	-67.4	-55.8	179	174.3	-105.6	0	0	0	112.1	Y468 I533 F546 L547 N548 M552 K553 M554 W609	Y468-F550 HydrophobicContact CE1-CE1 4.31Å; I533-F550 HydrophobicContact CD1-CD1 4.23Å; I533-F550 HydrophobicContact CD1-CE1 4.16Å; F546-F550 PolarHBondContact O-N 3.24Å; L547-F550 PolarHBondContact O-N 2.92Å; N548-F550 VanDerWaalsContact C-N 3.32Å; N548-F550 PolarHBondContact O-N 3.49Å; F550-M552 VanDerWaalsContact C-N 3.34Å; F550-M552 PolarHBondContact O-N 3.09Å; F550-K553 PolarHBondContact O-N 3.12Å; F550-M554 WeakPolarHBondContact O-CB 3.41Å; F550-M554 PolarHBondContact O-N 3.42Å; F550-W609 HydrophobicContact CD2-CZ2 4.45Å
551	K	91.8	Very high	91.1	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-63.7	-38.7	-176.5	-71.3	-170.9	177.7	-167.3	0	111.8	L547 M554 S555 W757 S760	L547-K551 VanDerWaalsContact O-CB 3.31Å; L547-K551 WeakPolarHBondContact O-CB 3.28Å; L547-K551 WeakPolarHBondContact O-CG 3.35Å; L547-K551 PolarHBondContact O-N 3.46Å; K551-M554 PolarHBondContact O-N 3.46Å; K551-S555 WeakPolarHBondContact O-CB 3.44Å; K551-S555 PolarHBondContact O-N 3.34Å; K551-S555 PolarHBondContact O-OG 2.93Å; K551-W757 HydrophobicContact CB-CB 4.37Å; K551-W757 VanDerWaalsContact CB-CD1 3.43Å; K551-W757 HydrophobicContact CB-CG 4.21Å; K551-S760 PolarHBondContact NZ-O 3.06Å; K551-S760 VanDerWaalsContact NZ-O 3.08Å; K551-S760 PolarHBondContact NZ-OG 3.39Å
552	M	91.8	Very high	91.4	Very high	73 Å²	73	42.3 Å²	42.3	36%	0.36	22%	0.22	S	C	.	.	H	α-helix	trans	-59.8	-50.3	175	-174.2	-174.6	70.6	0	0	111.2	N548 F550 M554 S555 V556 L754 W757	N548-M552 WeakPolarHBondContact O-CB 3.24Å; N548-M552 PolarHBondContact O-N 2.79Å; F550-M552 VanDerWaalsContact C-N 3.34Å; F550-M552 PolarHBondContact O-N 3.09Å; M552-M554 PolarHBondContact O-N 3.45Å; M552-S555 PolarHBondContact O-N 3.15Å; M552-S555 PolarHBondContact O-OG 3.46Å; M552-V556 WeakPolarHBondContact O-CG2 3.19Å; M552-V556 PolarHBondContact O-N 3.19Å; M552-L754 HydrophobicContact CG-CD2 3.83Å; M552-W757 HydrophobicContact CB-CD2 4.04Å; M552-W757 HydrophobicContact CB-CE3 4.38Å; M552-W757 HydrophobicContact CB-CG 4.16Å; M552-W757 HydrophobicContact CG-CD2 4.41Å; M552-W757 HydrophobicContact CG-CE3 4.24Å
553	K	93.1	Very high	91.6	Very high	32 Å²	32	38.7 Å²	38.7	14%	0.139	20%	0.201	C	C	.	.	H	α-helix	trans	-63.3	-41.8	178.9	-72.4	171.8	-176.6	174.5	0	112.4	S549 F550 S555 V556 I557 I605 W609	S549-K553 WeakPolarHBondContact O-CD 3.16Å; S549-K553 VanDerWaalsContact O-CG 3.28Å; S549-K553 WeakPolarHBondContact O-CG 3.43Å; S549-K553 PolarHBondContact O-N 2.91Å; F550-K553 PolarHBondContact O-N 3.12Å; K553-S555 PolarHBondContact O-N 2.91Å; K553-V556 PolarHBondContact O-N 2.96Å; K553-I557 WeakPolarHBondContact O-CG1 3.47Å; K553-I557 PolarHBondContact O-N 2.95Å; K553-I605 HydrophobicContact CB-CG2 4.17Å; K553-I605 HydrophobicContact CD-CG2 4.08Å; K553-I605 HydrophobicContact CG-CG2 4.29Å; K553-W609 HydrophobicContact CB-CH2 4.33Å; K553-W609 HydrophobicContact CB-CZ2 3.94Å; K553-W609 HydrophobicContact CD-CZ2 3.92Å
554	M	92.3	Very high	91.7	Very high	37 Å²	37	37.9 Å²	37.9	18%	0.182	20%	0.2	C	C	.	.	H	α-helix	trans	-61.8	-42.4	177.7	-179.9	-90.8	-146.7	0	0	111.7	V410 Y468 F550 K551 M552 V556 I557 L558	V410-M554 HydrophobicContact CB-CE 4.38Å; V410-M554 HydrophobicContact CG1-CE 3.73Å; V410-M554 HydrophobicContact CG1-SD 3.83Å; V410-M554 HydrophobicContact CG2-CE 3.79Å; Y468-M554 HydrophobicContact CE1-CE 4.42Å; F550-M554 WeakPolarHBondContact O-CB 3.41Å; F550-M554 PolarHBondContact O-N 3.42Å; K551-M554 PolarHBondContact O-N 3.46Å; M552-M554 PolarHBondContact O-N 3.45Å; M554-V556 VanDerWaalsContact C-N 3.35Å; M554-V556 PolarHBondContact O-N 2.93Å; M554-I557 PolarHBondContact O-N 3.33Å; M554-L558 HydrophobicContact CE-CD1 3.76Å; M554-L558 HydrophobicContact CG-CD1 4.42Å; M554-L558 WeakPolarHBondContact O-CG 3.39Å; M554-L558 PolarHBondContact O-N 3.14Å; M554-L558 HydrophobicContact SD-CD1 3.47Å; M554-L558 WeakPolarHBondContact SD-CD1 3.42Å; M554-L558 HydrophobicContact SD-CG 4.21Å
555	S	93.4	Very high	92	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-40.6	176.6	69.7	0	0	0	0	113.2	K551 M552 K553 G559	K551-S555 WeakPolarHBondContact O-CB 3.44Å; K551-S555 PolarHBondContact O-N 3.34Å; K551-S555 PolarHBondContact O-OG 2.93Å; M552-S555 PolarHBondContact O-N 3.15Å; M552-S555 PolarHBondContact O-OG 3.46Å; K553-S555 PolarHBondContact O-N 2.91Å; S555-G559 PolarHBondContact O-N 3.4Å
556	V	93.3	Very high	92	Very high	20 Å²	20	32.1 Å²	32.1	12%	0.121	16%	0.162	C	C	.	.	H	α-helix	trans	-66.7	-44.3	177.6	172.4	0	0	0	0	110.9	M552 K553 M554 G559 I560 L601 I605 L754	M552-V556 WeakPolarHBondContact O-CG2 3.19Å; M552-V556 PolarHBondContact O-N 3.19Å; K553-V556 PolarHBondContact O-N 2.96Å; M554-V556 VanDerWaalsContact C-N 3.35Å; M554-V556 PolarHBondContact O-N 2.93Å; V556-G559 PolarHBondContact O-N 2.91Å; V556-I560 HydrophobicContact CG1-CD1 3.59Å; V556-I560 WeakPolarHBondContact O-CD1 3.23Å; V556-I560 VanDerWaalsContact O-CG1 3.31Å; V556-I560 WeakPolarHBondContact O-CG1 3.39Å; V556-I560 PolarHBondContact O-N 3.4Å; V556-L601 HydrophobicContact CG1-CD2 3.92Å; V556-I605 HydrophobicContact CG1-CD1 4.44Å; V556-L754 HydrophobicContact CG2-CD2 3.95Å
557	I	94.3	Very high	92	Very high	15 Å²	15	28.6 Å²	28.6	8%	0.077	15%	0.147	C	C	.	.	H	α-helix	trans	-61.4	-50.1	177.8	-66.1	169	0	0	0	110.6	K553 M554 G559 I560 I561 I602 I605 F606 W609	K553-I557 WeakPolarHBondContact O-CG1 3.47Å; K553-I557 PolarHBondContact O-N 2.95Å; M554-I557 PolarHBondContact O-N 3.33Å; I557-G559 VanDerWaalsContact C-N 3.34Å; I557-G559 PolarHBondContact O-N 3.32Å; I557-I560 PolarHBondContact O-N 3.35Å; I557-I561 HydrophobicContact CG2-CD1 3.68Å; I557-I561 HydrophobicContact CG2-CG1 4.49Å; I557-I561 VanDerWaalsContact O-CG1 3.31Å; I557-I561 WeakPolarHBondContact O-CG1 3.4Å; I557-I561 PolarHBondContact O-N 3.5Å; I557-I602 HydrophobicContact CG1-CG1 4.48Å; I557-I605 HydrophobicContact CD1-CG2 3.89Å; I557-I605 HydrophobicContact CG1-CD1 4.21Å; I557-F606 HydrophobicContact CD1-CE2 4.03Å; I557-F606 HydrophobicContact CD1-CZ 4.03Å; I557-F606 HydrophobicContact CG2-CE2 4.23Å; I557-F606 HydrophobicContact CG2-CZ 4.35Å; I557-W609 HydrophobicContact CD1-CH2 3.8Å; I557-W609 HydrophobicContact CD1-CZ3 3.74Å
558	L	93.1	Very high	92.1	Very high	37 Å²	37	31 Å²	31	19%	0.194	16%	0.159	C	C	.	.	H	α-helix	trans	-60.7	-43.3	178.9	-73.6	-177.9	0	0	0	111.9	F406 V410 M554 H562	F406-L558 HydrophobicContact CE1-CD1 4Å; F406-L558 HydrophobicContact CE1-CD2 3.88Å; F406-L558 HydrophobicContact CZ-CD1 4.41Å; F406-L558 HydrophobicContact CZ-CD2 4.3Å; V410-L558 HydrophobicContact CG1-CD1 4.33Å; V410-L558 HydrophobicContact CG2-CD1 3.89Å; M554-L558 HydrophobicContact CE-CD1 3.76Å; M554-L558 HydrophobicContact CG-CD1 4.42Å; M554-L558 WeakPolarHBondContact O-CG 3.39Å; M554-L558 PolarHBondContact O-N 3.14Å; M554-L558 HydrophobicContact SD-CD1 3.47Å; M554-L558 WeakPolarHBondContact SD-CD1 3.42Å; M554-L558 HydrophobicContact SD-CG 4.21Å; L558-H562 VanDerWaalsContact O-CB 3.24Å; L558-H562 WeakPolarHBondContact O-CB 3.26Å; L558-H562 PolarHBondContact O-N 3.44Å
559	G	92.8	Very high	92	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-60.7	-48.1	179.1	0	0	0	0	0	113.1	S555 V556 I557 H562 M563 Y753	S555-G559 PolarHBondContact O-N 3.4Å; V556-G559 PolarHBondContact O-N 2.91Å; I557-G559 VanDerWaalsContact C-N 3.34Å; I557-G559 PolarHBondContact O-N 3.32Å; G559-H562 PolarHBondContact O-N 3.06Å; G559-M563 WeakPolarHBondContact O-CE 3.47Å; G559-M563 WeakPolarHBondContact O-CG 3.4Å; G559-M563 PolarHBondContact O-N 3.42Å; G559-Y753 VanDerWaalsContact CA-CD1 3.47Å
560	I	93.1	Very high	91.8	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-68.8	-39.9	-178.3	-62.2	159.7	0	0	0	111.1	V556 I557 H562 M563 T564 F598 L601 I602 T750	V556-I560 HydrophobicContact CG1-CD1 3.59Å; V556-I560 WeakPolarHBondContact O-CD1 3.23Å; V556-I560 VanDerWaalsContact O-CG1 3.31Å; V556-I560 WeakPolarHBondContact O-CG1 3.39Å; V556-I560 PolarHBondContact O-N 3.4Å; I557-I560 PolarHBondContact O-N 3.35Å; I560-H562 VanDerWaalsContact C-N 3.32Å; I560-H562 PolarHBondContact O-N 3.38Å; I560-M563 HydrophobicContact CG1-CE 4.25Å; I560-M563 PolarHBondContact O-N 3.47Å; I560-T564 HydrophobicContact CG2-CG2 4.19Å; I560-T564 WeakPolarHBondContact O-CB 3.37Å; I560-T564 VanDerWaalsContact O-CG2 3.24Å; I560-T564 WeakPolarHBondContact O-CG2 3.35Å; I560-T564 PolarHBondContact O-N 3Å; I560-T564 PolarHBondContact O-OG1 3.39Å; I560-F598 HydrophobicContact CD1-CB 3.77Å; I560-F598 HydrophobicContact CD1-CD1 4.28Å; I560-F598 HydrophobicContact CD1-CG 4.43Å; I560-F598 HydrophobicContact CG1-CB 3.93Å; I560-F598 HydrophobicContact CG1-CG 4.49Å; I560-F598 HydrophobicContact CG2-CB 3.84Å; I560-L601 HydrophobicContact CD1-CD2 4.48Å; I560-I602 HydrophobicContact CB-CD1 3.64Å; I560-I602 HydrophobicContact CB-CG1 4.29Å; I560-I602 HydrophobicContact CD1-CD1 4.19Å; I560-I602 HydrophobicContact CD1-CG1 3.91Å; I560-I602 HydrophobicContact CG2-CD1 3.39Å; I560-I602 HydrophobicContact CG2-CG1 4.28Å; I560-T750 HydrophobicContact CD1-CG2 4.18Å; I560-T750 HydrophobicContact CG1-CG2 3.91Å
561	I	93.1	Very high	91.6	Very high	91 Å²	91	25.6 Å²	25.6	47%	0.467	13%	0.13	S	C	.	.	H	α-helix	trans	-61.8	-42.9	174.3	-67.5	171.8	0	0	0	110.5	I557 T564 F565 I602	I557-I561 HydrophobicContact CG2-CD1 3.68Å; I557-I561 HydrophobicContact CG2-CG1 4.49Å; I557-I561 VanDerWaalsContact O-CG1 3.31Å; I557-I561 WeakPolarHBondContact O-CG1 3.4Å; I557-I561 PolarHBondContact O-N 3.5Å; I561-T564 WeakPolarHBondContact CA-OG1 3.48Å; I561-T564 PolarHBondContact O-OG1 3.42Å; I561-F565 WeakPolarHBondContact O-CB 3.32Å; I561-F565 PolarHBondContact O-N 2.93Å; I561-I602 HydrophobicContact CG1-CD1 4.33Å
562	H	93.3	Very high	91.4	Very high	14 Å²	14	30 Å²	30	7%	0.065	15%	0.149	C	C	.	.	H	α-helix	trans	-66.1	-42.9	179.2	-173.5	-137.1	0	0	0	112.7	L558 G559 I560 F565 G566 Y753 H821 F825	L558-H562 VanDerWaalsContact O-CB 3.24Å; L558-H562 WeakPolarHBondContact O-CB 3.26Å; L558-H562 PolarHBondContact O-N 3.44Å; G559-H562 PolarHBondContact O-N 3.06Å; I560-H562 VanDerWaalsContact C-N 3.32Å; I560-H562 PolarHBondContact O-N 3.38Å; H562-F565 WeakPolarHBondContact O-CB 3.11Å; H562-F565 PolarHBondContact O-N 2.99Å; H562-G566 PolarHBondContact O-N 3.38Å; H562-G566 VanDerWaalsContact O-N 3.12Å; H562-Y753 AromaticContact ND1-CE1 3.96Å; H562-Y753 AromaticContact ND1-CZ 3.77Å; H562-Y753 PolarHBondContact ND1-OH 3.11Å; H562-H821 AromaticContact CE1-CD2 3.94Å; H562-H821 AromaticContact CE1-NE2 3.87Å; H562-H821 AromaticContact NE2-CD2 3.99Å; H562-H821 AromaticContact NE2-NE2 3.85Å; H562-F825 AromaticContact CD2-CD2 3.71Å; H562-F825 AromaticContact CD2-CE2 3.99Å; H562-F825 AromaticContact CE1-CD2 3.84Å; H562-F825 AromaticContact CE1-CG 3.79Å; H562-F825 AromaticContact NE2-CD2 3.4Å; H562-F825 WeakPolarHBondContact NE2-CD2 3.46Å; H562-F825 AromaticContact NE2-CE2 3.88Å; H562-F825 AromaticContact NE2-CG 3.6Å
563	M	91.5	Very high	91.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-68.4	-42.5	176.7	-72.6	-176.9	-68.3	0	0	112.9	G559 I560 F565 G566 V567 M594 N749 T750 Y753	G559-M563 WeakPolarHBondContact O-CE 3.47Å; G559-M563 WeakPolarHBondContact O-CG 3.4Å; G559-M563 PolarHBondContact O-N 3.42Å; I560-M563 HydrophobicContact CG1-CE 4.25Å; I560-M563 PolarHBondContact O-N 3.47Å; M563-F565 VanDerWaalsContact C-N 3.26Å; M563-F565 PolarHBondContact O-N 3.26Å; M563-G566 PolarHBondContact O-N 3.26Å; M563-G566 VanDerWaalsContact O-N 3.09Å; M563-V567 PolarHBondContact O-N 3.36Å; M563-M594 HydrophobicContact CB-CE 4.09Å; M563-M594 HydrophobicContact CE-CE 4.08Å; M563-M594 HydrophobicContact SD-CE 4.29Å; M563-N749 HydrophobicContact SD-CB 3.67Å; M563-T750 HydrophobicContact CE-CG2 4.41Å; M563-T750 WeakPolarHBondContact CE-OG1 3.42Å; M563-Y753 HydrophobicContact CE-CD2 4Å; M563-Y753 HydrophobicContact CE-CE2 3.92Å; M563-Y753 HydrophobicContact CG-CE2 3.63Å; M563-Y753 HydrophobicContact SD-CD2 4.27Å; M563-Y753 HydrophobicContact SD-CE2 3.72Å
564	T	91.6	Very high	90.8	Very high	21 Å²	21	27.9 Å²	27.9	13%	0.129	14%	0.139	C	C	.	.	H	α-helix	trans	-62.6	-37.6	176.9	50.6	0	0	0	0	111	I560 I561 G566 V567 I568 L595	I560-T564 HydrophobicContact CG2-CG2 4.19Å; I560-T564 WeakPolarHBondContact O-CB 3.37Å; I560-T564 VanDerWaalsContact O-CG2 3.24Å; I560-T564 WeakPolarHBondContact O-CG2 3.35Å; I560-T564 PolarHBondContact O-N 3Å; I560-T564 PolarHBondContact O-OG1 3.39Å; I561-T564 WeakPolarHBondContact CA-OG1 3.48Å; I561-T564 PolarHBondContact O-OG1 3.42Å; T564-G566 PolarHBondContact O-N 3.38Å; T564-V567 PolarHBondContact O-N 2.87Å; T564-I568 VanDerWaalsContact O-CG1 3.31Å; T564-I568 WeakPolarHBondContact O-CG1 3.3Å; T564-I568 PolarHBondContact O-N 3.32Å; T564-I568 VanDerWaalsContact O-N 3.09Å; T564-L595 HydrophobicContact CG2-CD2 4.01Å
565	F	91.9	Very high	90.5	Very high	70 Å²	70	31.2 Å²	31.2	31%	0.307	16%	0.157	S	C	.	.	H	α-helix	trans	-59.5	-43.3	170.7	-180	-118	0	0	0	112.5	F399 I561 H562 M563 V567 I568 L569 F825	F399-F565 HydrophobicContact CB-CE1 4.17Å; F399-F565 AromaticContact CD1-CE1 3.72Å; F399-F565 HydrophobicContact CD1-CE1 3.72Å; F399-F565 AromaticContact CD1-CZ 3.53Å; F399-F565 HydrophobicContact CD1-CZ 3.53Å; F399-F565 HydrophobicContact CD2-CE1 4.3Å; F399-F565 HydrophobicContact CD2-CZ 4.43Å; F399-F565 HydrophobicContact CE1-CE1 4.19Å; F399-F565 AromaticContact CE1-CZ 3.54Å; F399-F565 HydrophobicContact CE1-CZ 3.54Å; F399-F565 HydrophobicContact CE2-CZ 4.43Å; F399-F565 AromaticContact CG-CE1 3.78Å; F399-F565 HydrophobicContact CG-CE1 3.78Å; F399-F565 HydrophobicContact CG-CZ 4Å; F399-F565 AromaticContact CZ-CZ 3.99Å; F399-F565 HydrophobicContact CZ-CZ 3.99Å; I561-F565 WeakPolarHBondContact O-CB 3.32Å; I561-F565 PolarHBondContact O-N 2.93Å; H562-F565 WeakPolarHBondContact O-CB 3.11Å; H562-F565 PolarHBondContact O-N 2.99Å; M563-F565 VanDerWaalsContact C-N 3.26Å; M563-F565 PolarHBondContact O-N 3.26Å; F565-V567 PolarHBondContact O-N 2.76Å; F565-I568 WeakPolarHBondContact O-CB 3.49Å; F565-I568 PolarHBondContact O-N 3.1Å; F565-L569 HydrophobicContact CD1-CD1 4.43Å; F565-L569 HydrophobicContact CE1-CD1 3.91Å; F565-L569 HydrophobicContact CE1-CG 4.44Å; F565-L569 HydrophobicContact CE2-CD2 4.27Å; F565-L569 HydrophobicContact CE2-CG 4.45Å; F565-L569 HydrophobicContact CZ-CD1 4.07Å; F565-L569 HydrophobicContact CZ-CD2 4.07Å; F565-L569 HydrophobicContact CZ-CG 4.22Å; F565-L569 PolarHBondContact O-N 3.02Å; F565-L569 VanDerWaalsContact O-N 3.12Å; F565-F825 AromaticContact CD1-CE2 3.65Å; F565-F825 HydrophobicContact CD1-CE2 3.65Å; F565-F825 AromaticContact CD1-CZ 3.95Å; F565-F825 HydrophobicContact CD1-CZ 3.95Å; F565-F825 HydrophobicContact CE1-CE2 4.18Å; F565-F825 AromaticContact CE1-CZ 3.98Å; F565-F825 HydrophobicContact CE1-CZ 3.98Å
566	G	90.1	Very high	90.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59	-44.5	174.8	0	0	0	0	0	113.5	H562 M563 T564 I568 L569 G570 F829	H562-G566 PolarHBondContact O-N 3.38Å; H562-G566 VanDerWaalsContact O-N 3.12Å; M563-G566 PolarHBondContact O-N 3.26Å; M563-G566 VanDerWaalsContact O-N 3.09Å; T564-G566 PolarHBondContact O-N 3.38Å; G566-I568 VanDerWaalsContact C-N 3.3Å; G566-I568 PolarHBondContact O-N 3.13Å; G566-L569 WeakPolarHBondContact O-CB 3.45Å; G566-L569 PolarHBondContact O-N 2.94Å; G566-L569 VanDerWaalsContact O-N 3.16Å; G566-G570 PolarHBondContact O-N 3.44Å; G566-F829 WeakPolarHBondContact O-CD1 3.49Å
567	V	90.4	Very high	89.7	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-38	176.5	177.4	0	0	0	0	111.4	M563 T564 F565 L569 G570 I571 L591 K828	M563-V567 PolarHBondContact O-N 3.36Å; T564-V567 PolarHBondContact O-N 2.87Å; F565-V567 PolarHBondContact O-N 2.76Å; V567-L569 VanDerWaalsContact C-N 3.32Å; V567-L569 PolarHBondContact O-N 3.36Å; V567-G570 PolarHBondContact O-N 3.26Å; V567-G570 VanDerWaalsContact O-N 3.13Å; V567-I571 PolarHBondContact O-N 2.98Å; V567-L591 HydrophobicContact CG1-CB 4.21Å; V567-L591 HydrophobicContact CG1-CD1 4.3Å; V567-K828 HydrophobicContact CG2-CB 4.14Å; V567-K828 HydrophobicContact CG2-CD 4.26Å; V567-K828 HydrophobicContact CG2-CG 4.17Å
568	I	90.4	Very high	89.1	Confident	65 Å²	65	46.2 Å²	46.2	33%	0.333	22%	0.215	S	C	.	.	H	α-helix	trans	-62.7	-38.6	175.7	-68	164.6	0	0	0	111.3	T564 F565 G566 G570 I571 F572 L591	T564-I568 VanDerWaalsContact O-CG1 3.31Å; T564-I568 WeakPolarHBondContact O-CG1 3.3Å; T564-I568 PolarHBondContact O-N 3.32Å; T564-I568 VanDerWaalsContact O-N 3.09Å; F565-I568 WeakPolarHBondContact O-CB 3.49Å; F565-I568 PolarHBondContact O-N 3.1Å; G566-I568 VanDerWaalsContact C-N 3.3Å; G566-I568 PolarHBondContact O-N 3.13Å; I568-G570 VanDerWaalsContact C-N 3.29Å; I568-G570 PolarHBondContact O-N 2.93Å; I568-I571 WeakPolarHBondContact O-CB 3.43Å; I568-I571 PolarHBondContact O-N 3.47Å; I568-I571 VanDerWaalsContact O-N 3.14Å; I568-F572 HydrophobicContact CG2-CD2 4.11Å; I568-F572 HydrophobicContact CG2-CE2 3.7Å; I568-F572 VanDerWaalsContact O-CD2 3.26Å; I568-F572 WeakPolarHBondContact O-CD2 3.43Å; I568-F572 PolarHBondContact O-N 3Å; I568-L591 HydrophobicContact CG1-CD1 4.48Å
569	L	89.3	Confident	88.4	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-63.2	-35.3	174.1	-63.8	177.5	0	0	0	112.4	V394 F399 F565 G566 V567 I571 F572 N573 F825 F829	V394-L569 HydrophobicContact CG1-CD2 4.49Å; F399-L569 HydrophobicContact CD2-CD1 3.55Å; F399-L569 HydrophobicContact CD2-CD2 4.48Å; F399-L569 HydrophobicContact CE2-CD1 3.43Å; F399-L569 VanDerWaalsContact CE2-CD1 3.43Å; F399-L569 HydrophobicContact CE2-CD2 3.57Å; F399-L569 HydrophobicContact CE2-CG 4.16Å; F399-L569 HydrophobicContact CG-CD1 4.39Å; F399-L569 HydrophobicContact CZ-CD1 4.2Å; F399-L569 HydrophobicContact CZ-CD2 3.62Å; F565-L569 HydrophobicContact CD1-CD1 4.43Å; F565-L569 HydrophobicContact CE1-CD1 3.91Å; F565-L569 HydrophobicContact CE1-CG 4.44Å; F565-L569 HydrophobicContact CE2-CD2 4.27Å; F565-L569 HydrophobicContact CE2-CG 4.45Å; F565-L569 HydrophobicContact CZ-CD1 4.07Å; F565-L569 HydrophobicContact CZ-CD2 4.07Å; F565-L569 HydrophobicContact CZ-CG 4.22Å; F565-L569 PolarHBondContact O-N 3.02Å; F565-L569 VanDerWaalsContact O-N 3.12Å; G566-L569 WeakPolarHBondContact O-CB 3.45Å; G566-L569 PolarHBondContact O-N 2.94Å; G566-L569 VanDerWaalsContact O-N 3.16Å; V567-L569 VanDerWaalsContact C-N 3.32Å; V567-L569 PolarHBondContact O-N 3.36Å; L569-I571 VanDerWaalsContact C-N 3.3Å; L569-I571 PolarHBondContact O-N 3.37Å; L569-F572 HydrophobicContact CD2-CD2 4.47Å; L569-F572 WeakPolarHBondContact O-CB 3.46Å; L569-F572 PolarHBondContact O-N 3.26Å; L569-F572 VanDerWaalsContact O-N 3.14Å; L569-N573 PolarHBondContact O-N 2.94Å; L569-N573 VanDerWaalsContact O-N 3.07Å; L569-F825 HydrophobicContact CD1-CE2 4.3Å; L569-F825 HydrophobicContact CD1-CZ 3.66Å; L569-F829 HydrophobicContact CB-CB 4.32Å; L569-F829 HydrophobicContact CB-CD1 4.13Å; L569-F829 HydrophobicContact CB-CD2 4.12Å; L569-F829 HydrophobicContact CB-CE1 4.5Å; L569-F829 HydrophobicContact CB-CE2 4.48Å; L569-F829 HydrophobicContact CB-CG 3.93Å; L569-F829 HydrophobicContact CD1-CD1 4.39Å; L569-F829 HydrophobicContact CD1-CE1 3.96Å; L569-F829 HydrophobicContact CD1-CE2 4.25Å; L569-F829 HydrophobicContact CD1-CZ 3.87Å
570	G	85.5	Confident	87.8	Confident	5 Å²	5	57 Å²	57	5%	0.052	26%	0.26	C	S	.	.	H	α-helix	trans	-58.4	-40.4	171.6	0	0	0	0	0	112.7	G566 V567 I568 F572 N573 H574	G566-G570 PolarHBondContact O-N 3.44Å; V567-G570 PolarHBondContact O-N 3.26Å; V567-G570 VanDerWaalsContact O-N 3.13Å; I568-G570 VanDerWaalsContact C-N 3.29Å; I568-G570 PolarHBondContact O-N 2.93Å; G570-F572 VanDerWaalsContact C-N 3.33Å; G570-F572 PolarHBondContact O-N 3.36Å; G570-N573 WeakPolarHBondContact O-CB 3.3Å; G570-N573 PolarHBondContact O-N 3.23Å; G570-H574 PolarHBondContact O-CD2 2.92Å; G570-H574 PolarHBondContact O-N 2.84Å; G570-H574 VanDerWaalsContact O-N 3.1Å
571	I	87.6	Confident	87.2	Confident	43 Å²	43	59.5 Å²	59.5	22%	0.221	27%	0.271	C	S	.	.	H	α-helix	trans	-61.2	-43	175	-61.7	170	0	0	0	110.7	V567 I568 L569 N573 H574 L575 L591	V567-I571 PolarHBondContact O-N 2.98Å; I568-I571 WeakPolarHBondContact O-CB 3.43Å; I568-I571 PolarHBondContact O-N 3.47Å; I568-I571 VanDerWaalsContact O-N 3.14Å; L569-I571 VanDerWaalsContact C-N 3.3Å; L569-I571 PolarHBondContact O-N 3.37Å; I571-N573 VanDerWaalsContact C-N 3.3Å; I571-N573 PolarHBondContact O-N 3.32Å; I571-H574 PolarHBondContact O-N 3.04Å; I571-L575 WeakPolarHBondContact O-CB 3.19Å; I571-L575 PolarHBondContact O-N 3.1Å; I571-L591 HydrophobicContact CD1-CD2 4.11Å
572	F	87.4	Confident	86.6	Confident	99 Å²	99	56 Å²	56	43%	0.434	25%	0.253	S	S	.	.	H	α-helix	trans	-63.7	-33.4	176.9	-75.6	-69.6	0	0	0	113.1	R6 I568 L569 G570 H576	R6-F572 PolarHBondContact NH2-O 3.06Å; I568-F572 HydrophobicContact CG2-CD2 4.11Å; I568-F572 HydrophobicContact CG2-CE2 3.7Å; I568-F572 VanDerWaalsContact O-CD2 3.26Å; I568-F572 WeakPolarHBondContact O-CD2 3.43Å; I568-F572 PolarHBondContact O-N 3Å; L569-F572 HydrophobicContact CD2-CD2 4.47Å; L569-F572 WeakPolarHBondContact O-CB 3.46Å; L569-F572 PolarHBondContact O-N 3.26Å; L569-F572 VanDerWaalsContact O-N 3.14Å; G570-F572 VanDerWaalsContact C-N 3.33Å; G570-F572 PolarHBondContact O-N 3.36Å; F572-H576 PolarHBondContact O-N 3.23Å; F572-H576 VanDerWaalsContact O-N 3.16Å
573	N	87	Confident	86.2	Confident	8 Å²	8	56.5 Å²	56.5	4%	0.043	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-52.8	172.9	-83.2	-17.5	0	0	0	110.9	V394 L569 G570 I571 L575 H576 F577 F829	V394-N573 VanDerWaalsContact CB-OD1 3.32Å; V394-N573 WeakPolarHBondContact CB-OD1 3.45Å; V394-N573 WeakPolarHBondContact CG2-OD1 3.4Å; V394-N573 PolarHBondContact N-OD1 3.45Å; L569-N573 PolarHBondContact O-N 2.94Å; L569-N573 VanDerWaalsContact O-N 3.07Å; G570-N573 WeakPolarHBondContact O-CB 3.3Å; G570-N573 PolarHBondContact O-N 3.23Å; I571-N573 VanDerWaalsContact C-N 3.3Å; I571-N573 PolarHBondContact O-N 3.32Å; N573-L575 VanDerWaalsContact C-N 3.29Å; N573-L575 PolarHBondContact O-N 3.35Å; N573-H576 PolarHBondContact O-N 3.15Å; N573-H576 VanDerWaalsContact O-N 3.12Å; N573-F577 WeakPolarHBondContact O-CD2 3.31Å; N573-F577 PolarHBondContact O-N 2.84Å; N573-F829 PolarHBondContact ND2-O 2.86Å
574	H	84.8	Confident	85.8	Confident	52 Å²	52	64.3 Å²	64.3	24%	0.241	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-33.9	-179.6	-64.6	-49.7	0	0	0	113.5	G570 I571 R578 K579 I583 S587	G570-H574 PolarHBondContact O-CD2 2.92Å; G570-H574 PolarHBondContact O-N 2.84Å; G570-H574 VanDerWaalsContact O-N 3.1Å; I571-H574 PolarHBondContact O-N 3.04Å; H574-R578 PolarHBondContact O-N 3.45Å; H574-K579 PolarHBondContact O-N 2.98Å; H574-I583 HydrophobicContact CB-CD1 4.35Å; H574-I583 HydrophobicContact CB-CG1 3.64Å; H574-S587 PolarHBondContact CD2-OG 3.37Å
575	L	86.7	Confident	85.5	Confident	108 Å²	108	65.1 Å²	65.1	57%	0.565	29%	0.29	S	S	*	.	H	α-helix	trans	-62.8	-43.3	173.8	-176.1	63.2	0	0	0	111.5	I571 N573 R578 I583	I571-L575 WeakPolarHBondContact O-CB 3.19Å; I571-L575 PolarHBondContact O-N 3.1Å; N573-L575 VanDerWaalsContact C-N 3.29Å; N573-L575 PolarHBondContact O-N 3.35Å; L575-R578 PolarHBondContact O-N 2.93Å; L575-I583 HydrophobicContact CB-CD1 4.4Å; L575-I583 HydrophobicContact CD1-CD1 4.39Å
576	H	84.7	Confident	85	Confident	50 Å²	50	62.3 Å²	62.3	23%	0.231	28%	0.279	C	S	.	.	H	α-helix	trans	-67.8	-43.9	179.6	-178.6	-117.9	0	0	0	113.2	R6 R392 F572 N573 R578	R6-H576 VanDerWaalsContact CZ-CG 3.5Å; R6-H576 PolarHBondContact NH1-CD2 3.34Å; R6-H576 PolarHBondContact NH1-NE2 3.11Å; R392-H576 VanDerWaalsContact CZ-CE1 3.47Å; R392-H576 PolarHBondContact O-ND1 3.19Å; F572-H576 PolarHBondContact O-N 3.23Å; F572-H576 VanDerWaalsContact O-N 3.16Å; N573-H576 PolarHBondContact O-N 3.15Å; N573-H576 VanDerWaalsContact O-N 3.12Å; H576-R578 PolarHBondContact O-N 3.49Å; H576-R578 VanDerWaalsContact O-N 3.14Å
577	F	84.7	Confident	84.8	Confident	84 Å²	84	62.5 Å²	62.5	37%	0.368	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	2.4	175.4	-68.9	-68.6	0	0	0	113.3	Y391 N573 K579	Y391-F577 WeakPolarHBondContact O-CZ 3.4Å; N573-F577 WeakPolarHBondContact O-CD2 3.31Å; N573-F577 PolarHBondContact O-N 2.84Å; F577-K579 HydrophobicContact CB-CG 4.35Å; F577-K579 PolarHBondContact O-N 3.19Å; F577-K579 VanDerWaalsContact O-N 3.12Å
578	R	81.8	Confident	84.7	Confident	216 Å²	216	65.6 Å²	65.6	82%	0.815	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	26.4	179.6	-61.7	-176	175.3	175.7	-0.9	114	H574 L575 H576 K580	H574-R578 PolarHBondContact O-N 3.45Å; L575-R578 PolarHBondContact O-N 2.93Å; H576-R578 PolarHBondContact O-N 3.49Å; H576-R578 VanDerWaalsContact O-N 3.14Å; R578-K580 VanDerWaalsContact C-N 3.34Å; R578-K580 PolarHBondContact O-N 2.89Å
579	K	79.4	Confident	84.6	Confident	106 Å²	106	63 Å²	63	46%	0.461	28%	0.283	S	S	.	.			trans	-85.3	73.4	177	-66.7	-174.1	-178.3	178.4	0	110.4	H574 F577 F581 N582	H574-K579 PolarHBondContact O-N 2.98Å; F577-K579 HydrophobicContact CB-CG 4.35Å; F577-K579 PolarHBondContact O-N 3.19Å; F577-K579 VanDerWaalsContact O-N 3.12Å; K579-F581 VanDerWaalsContact C-N 3.27Å; K579-F581 HydrophobicContact CB-CE1 4.27Å; K579-F581 PolarHBondContact O-N 2.87Å; K579-N582 HydrophobicContact CB-CB 4.37Å; K579-N582 PolarHBondContact O-N 3.01Å
580	K	78.4	Confident	84.6	Confident	158 Å²	158	63.4 Å²	63.4	69%	0.687	28%	0.284	S	S	*	.	H	α-helix	trans	-55.6	-36.8	-174.2	-66.6	-173.9	178.9	-177.2	0	113.7	R578 I583 Y584	R578-K580 VanDerWaalsContact C-N 3.34Å; R578-K580 PolarHBondContact O-N 2.89Å; K580-I583 PolarHBondContact O-N 3.28Å; K580-Y584 VanDerWaalsContact O-CD2 3.22Å; K580-Y584 WeakPolarHBondContact O-CD2 3.24Å
581	F	80.6	Confident	84.9	Confident	54 Å²	54	65 Å²	65	24%	0.237	29%	0.292	C	S	.	.	H	α-helix	trans	-66.7	-37.7	-178.6	72.1	-86.2	0	0	0	113	K579 I583 Y584 L585 K667 F670	K579-F581 VanDerWaalsContact C-N 3.27Å; K579-F581 HydrophobicContact CB-CE1 4.27Å; K579-F581 PolarHBondContact O-N 2.87Å; F581-I583 VanDerWaalsContact C-N 3.28Å; F581-I583 PolarHBondContact O-N 3.47Å; F581-Y584 PolarHBondContact O-N 3.44Å; F581-L585 HydrophobicContact CB-CD1 4.37Å; F581-L585 WeakPolarHBondContact O-CB 3.35Å; F581-L585 WeakPolarHBondContact O-CG 3.46Å; F581-L585 PolarHBondContact O-N 2.81Å; F581-K667 HydrophobicContact CE2-CG 4.11Å; F581-F670 HydrophobicContact CB-CD1 3.72Å; F581-F670 HydrophobicContact CB-CE1 3.43Å; F581-F670 VanDerWaalsContact CB-CE1 3.43Å; F581-F670 HydrophobicContact CB-CG 4.46Å; F581-F670 HydrophobicContact CB-CZ 3.97Å; F581-F670 HydrophobicContact CD1-CE1 4.26Å; F581-F670 AromaticContact CD2-CD1 3.98Å; F581-F670 HydrophobicContact CD2-CD1 3.98Å; F581-F670 HydrophobicContact CD2-CE1 4.31Å; F581-F670 AromaticContact CG-CD1 3.91Å; F581-F670 HydrophobicContact CG-CD1 3.91Å; F581-F670 AromaticContact CG-CE1 3.77Å; F581-F670 HydrophobicContact CG-CE1 3.77Å
582	N	81.6	Confident	85	Confident	16 Å²	16	66.6 Å²	66.6	9%	0.086	30%	0.3	C	S	.	.	H	α-helix	trans	-64.8	-33.7	177.2	-78.3	-15.8	0	0	0	111.9	K579 V586 S587	K579-N582 HydrophobicContact CB-CB 4.37Å; K579-N582 PolarHBondContact O-N 3.01Å; N582-V586 WeakPolarHBondContact O-CA 3.38Å; N582-V586 VanDerWaalsContact O-CB 3.29Å; N582-V586 WeakPolarHBondContact O-CB 3.34Å; N582-V586 PolarHBondContact O-N 2.87Å; N582-S587 PolarHBondContact O-N 2.92Å; N582-S587 VanDerWaalsContact O-N 3.16Å
583	I	83.9	Confident	85.2	Confident	25 Å²	25	62.7 Å²	62.7	13%	0.128	28%	0.283	C	S	.	.	I	π-helix	trans	-61.3	-49.9	178.6	-60.8	172.8	0	0	0	110.1	H574 L575 K580 F581 S587 I588	H574-I583 HydrophobicContact CB-CD1 4.35Å; H574-I583 HydrophobicContact CB-CG1 3.64Å; L575-I583 HydrophobicContact CB-CD1 4.4Å; L575-I583 HydrophobicContact CD1-CD1 4.39Å; K580-I583 PolarHBondContact O-N 3.28Å; F581-I583 VanDerWaalsContact C-N 3.28Å; F581-I583 PolarHBondContact O-N 3.47Å; I583-S587 PolarHBondContact O-N 3.08Å; I583-I588 WeakPolarHBondContact O-CG1 3.41Å; I583-I588 PolarHBondContact O-N 3.14Å; I583-I588 VanDerWaalsContact O-N 3.09Å
584	Y	84.9	Confident	85.3	Confident	164 Å²	164	62.3 Å²	62.3	64%	0.643	28%	0.281	S	S	*	.	I	π-helix	trans	-75.8	-37.6	-176.7	-67	-72.4	0	0	0	113.5	K580 F581 I588 P589	K580-Y584 VanDerWaalsContact O-CD2 3.22Å; K580-Y584 WeakPolarHBondContact O-CD2 3.24Å; F581-Y584 PolarHBondContact O-N 3.44Å; Y584-I588 HydrophobicContact CD1-CD1 3.73Å; Y584-I588 HydrophobicContact CE1-CD1 4.25Å; Y584-P589 WeakPolarHBondContact O-CD 3.41Å
585	L	83.9	Confident	85.6	Confident	38 Å²	38	63.7 Å²	63.7	20%	0.199	29%	0.29	C	S	.	.	I	π-helix	trans	-94.9	-18.6	-170.5	-62.7	170	0	0	0	114	F581 F670	F581-L585 HydrophobicContact CB-CD1 4.37Å; F581-L585 WeakPolarHBondContact O-CB 3.35Å; F581-L585 WeakPolarHBondContact O-CG 3.46Å; F581-L585 PolarHBondContact O-N 2.81Å; L585-F670 HydrophobicContact CD1-CB 3.64Å; L585-F670 HydrophobicContact CD1-CD1 4.46Å; L585-F670 HydrophobicContact CD1-CD2 4.29Å; L585-F670 HydrophobicContact CD1-CG 3.87Å
586	V	82.1	Confident	85.8	Confident	12 Å²	12	59.5 Å²	59.5	7%	0.073	27%	0.269	C	S	.	.	I	π-helix	trans	-118.7	-60.3	-178.4	-177	0	0	0	0	110.3	N582 P589 E590 L663	N582-V586 WeakPolarHBondContact O-CA 3.38Å; N582-V586 VanDerWaalsContact O-CB 3.29Å; N582-V586 WeakPolarHBondContact O-CB 3.34Å; N582-V586 PolarHBondContact O-N 2.87Å; V586-P589 WeakPolarHBondContact O-CD 3.14Å; V586-E590 WeakPolarHBondContact CG1-OE1 3.37Å; V586-E590 WeakPolarHBondContact O-CB 3.24Å; V586-E590 VanDerWaalsContact O-CG 3.27Å; V586-E590 WeakPolarHBondContact O-CG 3.42Å; V586-E590 PolarHBondContact O-N 3.09Å; V586-E590 VanDerWaalsContact O-N 3.15Å; V586-L663 HydrophobicContact CB-CD1 4.49Å; V586-L663 HydrophobicContact CG1-CD1 4.09Å
587	S	84.8	Confident	86	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.021	26%	0.26	C	S	.	.	I	π-helix	trans	-72.3	-37	-169.2	-44.4	0	0	0	0	115	H574 N582 I583 L591	H574-S587 PolarHBondContact CD2-OG 3.37Å; N582-S587 PolarHBondContact O-N 2.92Å; N582-S587 VanDerWaalsContact O-N 3.16Å; I583-S587 PolarHBondContact O-N 3.08Å; S587-L591 WeakPolarHBondContact O-CB 3.17Å; S587-L591 PolarHBondContact O-N 3.27Å
588	I	88.4	Confident	86.3	Confident	68 Å²	68	54 Å²	54	35%	0.349	25%	0.245	S	C	.	.	H	α-helix	trans	-66.9	-49.5	176.9	-69.7	175.9	0	0	0	111.4	I583 Y584 E590 L591 L592	I583-I588 WeakPolarHBondContact O-CG1 3.41Å; I583-I588 PolarHBondContact O-N 3.14Å; I583-I588 VanDerWaalsContact O-N 3.09Å; Y584-I588 HydrophobicContact CD1-CD1 3.73Å; Y584-I588 HydrophobicContact CE1-CD1 4.25Å; I588-E590 VanDerWaalsContact C-N 3.31Å; I588-E590 PolarHBondContact O-N 3.37Å; I588-L591 PolarHBondContact O-N 3.43Å; I588-L592 HydrophobicContact CG2-CD1 3.8Å; I588-L592 HydrophobicContact CG2-CG 4.26Å; I588-L592 WeakPolarHBondContact O-CB 3.48Å; I588-L592 WeakPolarHBondContact O-CG 3.24Å; I588-L592 PolarHBondContact O-N 2.89Å
589	P	89.7	Confident	86.7	Confident	9 Å²	9	44.7 Å²	44.7	6%	0.058	22%	0.216	C	C	.	.	H	α-helix	trans	-55.6	-43.3	174	-28.8	35.2	0	0	0	113.4	Y584 V586 L592 F593 V662 L663	Y584-P589 WeakPolarHBondContact O-CD 3.41Å; V586-P589 WeakPolarHBondContact O-CD 3.14Å; P589-L592 PolarHBondContact O-N 3.06Å; P589-F593 VanDerWaalsContact O-CB 3.28Å; P589-F593 WeakPolarHBondContact O-CB 3.34Å; P589-F593 PolarHBondContact O-N 2.92Å; P589-V662 HydrophobicContact CG-CB 4.37Å; P589-V662 HydrophobicContact CG-CG1 3.69Å; P589-L663 HydrophobicContact CB-CD1 4.48Å
590	E	89.1	Confident	87.2	Confident	13 Å²	13	40.2 Å²	40.2	6%	0.061	20%	0.196	C	C	.	.	H	α-helix	trans	-59.2	-49.9	176.2	-80	179	-168.5	0	0	112.8	V586 I588 L592 F593 M594 L663 H738 Y742	V586-E590 WeakPolarHBondContact CG1-OE1 3.37Å; V586-E590 WeakPolarHBondContact O-CB 3.24Å; V586-E590 VanDerWaalsContact O-CG 3.27Å; V586-E590 WeakPolarHBondContact O-CG 3.42Å; V586-E590 PolarHBondContact O-N 3.09Å; V586-E590 VanDerWaalsContact O-N 3.15Å; I588-E590 VanDerWaalsContact C-N 3.31Å; I588-E590 PolarHBondContact O-N 3.37Å; E590-L592 PolarHBondContact O-N 2.95Å; E590-F593 PolarHBondContact O-N 3.44Å; E590-M594 PolarHBondContact O-N 3.39Å; E590-L663 HydrophobicContact CG-CD1 3.89Å; E590-L663 HydrophobicContact CG-CD2 4.43Å; E590-H738 IonicContact OE1-CE1 3.23Å; E590-H738 PolarHBondContact OE1-CE1 3.49Å; E590-Y742 HydrophobicContact CB-CE1 3.88Å; E590-Y742 HydrophobicContact CB-CE2 4.01Å; E590-Y742 WeakPolarHBondContact CB-OH 3.46Å; E590-Y742 HydrophobicContact CG-CD1 3.98Å; E590-Y742 HydrophobicContact CG-CD2 4.03Å; E590-Y742 HydrophobicContact CG-CE1 3.68Å; E590-Y742 HydrophobicContact CG-CE2 3.7Å; E590-Y742 HydrophobicContact CG-CG 4.16Å; E590-Y742 PolarHBondContact O-OH 3.48Å; E590-Y742 VanDerWaalsContact O-OH 3.11Å
591	L	91	Very high	87.7	Confident	40 Å²	40	33.8 Å²	33.8	21%	0.209	17%	0.169	C	C	.	.	H	α-helix	trans	-63.4	-43.3	178.8	-177.7	65.2	0	0	0	111.6	V567 I568 I571 S587 I588 M594 L595	V567-L591 HydrophobicContact CG1-CB 4.21Å; V567-L591 HydrophobicContact CG1-CD1 4.3Å; I568-L591 HydrophobicContact CG1-CD1 4.48Å; I571-L591 HydrophobicContact CD1-CD2 4.11Å; S587-L591 WeakPolarHBondContact O-CB 3.17Å; S587-L591 PolarHBondContact O-N 3.27Å; I588-L591 PolarHBondContact O-N 3.43Å; L591-M594 PolarHBondContact O-N 3.31Å; L591-L595 HydrophobicContact CD1-CD1 3.86Å; L591-L595 HydrophobicContact CD1-CG 4.1Å; L591-L595 HydrophobicContact CD2-CD1 4.42Å; L591-L595 HydrophobicContact CG-CD1 3.82Å; L591-L595 HydrophobicContact CG-CG 4.38Å; L591-L595 WeakPolarHBondContact O-CB 3.44Å; L591-L595 WeakPolarHBondContact O-CG 3.28Å; L591-L595 PolarHBondContact O-N 2.94Å
592	L	90.4	Very high	88.3	Confident	76 Å²	76	32.4 Å²	32.4	40%	0.398	16%	0.164	S	C	.	.	H	α-helix	trans	-62.8	-45.2	177.3	-75.8	175.3	0	0	0	111.4	I588 P589 E590 M594 L595 C596	I588-L592 HydrophobicContact CG2-CD1 3.8Å; I588-L592 HydrophobicContact CG2-CG 4.26Å; I588-L592 WeakPolarHBondContact O-CB 3.48Å; I588-L592 WeakPolarHBondContact O-CG 3.24Å; I588-L592 PolarHBondContact O-N 2.89Å; P589-L592 PolarHBondContact O-N 3.06Å; E590-L592 PolarHBondContact O-N 2.95Å; L592-M594 PolarHBondContact O-N 3.44Å; L592-L595 PolarHBondContact O-N 3.41Å; L592-C596 VanDerWaalsContact O-CB 3.24Å; L592-C596 WeakPolarHBondContact O-CB 3.07Å; L592-C596 PolarHBondContact O-N 3.31Å; L592-C596 PolarHBondContact O-SG 2.96Å
593	F	91.1	Very high	88.8	Confident	17 Å²	17	36.4 Å²	36.4	8%	0.075	18%	0.181	C	C	.	.	H	α-helix	trans	-56.5	-49.1	177	179.6	-91.6	0	0	0	111.3	P589 E590 I597 T656 V660 Y742 C743 C746	P589-F593 VanDerWaalsContact O-CB 3.28Å; P589-F593 WeakPolarHBondContact O-CB 3.34Å; P589-F593 PolarHBondContact O-N 2.92Å; E590-F593 PolarHBondContact O-N 3.44Å; F593-I597 HydrophobicContact CD2-CD1 4.4Å; F593-I597 HydrophobicContact CE1-CD1 4.08Å; F593-I597 HydrophobicContact CE2-CD1 3.86Å; F593-I597 HydrophobicContact CZ-CD1 3.68Å; F593-I597 PolarHBondContact O-N 2.91Å; F593-T656 HydrophobicContact CD2-CG2 3.41Å; F593-T656 VanDerWaalsContact CD2-CG2 3.41Å; F593-T656 HydrophobicContact CE2-CG2 3.54Å; F593-T656 HydrophobicContact CG-CG2 4.39Å; F593-V660 HydrophobicContact CD2-CG2 4.27Å; F593-V660 HydrophobicContact CE2-CG2 4.14Å; F593-Y742 HydrophobicContact CD1-CE1 4.18Å; F593-C743 HydrophobicContact CZ-CB 4.27Å; F593-C746 HydrophobicContact CE1-CB 4.09Å
594	M	89.9	Confident	89	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.1	-46.5	179.1	-81.6	-65	-74.7	0	0	113.3	M563 E590 L591 L592 F598 G599 Y742 C746	M563-M594 HydrophobicContact CB-CE 4.09Å; M563-M594 HydrophobicContact CE-CE 4.08Å; M563-M594 HydrophobicContact SD-CE 4.29Å; E590-M594 PolarHBondContact O-N 3.39Å; L591-M594 PolarHBondContact O-N 3.31Å; L592-M594 PolarHBondContact O-N 3.44Å; M594-F598 HydrophobicContact CE-CD2 4.15Å; M594-F598 WeakPolarHBondContact O-CB 3.37Å; M594-F598 PolarHBondContact O-N 3.49Å; M594-F598 HydrophobicContact SD-CD2 3.7Å; M594-F598 HydrophobicContact SD-CE2 4.11Å; M594-G599 PolarHBondContact O-N 3.33Å; M594-Y742 HydrophobicContact CG-CE1 4.37Å; M594-Y742 VanDerWaalsContact CG-OH 3.24Å; M594-Y742 WeakPolarHBondContact CG-OH 3.29Å; M594-C746 HydrophobicContact SD-CB 3.44Å; M594-C746 WeakPolarHBondContact SD-CB 3.47Å; M594-C746 PolarHBondContact SD-SG 2.98Å
595	L	90.1	Very high	89.3	Confident	81 Å²	81	27.7 Å²	27.7	42%	0.424	15%	0.146	S	C	.	.	I	π-helix	trans	-69.2	-36.3	-178.6	-71.7	176.4	0	0	0	112.3	T564 L591 L592 G599 Y600	T564-L595 HydrophobicContact CG2-CD2 4.01Å; L591-L595 HydrophobicContact CD1-CD1 3.86Å; L591-L595 HydrophobicContact CD1-CG 4.1Å; L591-L595 HydrophobicContact CD2-CD1 4.42Å; L591-L595 HydrophobicContact CG-CD1 3.82Å; L591-L595 HydrophobicContact CG-CG 4.38Å; L591-L595 WeakPolarHBondContact O-CB 3.44Å; L591-L595 WeakPolarHBondContact O-CG 3.28Å; L591-L595 PolarHBondContact O-N 2.94Å; L592-L595 PolarHBondContact O-N 3.41Å; L595-G599 CarbonylContact O-C 3.55Å; L595-G599 WeakPolarHBondContact O-CA 3.25Å; L595-G599 PolarHBondContact O-N 3.2Å; L595-G599 VanDerWaalsContact O-N 3.08Å; L595-Y600 PolarHBondContact O-N 3.1Å
596	C	90.7	Very high	89.7	Confident	19 Å²	19	30.4 Å²	30.4	13%	0.128	16%	0.156	C	C	.	.	I	π-helix	trans	-67.6	-43.7	179.7	-68.5	0	0	0	0	112	L592 Y600 L652 T656	L592-C596 VanDerWaalsContact O-CB 3.24Å; L592-C596 WeakPolarHBondContact O-CB 3.07Å; L592-C596 PolarHBondContact O-N 3.31Å; L592-C596 PolarHBondContact O-SG 2.96Å; C596-Y600 WeakPolarHBondContact O-CB 3.36Å; C596-L652 HydrophobicContact CB-CG 4.49Å; C596-L652 WeakPolarHBondContact O-CD2 3.4Å; C596-T656 WeakPolarHBondContact CB-OG1 3.49Å
597	I	89.5	Confident	90	Very high	9 Å²	9	32.6 Å²	32.6	5%	0.046	16%	0.163	C	C	.	.	I	π-helix	trans	-80.3	-60.2	179.5	-65.2	168.1	0	0	0	110.9	F593 L601 F627 F631 T656	F593-I597 HydrophobicContact CD2-CD1 4.4Å; F593-I597 HydrophobicContact CE1-CD1 4.08Å; F593-I597 HydrophobicContact CE2-CD1 3.86Å; F593-I597 HydrophobicContact CZ-CD1 3.68Å; F593-I597 PolarHBondContact O-N 2.91Å; I597-L601 PolarHBondContact O-N 3.09Å; I597-F627 HydrophobicContact CG2-CE2 3.95Å; I597-F627 HydrophobicContact CG2-CZ 3.8Å; I597-F631 HydrophobicContact CD1-CE1 4.46Å; I597-F631 HydrophobicContact CD1-CZ 4.17Å; I597-F631 HydrophobicContact CG1-CZ 4.06Å; I597-F631 HydrophobicContact CG2-CE2 4.47Å; I597-F631 HydrophobicContact CG2-CZ 3.94Å; I597-T656 HydrophobicContact CD1-CG2 3.68Å; I597-T656 HydrophobicContact CG1-CG2 3.98Å
598	F	90.1	Very high	90.2	Very high	10 Å²	10	34.6 Å²	34.6	4%	0.044	17%	0.172	C	C	.	.	I	π-helix	trans	-89.7	-31.1	-166.9	-65.9	-68.2	0	0	0	112.6	I560 M594 Y600 L601 I602 C746 I747 T750	I560-F598 HydrophobicContact CD1-CB 3.77Å; I560-F598 HydrophobicContact CD1-CD1 4.28Å; I560-F598 HydrophobicContact CD1-CG 4.43Å; I560-F598 HydrophobicContact CG1-CB 3.93Å; I560-F598 HydrophobicContact CG1-CG 4.49Å; I560-F598 HydrophobicContact CG2-CB 3.84Å; M594-F598 HydrophobicContact CE-CD2 4.15Å; M594-F598 WeakPolarHBondContact O-CB 3.37Å; M594-F598 PolarHBondContact O-N 3.49Å; M594-F598 HydrophobicContact SD-CD2 3.7Å; M594-F598 HydrophobicContact SD-CE2 4.11Å; F598-Y600 VanDerWaalsContact C-N 3.28Å; F598-Y600 PolarHBondContact O-N 2.95Å; F598-L601 HydrophobicContact CD1-CD2 4.47Å; F598-L601 WeakPolarHBondContact O-CB 3.43Å; F598-L601 PolarHBondContact O-N 3.41Å; F598-I602 PolarHBondContact O-N 2.89Å; F598-C746 HydrophobicContact CE2-CB 4.25Å; F598-I747 HydrophobicContact CZ-CG1 4.12Å; F598-T750 HydrophobicContact CD1-CG2 3.76Å; F598-T750 HydrophobicContact CE1-CG2 3.74Å
599	G	90.1	Very high	90.2	Very high	20 Å²	20	36.4 Å²	36.4	21%	0.206	17%	0.174	C	C	.	.	I	π-helix	trans	-61.7	-38.7	169.5	0	0	0	0	0	111.8	M594 L595 I602 F603	M594-G599 PolarHBondContact O-N 3.33Å; L595-G599 CarbonylContact O-C 3.55Å; L595-G599 WeakPolarHBondContact O-CA 3.25Å; L595-G599 PolarHBondContact O-N 3.2Å; L595-G599 VanDerWaalsContact O-N 3.08Å; G599-I602 PolarHBondContact O-N 3.42Å; G599-F603 PolarHBondContact O-N 3.3Å
600	Y	90.7	Very high	90	Very high	13 Å²	13	43.1 Å²	43.1	5%	0.051	21%	0.209	C	C	.	.	H	α-helix	trans	-65	-37.1	172.6	-175.5	-108.4	0	0	0	112.8	L595 C596 F598 I602 F603 M604 M630 Y642 V648 Q649 L652	L595-Y600 PolarHBondContact O-N 3.1Å; C596-Y600 WeakPolarHBondContact O-CB 3.36Å; F598-Y600 VanDerWaalsContact C-N 3.28Å; F598-Y600 PolarHBondContact O-N 2.95Å; Y600-I602 PolarHBondContact O-N 3.45Å; Y600-F603 HydrophobicContact CD2-CD1 4.13Å; Y600-F603 AromaticContact CE2-CD1 3.96Å; Y600-F603 HydrophobicContact CE2-CD1 3.96Å; Y600-F603 HydrophobicContact CE2-CE1 4.42Å; Y600-F603 WeakPolarHBondContact O-CB 3.45Å; Y600-F603 PolarHBondContact O-N 3.31Å; Y600-M604 HydrophobicContact CD1-CE 3.82Å; Y600-M604 HydrophobicContact CD1-CG 4.22Å; Y600-M604 HydrophobicContact CD1-SD 4.09Å; Y600-M604 HydrophobicContact CE1-CE 3.72Å; Y600-M604 HydrophobicContact CE1-CG 3.74Å; Y600-M604 HydrophobicContact CE1-SD 3.4Å; Y600-M604 WeakPolarHBondContact CE1-SD 2.99Å; Y600-M604 HydrophobicContact CE2-CG 4.42Å; Y600-M604 WeakPolarHBondContact O-CG 3.47Å; Y600-M604 PolarHBondContact O-N 2.75Å; Y600-M630 HydrophobicContact CD1-SD 3.97Å; Y600-M630 HydrophobicContact CE1-SD 4.22Å; Y600-Y642 PolarHBondContact OH-OH 3.27Å; Y600-Y642 VanDerWaalsContact OH-OH 3.07Å; Y600-V648 HydrophobicContact CE2-CG1 4.28Å; Y600-Q649 HydrophobicContact CE1-CG 3.98Å; Y600-L652 HydrophobicContact CD2-CD2 3.75Å; Y600-L652 HydrophobicContact CG-CD2 3.76Å
601	L	90.1	Very high	89.8	Confident	23 Å²	23	46 Å²	46	12%	0.12	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-43.1	173.2	-179.4	63.1	0	0	0	112	V556 I560 I597 F598 F603 M604 I605 I623 F627	V556-L601 HydrophobicContact CG1-CD2 3.92Å; I560-L601 HydrophobicContact CD1-CD2 4.48Å; I597-L601 PolarHBondContact O-N 3.09Å; F598-L601 HydrophobicContact CD1-CD2 4.47Å; F598-L601 WeakPolarHBondContact O-CB 3.43Å; F598-L601 PolarHBondContact O-N 3.41Å; L601-F603 VanDerWaalsContact C-N 3.33Å; L601-F603 PolarHBondContact O-N 3.42Å; L601-M604 HydrophobicContact CD1-CE 3.92Å; L601-M604 PolarHBondContact O-N 2.72Å; L601-I605 HydrophobicContact CG-CD1 4.43Å; L601-I605 WeakPolarHBondContact O-CG1 3.45Å; L601-I605 PolarHBondContact O-N 3.18Å; L601-I605 VanDerWaalsContact O-N 3.13Å; L601-I623 HydrophobicContact CD1-CG2 3.7Å; L601-F627 HydrophobicContact CB-CE2 4.37Å; L601-F627 HydrophobicContact CD1-CD2 4.18Å; L601-F627 HydrophobicContact CD1-CG 4.42Å
602	I	91.9	Very high	89.4	Confident	24 Å²	24	46.5 Å²	46.5	12%	0.123	23%	0.227	C	C	.	.	H	α-helix	trans	-59.2	-46.8	173.4	-68.5	165.7	0	0	0	110.4	I557 I560 I561 F598 G599 Y600 M604 I605 F606	I557-I602 HydrophobicContact CG1-CG1 4.48Å; I560-I602 HydrophobicContact CB-CD1 3.64Å; I560-I602 HydrophobicContact CB-CG1 4.29Å; I560-I602 HydrophobicContact CD1-CD1 4.19Å; I560-I602 HydrophobicContact CD1-CG1 3.91Å; I560-I602 HydrophobicContact CG2-CD1 3.39Å; I560-I602 HydrophobicContact CG2-CG1 4.28Å; I561-I602 HydrophobicContact CG1-CD1 4.33Å; F598-I602 PolarHBondContact O-N 2.89Å; G599-I602 PolarHBondContact O-N 3.42Å; Y600-I602 PolarHBondContact O-N 3.45Å; I602-M604 VanDerWaalsContact C-N 3.33Å; I602-M604 PolarHBondContact O-N 2.97Å; I602-I605 PolarHBondContact O-N 2.56Å; I602-I605 VanDerWaalsContact O-N 3.12Å; I602-F606 HydrophobicContact CG2-CD2 3.5Å; I602-F606 HydrophobicContact CG2-CE2 3.48Å; I602-F606 VanDerWaalsContact CG2-CE2 3.48Å; I602-F606 WeakPolarHBondContact O-CD2 3.4Å; I602-F606 PolarHBondContact O-N 3.22Å
603	F	91.6	Very high	88.8	Confident	101 Å²	101	46.7 Å²	46.7	44%	0.443	24%	0.236	S	C	.	.	H	α-helix	trans	-57.5	-45	178.4	172.8	-100.2	0	0	0	111.9	G599 Y600 L601 I605 F606 Y607 Y642	G599-F603 PolarHBondContact O-N 3.3Å; Y600-F603 HydrophobicContact CD2-CD1 4.13Å; Y600-F603 AromaticContact CE2-CD1 3.96Å; Y600-F603 HydrophobicContact CE2-CD1 3.96Å; Y600-F603 HydrophobicContact CE2-CE1 4.42Å; Y600-F603 WeakPolarHBondContact O-CB 3.45Å; Y600-F603 PolarHBondContact O-N 3.31Å; L601-F603 VanDerWaalsContact C-N 3.33Å; L601-F603 PolarHBondContact O-N 3.42Å; F603-I605 VanDerWaalsContact C-N 3.31Å; F603-I605 PolarHBondContact O-N 3.48Å; F603-F606 PolarHBondContact O-N 3.19Å; F603-Y607 HydrophobicContact CZ-CD2 4.26Å; F603-Y607 VanDerWaalsContact O-CB 3.24Å; F603-Y607 WeakPolarHBondContact O-CB 3.38Å; F603-Y607 PolarHBondContact O-N 2.65Å; F603-Y642 HydrophobicContact CE1-CE1 4.06Å
604	M	88.9	Confident	88	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.9	-37.3	176.1	-71.4	-167.2	-67.9	0	0	112.8	Y600 L601 I602 K608 I623 F627 L641	Y600-M604 HydrophobicContact CD1-CE 3.82Å; Y600-M604 HydrophobicContact CD1-CG 4.22Å; Y600-M604 HydrophobicContact CD1-SD 4.09Å; Y600-M604 HydrophobicContact CE1-CE 3.72Å; Y600-M604 HydrophobicContact CE1-CG 3.74Å; Y600-M604 HydrophobicContact CE1-SD 3.4Å; Y600-M604 WeakPolarHBondContact CE1-SD 2.99Å; Y600-M604 HydrophobicContact CE2-CG 4.42Å; Y600-M604 WeakPolarHBondContact O-CG 3.47Å; Y600-M604 PolarHBondContact O-N 2.75Å; L601-M604 HydrophobicContact CD1-CE 3.92Å; L601-M604 PolarHBondContact O-N 2.72Å; I602-M604 VanDerWaalsContact C-N 3.33Å; I602-M604 PolarHBondContact O-N 2.97Å; M604-K608 VanDerWaalsContact O-CB 3.31Å; M604-K608 WeakPolarHBondContact O-CB 3.49Å; M604-K608 PolarHBondContact O-N 3.44Å; M604-I623 HydrophobicContact CB-CG2 4.41Å; M604-I623 HydrophobicContact CE-CG2 4.29Å; M604-F627 HydrophobicContact CE-CB 4.28Å; M604-F627 HydrophobicContact CE-CD2 4.07Å; M604-L641 HydrophobicContact CB-CD2 4.24Å; M604-L641 HydrophobicContact CG-CD2 4.27Å
605	I	91	Very high	87.1	Confident	6 Å²	6	55.7 Å²	55.7	3%	0.031	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-50.7	177.9	-66.1	164.3	0	0	0	110.8	K553 V556 I557 L601 I602 F603 K608 W609 I623	K553-I605 HydrophobicContact CB-CG2 4.17Å; K553-I605 HydrophobicContact CD-CG2 4.08Å; K553-I605 HydrophobicContact CG-CG2 4.29Å; V556-I605 HydrophobicContact CG1-CD1 4.44Å; I557-I605 HydrophobicContact CD1-CG2 3.89Å; I557-I605 HydrophobicContact CG1-CD1 4.21Å; L601-I605 HydrophobicContact CG-CD1 4.43Å; L601-I605 WeakPolarHBondContact O-CG1 3.45Å; L601-I605 PolarHBondContact O-N 3.18Å; L601-I605 VanDerWaalsContact O-N 3.13Å; I602-I605 PolarHBondContact O-N 2.56Å; I602-I605 VanDerWaalsContact O-N 3.12Å; F603-I605 VanDerWaalsContact C-N 3.31Å; F603-I605 PolarHBondContact O-N 3.48Å; I605-K608 PolarHBondContact O-N 3.07Å; I605-W609 HydrophobicContact CG2-CD2 4.08Å; I605-W609 HydrophobicContact CG2-CE3 4.06Å; I605-W609 HydrophobicContact CG2-CH2 4Å; I605-W609 HydrophobicContact CG2-CZ2 4.02Å; I605-W609 HydrophobicContact CG2-CZ3 4.02Å; I605-W609 PolarHBondContact O-N 3.49Å; I605-W609 VanDerWaalsContact O-N 3.09Å; I605-I623 HydrophobicContact CG1-CD1 4.02Å
606	F	91.7	Very high	86.4	Confident	94 Å²	94	54.7 Å²	54.7	41%	0.412	28%	0.282	S	S	.	.	H	α-helix	trans	-65.2	-42.3	179.3	-80	-68.4	0	0	0	112.2	I557 I602 F603 K608 W609 L610	I557-F606 HydrophobicContact CD1-CE2 4.03Å; I557-F606 HydrophobicContact CD1-CZ 4.03Å; I557-F606 HydrophobicContact CG2-CE2 4.23Å; I557-F606 HydrophobicContact CG2-CZ 4.35Å; I602-F606 HydrophobicContact CG2-CD2 3.5Å; I602-F606 HydrophobicContact CG2-CE2 3.48Å; I602-F606 VanDerWaalsContact CG2-CE2 3.48Å; I602-F606 WeakPolarHBondContact O-CD2 3.4Å; I602-F606 PolarHBondContact O-N 3.22Å; F603-F606 PolarHBondContact O-N 3.19Å; F606-K608 VanDerWaalsContact C-N 3.29Å; F606-K608 PolarHBondContact O-N 3.13Å; F606-W609 AromaticContact CD1-CE3 3.86Å; F606-W609 HydrophobicContact CD1-CE3 3.86Å; F606-W609 HydrophobicContact CD1-CZ3 4.17Å; F606-W609 HydrophobicContact CE1-CE3 4.08Å; F606-W609 AromaticContact CE1-CZ3 3.94Å; F606-W609 HydrophobicContact CE1-CZ3 3.94Å; F606-W609 PolarHBondContact O-N 2.99Å; F606-W609 VanDerWaalsContact O-N 3.14Å; F606-L610 WeakPolarHBondContact O-CG 3.42Å; F606-L610 PolarHBondContact O-N 3.45Å; F606-L610 VanDerWaalsContact O-N 3.08Å
607	Y	89.8	Confident	85.6	Confident	58 Å²	58	57.8 Å²	57.8	23%	0.227	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-44	176.1	-175.9	-87	0	0	0	111.1	F603 W609 L610 V611 L641 Y642	F603-Y607 HydrophobicContact CZ-CD2 4.26Å; F603-Y607 VanDerWaalsContact O-CB 3.24Å; F603-Y607 WeakPolarHBondContact O-CB 3.38Å; F603-Y607 PolarHBondContact O-N 2.65Å; Y607-W609 VanDerWaalsContact C-N 3.31Å; Y607-W609 PolarHBondContact O-N 2.97Å; Y607-L610 PolarHBondContact O-N 3.4Å; Y607-V611 HydrophobicContact CD1-CB 4.46Å; Y607-V611 HydrophobicContact CD1-CG2 4.22Å; Y607-V611 HydrophobicContact CD2-CG2 4.11Å; Y607-V611 HydrophobicContact CE1-CB 4.06Å; Y607-V611 HydrophobicContact CE1-CG1 4.26Å; Y607-V611 HydrophobicContact CE1-CG2 3.87Å; Y607-V611 HydrophobicContact CE2-CG2 3.75Å; Y607-V611 HydrophobicContact CG-CG2 4.34Å; Y607-V611 PolarHBondContact O-N 2.85Å; Y607-L641 HydrophobicContact CD1-CB 4.08Å; Y607-L641 HydrophobicContact CD1-CD2 3.65Å; Y607-L641 HydrophobicContact CD1-CG 3.98Å; Y607-L641 HydrophobicContact CE1-CB 3.87Å; Y607-L641 HydrophobicContact CE1-CD2 4.3Å; Y607-L641 HydrophobicContact CE1-CG 4.15Å; Y607-L641 WeakPolarHBondContact CE1-O 3.48Å; Y607-L641 HydrophobicContact CG-CD2 4.46Å; Y607-L641 PolarHBondContact OH-O 3.3Å; Y607-Y642 WeakPolarHBondContact OH-CB 3.28Å
608	K	88.3	Confident	84.8	Confident	45 Å²	45	69.2 Å²	69.2	20%	0.196	35%	0.346	C	S	.	.	H	α-helix	trans	-61.9	-38.7	176.9	-176.2	170.9	-176.9	167.8	0	112.4	M604 I605 F606 L610 F612 P621 I623	M604-K608 VanDerWaalsContact O-CB 3.31Å; M604-K608 WeakPolarHBondContact O-CB 3.49Å; M604-K608 PolarHBondContact O-N 3.44Å; I605-K608 PolarHBondContact O-N 3.07Å; F606-K608 VanDerWaalsContact C-N 3.29Å; F606-K608 PolarHBondContact O-N 3.13Å; K608-L610 VanDerWaalsContact C-N 3.33Å; K608-F612 HydrophobicContact CB-CD2 4.4Å; K608-F612 HydrophobicContact CG-CD2 3.91Å; K608-F612 HydrophobicContact CG-CE2 4.46Å; K608-F612 PolarHBondContact O-N 3.35Å; K608-P621 PolarHBondContact NZ-O 3.01Å; K608-I623 HydrophobicContact CB-CD1 4.28Å; K608-I623 HydrophobicContact CD-CD1 3.67Å; K608-I623 HydrophobicContact CD-CG1 3.83Å
609	W	87.9	Confident	84.2	Confident	107 Å²	107	72.9 Å²	72.9	41%	0.405	37%	0.369	S	S	.	.	H	α-helix	trans	-68.1	-29.1	177.6	-76.6	-27.6	0	0	0	113.7	F550 K553 I557 I605 F606 Y607	F550-W609 HydrophobicContact CD2-CZ2 4.45Å; K553-W609 HydrophobicContact CB-CH2 4.33Å; K553-W609 HydrophobicContact CB-CZ2 3.94Å; K553-W609 HydrophobicContact CD-CZ2 3.92Å; I557-W609 HydrophobicContact CD1-CH2 3.8Å; I557-W609 HydrophobicContact CD1-CZ3 3.74Å; I605-W609 HydrophobicContact CG2-CD2 4.08Å; I605-W609 HydrophobicContact CG2-CE3 4.06Å; I605-W609 HydrophobicContact CG2-CH2 4Å; I605-W609 HydrophobicContact CG2-CZ2 4.02Å; I605-W609 HydrophobicContact CG2-CZ3 4.02Å; I605-W609 PolarHBondContact O-N 3.49Å; I605-W609 VanDerWaalsContact O-N 3.09Å; F606-W609 AromaticContact CD1-CE3 3.86Å; F606-W609 HydrophobicContact CD1-CE3 3.86Å; F606-W609 HydrophobicContact CD1-CZ3 4.17Å; F606-W609 HydrophobicContact CE1-CE3 4.08Å; F606-W609 AromaticContact CE1-CZ3 3.94Å; F606-W609 HydrophobicContact CE1-CZ3 3.94Å; F606-W609 PolarHBondContact O-N 2.99Å; F606-W609 VanDerWaalsContact O-N 3.14Å; Y607-W609 VanDerWaalsContact C-N 3.31Å; Y607-W609 PolarHBondContact O-N 2.97Å
610	L	86.8	Confident	83.6	Confident	150 Å²	150	73.6 Å²	73.6	79%	0.785	37%	0.372	S	S	*	.	H	α-helix	trans	-89	-34.2	-177.5	-66.8	173.3	0	0	0	113.8	F606 Y607 K608	F606-L610 WeakPolarHBondContact O-CG 3.42Å; F606-L610 PolarHBondContact O-N 3.45Å; F606-L610 VanDerWaalsContact O-N 3.08Å; Y607-L610 PolarHBondContact O-N 3.4Å; K608-L610 VanDerWaalsContact C-N 3.33Å
611	V	84.3	Confident	83.1	Confident	73 Å²	73	74.2 Å²	74.2	44%	0.442	38%	0.378	S	S	.	.	H	α-helix	trans	-97.8	-34.1	-167.5	177.2	0	0	0	0	113.7	Y607	Y607-V611 HydrophobicContact CD1-CB 4.46Å; Y607-V611 HydrophobicContact CD1-CG2 4.22Å; Y607-V611 HydrophobicContact CD2-CG2 4.11Å; Y607-V611 HydrophobicContact CE1-CB 4.06Å; Y607-V611 HydrophobicContact CE1-CG1 4.26Å; Y607-V611 HydrophobicContact CE1-CG2 3.87Å; Y607-V611 HydrophobicContact CE2-CG2 3.75Å; Y607-V611 HydrophobicContact CG-CG2 4.34Å; Y607-V611 PolarHBondContact O-N 2.85Å
612	F	82.5	Confident	82.9	Confident	50 Å²	50	75.7 Å²	75.7	22%	0.219	39%	0.391	C	S	.	.			trans	-92.7	114.2	-175.7	-66.3	-86.3	0	0	0	111.4	K608 A620 P621 L641	K608-F612 HydrophobicContact CB-CD2 4.4Å; K608-F612 HydrophobicContact CG-CD2 3.91Å; K608-F612 HydrophobicContact CG-CE2 4.46Å; K608-F612 PolarHBondContact O-N 3.35Å; F612-A620 HydrophobicContact CD1-CB 3.83Å; F612-A620 HydrophobicContact CE1-CB 4.28Å; F612-A620 HydrophobicContact CG-CB 4.21Å; F612-P621 HydrophobicContact CZ-CG 4.35Å; F612-L641 HydrophobicContact CE2-CG 4.28Å
613	S	78.6	Confident	82.6	Confident	81 Å²	81	75.5 Å²	75.5	57%	0.566	39%	0.39	S	S	*	.			trans	-103.4	176.1	172.7	-171.5	0	0	0	0	111.7	E615 T616 S617	S613-E615 PolarHBondContact O-N 3.4Å; S613-T616 PolarHBondContact N-OG1 3.38Å; S613-T616 VanDerWaalsContact N-OG1 3.11Å; S613-T616 PolarHBondContact O-N 3.39Å; S613-T616 PolarHBondContact O-OG1 2.96Å; S613-S617 PolarHBondContact O-N 3.31Å
614	A	73.7	Confident	82.3	Confident	37 Å²	37	76.6 Å²	76.6	31%	0.306	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-51.5	-39.3	-179.7	0	0	0	0	0	113.2	P519 T616 S617	P519-A614 HydrophobicContact CB-CB 3.86Å; P519-A614 HydrophobicContact CG-CB 3.86Å; A614-T616 VanDerWaalsContact C-N 3.29Å; A614-T616 PolarHBondContact O-N 3.04Å; A614-S617 WeakPolarHBondContact O-CB 3.48Å; A614-S617 PolarHBondContact O-N 3.16Å
615	E	71.2	Confident	82.1	Confident	168 Å²	168	81.1 Å²	81.1	79%	0.785	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-65.7	-30.1	-179.7	-61	-177.8	176.7	0	0	113.2	S613	S613-E615 PolarHBondContact O-N 3.4Å
616	T	74.8	Confident	81.8	Confident	61 Å²	61	81.3 Å²	81.3	37%	0.374	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-100.4	6.1	-177.3	52.7	0	0	0	0	113.7	S613 A614 R618 V619 A620	S613-T616 PolarHBondContact N-OG1 3.38Å; S613-T616 VanDerWaalsContact N-OG1 3.11Å; S613-T616 PolarHBondContact O-N 3.39Å; S613-T616 PolarHBondContact O-OG1 2.96Å; A614-T616 VanDerWaalsContact C-N 3.29Å; A614-T616 PolarHBondContact O-N 3.04Å; T616-R618 PolarHBondContact O-N 3.28Å; T616-V619 PolarHBondContact O-N 3.36Å; T616-A620 PolarHBondContact O-N 3.41Å
617	S	74.6	Confident	81.5	Confident	83 Å²	83	78.6 Å²	78.6	58%	0.58	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-27.3	-172.2	-177	0	0	0	0	114.3	S613 A614 V619	S613-S617 PolarHBondContact O-N 3.31Å; A614-S617 WeakPolarHBondContact O-CB 3.48Å; A614-S617 PolarHBondContact O-N 3.16Å; S617-V619 VanDerWaalsContact C-N 3.29Å; S617-V619 PolarHBondContact O-N 2.83Å
618	R	73.4	Confident	81.4	Confident	250 Å²	250	79.8 Å²	79.8	94%	0.943	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-23.6	179.7	-65.7	-176	-177.9	-178.2	1	113.4	T616	T616-R618 PolarHBondContact O-N 3.28Å
619	V	75.8	Confident	81.2	Confident	87 Å²	87	79.4 Å²	79.4	53%	0.527	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-5.2	-176.9	-168.4	0	0	0	0	111	T616 S617 P621	T616-V619 PolarHBondContact O-N 3.36Å; S617-V619 VanDerWaalsContact C-N 3.29Å; S617-V619 PolarHBondContact O-N 2.83Å; V619-P621 WeakPolarHBondContact O-CD 3.3Å
620	A	78.1	Confident	81	Confident	34 Å²	34	74.8 Å²	74.8	28%	0.281	40%	0.404	S	S	.	.			trans	-66.6	112.9	-175.3	0	0	0	0	0	111.6	F612 T616	F612-A620 HydrophobicContact CD1-CB 3.83Å; F612-A620 HydrophobicContact CE1-CB 4.28Å; F612-A620 HydrophobicContact CG-CB 4.21Å; T616-A620 PolarHBondContact O-N 3.41Å
621	P	80.3	Confident	80.9	Confident	27 Å²	27	72.1 Å²	72.1	18%	0.175	39%	0.386	C	S	.	.			trans	-78	161.5	-176.4	32.5	-34.5	0	0	0	111.9	K608 F612 V619 E626 L641	K608-P621 PolarHBondContact NZ-O 3.01Å; F612-P621 HydrophobicContact CZ-CG 4.35Å; V619-P621 WeakPolarHBondContact O-CD 3.3Å; P621-E626 HydrophobicContact CB-CG 4.5Å; P621-E626 WeakPolarHBondContact CB-OE1 3.47Å; P621-E626 WeakPolarHBondContact CG-OE1 3.13Å; P621-L641 HydrophobicContact CB-CD1 4.47Å; P621-L641 HydrophobicContact CG-CD1 3.38Å; P621-L641 HydrophobicContact CG-CG 4.4Å
622	S	85	Confident	80.8	Confident	54 Å²	54	74.6 Å²	74.6	38%	0.378	40%	0.396	S	S	.	.			trans	-88.7	116.9	179.4	54.4	0	0	0	0	111.4	L624 I625 E626	S622-L624 PolarHBondContact O-N 3.02Å; S622-L624 VanDerWaalsContact O-N 3.17Å; S622-I625 PolarHBondContact O-N 2.99Å; S622-I625 VanDerWaalsContact O-N 3.16Å; S622-I625 WeakPolarHBondContact OG-CB 3.4Å; S622-I625 WeakPolarHBondContact OG-CD1 3.26Å; S622-I625 WeakPolarHBondContact OG-CG1 3.44Å; S622-E626 PolarHBondContact O-N 3.5Å; S622-E626 VanDerWaalsContact O-N 3.14Å
623	I	85.8	Confident	80.4	Confident	20 Å²	20	77.8 Å²	77.8	10%	0.103	41%	0.41	C	S	.	.	H	α-helix	trans	-53.5	-39.8	-179.5	-60.6	167.2	0	0	0	111.8	L601 M604 I605 K608 E626 F627	L601-I623 HydrophobicContact CD1-CG2 3.7Å; M604-I623 HydrophobicContact CB-CG2 4.41Å; M604-I623 HydrophobicContact CE-CG2 4.29Å; I605-I623 HydrophobicContact CG1-CD1 4.02Å; K608-I623 HydrophobicContact CB-CD1 4.28Å; K608-I623 HydrophobicContact CD-CD1 3.67Å; K608-I623 HydrophobicContact CD-CG1 3.83Å; I623-E626 PolarHBondContact O-N 3.3Å; I623-F627 VanDerWaalsContact O-CB 3.26Å; I623-F627 WeakPolarHBondContact O-CB 3.14Å; I623-F627 PolarHBondContact O-N 3.14Å
624	L	85.5	Confident	79.8	Confident	124 Å²	124	76.5 Å²	76.5	65%	0.649	40%	0.4	S	S	*	.	H	α-helix	trans	-63.4	-46.9	-178.4	-176.8	68.5	0	0	0	112.2	S622 F627 I628	S622-L624 PolarHBondContact O-N 3.02Å; S622-L624 VanDerWaalsContact O-N 3.17Å; L624-F627 PolarHBondContact O-N 3.17Å; L624-I628 HydrophobicContact CD1-CD1 4.39Å; L624-I628 HydrophobicContact CG-CD1 4.05Å; L624-I628 VanDerWaalsContact O-CG1 3.29Å; L624-I628 WeakPolarHBondContact O-CG1 3.45Å; L624-I628 PolarHBondContact O-N 3.48Å
625	I	85.8	Confident	78.9	Confident	94 Å²	94	82 Å²	82	48%	0.482	43%	0.43	S	S	.	.	H	α-helix	trans	-68.3	-39.9	-179.4	-65.5	172.3	0	0	0	110	S622 F627 I628 N629	S622-I625 PolarHBondContact O-N 2.99Å; S622-I625 VanDerWaalsContact O-N 3.16Å; S622-I625 WeakPolarHBondContact OG-CB 3.4Å; S622-I625 WeakPolarHBondContact OG-CD1 3.26Å; S622-I625 WeakPolarHBondContact OG-CG1 3.44Å; I625-F627 VanDerWaalsContact C-N 3.3Å; I625-F627 PolarHBondContact O-N 2.97Å; I625-I628 PolarHBondContact O-N 3.44Å; I625-N629 VanDerWaalsContact O-CB 3.25Å; I625-N629 WeakPolarHBondContact O-CB 3.29Å; I625-N629 PolarHBondContact O-N 2.81Å; I625-N629 PolarHBondContact O-ND2 2.84Å; I625-N629 PolarHBondContact O-OD1 3.16Å
626	E	83.6	Confident	78.2	Confident	10 Å²	10	77.4 Å²	77.4	5%	0.047	42%	0.416	C	S	.	.	H	α-helix	trans	-65.4	-35.2	176.2	-68	175.2	139.5	0	0	112.6	P621 S622 I623 M630 L641	P621-E626 HydrophobicContact CB-CG 4.5Å; P621-E626 WeakPolarHBondContact CB-OE1 3.47Å; P621-E626 WeakPolarHBondContact CG-OE1 3.13Å; S622-E626 PolarHBondContact O-N 3.5Å; S622-E626 VanDerWaalsContact O-N 3.14Å; I623-E626 PolarHBondContact O-N 3.3Å; E626-M630 PolarHBondContact O-N 3.5Å; E626-L641 WeakPolarHBondContact OE1-CD1 3.33Å; E626-L641 WeakPolarHBondContact OE2-CD1 3.44Å
627	F	86.5	Confident	77.3	Confident	37 Å²	37	84.2 Å²	84.2	16%	0.162	44%	0.441	C	S	.	.	H	α-helix	trans	-68.5	-39.7	173.6	-175.4	-105.6	0	0	0	112.1	I597 L601 M604 I623 L624 I625 M630 F631	I597-F627 HydrophobicContact CG2-CE2 3.95Å; I597-F627 HydrophobicContact CG2-CZ 3.8Å; L601-F627 HydrophobicContact CB-CE2 4.37Å; L601-F627 HydrophobicContact CD1-CD2 4.18Å; L601-F627 HydrophobicContact CD1-CG 4.42Å; M604-F627 HydrophobicContact CE-CB 4.28Å; M604-F627 HydrophobicContact CE-CD2 4.07Å; I623-F627 VanDerWaalsContact O-CB 3.26Å; I623-F627 WeakPolarHBondContact O-CB 3.14Å; I623-F627 PolarHBondContact O-N 3.14Å; L624-F627 PolarHBondContact O-N 3.17Å; I625-F627 VanDerWaalsContact C-N 3.3Å; I625-F627 PolarHBondContact O-N 2.97Å; F627-M630 HydrophobicContact CD2-CE 4.1Å; F627-M630 HydrophobicContact CE2-CE 3.86Å; F627-M630 VanDerWaalsContact O-CB 3.27Å; F627-M630 WeakPolarHBondContact O-CB 3.26Å; F627-M630 PolarHBondContact O-N 3.03Å; F627-F631 HydrophobicContact CE1-CE2 4.05Å; F627-F631 HydrophobicContact CE2-CE2 4.04Å; F627-F631 AromaticContact CZ-CE2 3.74Å; F627-F631 HydrophobicContact CZ-CE2 3.74Å; F627-F631 HydrophobicContact CZ-CZ 4.48Å; F627-F631 WeakPolarHBondContact O-CD2 3.39Å
628	I	86.8	Confident	76.6	Confident	84 Å²	84	84.1 Å²	84.1	43%	0.431	44%	0.437	S	S	.	.	H	α-helix	trans	-66	-44.7	173.5	-68	165.6	0	0	0	110.5	L624 I625 M630 F631 L632	L624-I628 HydrophobicContact CD1-CD1 4.39Å; L624-I628 HydrophobicContact CG-CD1 4.05Å; L624-I628 VanDerWaalsContact O-CG1 3.29Å; L624-I628 WeakPolarHBondContact O-CG1 3.45Å; L624-I628 PolarHBondContact O-N 3.48Å; I625-I628 PolarHBondContact O-N 3.44Å; I628-M630 PolarHBondContact O-N 3.5Å; I628-F631 PolarHBondContact O-N 2.84Å; I628-L632 PolarHBondContact O-N 2.95Å
629	N	84.1	Confident	76	Confident	37 Å²	37	78.2 Å²	78.2	20%	0.198	42%	0.424	C	S	.	.	H	α-helix	trans	-62.9	-28.1	179.1	-71	-9.4	0	0	0	112.2	I625 F631 L632 F633 P634	I625-N629 VanDerWaalsContact O-CB 3.25Å; I625-N629 WeakPolarHBondContact O-CB 3.29Å; I625-N629 PolarHBondContact O-N 2.81Å; I625-N629 PolarHBondContact O-ND2 2.84Å; I625-N629 PolarHBondContact O-OD1 3.16Å; N629-F631 PolarHBondContact O-N 3.44Å; N629-L632 PolarHBondContact O-N 3.35Å; N629-F633 PolarHBondContact O-N 3.29Å; N629-F633 VanDerWaalsContact O-N 3.14Å; N629-P634 HydrophobicContact CB-CG 3.74Å; N629-P634 VanDerWaalsContact O-CD 3.29Å; N629-P634 WeakPolarHBondContact O-CD 3.48Å
630	M	84.9	Confident	75.5	Confident	9 Å²	9	76 Å²	76	4%	0.044	42%	0.419	C	S	.	.	H	α-helix	trans	-56.7	-37	172.8	-171.4	-179.5	76.6	0	0	112.1	Y600 E626 F627 I628 Q649 L653	Y600-M630 HydrophobicContact CD1-SD 3.97Å; Y600-M630 HydrophobicContact CE1-SD 4.22Å; E626-M630 PolarHBondContact O-N 3.5Å; F627-M630 HydrophobicContact CD2-CE 4.1Å; F627-M630 HydrophobicContact CE2-CE 3.86Å; F627-M630 VanDerWaalsContact O-CB 3.27Å; F627-M630 WeakPolarHBondContact O-CB 3.26Å; F627-M630 PolarHBondContact O-N 3.03Å; I628-M630 PolarHBondContact O-N 3.5Å; M630-Q649 HydrophobicContact CG-CB 4.13Å; M630-Q649 HydrophobicContact CG-CG 4.11Å; M630-Q649 HydrophobicContact SD-CG 4.37Å; M630-L653 WeakPolarHBondContact O-CD1 3.27Å
631	F	83.6	Confident	75.4	Confident	95 Å²	95	74.9 Å²	74.9	42%	0.417	41%	0.408	S	S	.	.	H	α-helix	trans	-94.2	-30.2	-179.6	-68.2	-75.5	0	0	0	113.7	I597 F627 I628 N629 L653	I597-F631 HydrophobicContact CD1-CE1 4.46Å; I597-F631 HydrophobicContact CD1-CZ 4.17Å; I597-F631 HydrophobicContact CG1-CZ 4.06Å; I597-F631 HydrophobicContact CG2-CE2 4.47Å; I597-F631 HydrophobicContact CG2-CZ 3.94Å; F627-F631 HydrophobicContact CE1-CE2 4.05Å; F627-F631 HydrophobicContact CE2-CE2 4.04Å; F627-F631 AromaticContact CZ-CE2 3.74Å; F627-F631 HydrophobicContact CZ-CE2 3.74Å; F627-F631 HydrophobicContact CZ-CZ 4.48Å; F627-F631 WeakPolarHBondContact O-CD2 3.39Å; I628-F631 PolarHBondContact O-N 2.84Å; N629-F631 PolarHBondContact O-N 3.44Å; F631-L653 HydrophobicContact CD1-CD1 4.01Å
632	L	82.6	Confident	75.4	Confident	125 Å²	125	75.8 Å²	75.8	65%	0.654	41%	0.408	S	S	*	.	H	α-helix	trans	-86.1	-14.9	-174.3	-168.6	61.1	0	0	0	113.7	I628 N629	I628-L632 PolarHBondContact O-N 2.95Å; N629-L632 PolarHBondContact O-N 3.35Å
633	F	72.8	Confident	75.2	Confident	117 Å²	117	80 Å²	80	51%	0.513	43%	0.432	S	S	.	.			trans	47.9	57	-177.2	-60.1	-70	0	0	0	115.1	N629 R650 L653	N629-F633 PolarHBondContact O-N 3.29Å; N629-F633 VanDerWaalsContact O-N 3.14Å; F633-R650 HydrophobicContact CE1-CG 4.42Å; F633-L653 HydrophobicContact CE1-CD1 4.25Å; F633-L653 HydrophobicContact CE2-CD1 4Å; F633-L653 HydrophobicContact CE2-CD2 4.19Å; F633-L653 HydrophobicContact CZ-CD1 3.5Å; F633-L653 VanDerWaalsContact CZ-CD1 3.5Å; F633-L653 HydrophobicContact CZ-CD2 3.72Å; F633-L653 HydrophobicContact CZ-CG 4.1Å
634	P	67.3	Low	75	Confident	53 Å²	53	81.3 Å²	81.3	34%	0.344	45%	0.45	S	S	.	.			trans	-70.9	144.1	175.6	30.2	-32.7	0	0	0	111.6	N629 S636	N629-P634 HydrophobicContact CB-CG 3.74Å; N629-P634 VanDerWaalsContact O-CD 3.29Å; N629-P634 WeakPolarHBondContact O-CD 3.48Å; P634-S636 PolarHBondContact O-N 2.69Å
635	T	54.4	Low	74.9	Confident	154 Å²	154	76 Å²	76	95%	0.945	42%	0.422	S	S	*	.			trans	-77.2	5.2	-176.6	-18.6	0	0	0	0	114.4
636	S	56.7	Low	74.7	Confident	71 Å²	71	76.5 Å²	76.5	50%	0.497	42%	0.422	S	S	.	.			trans	-92.7	123.8	-172.9	51.2	0	0	0	0	112.9	P634 T638	P634-S636 PolarHBondContact O-N 2.69Å; S636-T638 PolarHBondContact O-N 2.68Å
637	K	56.6	Low	74.9	Confident	203 Å²	203	84.3 Å²	84.3	88%	0.883	45%	0.453	S	S	*	.			trans	-66.7	97.3	172.8	-67.6	179.8	-180	178.8	0	109.6
638	T	58.2	Low	74.9	Confident	81 Å²	81	84.8 Å²	84.8	50%	0.497	46%	0.459	S	S	.	.			trans	-93.1	149.3	166.4	49.7	0	0	0	0	109	S636 G640	S636-T638 PolarHBondContact O-N 2.68Å; T638-G640 PolarHBondContact O-N 3.35Å
639	N	61.8	Low	75	Confident	127 Å²	127	82 Å²	82	68%	0.679	44%	0.444	S	S	*	.			trans	-65.1	103.9	172.9	-68.5	-18.3	0	0	0	107.9
640	G	65.6	Low	75.1	Confident	41 Å²	41	87.4 Å²	87.4	42%	0.423	46%	0.461	S	S	.	.			trans	-65.2	157.4	178.2	0	0	0	0	0	112.9	T638 Y642	T638-G640 PolarHBondContact O-N 3.35Å; G640-Y642 VanDerWaalsContact C-N 3.26Å; G640-Y642 PolarHBondContact O-N 3.16Å
641	L	74.6	Confident	75.4	Confident	10 Å²	10	90 Å²	90	5%	0.052	48%	0.477	C	S	.	.	S	Bend	trans	-52.3	-42.4	173.6	-101.2	71.2	0	0	0	112.7	M604 Y607 F612 P621 E626	M604-L641 HydrophobicContact CB-CD2 4.24Å; M604-L641 HydrophobicContact CG-CD2 4.27Å; Y607-L641 HydrophobicContact CD1-CB 4.08Å; Y607-L641 HydrophobicContact CD1-CD2 3.65Å; Y607-L641 HydrophobicContact CD1-CG 3.98Å; Y607-L641 HydrophobicContact CE1-CB 3.87Å; Y607-L641 HydrophobicContact CE1-CD2 4.3Å; Y607-L641 HydrophobicContact CE1-CG 4.15Å; Y607-L641 WeakPolarHBondContact CE1-O 3.48Å; Y607-L641 HydrophobicContact CG-CD2 4.46Å; Y607-L641 PolarHBondContact OH-O 3.3Å; F612-L641 HydrophobicContact CE2-CG 4.28Å; P621-L641 HydrophobicContact CB-CD1 4.47Å; P621-L641 HydrophobicContact CG-CD1 3.38Å; P621-L641 HydrophobicContact CG-CG 4.4Å; E626-L641 WeakPolarHBondContact OE1-CD1 3.33Å; E626-L641 WeakPolarHBondContact OE2-CD1 3.44Å
642	Y	81.4	Confident	75.6	Confident	45 Å²	45	87.1 Å²	87.1	18%	0.176	47%	0.467	C	S	.	.	S	Bend	trans	-145.1	157.9	-175.5	63	-88.1	0	0	0	111.1	Y600 F603 Y607 G640 G644 Q645 V648	Y600-Y642 PolarHBondContact OH-OH 3.27Å; Y600-Y642 VanDerWaalsContact OH-OH 3.07Å; F603-Y642 HydrophobicContact CE1-CE1 4.06Å; Y607-Y642 WeakPolarHBondContact OH-CB 3.28Å; G640-Y642 VanDerWaalsContact C-N 3.26Å; G640-Y642 PolarHBondContact O-N 3.16Å; Y642-G644 PolarHBondContact O-N 3.5Å; Y642-Q645 HydrophobicContact CD1-CB 4.31Å; Y642-Q645 HydrophobicContact CD2-CB 4.39Å; Y642-Q645 HydrophobicContact CE1-CB 3.99Å; Y642-Q645 HydrophobicContact CE1-CG 4.02Å; Y642-Q645 HydrophobicContact CE2-CB 4.09Å; Y642-Q645 HydrophobicContact CG-CB 4.48Å; Y642-Q645 PolarHBondContact O-N 3Å; Y642-V648 HydrophobicContact CE2-CB 4.48Å; Y642-V648 HydrophobicContact CE2-CG2 4.07Å; Y642-V648 WeakPolarHBondContact OH-CB 3.44Å; Y642-V648 WeakPolarHBondContact OH-CG1 3.43Å
643	T	80.7	Confident	75.9	Confident	143 Å²	143	83 Å²	83	88%	0.877	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	120.6	178.8	52.3	0	0	0	0	110.5
644	G	81.1	Confident	76.7	Confident	47 Å²	47	82 Å²	82	49%	0.485	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	11.4	179.2	0	0	0	0	0	115.9	Y642 E646 Y647 V648	Y642-G644 PolarHBondContact O-N 3.5Å; G644-E646 VanDerWaalsContact C-N 3.33Å; G644-E646 PolarHBondContact O-N 2.93Å; G644-Y647 WeakPolarHBondContact O-CB 3.47Å; G644-Y647 PolarHBondContact O-N 2.89Å; G644-Y647 VanDerWaalsContact O-N 3.12Å; G644-V648 PolarHBondContact O-N 3.4Å
645	Q	83.8	Confident	77.8	Confident	12 Å²	12	82.2 Å²	82.2	6%	0.056	45%	0.448	C	S	.	.	H	α-helix	trans	-52.9	-43.6	179.6	176.8	176.6	-9.9	0	0	114.2	Y642 Y647 V648 Q649	Y642-Q645 HydrophobicContact CD1-CB 4.31Å; Y642-Q645 HydrophobicContact CD2-CB 4.39Å; Y642-Q645 HydrophobicContact CE1-CB 3.99Å; Y642-Q645 HydrophobicContact CE1-CG 4.02Å; Y642-Q645 HydrophobicContact CE2-CB 4.09Å; Y642-Q645 HydrophobicContact CG-CB 4.48Å; Y642-Q645 PolarHBondContact O-N 3Å; Q645-Y647 VanDerWaalsContact C-N 3.25Å; Q645-Y647 PolarHBondContact O-N 2.96Å; Q645-V648 PolarHBondContact O-N 3.08Å; Q645-Q649 HydrophobicContact CG-CG 4.2Å; Q645-Q649 VanDerWaalsContact NE2-NE2 3.15Å; Q645-Q649 WeakPolarHBondContact O-CB 3.46Å; Q645-Q649 WeakPolarHBondContact O-CG 3.29Å; Q645-Q649 PolarHBondContact O-N 3.32Å
646	E	81.9	Confident	79.4	Confident	105 Å²	105	75.5 Å²	75.5	49%	0.491	41%	0.407	S	S	.	.	H	α-helix	trans	-60.7	-36.2	-179.4	-66.9	-174.4	-176.5	0	0	112.2	G644 R650	G644-E646 VanDerWaalsContact C-N 3.33Å; G644-E646 PolarHBondContact O-N 2.93Å; E646-R650 VanDerWaalsContact O-CG 3.26Å; E646-R650 WeakPolarHBondContact O-CG 3.4Å; E646-R650 PolarHBondContact O-N 3.08Å; E646-R650 VanDerWaalsContact O-N 3.14Å
647	Y	86.6	Confident	80.9	Confident	174 Å²	174	74.9 Å²	74.9	68%	0.682	41%	0.406	S	S	*	.	H	α-helix	trans	-69.1	-46.9	178.7	-178.3	-98.3	0	0	0	111	G644 Q645 R650 V651	G644-Y647 WeakPolarHBondContact O-CB 3.47Å; G644-Y647 PolarHBondContact O-N 2.89Å; G644-Y647 VanDerWaalsContact O-N 3.12Å; Q645-Y647 VanDerWaalsContact C-N 3.25Å; Q645-Y647 PolarHBondContact O-N 2.96Å; Y647-R650 PolarHBondContact O-N 3.05Å; Y647-V651 HydrophobicContact CD1-CG2 4.31Å; Y647-V651 HydrophobicContact CE1-CG2 3.92Å; Y647-V651 HydrophobicContact CE2-CG2 4.49Å; Y647-V651 WeakPolarHBondContact O-CG2 3.48Å; Y647-V651 PolarHBondContact O-N 3.22Å
648	V	87.9	Confident	82.4	Confident	48 Å²	48	71 Å²	71	29%	0.291	40%	0.395	S	S	.	.	H	α-helix	trans	-60.4	-48.2	178	176.1	0	0	0	0	110.6	Y600 Y642 G644 Q645 R650 V651 L652	Y600-V648 HydrophobicContact CE2-CG1 4.28Å; Y642-V648 HydrophobicContact CE2-CB 4.48Å; Y642-V648 HydrophobicContact CE2-CG2 4.07Å; Y642-V648 WeakPolarHBondContact OH-CB 3.44Å; Y642-V648 WeakPolarHBondContact OH-CG1 3.43Å; G644-V648 PolarHBondContact O-N 3.4Å; Q645-V648 PolarHBondContact O-N 3.08Å; V648-R650 VanDerWaalsContact C-N 3.33Å; V648-R650 PolarHBondContact O-N 3.23Å; V648-V651 PolarHBondContact O-N 3.04Å; V648-L652 HydrophobicContact CG1-CD1 3.67Å; V648-L652 WeakPolarHBondContact O-CD1 3.44Å; V648-L652 PolarHBondContact O-N 2.88Å
649	Q	87.6	Confident	83.8	Confident	25 Å²	25	67.7 Å²	67.7	12%	0.117	38%	0.375	C	S	.	.	H	α-helix	trans	-58.3	-42.2	178.3	-76	-178.8	-24.1	0	0	112.7	Y600 M630 Q645 L652 L653	Y600-Q649 HydrophobicContact CE1-CG 3.98Å; M630-Q649 HydrophobicContact CG-CB 4.13Å; M630-Q649 HydrophobicContact CG-CG 4.11Å; M630-Q649 HydrophobicContact SD-CG 4.37Å; Q645-Q649 HydrophobicContact CG-CG 4.2Å; Q645-Q649 VanDerWaalsContact NE2-NE2 3.15Å; Q645-Q649 WeakPolarHBondContact O-CB 3.46Å; Q645-Q649 WeakPolarHBondContact O-CG 3.29Å; Q645-Q649 PolarHBondContact O-N 3.32Å; Q649-L652 PolarHBondContact O-N 3.05Å; Q649-L653 WeakPolarHBondContact O-CB 3.43Å; Q649-L653 PolarHBondContact O-N 3.31Å
650	R	87.7	Confident	85	Confident	150 Å²	150	64.6 Å²	64.6	57%	0.566	36%	0.36	S	S	*	.	H	α-helix	trans	-63.8	-44	176.1	-73.8	176.2	-171.7	-174.4	6.8	112	F633 E646 Y647 V648 L653 V654	F633-R650 HydrophobicContact CE1-CG 4.42Å; E646-R650 VanDerWaalsContact O-CG 3.26Å; E646-R650 WeakPolarHBondContact O-CG 3.4Å; E646-R650 PolarHBondContact O-N 3.08Å; E646-R650 VanDerWaalsContact O-N 3.14Å; Y647-R650 PolarHBondContact O-N 3.05Å; V648-R650 VanDerWaalsContact C-N 3.33Å; V648-R650 PolarHBondContact O-N 3.23Å; R650-L653 PolarHBondContact O-N 3.16Å; R650-V654 VanDerWaalsContact O-CG2 3.29Å; R650-V654 WeakPolarHBondContact O-CG2 3.24Å; R650-V654 PolarHBondContact O-N 3.49Å
651	V	90.4	Very high	86	Confident	63 Å²	63	66 Å²	66	38%	0.382	36%	0.362	S	S	.	.	H	α-helix	trans	-61.5	-47.2	177.6	171.4	0	0	0	0	110.9	Y647 V648 L653 V654 V655	Y647-V651 HydrophobicContact CD1-CG2 4.31Å; Y647-V651 HydrophobicContact CE1-CG2 3.92Å; Y647-V651 HydrophobicContact CE2-CG2 4.49Å; Y647-V651 WeakPolarHBondContact O-CG2 3.48Å; Y647-V651 PolarHBondContact O-N 3.22Å; V648-V651 PolarHBondContact O-N 3.04Å; V651-L653 VanDerWaalsContact C-N 3.32Å; V651-L653 PolarHBondContact O-N 3.03Å; V651-V654 PolarHBondContact O-N 3.44Å; V651-V655 WeakPolarHBondContact O-CG2 3.32Å; V651-V655 PolarHBondContact O-N 3.42Å
652	L	89	Confident	86.6	Confident	36 Å²	36	68.2 Å²	68.2	19%	0.188	38%	0.376	C	S	.	.	H	α-helix	trans	-61.8	-40.3	179.6	-89.3	69.4	0	0	0	111.9	C596 Y600 V648 Q649 V655 T656	C596-L652 HydrophobicContact CB-CG 4.49Å; C596-L652 WeakPolarHBondContact O-CD2 3.4Å; Y600-L652 HydrophobicContact CD2-CD2 3.75Å; Y600-L652 HydrophobicContact CG-CD2 3.76Å; V648-L652 HydrophobicContact CG1-CD1 3.67Å; V648-L652 WeakPolarHBondContact O-CD1 3.44Å; V648-L652 PolarHBondContact O-N 2.88Å; Q649-L652 PolarHBondContact O-N 3.05Å; L652-V655 PolarHBondContact O-N 3.23Å; L652-T656 WeakPolarHBondContact O-CB 3.41Å; L652-T656 PolarHBondContact O-N 2.99Å; L652-T656 PolarHBondContact O-OG1 3.33Å
653	L	87.9	Confident	86.7	Confident	37 Å²	37	66.4 Å²	66.4	19%	0.194	37%	0.369	C	S	.	.	H	α-helix	trans	-69.6	-38.1	178.6	-165.6	148.9	0	0	0	112	M630 F631 F633 Q649 R650 V651 T656 A657	M630-L653 WeakPolarHBondContact O-CD1 3.27Å; F631-L653 HydrophobicContact CD1-CD1 4.01Å; F633-L653 HydrophobicContact CE1-CD1 4.25Å; F633-L653 HydrophobicContact CE2-CD1 4Å; F633-L653 HydrophobicContact CE2-CD2 4.19Å; F633-L653 HydrophobicContact CZ-CD1 3.5Å; F633-L653 VanDerWaalsContact CZ-CD1 3.5Å; F633-L653 HydrophobicContact CZ-CD2 3.72Å; F633-L653 HydrophobicContact CZ-CG 4.1Å; Q649-L653 WeakPolarHBondContact O-CB 3.43Å; Q649-L653 PolarHBondContact O-N 3.31Å; R650-L653 PolarHBondContact O-N 3.16Å; V651-L653 VanDerWaalsContact C-N 3.32Å; V651-L653 PolarHBondContact O-N 3.03Å; L653-T656 PolarHBondContact O-N 2.97Å; L653-A657 WeakPolarHBondContact O-CB 3.31Å; L653-A657 PolarHBondContact O-N 3.29Å
654	V	90.2	Very high	86.9	Confident	98 Å²	98	63.2 Å²	63.2	59%	0.594	34%	0.343	S	S	*	.	H	α-helix	trans	-62.5	-44.6	173.7	170.3	0	0	0	0	111.3	R650 V651 T656 A657 L658	R650-V654 VanDerWaalsContact O-CG2 3.29Å; R650-V654 WeakPolarHBondContact O-CG2 3.24Å; R650-V654 PolarHBondContact O-N 3.49Å; V651-V654 PolarHBondContact O-N 3.44Å; V654-T656 VanDerWaalsContact C-N 3.3Å; V654-T656 PolarHBondContact O-N 3.28Å; V654-A657 PolarHBondContact O-N 3.05Å; V654-L658 WeakPolarHBondContact O-CB 3.37Å; V654-L658 PolarHBondContact O-N 2.97Å
655	V	90.1	Very high	87	Confident	56 Å²	56	64.5 Å²	64.5	34%	0.339	34%	0.339	S	S	.	.	H	α-helix	trans	-60.6	-43	176	171.6	0	0	0	0	110.9	V651 L652 L658 S659	V651-V655 WeakPolarHBondContact O-CG2 3.32Å; V651-V655 PolarHBondContact O-N 3.42Å; L652-V655 PolarHBondContact O-N 3.23Å; V655-L658 PolarHBondContact O-N 3.33Å; V655-S659 PolarHBondContact O-N 3.33Å
656	T	87.4	Confident	86.8	Confident	13 Å²	13	64.5 Å²	64.5	8%	0.08	34%	0.342	C	S	.	.	H	α-helix	trans	-63.6	-46.1	177.4	-54.6	0	0	0	0	111.2	F593 C596 I597 L652 L653 V654 L658 S659	F593-T656 HydrophobicContact CD2-CG2 3.41Å; F593-T656 VanDerWaalsContact CD2-CG2 3.41Å; F593-T656 HydrophobicContact CE2-CG2 3.54Å; F593-T656 HydrophobicContact CG-CG2 4.39Å; C596-T656 WeakPolarHBondContact CB-OG1 3.49Å; I597-T656 HydrophobicContact CD1-CG2 3.68Å; I597-T656 HydrophobicContact CG1-CG2 3.98Å; L652-T656 WeakPolarHBondContact O-CB 3.41Å; L652-T656 PolarHBondContact O-N 2.99Å; L652-T656 PolarHBondContact O-OG1 3.33Å; L653-T656 PolarHBondContact O-N 2.97Å; V654-T656 VanDerWaalsContact C-N 3.3Å; V654-T656 PolarHBondContact O-N 3.28Å; T656-L658 VanDerWaalsContact C-N 3.29Å; T656-L658 PolarHBondContact O-N 3.05Å; T656-S659 PolarHBondContact O-N 3.46Å; T656-S659 VanDerWaalsContact O-N 3.16Å; T656-S659 PolarHBondContact O-OG 3.27Å
657	A	88.4	Confident	86.8	Confident	58 Å²	58	62.2 Å²	62.2	48%	0.479	33%	0.33	S	S	.	.	H	α-helix	trans	-62.4	-35.5	178	0	0	0	0	0	112.4	L653 V654 P661	L653-A657 WeakPolarHBondContact O-CB 3.31Å; L653-A657 PolarHBondContact O-N 3.29Å; V654-A657 PolarHBondContact O-N 3.05Å; A657-P661 WeakPolarHBondContact O-CD 3.49Å
658	L	89	Confident	86.6	Confident	123 Å²	123	54 Å²	54	64%	0.644	30%	0.298	S	S	*	.	H	α-helix	trans	-71.2	-31.7	176	-168.4	75.8	0	0	0	112.5	V654 V655 T656 V660 P661 V662	V654-L658 WeakPolarHBondContact O-CB 3.37Å; V654-L658 PolarHBondContact O-N 2.97Å; V655-L658 PolarHBondContact O-N 3.33Å; T656-L658 VanDerWaalsContact C-N 3.29Å; T656-L658 PolarHBondContact O-N 3.05Å; L658-V660 VanDerWaalsContact C-N 3.32Å; L658-V660 PolarHBondContact O-N 3.49Å; L658-P661 WeakPolarHBondContact O-CD 3.43Å; L658-V662 WeakPolarHBondContact O-CG2 3.4Å
659	S	86.4	Confident	86.3	Confident	11 Å²	11	56 Å²	56	8%	0.077	31%	0.307	C	S	.	.	H	α-helix	trans	-67.1	-30.3	-179.3	72.7	0	0	0	0	113.5	V655 T656 V662 L663	V655-S659 PolarHBondContact O-N 3.33Å; T656-S659 PolarHBondContact O-N 3.46Å; T656-S659 VanDerWaalsContact O-N 3.16Å; T656-S659 PolarHBondContact O-OG 3.27Å; S659-V662 PolarHBondContact O-N 3.34Å; S659-L663 PolarHBondContact O-N 3.36Å
660	V	87.2	Confident	86	Confident	62 Å²	62	58.1 Å²	58.1	38%	0.376	32%	0.316	S	S	.	.	H	α-helix	trans	-67	-50.2	-176.8	173.7	0	0	0	0	112.5	F593 L658 V662 L663 F664	F593-V660 HydrophobicContact CD2-CG2 4.27Å; F593-V660 HydrophobicContact CE2-CG2 4.14Å; L658-V660 VanDerWaalsContact C-N 3.32Å; L658-V660 PolarHBondContact O-N 3.49Å; V660-V662 VanDerWaalsContact C-N 3.28Å; V660-V662 PolarHBondContact O-N 3.18Å; V660-L663 PolarHBondContact O-N 3.06Å; V660-F664 PolarHBondContact O-N 3.08Å; V660-F664 VanDerWaalsContact O-N 3.1Å
661	P	87.1	Confident	85.7	Confident	71 Å²	71	52.7 Å²	52.7	46%	0.461	30%	0.298	S	S	.	.	H	α-helix	trans	-59.5	-35.9	173.2	-26.4	34.1	0	0	0	113.9	A657 L658 F664 L665	A657-P661 WeakPolarHBondContact O-CD 3.49Å; L658-P661 WeakPolarHBondContact O-CD 3.43Å; P661-F664 PolarHBondContact O-N 3.06Å; P661-L665 PolarHBondContact O-N 3.27Å
662	V	86.9	Confident	85.1	Confident	56 Å²	56	52.3 Å²	52.3	34%	0.339	29%	0.293	S	S	.	.	H	α-helix	trans	-64.6	-42.2	177.9	176.7	0	0	0	0	110.6	P589 L658 S659 V660 G666	P589-V662 HydrophobicContact CG-CB 4.37Å; P589-V662 HydrophobicContact CG-CG1 3.69Å; L658-V662 WeakPolarHBondContact O-CG2 3.4Å; S659-V662 PolarHBondContact O-N 3.34Å; V660-V662 VanDerWaalsContact C-N 3.28Å; V660-V662 PolarHBondContact O-N 3.18Å; V662-G666 WeakPolarHBondContact O-CA 3.11Å; V662-G666 PolarHBondContact O-N 3.46Å
663	L	84.4	Confident	84.8	Confident	6 Å²	6	59.2 Å²	59.2	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-65.6	-39.5	177.4	-168.5	67.6	0	0	0	112.2	V586 P589 E590 S659 V660 Q735 S739 Y742	V586-L663 HydrophobicContact CB-CD1 4.49Å; V586-L663 HydrophobicContact CG1-CD1 4.09Å; P589-L663 HydrophobicContact CB-CD1 4.48Å; E590-L663 HydrophobicContact CG-CD1 3.89Å; E590-L663 HydrophobicContact CG-CD2 4.43Å; S659-L663 PolarHBondContact O-N 3.36Å; V660-L663 PolarHBondContact O-N 3.06Å; L663-Q735 PolarHBondContact O-NE2 3.15Å; L663-S739 PolarHBondContact O-OG 3.17Å; L663-Y742 HydrophobicContact CD2-CD1 4.47Å
664	F	84.7	Confident	84.5	Confident	76 Å²	76	60.9 Å²	60.9	33%	0.333	33%	0.326	S	S	.	.	H	α-helix	trans	-72.4	-49.9	-177.2	-170.3	-90.4	0	0	0	112.8	V660 P661 V736	V660-F664 PolarHBondContact O-N 3.08Å; V660-F664 VanDerWaalsContact O-N 3.1Å; P661-F664 PolarHBondContact O-N 3.06Å; F664-V736 HydrophobicContact CD2-CB 4.34Å; F664-V736 HydrophobicContact CD2-CG1 4.39Å; F664-V736 HydrophobicContact CD2-CG2 3.87Å; F664-V736 HydrophobicContact CE1-CG2 3.93Å; F664-V736 HydrophobicContact CE2-CB 3.74Å; F664-V736 HydrophobicContact CE2-CG1 3.54Å; F664-V736 HydrophobicContact CE2-CG2 3.17Å; F664-V736 HydrophobicContact CZ-CB 4.22Å; F664-V736 HydrophobicContact CZ-CG1 4.16Å; F664-V736 HydrophobicContact CZ-CG2 3.2Å
665	L	81.9	Confident	83.7	Confident	75 Å²	75	60.6 Å²	60.6	39%	0.393	32%	0.318	S	S	.	.	H	α-helix	trans	-98.9	-18.9	-172.9	-65.1	178.4	0	0	0	114.1	P661 K667 P668 L669	P661-L665 PolarHBondContact O-N 3.27Å; L665-K667 PolarHBondContact O-N 3.35Å; L665-P668 WeakPolarHBondContact O-CD 3.43Å; L665-P668 WeakPolarHBondContact O-CG 3.14Å; L665-L669 HydrophobicContact CB-CD1 3.7Å; L665-L669 HydrophobicContact CB-CG 4.21Å; L665-L669 HydrophobicContact CD1-CD1 4.42Å; L665-L669 VanDerWaalsContact O-CB 3.23Å; L665-L669 WeakPolarHBondContact O-CB 3.25Å; L665-L669 VanDerWaalsContact O-CG 3.23Å; L665-L669 WeakPolarHBondContact O-CG 3.42Å; L665-L669 PolarHBondContact O-N 3.11Å; L665-L669 VanDerWaalsContact O-N 3.08Å
666	G	80.2	Confident	82.9	Confident	12 Å²	12	62.2 Å²	62.2	12%	0.124	33%	0.325	C	S	.	.	H	α-helix	trans	-58.7	-56.3	-168.3	0	0	0	0	0	113.3	V662 F670	V662-G666 WeakPolarHBondContact O-CA 3.11Å; V662-G666 PolarHBondContact O-N 3.46Å; G666-F670 VanDerWaalsContact O-CB 3.26Å; G666-F670 WeakPolarHBondContact O-CB 3.22Å; G666-F670 PolarHBondContact O-N 3.24Å
667	K	81.7	Confident	81.7	Confident	57 Å²	57	63.5 Å²	63.5	25%	0.248	34%	0.34	C	S	.	.	H	α-helix	trans	-63.8	-51.5	-179.1	-172.3	-175.1	176.9	-168.4	0	114	F581 L665 F670 L671 Q735	F581-K667 HydrophobicContact CE2-CG 4.11Å; L665-K667 PolarHBondContact O-N 3.35Å; K667-F670 PolarHBondContact O-N 3.4Å; K667-L671 HydrophobicContact CG-CD1 4.13Å; K667-L671 WeakPolarHBondContact O-CG 3.4Å; K667-L671 PolarHBondContact O-N 2.89Å; K667-Q735 HydrophobicContact CB-CG 4.45Å; K667-Q735 VanDerWaalsContact CD-OE1 3.29Å
668	P	83.4	Confident	80.2	Confident	1 Å²	1	70 Å²	70	1%	0.006	35%	0.352	C	S	.	.	H	α-helix	trans	-65	-40.5	-178.3	23.3	-33.5	0	0	0	112.2	L665 F670 L671 L672 F728 I731 L732	L665-P668 WeakPolarHBondContact O-CD 3.43Å; L665-P668 WeakPolarHBondContact O-CG 3.14Å; P668-F670 PolarHBondContact O-N 3.47Å; P668-L671 PolarHBondContact O-N 3.47Å; P668-L672 WeakPolarHBondContact O-CB 3.29Å; P668-L672 PolarHBondContact O-N 3.4Å; P668-F728 HydrophobicContact CB-CE2 3.94Å; P668-F728 HydrophobicContact CB-CZ 4.37Å; P668-I731 HydrophobicContact CB-CG2 4.44Å; P668-L732 HydrophobicContact CB-CD1 4.12Å; P668-L732 HydrophobicContact CG-CD1 3.86Å
669	L	81.3	Confident	78.3	Confident	89 Å²	89	67.5 Å²	67.5	47%	0.466	35%	0.345	S	S	.	.	H	α-helix	trans	-66.2	-38.1	177	-69.6	178.7	0	0	0	112.2	L665 L672 W673	L665-L669 HydrophobicContact CB-CD1 3.7Å; L665-L669 HydrophobicContact CB-CG 4.21Å; L665-L669 HydrophobicContact CD1-CD1 4.42Å; L665-L669 VanDerWaalsContact O-CB 3.23Å; L665-L669 WeakPolarHBondContact O-CB 3.25Å; L665-L669 VanDerWaalsContact O-CG 3.23Å; L665-L669 WeakPolarHBondContact O-CG 3.42Å; L665-L669 PolarHBondContact O-N 3.11Å; L665-L669 VanDerWaalsContact O-N 3.08Å; L669-L672 PolarHBondContact O-N 3.04Å; L669-W673 WeakPolarHBondContact O-CB 3.43Å; L669-W673 PolarHBondContact O-N 2.99Å
670	F	81.8	Confident	76.1	Confident	71 Å²	71	72.3 Å²	72.3	31%	0.311	38%	0.378	S	S	.	.	H	α-helix	trans	-65.2	-42.5	176.6	-178.1	-96.9	0	0	0	112.1	F581 L585 G666 K667 P668 W673 L674	F581-F670 HydrophobicContact CB-CD1 3.72Å; F581-F670 HydrophobicContact CB-CE1 3.43Å; F581-F670 VanDerWaalsContact CB-CE1 3.43Å; F581-F670 HydrophobicContact CB-CG 4.46Å; F581-F670 HydrophobicContact CB-CZ 3.97Å; F581-F670 HydrophobicContact CD1-CE1 4.26Å; F581-F670 AromaticContact CD2-CD1 3.98Å; F581-F670 HydrophobicContact CD2-CD1 3.98Å; F581-F670 HydrophobicContact CD2-CE1 4.31Å; F581-F670 AromaticContact CG-CD1 3.91Å; F581-F670 HydrophobicContact CG-CD1 3.91Å; F581-F670 AromaticContact CG-CE1 3.77Å; F581-F670 HydrophobicContact CG-CE1 3.77Å; L585-F670 HydrophobicContact CD1-CB 3.64Å; L585-F670 HydrophobicContact CD1-CD1 4.46Å; L585-F670 HydrophobicContact CD1-CD2 4.29Å; L585-F670 HydrophobicContact CD1-CG 3.87Å; G666-F670 VanDerWaalsContact O-CB 3.26Å; G666-F670 WeakPolarHBondContact O-CB 3.22Å; G666-F670 PolarHBondContact O-N 3.24Å; K667-F670 PolarHBondContact O-N 3.4Å; P668-F670 PolarHBondContact O-N 3.47Å; F670-W673 HydrophobicContact CE2-CE3 4.35Å; F670-W673 HydrophobicContact CE2-CZ3 4.41Å; F670-W673 PolarHBondContact O-N 3.08Å; F670-L674 WeakPolarHBondContact O-CB 3.37Å; F670-L674 PolarHBondContact O-N 3.4Å
671	L	79.9	Confident	73.9	Confident	35 Å²	35	78.4 Å²	78.4	18%	0.183	40%	0.399	C	S	.	.	H	α-helix	trans	-66.8	-39.6	176.7	-71.4	170.6	0	0	0	111.9	K667 P668 L674 H675 F726 I731	K667-L671 HydrophobicContact CG-CD1 4.13Å; K667-L671 WeakPolarHBondContact O-CG 3.4Å; K667-L671 PolarHBondContact O-N 2.89Å; P668-L671 PolarHBondContact O-N 3.47Å; L671-L674 PolarHBondContact O-N 2.72Å; L671-H675 WeakPolarHBondContact O-CB 3.47Å; L671-H675 PolarHBondContact O-N 3.28Å; L671-F726 HydrophobicContact CB-CE2 4.06Å; L671-F726 HydrophobicContact CB-CZ 3.93Å; L671-I731 HydrophobicContact CD1-CD1 4.44Å; L671-I731 HydrophobicContact CD1-CG2 4.01Å
672	L	79.3	Confident	71.7	Confident	55 Å²	55	77.7 Å²	77.7	29%	0.288	41%	0.405	S	S	.	.	H	α-helix	trans	-62.5	-42.7	173.9	-174.3	70.8	0	0	0	111.7	P668 L669 H675 N676 F728	P668-L672 WeakPolarHBondContact O-CB 3.29Å; P668-L672 PolarHBondContact O-N 3.4Å; L669-L672 PolarHBondContact O-N 3.04Å; L672-H675 PolarHBondContact O-N 3.03Å; L672-N676 WeakPolarHBondContact O-CB 3.43Å; L672-N676 PolarHBondContact O-N 3.28Å; L672-F728 HydrophobicContact CB-CD2 4.29Å; L672-F728 HydrophobicContact CB-CE2 4Å; L672-F728 HydrophobicContact CD1-CD2 4.1Å; L672-F728 HydrophobicContact CD1-CE2 4.33Å; L672-F728 HydrophobicContact CD2-CE2 4.17Å; L672-F728 HydrophobicContact CD2-CZ 4.44Å; L672-F728 HydrophobicContact CG-CE2 4.41Å
673	W	81.5	Confident	69.5	Low	181 Å²	181	81 Å²	81	69%	0.686	43%	0.425	S	S	*	.	H	α-helix	trans	-63.4	-42.3	176	-180	78.1	0	0	0	111.9	L669 F670 N676 G677	L669-W673 WeakPolarHBondContact O-CB 3.43Å; L669-W673 PolarHBondContact O-N 2.99Å; F670-W673 HydrophobicContact CE2-CE3 4.35Å; F670-W673 HydrophobicContact CE2-CZ3 4.41Å; F670-W673 PolarHBondContact O-N 3.08Å; W673-N676 PolarHBondContact O-N 2.82Å; W673-G677 PolarHBondContact O-N 3.5Å
674	L	80.9	Confident	67.1	Low	72 Å²	72	88.3 Å²	88.3	38%	0.377	46%	0.464	S	S	.	.	H	α-helix	trans	-64.1	-40.6	176.4	-175	66.5	0	0	0	112.1	F670 L671 R678	F670-L674 WeakPolarHBondContact O-CB 3.37Å; F670-L674 PolarHBondContact O-N 3.4Å; L671-L674 PolarHBondContact O-N 2.72Å; L674-R678 PolarHBondContact O-N 3.46Å; L674-R678 VanDerWaalsContact O-N 3.07Å
675	H	74.5	Confident	64.7	Low	93 Å²	93	95.3 Å²	95.3	43%	0.431	49%	0.488	S	S	.	.	H	α-helix	trans	-65.7	-48.8	177.1	-177.1	-93.8	0	0	0	111.6	L671 L672 G677 R678 S679	L671-H675 WeakPolarHBondContact O-CB 3.47Å; L671-H675 PolarHBondContact O-N 3.28Å; L672-H675 PolarHBondContact O-N 3.03Å; H675-G677 VanDerWaalsContact C-N 3.33Å; H675-G677 PolarHBondContact O-N 3.04Å; H675-R678 PolarHBondContact O-N 3.21Å; H675-S679 PolarHBondContact O-N 3.46Å
676	N	73.6	Confident	62.6	Low	90 Å²	90	98 Å²	98	48%	0.481	51%	0.513	S	S	.	.	H	α-helix	trans	-66.7	-33.8	178.2	-72.5	-3.5	0	0	0	112.2	L672 W673 S679 C680	L672-N676 WeakPolarHBondContact O-CB 3.43Å; L672-N676 PolarHBondContact O-N 3.28Å; W673-N676 PolarHBondContact O-N 2.82Å; N676-S679 PolarHBondContact O-N 3.21Å; N676-C680 WeakPolarHBondContact O-CB 2.98Å; N676-C680 PolarHBondContact O-N 3.29Å
677	G	60.9	Low	60.3	Low	39 Å²	39	99.3 Å²	99.3	40%	0.402	53%	0.527	S	S	.	.	H	α-helix	trans	-67	-35.7	173.7	0	0	0	0	0	113.6	W673 H675 F681	W673-G677 PolarHBondContact O-N 3.5Å; H675-G677 VanDerWaalsContact C-N 3.33Å; H675-G677 PolarHBondContact O-N 3.04Å; G677-F681 PolarHBondContact O-N 3.37Å
678	R	57.4	Low	57.9	Low	194 Å²	194	107.6 Å²	107.6	73%	0.732	56%	0.558	S	S	*	*	H	α-helix	trans	-72.1	-37.9	172.1	-85.1	-178.9	171.2	173.1	-3.2	112.6	L674 H675 F681 G682	L674-R678 PolarHBondContact O-N 3.46Å; L674-R678 VanDerWaalsContact O-N 3.07Å; H675-R678 PolarHBondContact O-N 3.21Å; R678-F681 PolarHBondContact O-N 3.04Å; R678-G682 PolarHBondContact O-N 2.88Å; R678-G682 VanDerWaalsContact O-N 3.16Å
679	S	49.8	Very low	55.3	Low	71 Å²	71	114.1 Å²	114.1	50%	0.497	60%	0.598	S	S	.	*	H	α-helix	trans	-64.6	-38.5	174.7	-177.6	0	0	0	0	112	H675 N676 F681 G682	H675-S679 PolarHBondContact O-N 3.46Å; N676-S679 PolarHBondContact O-N 3.21Å; S679-F681 PolarHBondContact O-N 3.22Å; S679-G682 PolarHBondContact O-N 3.12Å
680	C	39.7	Very low	52.8	Low	113 Å²	113	117.8 Å²	117.8	76%	0.764	62%	0.618	S	S	*	*	H	α-helix	trans	-71.5	-25.7	179.8	-157	0	0	0	0	113.8	N676	N676-C680 WeakPolarHBondContact O-CB 2.98Å; N676-C680 PolarHBondContact O-N 3.29Å
681	F	40.6	Very low	50.4	Low	190 Å²	190	121.2 Å²	121.2	83%	0.833	64%	0.638	S	S	*	*	H	α-helix	trans	-91.6	-9.9	174.3	-129	-88.8	0	0	0	113.6	G677 R678 S679	G677-F681 PolarHBondContact O-N 3.37Å; R678-F681 PolarHBondContact O-N 3.04Å; S679-F681 PolarHBondContact O-N 3.22Å
682	G	41.2	Very low	47.8	Very low	56 Å²	56	130.4 Å²	130.4	58%	0.577	67%	0.67	S	S	*	*	S	Bend	trans	-92.9	-4	-170.7	0	0	0	0	0	116.5	R678 S679	R678-G682 PolarHBondContact O-N 2.88Å; R678-G682 VanDerWaalsContact O-N 3.16Å; S679-G682 PolarHBondContact O-N 3.12Å
683	V	39.8	Very low	45.3	Very low	125 Å²	125	135.9 Å²	135.9	76%	0.758	69%	0.691	S	S	*	*	S	Bend	trans	-92.5	-5.2	-176.2	-179.4	0	0	0	0	113.5
684	N	35.3	Very low	42.6	Very low	160 Å²	160	135.9 Å²	135.9	86%	0.856	70%	0.699	S	S	*	*	S	Bend	trans	-128.8	21.2	-175.3	-118	10.3	0	0	0	117
685	R	34	Very low	40	Very low	222 Å²	222	137.7 Å²	137.7	84%	0.838	72%	0.717	S	S	*	*			trans	-146.1	73.3	171.5	-111.5	177.6	166.8	179.6	-5.4	111.9
686	S	37.2	Very low	37.7	Very low	132 Å²	132	141.3 Å²	141.3	92%	0.923	74%	0.735	S	S	*	*			trans	-67.9	131.5	149.3	-176.2	0	0	0	0	108
687	G	33.6	Very low	35.5	Very low	40 Å²	40	145.7 Å²	145.7	41%	0.412	75%	0.752	S	S	.	*	S	Bend	trans	98.2	128.1	177.3	0	0	0	0	0	114.5
688	Y	31.2	Very low	33.9	Very low	231 Å²	231	152.9 Å²	152.9	91%	0.906	78%	0.776	S	S	*	*			trans	87.3	88.4	169.6	-46.7	-75.4	0	0	0	117.1	L690	Y688-L690 PolarHBondContact O-N 2.87Å
689	T	27.6	Very low	32.4	Very low	137 Å²	137	150.3 Å²	150.3	84%	0.84	78%	0.781	S	S	*	*			trans	-65.9	104.7	156.1	38.3	0	0	0	0	109.8	I691	T689-I691 PolarHBondContact O-N 2.8Å
690	L	28.6	Very low	31.2	Very low	167 Å²	167	151.6 Å²	151.6	87%	0.874	79%	0.79	S	S	*	*			trans	-82.1	95.5	172	-142.5	153.7	0	0	0	108.6	Y688 R692	Y688-L690 PolarHBondContact O-N 2.87Å; L690-R692 PolarHBondContact O-N 2.99Å
691	I	31	Very low	30.5	Very low	143 Å²	143	153.3 Å²	153.3	73%	0.733	79%	0.791	S	S	*	*			trans	-57.4	112.9	166.4	-67.3	167.2	0	0	0	107.7	T689 K693	T689-I691 PolarHBondContact O-N 2.8Å; I691-K693 PolarHBondContact O-N 3.49Å
692	R	26.3	Very low	29.8	Very low	228 Å²	228	152.2 Å²	152.2	86%	0.86	79%	0.793	S	S	*	*			trans	-78	102.7	168.3	-179.2	175.9	152.7	105.9	3.4	108	L690	L690-R692 PolarHBondContact O-N 2.99Å
693	K	27	Very low	29	Very low	170 Å²	170	152.8 Å²	152.8	74%	0.739	80%	0.799	S	S	*	*			trans	-56.3	126.3	175.6	-126.8	178.6	179.8	-175.9	0	112.7	I691	I691-K693 PolarHBondContact O-N 3.49Å
694	E	23.6	Very low	28.2	Very low	180 Å²	180	153.9 Å²	153.9	84%	0.841	80%	0.801	S	S	*	*			trans	-152.3	87.3	135.4	-91.9	179.9	-173	0	0	103.2
695	S	26.2	Very low	27.7	Very low	110 Å²	110	154 Å²	154	77%	0.769	80%	0.796	S	S	*	*				173.7	157.8	84	33.5	0	0	0	0	107.2
696	E	27.7	Very low	27.2	Very low	170 Å²	170	149.5 Å²	149.5	79%	0.794	79%	0.788	S	S	*	*			trans	-57.1	140.8	-178.7	-62.8	157.7	160.3	0	0	110.7
697	E	26.3	Very low	26.6	Very low	181 Å²	181	148.8 Å²	148.8	85%	0.846	78%	0.778	S	S	*	*				-170.9	162	74.7	-81.9	177.2	154.9	0	0	110.5
698	E	26.8	Very low	26.3	Very low	191 Å²	191	154.8 Å²	154.8	89%	0.893	80%	0.796	S	S	*	*			trans	80.6	88.2	165.4	-59.7	-164.5	162.2	0	0	120
699	V	26.5	Very low	26	Very low	139 Å²	139	152.9 Å²	152.9	84%	0.842	80%	0.795	S	S	*	*			trans	-80.5	130.9	145.1	170.1	0	0	0	0	108.1
700	S	24.1	Very low	25.9	Very low	99 Å²	99	149.9 Å²	149.9	69%	0.692	79%	0.791	S	S	*	*				155.2	123.7	123.9	51.6	0	0	0	0	112.1
701	L	26.3	Very low	25.8	Very low	148 Å²	148	148.8 Å²	148.8	78%	0.775	79%	0.786	S	S	*	*				170.4	114.6	118.3	-86.1	165.2	0	0	0	109.9
702	L	25.8	Very low	25.4	Very low	167 Å²	167	150.9 Å²	150.9	87%	0.874	79%	0.793	S	S	*	*			trans	62.7	135.1	143.4	-57.6	160.7	0	0	0	117.4
703	G	23.7	Very low	25.6	Very low	69 Å²	69	148.8 Å²	148.8	71%	0.711	79%	0.793	S	S	*	*			cis	138.9	104.8	20.1	0	0	0	0	0	108.1
704	N	23.5	Very low	25.6	Very low	148 Å²	148	147 Å²	147	79%	0.791	80%	0.796	S	S	*	*			trans	37	137.7	147	-79.4	4.9	0	0	0	124.1
705	Q	24.5	Very low	26	Very low	161 Å²	161	147.9 Å²	147.9	75%	0.752	80%	0.8	S	S	*	*			trans	76.2	143.4	148.5	-67.6	176.4	-42.7	0	0	117
706	D	23.2	Very low	26	Very low	128 Å²	128	149.8 Å²	149.8	68%	0.684	80%	0.801	S	S	*	*			cis	-174.1	155.1	-2.9	-102.7	-21.8	0	0	0	106.3
707	V	25.7	Very low	26	Very low	118 Å²	118	145.2 Å²	145.2	72%	0.715	80%	0.8	S	S	*	*			trans	80.2	115.7	146.6	175.9	0	0	0	0	121.8
708	E	25.6	Very low	25.8	Very low	166 Å²	166	142 Å²	142	78%	0.776	80%	0.796	S	S	*	*			trans	55.4	130.8	134.7	-63.6	177.2	157.2	0	0	125.1
709	E	27	Very low	25.8	Very low	191 Å²	191	144.3 Å²	144.3	89%	0.893	80%	0.797	S	S	*	*			trans	63.5	123.9	142	-70.9	-173.8	163.1	0	0	121
710	G	23.8	Very low	25.7	Very low	74 Å²	74	146.7 Å²	146.7	76%	0.763	80%	0.798	S	S	*	*			trans	158.5	83.3	163.8	0	0	0	0	0	113.6	H712	G710-H712 PolarHBondContact O-N 3.27Å
711	D	26.9	Very low	25.8	Very low	144 Å²	144	149.2 Å²	149.2	77%	0.77	80%	0.801	S	S	*	*			trans	-48.3	123.2	166.6	-172	25.6	0	0	0	111.9
712	H	23.7	Very low	25.8	Very low	186 Å²	186	146.4 Å²	146.4	86%	0.861	80%	0.799	S	S	*	*			trans	-163.7	118.7	150.1	-90.6	-54.1	0	0	0	111.3	G710 V714	G710-H712 PolarHBondContact O-N 3.27Å; H712-V714 PolarHBondContact O-N 2.9Å
713	Q	30.2	Very low	26	Very low	185 Å²	185	143.8 Å²	143.8	86%	0.864	79%	0.794	S	S	*	*			trans	-50.8	124.8	170.5	-68.9	163.2	-15.9	0	0	112.6
714	V	26.8	Very low	26.8	Very low	132 Å²	132	149.4 Å²	149.4	80%	0.8	80%	0.801	S	S	*	*			trans	-138.4	118.3	150.2	-178.2	0	0	0	0	107.3	H712 D716	H712-V714 PolarHBondContact O-N 2.9Å; V714-D716 PolarHBondContact O-N 3.48Å
715	E	31.7	Very low	27.9	Very low	199 Å²	199	151 Å²	151	93%	0.93	80%	0.804	S	S	*	*			trans	-54.1	115.2	168.7	-71.8	174.5	134.6	0	0	109.7
716	D	25.8	Very low	29.8	Very low	149 Å²	149	147.1 Å²	147.1	80%	0.797	79%	0.785	S	S	*	*			trans	-120.4	110.1	159	-155	2.4	0	0	0	108.7	V714 C718	V714-D716 PolarHBondContact O-N 3.48Å; D716-C718 PolarHBondContact O-N 2.94Å
717	G	27.3	Very low	32.5	Very low	75 Å²	75	145.2 Å²	145.2	77%	0.773	78%	0.775	S	S	*	*			trans	-70.5	76.2	-179.5	0	0	0	0	0	111.1	R719	G717-R719 PolarHBondContact O-N 3.39Å; G717-R719 VanDerWaalsContact O-N 3.13Å
718	C	23.7	Very low	35.2	Very low	112 Å²	112	142.7 Å²	142.7	76%	0.757	75%	0.754	S	S	*	*			trans	-69.1	104.3	157.4	-90.8	0	0	0	0	108.1	D716 E720	D716-C718 PolarHBondContact O-N 2.94Å; C718-E720 PolarHBondContact O-N 2.96Å
719	R	25.9	Very low	38.1	Very low	241 Å²	241	136.6 Å²	136.6	91%	0.909	74%	0.736	S	S	*	*			trans	-38.3	110.6	165.3	-90.9	166.6	72.6	145.2	-2.4	109	G717 M721	G717-R719 PolarHBondContact O-N 3.39Å; G717-R719 VanDerWaalsContact O-N 3.13Å; R719-M721 PolarHBondContact O-N 3.11Å
720	E	25.3	Very low	41	Very low	188 Å²	188	133.6 Å²	133.6	88%	0.879	72%	0.722	S	S	*	*			trans	-46	114.8	167.3	-74.7	177.5	146.4	0	0	108.1	C718 A722	C718-E720 PolarHBondContact O-N 2.96Å; E720-A722 VanDerWaalsContact C-N 3.28Å; E720-A722 PolarHBondContact O-N 3.34Å
721	M	25.8	Very low	44	Very low	153 Å²	153	132 Å²	132	75%	0.754	70%	0.696	S	S	*	*			trans	-63.8	99.1	164	-167.1	168	-167.9	0	0	105.1	R719 C723	R719-M721 PolarHBondContact O-N 3.11Å; M721-C723 PolarHBondContact O-N 3.06Å
722	A	26.1	Very low	46.9	Very low	88 Å²	88	127.7 Å²	127.7	73%	0.727	67%	0.672	S	S	*	*			trans	-57.6	93.5	170.3	0	0	0	0	0	107.8	E720 E724	E720-A722 VanDerWaalsContact C-N 3.28Å; E720-A722 PolarHBondContact O-N 3.34Å; A722-E724 VanDerWaalsContact C-N 3.3Å; A722-E724 PolarHBondContact O-N 2.88Å
723	C	29.9	Very low	50	Low	112 Å²	112	125.3 Å²	125.3	76%	0.757	66%	0.663	S	S	*	*			trans	-58.6	104.6	151.7	-85.5	0	0	0	0	104.5	M721 E725	M721-C723 PolarHBondContact O-N 3.06Å; C723-E725 PolarHBondContact O-N 3.08Å
724	E	39.9	Very low	52.7	Low	188 Å²	188	120.6 Å²	120.6	88%	0.879	65%	0.647	S	S	*	*			trans	-47.6	113.8	165.3	-75.9	-179.9	161.9	0	0	107.1	A722 F726	A722-E724 VanDerWaalsContact C-N 3.3Å; A722-E724 PolarHBondContact O-N 2.88Å; E724-F726 PolarHBondContact O-N 3.47Å; E724-F726 VanDerWaalsContact O-N 3.13Å
725	E	46.5	Very low	55.6	Low	181 Å²	181	114.6 Å²	114.6	85%	0.846	61%	0.61	S	S	*	*			trans	-55.2	121.9	174.7	-71.9	-174.8	155.2	0	0	107.5	C723 N727	C723-E725 PolarHBondContact O-N 3.08Å; E725-N727 VanDerWaalsContact C-N 3.27Å; E725-N727 PolarHBondContact O-N 3.39Å
726	F	64	Low	58.4	Low	79 Å²	79	106.6 Å²	106.6	35%	0.346	58%	0.575	S	S	.	*			trans	-67.6	90.2	177.8	178.2	-99	0	0	0	109	L671 E724 F728 I731	L671-F726 HydrophobicContact CB-CE2 4.06Å; L671-F726 HydrophobicContact CB-CZ 3.93Å; E724-F726 PolarHBondContact O-N 3.47Å; E724-F726 VanDerWaalsContact O-N 3.13Å; F726-F728 HydrophobicContact CE1-CB 4.06Å; F726-F728 HydrophobicContact CE1-CD2 4.29Å; F726-F728 PolarHBondContact O-N 3.14Å; F726-I731 HydrophobicContact CD2-CD1 3.76Å; F726-I731 HydrophobicContact CE2-CD1 3.28Å; F726-I731 HydrophobicContact CZ-CD1 3.8Å
727	N	81.3	Confident	61.5	Low	89 Å²	89	104.4 Å²	104.4	48%	0.476	56%	0.562	S	S	.	*			trans	-86.8	90.9	-179.4	-160.4	-16.7	0	0	0	109.9	E725 G729 E730 I731	E725-N727 VanDerWaalsContact C-N 3.27Å; E725-N727 PolarHBondContact O-N 3.39Å; N727-G729 PolarHBondContact O-N 2.93Å; N727-G729 PolarHBondContact OD1-N 3.38Å; N727-E730 HydrophobicContact CB-CB 4.07Å; N727-E730 PolarHBondContact O-N 3.25Å; N727-E730 VanDerWaalsContact O-N 3.14Å; N727-I731 PolarHBondContact O-N 3.4Å
728	F	82.5	Confident	64.4	Low	65 Å²	65	104.4 Å²	104.4	29%	0.285	54%	0.542	S	S	.	.	H	α-helix	trans	-54.9	-35.9	178.9	178.2	-99.3	0	0	0	112.4	P668 L672 F726 I731 L732	P668-F728 HydrophobicContact CB-CE2 3.94Å; P668-F728 HydrophobicContact CB-CZ 4.37Å; L672-F728 HydrophobicContact CB-CD2 4.29Å; L672-F728 HydrophobicContact CB-CE2 4Å; L672-F728 HydrophobicContact CD1-CD2 4.1Å; L672-F728 HydrophobicContact CD1-CE2 4.33Å; L672-F728 HydrophobicContact CD2-CE2 4.17Å; L672-F728 HydrophobicContact CD2-CZ 4.44Å; L672-F728 HydrophobicContact CG-CE2 4.41Å; F726-F728 HydrophobicContact CE1-CB 4.06Å; F726-F728 HydrophobicContact CE1-CD2 4.29Å; F726-F728 PolarHBondContact O-N 3.14Å; F728-I731 PolarHBondContact O-N 3.37Å; F728-L732 HydrophobicContact CE1-CD2 4.2Å; F728-L732 WeakPolarHBondContact O-CB 3.44Å; F728-L732 PolarHBondContact O-N 2.88Å
729	G	86.2	Confident	67.4	Low	38 Å²	38	99.4 Å²	99.4	39%	0.392	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-41.9	179.1	0	0	0	0	0	112.6	N727 M733	N727-G729 PolarHBondContact O-N 2.93Å; N727-G729 PolarHBondContact OD1-N 3.38Å; G729-M733 WeakPolarHBondContact O-CB 3.07Å; G729-M733 WeakPolarHBondContact O-CG 3.39Å; G729-M733 PolarHBondContact O-N 3.35Å
730	E	88.1	Confident	70.5	Confident	127 Å²	127	92.3 Å²	92.3	59%	0.593	49%	0.487	S	S	*	.	H	α-helix	trans	-66.5	-48.3	177.6	-170.7	177.5	175.6	0	0	111.2	N727 L732 M733 T734	N727-E730 HydrophobicContact CB-CB 4.07Å; N727-E730 PolarHBondContact O-N 3.25Å; N727-E730 VanDerWaalsContact O-N 3.14Å; E730-L732 VanDerWaalsContact C-N 3.3Å; E730-L732 PolarHBondContact O-N 3.08Å; E730-M733 PolarHBondContact O-N 3.32Å; E730-T734 PolarHBondContact O-N 3.31Å; E730-T734 PolarHBondContact O-OG1 2.89Å
731	I	86	Confident	73.6	Confident	42 Å²	42	88.1 Å²	88.1	22%	0.215	47%	0.468	C	S	.	.	H	α-helix	trans	-59.9	-42.1	178.8	-64.5	167.6	0	0	0	111.3	P668 L671 F726 N727 F728 Q735	P668-I731 HydrophobicContact CB-CG2 4.44Å; L671-I731 HydrophobicContact CD1-CD1 4.44Å; L671-I731 HydrophobicContact CD1-CG2 4.01Å; F726-I731 HydrophobicContact CD2-CD1 3.76Å; F726-I731 HydrophobicContact CE2-CD1 3.28Å; F726-I731 HydrophobicContact CZ-CD1 3.8Å; N727-I731 PolarHBondContact O-N 3.4Å; F728-I731 PolarHBondContact O-N 3.37Å; I731-Q735 VanDerWaalsContact O-CB 3.32Å; I731-Q735 WeakPolarHBondContact O-CB 3.47Å; I731-Q735 PolarHBondContact O-N 2.9Å
732	L	87.8	Confident	76.7	Confident	53 Å²	53	81.5 Å²	81.5	28%	0.277	43%	0.434	S	S	.	.	H	α-helix	trans	-63	-51.9	176.5	-177.5	66.7	0	0	0	110.2	P668 F728 E730 T734 Q735 V736	P668-L732 HydrophobicContact CB-CD1 4.12Å; P668-L732 HydrophobicContact CG-CD1 3.86Å; F728-L732 HydrophobicContact CE1-CD2 4.2Å; F728-L732 WeakPolarHBondContact O-CB 3.44Å; F728-L732 PolarHBondContact O-N 2.88Å; E730-L732 VanDerWaalsContact C-N 3.3Å; E730-L732 PolarHBondContact O-N 3.08Å; L732-T734 PolarHBondContact O-N 3.28Å; L732-Q735 PolarHBondContact O-N 3.46Å; L732-V736 HydrophobicContact CD1-CG2 4.39Å; L732-V736 HydrophobicContact CG-CG2 4.38Å; L732-V736 VanDerWaalsContact O-CG2 3.24Å; L732-V736 WeakPolarHBondContact O-CG2 2.96Å; L732-V736 PolarHBondContact O-N 3.38Å
733	M	88.8	Confident	79.6	Confident	135 Å²	135	78.4 Å²	78.4	67%	0.665	41%	0.407	S	S	*	.	H	α-helix	trans	-56.9	-48.9	179.1	-79.7	-128.5	-171.4	0	0	112.3	G729 E730 Q735 V736 I737	G729-M733 WeakPolarHBondContact O-CB 3.07Å; G729-M733 WeakPolarHBondContact O-CG 3.39Å; G729-M733 PolarHBondContact O-N 3.35Å; E730-M733 PolarHBondContact O-N 3.32Å; M733-Q735 VanDerWaalsContact C-N 3.29Å; M733-Q735 PolarHBondContact O-N 2.87Å; M733-V736 PolarHBondContact O-N 3.37Å; M733-I737 VanDerWaalsContact O-CG1 3.3Å; M733-I737 WeakPolarHBondContact O-CG1 3.46Å; M733-I737 PolarHBondContact O-N 3.07Å
734	T	87.9	Confident	82.4	Confident	86 Å²	86	78.6 Å²	78.6	53%	0.528	40%	0.4	S	S	.	.	H	α-helix	trans	-60.2	-40.3	178.4	-51.4	0	0	0	0	111.5	E730 L732 H738	E730-T734 PolarHBondContact O-N 3.31Å; E730-T734 PolarHBondContact O-OG1 2.89Å; L732-T734 PolarHBondContact O-N 3.28Å; T734-H738 WeakPolarHBondContact O-CB 3.49Å; T734-H738 PolarHBondContact O-N 3.12Å
735	Q	88	Confident	84.8	Confident	6 Å²	6	70.4 Å²	70.4	3%	0.028	37%	0.366	C	S	.	.	H	α-helix	trans	-69.7	-38.3	178.3	-171.7	65.7	21.1	0	0	112.5	L663 K667 I731 L732 M733 H738 S739	L663-Q735 PolarHBondContact O-NE2 3.15Å; K667-Q735 HydrophobicContact CB-CG 4.45Å; K667-Q735 VanDerWaalsContact CD-OE1 3.29Å; I731-Q735 VanDerWaalsContact O-CB 3.32Å; I731-Q735 WeakPolarHBondContact O-CB 3.47Å; I731-Q735 PolarHBondContact O-N 2.9Å; L732-Q735 PolarHBondContact O-N 3.46Å; M733-Q735 VanDerWaalsContact C-N 3.29Å; M733-Q735 PolarHBondContact O-N 2.87Å; Q735-H738 PolarHBondContact O-N 3.13Å; Q735-S739 WeakPolarHBondContact O-CB 3.09Å; Q735-S739 PolarHBondContact O-N 2.67Å; Q735-S739 PolarHBondContact O-OG 3.42Å
736	V	89.3	Confident	86.7	Confident	31 Å²	31	61.8 Å²	61.8	19%	0.188	33%	0.326	C	S	.	.	H	α-helix	trans	-59.8	-50.6	174.2	167.1	0	0	0	0	110.4	F664 L732 M733 H738 S739 I740	F664-V736 HydrophobicContact CD2-CB 4.34Å; F664-V736 HydrophobicContact CD2-CG1 4.39Å; F664-V736 HydrophobicContact CD2-CG2 3.87Å; F664-V736 HydrophobicContact CE1-CG2 3.93Å; F664-V736 HydrophobicContact CE2-CB 3.74Å; F664-V736 HydrophobicContact CE2-CG1 3.54Å; F664-V736 HydrophobicContact CE2-CG2 3.17Å; F664-V736 HydrophobicContact CZ-CB 4.22Å; F664-V736 HydrophobicContact CZ-CG1 4.16Å; F664-V736 HydrophobicContact CZ-CG2 3.2Å; L732-V736 HydrophobicContact CD1-CG2 4.39Å; L732-V736 HydrophobicContact CG-CG2 4.38Å; L732-V736 VanDerWaalsContact O-CG2 3.24Å; L732-V736 WeakPolarHBondContact O-CG2 2.96Å; L732-V736 PolarHBondContact O-N 3.38Å; M733-V736 PolarHBondContact O-N 3.37Å; V736-H738 PolarHBondContact O-N 3.4Å; V736-S739 PolarHBondContact O-N 3.45Å; V736-I740 HydrophobicContact CG1-CD1 3.73Å; V736-I740 HydrophobicContact CG1-CG1 4.5Å; V736-I740 WeakPolarHBondContact O-CG1 3.33Å; V736-I740 PolarHBondContact O-N 3.31Å
737	I	90.3	Very high	88	Confident	103 Å²	103	62.8 Å²	62.8	53%	0.528	33%	0.334	S	S	.	.	H	α-helix	trans	-58.5	-50.3	179.6	-66.9	165.5	0	0	0	109.7	M733 S739 I740 E741	M733-I737 VanDerWaalsContact O-CG1 3.3Å; M733-I737 WeakPolarHBondContact O-CG1 3.46Å; M733-I737 PolarHBondContact O-N 3.07Å; I737-S739 VanDerWaalsContact C-N 3.31Å; I737-S739 PolarHBondContact O-N 3.32Å; I737-I740 PolarHBondContact O-N 2.98Å; I737-E741 VanDerWaalsContact O-CB 3.26Å; I737-E741 WeakPolarHBondContact O-CB 3.36Å; I737-E741 PolarHBondContact O-N 3.13Å
738	H	88.3	Confident	88.5	Confident	76 Å²	76	62.3 Å²	62.3	35%	0.352	34%	0.337	S	S	.	.	H	α-helix	trans	-57	-42.7	178.2	-179.3	-96.7	0	0	0	112.7	E590 T734 Q735 V736 Y742	E590-H738 IonicContact OE1-CE1 3.23Å; E590-H738 PolarHBondContact OE1-CE1 3.49Å; T734-H738 WeakPolarHBondContact O-CB 3.49Å; T734-H738 PolarHBondContact O-N 3.12Å; Q735-H738 PolarHBondContact O-N 3.13Å; V736-H738 PolarHBondContact O-N 3.4Å; H738-Y742 VanDerWaalsContact O-CB 3.24Å; H738-Y742 WeakPolarHBondContact O-CB 3.4Å; H738-Y742 PolarHBondContact O-N 2.97Å
739	S	88.4	Confident	88.9	Confident	6 Å²	6	59.8 Å²	59.8	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-66.9	-43.2	-179.6	-55.2	0	0	0	0	112	L663 Q735 V736 I737 C743	L663-S739 PolarHBondContact O-OG 3.17Å; Q735-S739 WeakPolarHBondContact O-CB 3.09Å; Q735-S739 PolarHBondContact O-N 2.67Å; Q735-S739 PolarHBondContact O-OG 3.42Å; V736-S739 PolarHBondContact O-N 3.45Å; I737-S739 VanDerWaalsContact C-N 3.31Å; I737-S739 PolarHBondContact O-N 3.32Å; S739-C743 WeakPolarHBondContact O-CB 3.32Å; S739-C743 PolarHBondContact O-N 2.93Å; S739-C743 PolarHBondContact O-SG 3.46Å; S739-C743 VanDerWaalsContact O-SG 3.36Å
740	I	90.3	Very high	89.1	Confident	92 Å²	92	58.5 Å²	58.5	47%	0.472	31%	0.311	S	S	.	.	H	α-helix	trans	-67	-46.6	178.2	-68.3	171.3	0	0	0	110.2	V736 I737 Y742 C743 L744	V736-I740 HydrophobicContact CG1-CD1 3.73Å; V736-I740 HydrophobicContact CG1-CG1 4.5Å; V736-I740 WeakPolarHBondContact O-CG1 3.33Å; V736-I740 PolarHBondContact O-N 3.31Å; I737-I740 PolarHBondContact O-N 2.98Å; I740-Y742 VanDerWaalsContact C-N 3.32Å; I740-Y742 PolarHBondContact O-N 3.07Å; I740-C743 PolarHBondContact O-N 3.34Å; I740-L744 HydrophobicContact CG2-CD1 3.7Å; I740-L744 HydrophobicContact CG2-CG 4.37Å; I740-L744 WeakPolarHBondContact O-CB 3.41Å; I740-L744 WeakPolarHBondContact O-CG 3.37Å; I740-L744 PolarHBondContact O-N 3.31Å
741	E	90.8	Very high	89.2	Confident	101 Å²	101	55.1 Å²	55.1	47%	0.472	31%	0.305	S	S	.	.	H	α-helix	trans	-59.9	-43.5	177.3	-174.1	-178.5	172	0	0	111	I737 G745	I737-E741 VanDerWaalsContact O-CB 3.26Å; I737-E741 WeakPolarHBondContact O-CB 3.36Å; I737-E741 PolarHBondContact O-N 3.13Å; E741-G745 WeakPolarHBondContact O-CA 3.29Å; E741-G745 PolarHBondContact O-N 3.4Å
742	Y	89.4	Confident	89.5	Confident	13 Å²	13	53.8 Å²	53.8	5%	0.051	30%	0.299	C	S	.	.	H	α-helix	trans	-62.7	-52.5	177.5	-175.2	-88	0	0	0	111.7	E590 F593 M594 L663 H738 I740 G745 C746 K828	E590-Y742 HydrophobicContact CB-CE1 3.88Å; E590-Y742 HydrophobicContact CB-CE2 4.01Å; E590-Y742 WeakPolarHBondContact CB-OH 3.46Å; E590-Y742 HydrophobicContact CG-CD1 3.98Å; E590-Y742 HydrophobicContact CG-CD2 4.03Å; E590-Y742 HydrophobicContact CG-CE1 3.68Å; E590-Y742 HydrophobicContact CG-CE2 3.7Å; E590-Y742 HydrophobicContact CG-CG 4.16Å; E590-Y742 PolarHBondContact O-OH 3.48Å; E590-Y742 VanDerWaalsContact O-OH 3.11Å; F593-Y742 HydrophobicContact CD1-CE1 4.18Å; M594-Y742 HydrophobicContact CG-CE1 4.37Å; M594-Y742 VanDerWaalsContact CG-OH 3.24Å; M594-Y742 WeakPolarHBondContact CG-OH 3.29Å; L663-Y742 HydrophobicContact CD2-CD1 4.47Å; H738-Y742 VanDerWaalsContact O-CB 3.24Å; H738-Y742 WeakPolarHBondContact O-CB 3.4Å; H738-Y742 PolarHBondContact O-N 2.97Å; I740-Y742 VanDerWaalsContact C-N 3.32Å; I740-Y742 PolarHBondContact O-N 3.07Å; Y742-G745 PolarHBondContact O-N 2.95Å; Y742-C746 WeakPolarHBondContact CE1-SG 3.42Å; Y742-C746 VanDerWaalsContact CZ-SG 3.58Å; Y742-C746 WeakPolarHBondContact O-CB 3.39Å; Y742-C746 PolarHBondContact O-N 3.28Å; Y742-C746 PolarHBondContact O-SG 3.18Å; Y742-K828 HydrophobicContact CD2-CD 4.36Å; Y742-K828 HydrophobicContact CE2-CD 3.91Å
743	C	88.6	Confident	89.8	Confident	23 Å²	23	51.2 Å²	51.2	16%	0.155	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-48.2	-176.3	-72.6	0	0	0	0	112.4	F593 S739 I740 C746	F593-C743 HydrophobicContact CZ-CB 4.27Å; S739-C743 WeakPolarHBondContact O-CB 3.32Å; S739-C743 PolarHBondContact O-N 2.93Å; S739-C743 PolarHBondContact O-SG 3.46Å; S739-C743 VanDerWaalsContact O-SG 3.36Å; I740-C743 PolarHBondContact O-N 3.34Å; C743-C746 PolarHBondContact O-N 2.92Å
744	L	89.1	Confident	89.9	Confident	116 Å²	116	47.6 Å²	47.6	61%	0.607	27%	0.269	S	S	*	.	H	α-helix	trans	-69.1	-40.1	177.1	-67.2	176.9	0	0	0	111.4	I740 C746 I747 S748	I740-L744 HydrophobicContact CG2-CD1 3.7Å; I740-L744 HydrophobicContact CG2-CG 4.37Å; I740-L744 WeakPolarHBondContact O-CB 3.41Å; I740-L744 WeakPolarHBondContact O-CG 3.37Å; I740-L744 PolarHBondContact O-N 3.31Å; L744-C746 VanDerWaalsContact C-N 3.3Å; L744-C746 PolarHBondContact O-N 3.32Å; L744-I747 PolarHBondContact O-N 2.93Å; L744-S748 PolarHBondContact O-N 3.35Å
745	G	88.9	Confident	90.2	Very high	16 Å²	16	46.5 Å²	46.5	17%	0.165	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-37.1	176.4	0	0	0	0	0	112.3	E741 Y742 I747 S748 N749	E741-G745 WeakPolarHBondContact O-CA 3.29Å; E741-G745 PolarHBondContact O-N 3.4Å; Y742-G745 PolarHBondContact O-N 2.95Å; G745-I747 VanDerWaalsContact C-N 3.35Å; G745-I747 PolarHBondContact O-N 3.17Å; G745-S748 PolarHBondContact O-N 3.28Å; G745-N749 WeakPolarHBondContact O-CA 3.13Å; G745-N749 WeakPolarHBondContact O-CB 3.41Å; G745-N749 PolarHBondContact O-N 3.33Å; G745-N749 PolarHBondContact O-ND2 3.15Å; G745-N749 PolarHBondContact O-OD1 3.2Å
746	C	87.6	Confident	90.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.4	-40.6	177.3	-72.3	0	0	0	0	113	F593 M594 F598 Y742 C743 L744 T750 K828	F593-C746 HydrophobicContact CE1-CB 4.09Å; M594-C746 HydrophobicContact SD-CB 3.44Å; M594-C746 WeakPolarHBondContact SD-CB 3.47Å; M594-C746 PolarHBondContact SD-SG 2.98Å; F598-C746 HydrophobicContact CE2-CB 4.25Å; Y742-C746 WeakPolarHBondContact CE1-SG 3.42Å; Y742-C746 VanDerWaalsContact CZ-SG 3.58Å; Y742-C746 WeakPolarHBondContact O-CB 3.39Å; Y742-C746 PolarHBondContact O-N 3.28Å; Y742-C746 PolarHBondContact O-SG 3.18Å; C743-C746 PolarHBondContact O-N 2.92Å; L744-C746 VanDerWaalsContact C-N 3.3Å; L744-C746 PolarHBondContact O-N 3.32Å; C746-T750 WeakPolarHBondContact O-CB 3.31Å; C746-T750 PolarHBondContact O-N 3.14Å; C746-T750 PolarHBondContact O-OG1 3.13Å; C746-K828 PolarHBondContact SG-NZ 3.29Å; C746-K828 VanDerWaalsContact SG-NZ 3.42Å
747	I	90.1	Very high	90.7	Very high	101 Å²	101	47.6 Å²	47.6	52%	0.518	26%	0.256	S	S	.	.	H	α-helix	trans	-70.5	-48.7	176.7	-58.8	171.2	0	0	0	110.3	F598 L744 G745 T750 A751	F598-I747 HydrophobicContact CZ-CG1 4.12Å; L744-I747 PolarHBondContact O-N 2.93Å; G745-I747 VanDerWaalsContact C-N 3.35Å; G745-I747 PolarHBondContact O-N 3.17Å; I747-T750 PolarHBondContact O-N 2.95Å; I747-A751 PolarHBondContact O-N 2.86Å; I747-A751 VanDerWaalsContact O-N 3.11Å
748	S	91.8	Very high	90.9	Very high	78 Å²	78	45.1 Å²	45.1	55%	0.545	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-46.7	-179.9	-173.9	0	0	0	0	112.2	L744 G745 T750 A751 S752	L744-S748 PolarHBondContact O-N 3.35Å; G745-S748 PolarHBondContact O-N 3.28Å; S748-T750 PolarHBondContact O-N 3Å; S748-A751 PolarHBondContact O-N 3.24Å; S748-S752 WeakPolarHBondContact O-CB 3.24Å; S748-S752 PolarHBondContact O-N 3.41Å
749	N	90.9	Very high	91.1	Very high	12 Å²	12	42.7 Å²	42.7	6%	0.064	24%	0.24	C	C	.	.	H	α-helix	trans	-65.8	-39.7	-179.2	-66.1	-2.2	0	0	0	111.1	M563 G745 A751 S752 Y753 E824	M563-N749 HydrophobicContact SD-CB 3.67Å; G745-N749 WeakPolarHBondContact O-CA 3.13Å; G745-N749 WeakPolarHBondContact O-CB 3.41Å; G745-N749 PolarHBondContact O-N 3.33Å; G745-N749 PolarHBondContact O-ND2 3.15Å; G745-N749 PolarHBondContact O-OD1 3.2Å; N749-A751 PolarHBondContact O-N 3.21Å; N749-S752 VanDerWaalsContact O-CB 3.28Å; N749-S752 WeakPolarHBondContact O-CB 3.37Å; N749-S752 PolarHBondContact O-N 3.44Å; N749-Y753 WeakPolarHBondContact O-CD2 3.44Å; N749-Y753 PolarHBondContact O-N 3.4Å; N749-E824 HydrophobicContact CB-CB 4.32Å; N749-E824 HydrophobicContact CB-CG 3.75Å
750	T	90.3	Very high	91.3	Very high	11 Å²	11	42.5 Å²	42.5	7%	0.067	24%	0.239	C	C	.	.	H	α-helix	trans	-61.8	-43.9	174.7	-54.1	0	0	0	0	111.6	I560 M563 F598 C746 I747 S748 S752 Y753	I560-T750 HydrophobicContact CD1-CG2 4.18Å; I560-T750 HydrophobicContact CG1-CG2 3.91Å; M563-T750 HydrophobicContact CE-CG2 4.41Å; M563-T750 WeakPolarHBondContact CE-OG1 3.42Å; F598-T750 HydrophobicContact CD1-CG2 3.76Å; F598-T750 HydrophobicContact CE1-CG2 3.74Å; C746-T750 WeakPolarHBondContact O-CB 3.31Å; C746-T750 PolarHBondContact O-N 3.14Å; C746-T750 PolarHBondContact O-OG1 3.13Å; I747-T750 PolarHBondContact O-N 2.95Å; S748-T750 PolarHBondContact O-N 3Å; T750-S752 VanDerWaalsContact C-N 3.3Å; T750-S752 PolarHBondContact O-N 3.01Å; T750-Y753 PolarHBondContact O-N 2.75Å
751	A	90.3	Very high	91.3	Very high	56 Å²	56	40 Å²	40	46%	0.463	23%	0.227	S	C	.	.	H	α-helix	trans	-65.3	-34.5	175.8	0	0	0	0	0	112.2	I747 S748 N749 Y753 L754	I747-A751 PolarHBondContact O-N 2.86Å; I747-A751 VanDerWaalsContact O-N 3.11Å; S748-A751 PolarHBondContact O-N 3.24Å; N749-A751 PolarHBondContact O-N 3.21Å; A751-Y753 PolarHBondContact O-N 2.83Å; A751-L754 WeakPolarHBondContact O-CB 3.46Å; A751-L754 VanDerWaalsContact O-CG 3.28Å; A751-L754 WeakPolarHBondContact O-CG 3.41Å; A751-L754 PolarHBondContact O-N 2.87Å
752	S	92.1	Very high	91.4	Very high	14 Å²	14	37 Å²	37	10%	0.098	22%	0.218	C	C	.	.	H	α-helix	trans	-59.5	-31.7	177.5	-167.6	0	0	0	0	113.1	S748 N749 T750 L754 R755 E824	S748-S752 WeakPolarHBondContact O-CB 3.24Å; S748-S752 PolarHBondContact O-N 3.41Å; N749-S752 VanDerWaalsContact O-CB 3.28Å; N749-S752 WeakPolarHBondContact O-CB 3.37Å; N749-S752 PolarHBondContact O-N 3.44Å; T750-S752 VanDerWaalsContact C-N 3.3Å; T750-S752 PolarHBondContact O-N 3.01Å; S752-L754 PolarHBondContact O-N 3.43Å; S752-R755 WeakPolarHBondContact O-CB 3.38Å; S752-R755 VanDerWaalsContact O-CG 3.25Å; S752-R755 WeakPolarHBondContact O-CG 3.47Å; S752-R755 PolarHBondContact O-N 3.46Å; S752-R755 VanDerWaalsContact O-N 3.15Å; S752-R755 PolarHBondContact OG-NH1 3.34Å; S752-R755 PolarHBondContact OG-NH2 2.94Å; S752-R755 VanDerWaalsContact OG-NH2 3.08Å; S752-E824 VanDerWaalsContact CB-OE1 3.25Å; S752-E824 WeakPolarHBondContact CB-OE1 3.25Å; S752-E824 PolarHBondContact OG-OE1 2.61Å
753	Y	93.9	Very high	91.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-15.1	175.6	-79.9	-77.7	0	0	0	114.3	L407 G559 H562 M563 N749 T750 A751 R755 L756 L820 E824	L407-Y753 HydrophobicContact CD1-CE1 4.44Å; G559-Y753 VanDerWaalsContact CA-CD1 3.47Å; H562-Y753 AromaticContact ND1-CE1 3.96Å; H562-Y753 AromaticContact ND1-CZ 3.77Å; H562-Y753 PolarHBondContact ND1-OH 3.11Å; M563-Y753 HydrophobicContact CE-CD2 4Å; M563-Y753 HydrophobicContact CE-CE2 3.92Å; M563-Y753 HydrophobicContact CG-CE2 3.63Å; M563-Y753 HydrophobicContact SD-CD2 4.27Å; M563-Y753 HydrophobicContact SD-CE2 3.72Å; N749-Y753 WeakPolarHBondContact O-CD2 3.44Å; N749-Y753 PolarHBondContact O-N 3.4Å; T750-Y753 PolarHBondContact O-N 2.75Å; A751-Y753 PolarHBondContact O-N 2.83Å; Y753-R755 PolarHBondContact O-N 3.27Å; Y753-L756 HydrophobicContact CD1-CD1 3.85Å; Y753-L756 HydrophobicContact CD1-CG 4.47Å; Y753-L756 WeakPolarHBondContact O-CB 3.34Å; Y753-L756 WeakPolarHBondContact O-CG 3.33Å; Y753-L756 PolarHBondContact O-N 3.49Å; Y753-L820 HydrophobicContact CD1-CD1 4.05Å; Y753-L820 HydrophobicContact CD1-CD2 3.8Å; Y753-L820 HydrophobicContact CD1-CG 4.46Å; Y753-L820 HydrophobicContact CE1-CB 4.21Å; Y753-L820 HydrophobicContact CE1-CD1 4.07Å; Y753-L820 HydrophobicContact CE1-CD2 3.76Å; Y753-L820 HydrophobicContact CE1-CG 4.22Å; Y753-L820 HydrophobicContact CG-CD2 4.23Å; Y753-L820 PolarHBondContact OH-O 3.35Å; Y753-E824 HydrophobicContact CE2-CB 3.84Å; Y753-E824 HydrophobicContact CE2-CG 4.12Å; Y753-E824 WeakPolarHBondContact OH-CB 3.46Å
754	L	92.6	Very high	91.6	Very high	59 Å²	59	36.2 Å²	36.2	31%	0.309	22%	0.216	S	C	.	.	H	α-helix	trans	-59.5	-17.8	171.3	-66.5	174.8	0	0	0	112.9	M552 V556 A751 S752 L756 W757 A758	M552-L754 HydrophobicContact CG-CD2 3.83Å; V556-L754 HydrophobicContact CG2-CD2 3.95Å; A751-L754 WeakPolarHBondContact O-CB 3.46Å; A751-L754 VanDerWaalsContact O-CG 3.28Å; A751-L754 WeakPolarHBondContact O-CG 3.41Å; A751-L754 PolarHBondContact O-N 2.87Å; S752-L754 PolarHBondContact O-N 3.43Å; L754-L756 PolarHBondContact O-N 3.41Å; L754-W757 HydrophobicContact CB-CE3 4.36Å; L754-W757 HydrophobicContact CD2-CE3 4.3Å; L754-W757 WeakPolarHBondContact O-CB 3.48Å; L754-W757 PolarHBondContact O-N 2.93Å; L754-W757 VanDerWaalsContact O-N 3.13Å; L754-A758 PolarHBondContact O-N 3.3Å
755	R	94	Very high	91.7	Very high	63 Å²	63	33.6 Å²	33.6	24%	0.238	20%	0.2	C	C	.	.	H	α-helix	trans	-56.2	-36.6	170.3	-69.6	178.8	-165.3	138.2	11.1	112.7	M411 S752 Y753 W757 A758 L759 E824	M411-R755 HydrophobicContact CE-CB 3.78Å; S752-R755 WeakPolarHBondContact O-CB 3.38Å; S752-R755 VanDerWaalsContact O-CG 3.25Å; S752-R755 WeakPolarHBondContact O-CG 3.47Å; S752-R755 PolarHBondContact O-N 3.46Å; S752-R755 VanDerWaalsContact O-N 3.15Å; S752-R755 PolarHBondContact OG-NH1 3.34Å; S752-R755 PolarHBondContact OG-NH2 2.94Å; S752-R755 VanDerWaalsContact OG-NH2 3.08Å; Y753-R755 PolarHBondContact O-N 3.27Å; R755-W757 PolarHBondContact O-N 3.39Å; R755-A758 PolarHBondContact O-N 2.87Å; R755-L759 WeakPolarHBondContact O-CB 3.42Å; R755-L759 PolarHBondContact O-N 3.32Å; R755-E824 IonicContact NH1-OE1 3.92Å
756	L	93.8	Very high	91.8	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-56.5	-43.4	177.2	-65.3	172.6	0	0	0	110.6	L407 V410 M411 Y753 L754 S760 L820	L407-L756 HydrophobicContact CB-CD2 4.27Å; L407-L756 HydrophobicContact CD2-CD1 4.04Å; L407-L756 HydrophobicContact CD2-CD2 4.21Å; V410-L756 HydrophobicContact CG1-CB 4.16Å; V410-L756 HydrophobicContact CG1-CD2 4.46Å; M411-L756 HydrophobicContact CE-CD2 3.88Å; M411-L756 HydrophobicContact CE-CG 4.4Å; M411-L756 HydrophobicContact CG-CD2 3.76Å; M411-L756 HydrophobicContact SD-CD2 3.99Å; Y753-L756 HydrophobicContact CD1-CD1 3.85Å; Y753-L756 HydrophobicContact CD1-CG 4.47Å; Y753-L756 WeakPolarHBondContact O-CB 3.34Å; Y753-L756 WeakPolarHBondContact O-CG 3.33Å; Y753-L756 PolarHBondContact O-N 3.49Å; L754-L756 PolarHBondContact O-N 3.41Å; L756-S760 WeakPolarHBondContact O-CB 3.26Å; L756-S760 PolarHBondContact O-N 2.94Å; L756-L820 HydrophobicContact CD2-CD1 3.7Å; L756-L820 HydrophobicContact CG-CD1 3.98Å
757	W	94.1	Very high	91.9	Very high	58 Å²	58	36.6 Å²	36.6	22%	0.22	21%	0.213	C	C	.	.	H	α-helix	trans	-69.7	-51	175.7	158.2	51.5	0	0	0	112.2	N548 K551 M552 L754 R755 L759 S760 L761	N548-W757 WeakPolarHBondContact OD1-CZ2 3.22Å; N548-W757 PolarHBondContact OD1-NE1 3.29Å; K551-W757 HydrophobicContact CB-CB 4.37Å; K551-W757 VanDerWaalsContact CB-CD1 3.43Å; K551-W757 HydrophobicContact CB-CG 4.21Å; M552-W757 HydrophobicContact CB-CD2 4.04Å; M552-W757 HydrophobicContact CB-CE3 4.38Å; M552-W757 HydrophobicContact CB-CG 4.16Å; M552-W757 HydrophobicContact CG-CD2 4.41Å; M552-W757 HydrophobicContact CG-CE3 4.24Å; L754-W757 HydrophobicContact CB-CE3 4.36Å; L754-W757 HydrophobicContact CD2-CE3 4.3Å; L754-W757 WeakPolarHBondContact O-CB 3.48Å; L754-W757 PolarHBondContact O-N 2.93Å; L754-W757 VanDerWaalsContact O-N 3.13Å; R755-W757 PolarHBondContact O-N 3.39Å; W757-L759 PolarHBondContact O-N 2.97Å; W757-S760 PolarHBondContact O-N 3.48Å; W757-L761 HydrophobicContact CZ2-CD1 4.44Å; W757-L761 WeakPolarHBondContact O-CB 3.28Å; W757-L761 PolarHBondContact O-N 3.09Å
758	A	93.3	Very high	91.9	Very high	51 Å²	51	33.1 Å²	33.1	42%	0.421	20%	0.195	S	C	.	.	H	α-helix	trans	-59	-46.2	-174.3	0	0	0	0	0	112.2	L754 R755 L761 A762	L754-A758 PolarHBondContact O-N 3.3Å; R755-A758 PolarHBondContact O-N 2.87Å; A758-L761 PolarHBondContact O-N 3.49Å; A758-A762 WeakPolarHBondContact O-CB 3.5Å; A758-A762 PolarHBondContact O-N 3.42Å
759	L	93.3	Very high	91.9	Very high	26 Å²	26	32.6 Å²	32.6	14%	0.136	19%	0.189	C	C	.	.	H	α-helix	trans	-70.7	-40	-179.5	-135.7	71.7	0	0	0	111.8	M411 R755 W757 L761 A762 H763 A813 H816	M411-L759 HydrophobicContact CB-CB 4.34Å; M411-L759 HydrophobicContact CB-CD2 4.3Å; M411-L759 HydrophobicContact CE-CB 4.47Å; M411-L759 HydrophobicContact CE-CD2 4.31Å; M411-L759 HydrophobicContact CG-CB 4.21Å; M411-L759 HydrophobicContact CG-CD2 4.37Å; M411-L759 HydrophobicContact SD-CD2 4.07Å; R755-L759 WeakPolarHBondContact O-CB 3.42Å; R755-L759 PolarHBondContact O-N 3.32Å; W757-L759 PolarHBondContact O-N 2.97Å; L759-L761 VanDerWaalsContact C-N 3.28Å; L759-L761 PolarHBondContact O-N 2.86Å; L759-A762 PolarHBondContact O-N 3.46Å; L759-H763 WeakPolarHBondContact O-CB 3.48Å; L759-H763 PolarHBondContact O-N 3.42Å; L759-A813 VanDerWaalsContact CD2-CA 3.45Å; L759-A813 HydrophobicContact CD2-CB 3.73Å; L759-H816 HydrophobicContact CD2-CB 4.5Å
760	S	92.6	Very high	91.9	Very high	2 Å²	2	33 Å²	33	1%	0.014	19%	0.191	C	C	.	.	H	α-helix	trans	-63.4	-32.9	174.5	-171.9	0	0	0	0	113.2	V410 M411 Y468 K551 L756 W757 A764	V410-S760 VanDerWaalsContact O-CB 3.29Å; V410-S760 WeakPolarHBondContact O-CB 3.38Å; V410-S760 PolarHBondContact O-OG 3.32Å; V410-S760 VanDerWaalsContact O-OG 3.04Å; M411-S760 VanDerWaalsContact O-CA 3.24Å; M411-S760 WeakPolarHBondContact O-CA 3.45Å; Y468-S760 WeakPolarHBondContact CE2-OG 3.45Å; K551-S760 PolarHBondContact NZ-O 3.06Å; K551-S760 VanDerWaalsContact NZ-O 3.08Å; K551-S760 PolarHBondContact NZ-OG 3.39Å; L756-S760 WeakPolarHBondContact O-CB 3.26Å; L756-S760 PolarHBondContact O-N 2.94Å; W757-S760 PolarHBondContact O-N 3.48Å; S760-A764 WeakPolarHBondContact O-CB 3.41Å; S760-A764 PolarHBondContact O-N 3.22Å
761	L	90.9	Very high	91.9	Very high	40 Å²	40	35.2 Å²	35.2	21%	0.209	20%	0.198	C	C	.	.	H	α-helix	trans	-74	-46	174.4	-171.2	150.6	0	0	0	110.7	L544 N548 W757 A758 L759 H763 A764 Q765	L544-L761 HydrophobicContact CD1-CD1 4.02Å; L544-L761 HydrophobicContact CD1-CD2 4.36Å; L544-L761 HydrophobicContact CD1-CG 4.29Å; N548-L761 HydrophobicContact CB-CD1 4.3Å; W757-L761 HydrophobicContact CZ2-CD1 4.44Å; W757-L761 WeakPolarHBondContact O-CB 3.28Å; W757-L761 PolarHBondContact O-N 3.09Å; A758-L761 PolarHBondContact O-N 3.49Å; L759-L761 VanDerWaalsContact C-N 3.28Å; L759-L761 PolarHBondContact O-N 2.86Å; L761-H763 PolarHBondContact O-N 2.89Å; L761-A764 PolarHBondContact O-N 3.02Å; L761-Q765 HydrophobicContact CD2-CG 3.87Å; L761-Q765 WeakPolarHBondContact O-CG 3.2Å; L761-Q765 PolarHBondContact O-N 3.35Å
762	A	92.6	Very high	91.8	Very high	36 Å²	36	33.9 Å²	33.9	30%	0.298	19%	0.187	S	C	.	.	H	α-helix	trans	-57.8	-47	177.4	0	0	0	0	0	111.7	A758 L759 A764 Q765 L766	A758-A762 WeakPolarHBondContact O-CB 3.5Å; A758-A762 PolarHBondContact O-N 3.42Å; L759-A762 PolarHBondContact O-N 3.46Å; A762-A764 PolarHBondContact O-N 3.2Å; A762-Q765 PolarHBondContact O-N 3.43Å; A762-L766 WeakPolarHBondContact O-CB 3.45Å; A762-L766 WeakPolarHBondContact O-CG 3.27Å; A762-L766 PolarHBondContact O-N 3Å
763	H	91.4	Very high	91.6	Very high	5 Å²	5	39.7 Å²	39.7	2%	0.023	21%	0.214	C	C	.	.	H	α-helix	trans	-59.4	-45.2	177.6	-174.9	72.5	0	0	0	112.6	F412 H417 L759 L761 Q765 S767	F412-H763 AromaticContact CD2-CE1 3.7Å; F412-H763 AromaticContact CD2-ND1 3.83Å; F412-H763 AromaticContact CE2-CE1 3.13Å; F412-H763 WeakPolarHBondContact CE2-CE1 3.33Å; F412-H763 AromaticContact CE2-ND1 3.56Å; F412-H763 AromaticContact CE2-NE2 3.81Å; F412-H763 AromaticContact CZ-CE1 3.64Å; H417-H763 AromaticContact CE1-CE1 3.93Å; H417-H763 AromaticContact CE1-NE2 3.85Å; H417-H763 AromaticContact ND1-CE1 3.34Å; H417-H763 PolarHBondContact ND1-CE1 3.3Å; H417-H763 VanDerWaalsContact ND1-CE1 3.34Å; H417-H763 AromaticContact ND1-NE2 3.11Å; H417-H763 PolarHBondContact ND1-NE2 2.85Å; H417-H763 VanDerWaalsContact ND1-NE2 3.11Å; L759-H763 WeakPolarHBondContact O-CB 3.48Å; L759-H763 PolarHBondContact O-N 3.42Å; L761-H763 PolarHBondContact O-N 2.89Å; H763-Q765 VanDerWaalsContact C-N 3.35Å; H763-Q765 PolarHBondContact O-N 3.37Å; H763-S767 WeakPolarHBondContact O-CB 3.48Å; H763-S767 PolarHBondContact O-N 2.95Å; H763-S767 PolarHBondContact O-OG 2.96Å
764	A	89.9	Confident	91.2	Very high	16 Å²	16	41.1 Å²	41.1	13%	0.132	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-34.6	177.3	0	0	0	0	0	112.8	S760 L761 A762 S767 D768	S760-A764 WeakPolarHBondContact O-CB 3.41Å; S760-A764 PolarHBondContact O-N 3.22Å; L761-A764 PolarHBondContact O-N 3.02Å; A762-A764 PolarHBondContact O-N 3.2Å; A764-S767 WeakPolarHBondContact CA-OG 3.49Å; A764-S767 PolarHBondContact O-OG 3.28Å; A764-D768 PolarHBondContact O-N 3.35Å
765	Q	90.9	Very high	90.9	Very high	60 Å²	60	39.3 Å²	39.3	28%	0.28	21%	0.212	S	C	.	.	H	α-helix	trans	-74.9	-43.1	176.9	-68.1	-54.3	-61.5	0	0	112.3	L761 A762 H763 S767 D768 V769	L761-Q765 HydrophobicContact CD2-CG 3.87Å; L761-Q765 WeakPolarHBondContact O-CG 3.2Å; L761-Q765 PolarHBondContact O-N 3.35Å; A762-Q765 PolarHBondContact O-N 3.43Å; H763-Q765 VanDerWaalsContact C-N 3.35Å; H763-Q765 PolarHBondContact O-N 3.37Å; Q765-S767 VanDerWaalsContact C-N 3.33Å; Q765-S767 PolarHBondContact O-N 3.23Å; Q765-D768 PolarHBondContact O-N 3.17Å; Q765-V769 VanDerWaalsContact O-CG2 3.3Å; Q765-V769 WeakPolarHBondContact O-CG2 3.39Å; Q765-V769 PolarHBondContact O-N 3.12Å
766	L	91.2	Very high	90.4	Very high	72 Å²	72	43.6 Å²	43.6	38%	0.377	23%	0.228	S	C	.	.	H	α-helix	trans	-62.7	-40.9	178.5	-73.8	170.5	0	0	0	111.5	A762 V769 L770 L805 E809	A762-L766 WeakPolarHBondContact O-CB 3.45Å; A762-L766 WeakPolarHBondContact O-CG 3.27Å; A762-L766 PolarHBondContact O-N 3Å; L766-V769 PolarHBondContact O-N 3.32Å; L766-L770 VanDerWaalsContact O-CB 3.26Å; L766-L770 WeakPolarHBondContact O-CB 3.32Å; L766-L770 PolarHBondContact O-N 2.99Å; L766-L805 HydrophobicContact CB-CD2 3.85Å; L766-E809 HydrophobicContact CD1-CG 4.32Å; L766-E809 WeakPolarHBondContact CD1-OE1 3.24Å
767	S	90.4	Very high	89.9	Confident	7 Å²	7	47.9 Å²	47.9	5%	0.049	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-42.1	175.2	52.8	0	0	0	0	112.7	H763 A764 Q765 L770 W771	H763-S767 WeakPolarHBondContact O-CB 3.48Å; H763-S767 PolarHBondContact O-N 2.95Å; H763-S767 PolarHBondContact O-OG 2.96Å; A764-S767 WeakPolarHBondContact CA-OG 3.49Å; A764-S767 PolarHBondContact O-OG 3.28Å; Q765-S767 VanDerWaalsContact C-N 3.33Å; Q765-S767 PolarHBondContact O-N 3.23Å; S767-L770 PolarHBondContact O-N 3.24Å; S767-W771 WeakPolarHBondContact O-CB 3.32Å; S767-W771 PolarHBondContact O-N 3.3Å
768	D	89.6	Confident	89.1	Confident	28 Å²	28	45.4 Å²	45.4	15%	0.15	25%	0.246	C	C	.	.	H	α-helix	trans	-67.6	-40	177	-166.5	23.3	0	0	0	112.3	S473 K474 R543 A764 Q765 W771 A772	S473-D768 VanDerWaalsContact CB-CA 3.45Å; K474-D768 IonicContact NZ-OD1 2.72Å; R543-D768 IonicContact CZ-OD2 2.78Å; R543-D768 IonicContact NH1-OD2 3.97Å; R543-D768 IonicContact NH2-OD2 3.6Å; R543-D768 PolarHBondContact NH2-OD2 3.26Å; A764-D768 PolarHBondContact O-N 3.35Å; Q765-D768 PolarHBondContact O-N 3.17Å; D768-W771 PolarHBondContact O-N 2.9Å; D768-A772 VanDerWaalsContact O-CB 3.23Å; D768-A772 WeakPolarHBondContact O-CB 3.3Å; D768-A772 PolarHBondContact O-N 3Å
769	V	91.3	Very high	88.6	Confident	67 Å²	67	48.2 Å²	48.2	41%	0.406	25%	0.254	S	S	.	.	H	α-helix	trans	-62.7	-45.2	174.5	171.4	0	0	0	0	110.8	Q765 L766 W771 A772 M773	Q765-V769 VanDerWaalsContact O-CG2 3.3Å; Q765-V769 WeakPolarHBondContact O-CG2 3.39Å; Q765-V769 PolarHBondContact O-N 3.12Å; L766-V769 PolarHBondContact O-N 3.32Å; V769-W771 PolarHBondContact O-N 3.43Å; V769-A772 PolarHBondContact O-N 3.47Å; V769-M773 HydrophobicContact CG1-CE 3.79Å; V769-M773 HydrophobicContact CG1-CG 4.24Å; V769-M773 HydrophobicContact CG1-SD 3.82Å; V769-M773 WeakPolarHBondContact O-CB 3.34Å; V769-M773 WeakPolarHBondContact O-CG 3.47Å; V769-M773 PolarHBondContact O-N 3.3Å
770	L	90.8	Very high	88	Confident	21 Å²	21	57.6 Å²	57.6	11%	0.11	29%	0.287	C	S	.	.	H	α-helix	trans	-63.9	-42.7	179.4	-163.5	156.4	0	0	0	110.7	L766 S767 L774 F797 L800 T801 L805	L766-L770 VanDerWaalsContact O-CB 3.26Å; L766-L770 WeakPolarHBondContact O-CB 3.32Å; L766-L770 PolarHBondContact O-N 2.99Å; S767-L770 PolarHBondContact O-N 3.24Å; L770-L774 HydrophobicContact CD2-CD1 3.66Å; L770-L774 HydrophobicContact CG-CD1 3.9Å; L770-L774 WeakPolarHBondContact O-CB 3.39Å; L770-L774 PolarHBondContact O-N 2.93Å; L770-L774 VanDerWaalsContact O-N 3.1Å; L770-F797 HydrophobicContact CD2-CD2 3.14Å; L770-F797 HydrophobicContact CD2-CE2 3.16Å; L770-F797 HydrophobicContact CD2-CG 4.15Å; L770-F797 HydrophobicContact CD2-CZ 4.19Å; L770-L800 HydrophobicContact CD1-CB 4.15Å; L770-T801 HydrophobicContact CD1-CG2 4.31Å; L770-T801 HydrophobicContact CD2-CG2 3.71Å; L770-L805 HydrophobicContact CD1-CD1 4.02Å; L770-L805 HydrophobicContact CD1-CG 4.32Å
771	W	90.3	Very high	87.2	Confident	57 Å²	57	60.8 Å²	60.8	22%	0.216	31%	0.306	C	S	.	.	I	π-helix	trans	-61.5	-44.9	172.7	-175.9	-82.6	0	0	0	112.5	F472 S473 K474 S767 D768 V769 M775 R776 F797	F472-W771 HydrophobicContact CB-CE3 4.4Å; F472-W771 HydrophobicContact CB-CZ3 4.36Å; S473-W771 VanDerWaalsContact OG-CB 3.32Å; S473-W771 WeakPolarHBondContact OG-CB 3.22Å; K474-W771 VanDerWaalsContact CE-CD1 3.47Å; K474-W771 HydrophobicContact CG-CZ2 4.4Å; S767-W771 WeakPolarHBondContact O-CB 3.32Å; S767-W771 PolarHBondContact O-N 3.3Å; D768-W771 PolarHBondContact O-N 2.9Å; V769-W771 PolarHBondContact O-N 3.43Å; W771-M775 HydrophobicContact CD2-CB 3.91Å; W771-M775 HydrophobicContact CD2-CG 4.09Å; W771-M775 HydrophobicContact CE3-CB 4.23Å; W771-M775 HydrophobicContact CE3-CG 3.89Å; W771-M775 HydrophobicContact CG-CB 4.3Å; W771-M775 HydrophobicContact CH2-CB 4.48Å; W771-M775 HydrophobicContact CH2-CE 4.4Å; W771-M775 HydrophobicContact CH2-CG 4.34Å; W771-M775 HydrophobicContact CZ2-CB 4.18Å; W771-M775 HydrophobicContact CZ3-CG 4.02Å; W771-M775 WeakPolarHBondContact O-CB 3.43Å; W771-M775 PolarHBondContact O-N 3.34Å; W771-R776 PolarHBondContact O-N 3.26Å; W771-R776 VanDerWaalsContact O-N 3.16Å; W771-F797 HydrophobicContact CE3-CE2 4.06Å; W771-F797 AromaticContact CE3-CZ 3.79Å; W771-F797 HydrophobicContact CE3-CZ 3.79Å; W771-F797 HydrophobicContact CZ3-CZ 4.19Å
772	A	88.8	Confident	86.4	Confident	28 Å²	28	65.3 Å²	65.3	23%	0.231	33%	0.331	C	S	.	.	I	π-helix	trans	-68.4	-36	-178.6	0	0	0	0	0	113	D768 V769 R776	D768-A772 VanDerWaalsContact O-CB 3.23Å; D768-A772 WeakPolarHBondContact O-CB 3.3Å; D768-A772 PolarHBondContact O-N 3Å; V769-A772 PolarHBondContact O-N 3.47Å; A772-R776 VanDerWaalsContact O-CB 3.25Å; A772-R776 WeakPolarHBondContact O-CB 3.46Å
773	M	87.4	Confident	85.5	Confident	137 Å²	137	69.8 Å²	69.8	68%	0.675	36%	0.355	S	S	*	.	I	π-helix	trans	-78.3	-38	-179.3	-73.1	-174.6	173.3	0	0	113	V769 V777	V769-M773 HydrophobicContact CG1-CE 3.79Å; V769-M773 HydrophobicContact CG1-CG 4.24Å; V769-M773 HydrophobicContact CG1-SD 3.82Å; V769-M773 WeakPolarHBondContact O-CB 3.34Å; V769-M773 WeakPolarHBondContact O-CG 3.47Å; V769-M773 PolarHBondContact O-N 3.3Å; M773-V777 VanDerWaalsContact O-CG2 3.24Å; M773-V777 WeakPolarHBondContact O-CG2 3.32Å
774	L	87.1	Confident	84.4	Confident	30 Å²	30	75.1 Å²	75.1	16%	0.157	39%	0.388	C	S	.	.	I	π-helix	trans	-97.5	-64.1	-176.1	-74.5	144.9	0	0	0	112	L770 R776 V777 G778 L796 F797 L800	L770-L774 HydrophobicContact CD2-CD1 3.66Å; L770-L774 HydrophobicContact CG-CD1 3.9Å; L770-L774 WeakPolarHBondContact O-CB 3.39Å; L770-L774 PolarHBondContact O-N 2.93Å; L770-L774 VanDerWaalsContact O-N 3.1Å; L774-R776 PolarHBondContact O-N 3.41Å; L774-V777 PolarHBondContact O-N 3.14Å; L774-G778 PolarHBondContact O-N 3.04Å; L774-L796 HydrophobicContact CD2-CD2 3.67Å; L774-L796 HydrophobicContact CD2-CG 3.99Å; L774-F797 HydrophobicContact CB-CD2 4.22Å; L774-F797 HydrophobicContact CD1-CD2 4.33Å; L774-L800 HydrophobicContact CD1-CD1 3.77Å
775	M	85	Confident	83.4	Confident	20 Å²	20	82.9 Å²	82.9	10%	0.099	42%	0.415	C	S	.	.	I	π-helix	trans	-68	-39.4	-170.4	-69.7	-58.7	-63.8	0	0	112.6	W771 V777 G778 L779 I794 F797	W771-M775 HydrophobicContact CD2-CB 3.91Å; W771-M775 HydrophobicContact CD2-CG 4.09Å; W771-M775 HydrophobicContact CE3-CB 4.23Å; W771-M775 HydrophobicContact CE3-CG 3.89Å; W771-M775 HydrophobicContact CG-CB 4.3Å; W771-M775 HydrophobicContact CH2-CB 4.48Å; W771-M775 HydrophobicContact CH2-CE 4.4Å; W771-M775 HydrophobicContact CH2-CG 4.34Å; W771-M775 HydrophobicContact CZ2-CB 4.18Å; W771-M775 HydrophobicContact CZ3-CG 4.02Å; W771-M775 WeakPolarHBondContact O-CB 3.43Å; W771-M775 PolarHBondContact O-N 3.34Å; M775-V777 VanDerWaalsContact C-N 3.3Å; M775-V777 PolarHBondContact O-N 3.49Å; M775-G778 PolarHBondContact O-N 3.32Å; M775-L779 WeakPolarHBondContact O-CB 3.32Å; M775-L779 WeakPolarHBondContact O-CD1 3.26Å; M775-L779 VanDerWaalsContact O-CG 3.23Å; M775-L779 WeakPolarHBondContact O-CG 3.45Å; M775-L779 PolarHBondContact O-N 3.04Å; M775-I794 HydrophobicContact CE-CD1 4.5Å; M775-I794 HydrophobicContact CE-CG1 4.07Å; M775-I794 HydrophobicContact SD-CG1 4Å; M775-F797 HydrophobicContact CG-CD1 4.5Å; M775-F797 HydrophobicContact CG-CD2 3.7Å; M775-F797 HydrophobicContact CG-CE2 3.88Å; M775-F797 HydrophobicContact CG-CG 4.06Å; M775-F797 HydrophobicContact CG-CZ 4.37Å; M775-F797 HydrophobicContact SD-CB 4.32Å; M775-F797 HydrophobicContact SD-CD1 4.43Å; M775-F797 HydrophobicContact SD-CD2 4.36Å; M775-F797 HydrophobicContact SD-CG 4.13Å
776	R	84.3	Confident	82.5	Confident	153 Å²	153	80.4 Å²	80.4	58%	0.577	41%	0.405	S	S	*	.	H	α-helix	trans	-64.4	-35.5	178.1	-165.5	-173.8	-62.4	-167.3	2.3	112.5	W771 A772 L774 R780	W771-R776 PolarHBondContact O-N 3.26Å; W771-R776 VanDerWaalsContact O-N 3.16Å; A772-R776 VanDerWaalsContact O-CB 3.25Å; A772-R776 WeakPolarHBondContact O-CB 3.46Å; L774-R776 PolarHBondContact O-N 3.41Å; R776-R780 PolarHBondContact O-N 3.48Å
777	V	82.4	Confident	81.7	Confident	92 Å²	92	82.3 Å²	82.3	56%	0.558	42%	0.42	S	S	*	.	H	α-helix	trans	-71.4	-44.7	177	176.9	0	0	0	0	110	M773 L774 M775 L779 R780	M773-V777 VanDerWaalsContact O-CG2 3.24Å; M773-V777 WeakPolarHBondContact O-CG2 3.32Å; L774-V777 PolarHBondContact O-N 3.14Å; M775-V777 VanDerWaalsContact C-N 3.3Å; M775-V777 PolarHBondContact O-N 3.49Å; V777-L779 VanDerWaalsContact C-N 3.32Å; V777-L779 PolarHBondContact O-N 3.4Å; V777-R780 PolarHBondContact O-N 2.81Å
778	G	78.4	Confident	81.2	Confident	5 Å²	5	88.8 Å²	88.8	5%	0.052	45%	0.453	C	S	.	.	H	α-helix	trans	-61.4	-36.1	177	0	0	0	0	0	113.7	L774 M775 R780	L774-G778 PolarHBondContact O-N 3.04Å; M775-G778 PolarHBondContact O-N 3.32Å; G778-R780 VanDerWaalsContact C-N 3.33Å; G778-R780 PolarHBondContact O-N 3.41Å
779	L	81.4	Confident	80.8	Confident	111 Å²	111	91.2 Å²	91.2	58%	0.581	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-9.9	179.4	-70.6	165.9	0	0	0	114.4	M775 V777	M775-L779 WeakPolarHBondContact O-CB 3.32Å; M775-L779 WeakPolarHBondContact O-CD1 3.26Å; M775-L779 VanDerWaalsContact O-CG 3.23Å; M775-L779 WeakPolarHBondContact O-CG 3.45Å; M775-L779 PolarHBondContact O-N 3.04Å; V777-L779 VanDerWaalsContact C-N 3.32Å; V777-L779 PolarHBondContact O-N 3.4Å
780	R	80.4	Confident	80.4	Confident	223 Å²	223	90.3 Å²	90.3	84%	0.842	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-10.5	-178.5	-168.1	173.2	178.3	-177	-0.1	113.3	R776 V777 G778	R776-R780 PolarHBondContact O-N 3.48Å; V777-R780 PolarHBondContact O-N 2.81Å; G778-R780 VanDerWaalsContact C-N 3.33Å; G778-R780 PolarHBondContact O-N 3.41Å
781	V	76.4	Confident	80.1	Confident	68 Å²	68	95.5 Å²	95.5	41%	0.412	49%	0.485	S	S	.	.	S	Bend	trans	-87.8	133.3	-174.4	-177.8	0	0	0	0	111.2	L789	V781-L789 HydrophobicContact CG2-CD2 4.08Å
782	D	75.3	Confident	79.9	Confident	135 Å²	135	96.1 Å²	96.1	72%	0.722	50%	0.497	S	S	*	.			trans	-62.3	161.3	-174.8	-71.5	-37.8	0	0	0	115.1	T784 G786	D782-T784 VanDerWaalsContact C-N 3.33Å; D782-T784 PolarHBondContact O-N 3.17Å; D782-G786 WeakPolarHBondContact O-CA 3.49Å; D782-G786 PolarHBondContact O-N 3.5Å
783	T	72.1	Confident	79.9	Confident	130 Å²	130	96.1 Å²	96.1	80%	0.798	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-18	-157.7	53.4	0	0	0	0	117.3
784	T	69.2	Low	79.9	Confident	117 Å²	117	93.2 Å²	93.2	72%	0.718	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-37.9	-173.3	49	0	0	0	0	114.1	D782	D782-T784 VanDerWaalsContact C-N 3.33Å; D782-T784 PolarHBondContact O-N 3.17Å
785	Y	69.5	Low	80.1	Confident	179 Å²	179	94.1 Å²	94.1	70%	0.702	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-9.3	174.4	-66.7	-79.6	0	0	0	112.8	V787 L788 L789	Y785-V787 PolarHBondContact O-N 3.35Å; Y785-L788 PolarHBondContact O-N 3.05Å; Y785-L789 PolarHBondContact O-N 2.91Å
786	G	71.4	Confident	80.3	Confident	8 Å²	8	97.4 Å²	97.4	8%	0.082	51%	0.51	C	S	.	.	H	α-helix	trans	-59.8	-40.1	-178.8	0	0	0	0	0	113.6	D782 L788 L789 L790	D782-G786 WeakPolarHBondContact O-CA 3.49Å; D782-G786 PolarHBondContact O-N 3.5Å; G786-L788 PolarHBondContact O-N 3.38Å; G786-L789 PolarHBondContact O-N 2.91Å; G786-L790 WeakPolarHBondContact O-CB 3.3Å; G786-L790 PolarHBondContact O-N 3.01Å
787	V	74.9	Confident	80.6	Confident	113 Å²	113	91.3 Å²	91.3	69%	0.685	49%	0.487	S	S	*	.	H	α-helix	trans	-67.4	-40	-178.8	-178.2	0	0	0	0	112	Y785 L790 L791	Y785-V787 PolarHBondContact O-N 3.35Å; V787-L790 PolarHBondContact O-N 3.1Å; V787-L791 PolarHBondContact O-N 3.09Å
788	L	79.8	Confident	81	Confident	142 Å²	142	88.8 Å²	88.8	74%	0.743	48%	0.477	S	S	*	.	H	α-helix	trans	-69.2	-35.7	179	-174.8	67	0	0	0	111.9	Y785 G786 P792	Y785-L788 PolarHBondContact O-N 3.05Å; G786-L788 PolarHBondContact O-N 3.38Å; L788-P792 WeakPolarHBondContact O-CD 3.34Å
789	L	80	Confident	81.6	Confident	80 Å²	80	93.1 Å²	93.1	42%	0.419	50%	0.502	S	S	.	.	H	α-helix	trans	-80.7	-28.1	177.3	-174.6	131	0	0	0	112.8	V781 Y785 G786 P792 V793	V781-L789 HydrophobicContact CG2-CD2 4.08Å; Y785-L789 PolarHBondContact O-N 2.91Å; G786-L789 PolarHBondContact O-N 2.91Å; L789-P792 VanDerWaalsContact O-CD 3.3Å; L789-P792 WeakPolarHBondContact O-CD 3.4Å; L789-P792 VanDerWaalsContact O-CG 3.32Å; L789-P792 WeakPolarHBondContact O-CG 3.43Å; L789-V793 HydrophobicContact CD2-CG2 4.22Å; L789-V793 WeakPolarHBondContact O-CG2 3.31Å; L789-V793 PolarHBondContact O-N 2.95Å
790	L	82.9	Confident	82.1	Confident	47 Å²	47	90.4 Å²	90.4	25%	0.246	49%	0.487	C	S	.	.	H	α-helix	trans	-68.2	-38.3	179.8	-176.1	68.2	0	0	0	112.1	G786 V787 V793 I794	G786-L790 WeakPolarHBondContact O-CB 3.3Å; G786-L790 PolarHBondContact O-N 3.01Å; V787-L790 PolarHBondContact O-N 3.1Å; L790-V793 PolarHBondContact O-N 3.34Å; L790-I794 HydrophobicContact CD1-CD1 4.01Å; L790-I794 HydrophobicContact CD1-CG1 4.13Å; L790-I794 HydrophobicContact CD2-CD1 4.09Å; L790-I794 HydrophobicContact CG-CD1 3.65Å; L790-I794 HydrophobicContact CG-CG1 4.14Å; L790-I794 WeakPolarHBondContact O-CB 3.43Å; L790-I794 WeakPolarHBondContact O-CG1 3.21Å; L790-I794 PolarHBondContact O-N 3.19Å
791	L	84.7	Confident	82.7	Confident	130 Å²	130	80.2 Å²	80.2	68%	0.681	45%	0.45	S	S	*	.	H	α-helix	trans	-59.6	-51.3	-179.1	-166.5	147.8	0	0	0	113.6	V787 V793 I794 A795	V787-L791 PolarHBondContact O-N 3.09Å; L791-V793 VanDerWaalsContact C-N 3.32Å; L791-V793 PolarHBondContact O-N 3.4Å; L791-I794 PolarHBondContact O-N 3.21Å; L791-A795 WeakPolarHBondContact O-CB 2.89Å; L791-A795 PolarHBondContact O-N 3.16Å
792	P	87.6	Confident	83.4	Confident	70 Å²	70	81.1 Å²	81.1	46%	0.455	45%	0.452	S	S	.	.	H	α-helix	trans	-67.3	-31.4	175.4	25.8	-33.7	0	0	0	112.6	L788 L789 A795 L796	L788-P792 WeakPolarHBondContact O-CD 3.34Å; L789-P792 VanDerWaalsContact O-CD 3.3Å; L789-P792 WeakPolarHBondContact O-CD 3.4Å; L789-P792 VanDerWaalsContact O-CG 3.32Å; L789-P792 WeakPolarHBondContact O-CG 3.43Å; P792-A795 PolarHBondContact O-N 3.46Å; P792-L796 VanDerWaalsContact O-CB 3.32Å; P792-L796 WeakPolarHBondContact O-CB 3.35Å; P792-L796 PolarHBondContact O-N 3.38Å
793	V	87.5	Confident	84.2	Confident	29 Å²	29	80.5 Å²	80.5	18%	0.176	44%	0.443	C	S	.	.	H	α-helix	trans	-67.2	-42	175.6	172.1	0	0	0	0	111.4	L789 L790 L791 L796 F797	L789-V793 HydrophobicContact CD2-CG2 4.22Å; L789-V793 WeakPolarHBondContact O-CG2 3.31Å; L789-V793 PolarHBondContact O-N 2.95Å; L790-V793 PolarHBondContact O-N 3.34Å; L791-V793 VanDerWaalsContact C-N 3.32Å; L791-V793 PolarHBondContact O-N 3.4Å; V793-L796 PolarHBondContact O-N 3.25Å; V793-F797 WeakPolarHBondContact O-CB 3.19Å; V793-F797 PolarHBondContact O-N 3.1Å
794	I	88	Confident	85.1	Confident	75 Å²	75	77.7 Å²	77.7	39%	0.385	42%	0.422	S	S	.	.	H	α-helix	trans	-65.9	-41.5	173.9	-71	174.2	0	0	0	110.5	M775 L790 L791 L796 F797 A798	M775-I794 HydrophobicContact CE-CD1 4.5Å; M775-I794 HydrophobicContact CE-CG1 4.07Å; M775-I794 HydrophobicContact SD-CG1 4Å; L790-I794 HydrophobicContact CD1-CD1 4.01Å; L790-I794 HydrophobicContact CD1-CG1 4.13Å; L790-I794 HydrophobicContact CD2-CD1 4.09Å; L790-I794 HydrophobicContact CG-CD1 3.65Å; L790-I794 HydrophobicContact CG-CG1 4.14Å; L790-I794 WeakPolarHBondContact O-CB 3.43Å; L790-I794 WeakPolarHBondContact O-CG1 3.21Å; L790-I794 PolarHBondContact O-N 3.19Å; L791-I794 PolarHBondContact O-N 3.21Å; I794-L796 VanDerWaalsContact C-N 3.35Å; I794-L796 PolarHBondContact O-N 3.37Å; I794-F797 WeakPolarHBondContact O-CB 3.28Å; I794-F797 PolarHBondContact O-N 3.15Å; I794-A798 WeakPolarHBondContact O-CB 3.4Å; I794-A798 PolarHBondContact O-N 2.74Å
795	A	89.9	Confident	86.1	Confident	49 Å²	49	72.2 Å²	72.2	41%	0.405	39%	0.388	S	S	.	.	H	α-helix	trans	-61.5	-44.5	176.3	0	0	0	0	0	111.4	L791 P792 A798 V799	L791-A795 WeakPolarHBondContact O-CB 2.89Å; L791-A795 PolarHBondContact O-N 3.16Å; P792-A795 PolarHBondContact O-N 3.46Å; A795-A798 PolarHBondContact O-N 3.3Å; A795-V799 WeakPolarHBondContact O-CG2 3.26Å; A795-V799 PolarHBondContact O-N 2.86Å
796	L	90.1	Very high	87.1	Confident	90 Å²	90	65 Å²	65	47%	0.471	36%	0.362	S	S	.	.	H	α-helix	trans	-63.2	-42.8	175.2	-178.5	62.5	0	0	0	111.7	L774 P792 V793 I794 A798 V799 L800	L774-L796 HydrophobicContact CD2-CD2 3.67Å; L774-L796 HydrophobicContact CD2-CG 3.99Å; P792-L796 VanDerWaalsContact O-CB 3.32Å; P792-L796 WeakPolarHBondContact O-CB 3.35Å; P792-L796 PolarHBondContact O-N 3.38Å; V793-L796 PolarHBondContact O-N 3.25Å; I794-L796 VanDerWaalsContact C-N 3.35Å; I794-L796 PolarHBondContact O-N 3.37Å; L796-A798 PolarHBondContact O-N 3.1Å; L796-V799 PolarHBondContact O-N 2.92Å; L796-L800 HydrophobicContact CD1-CD1 3.97Å; L796-L800 HydrophobicContact CD1-CG 4.17Å; L796-L800 HydrophobicContact CG-CD1 3.9Å; L796-L800 HydrophobicContact CG-CG 4.48Å; L796-L800 WeakPolarHBondContact O-CB 3.04Å; L796-L800 VanDerWaalsContact O-CG 3.29Å; L796-L800 WeakPolarHBondContact O-CG 2.9Å; L796-L800 PolarHBondContact O-N 3.24Å
797	F	90.4	Very high	88	Confident	24 Å²	24	68.8 Å²	68.8	11%	0.105	38%	0.379	C	S	.	.	H	α-helix	trans	-58.6	-45.4	173.3	175.4	-92.1	0	0	0	111.5	L770 W771 L774 M775 V793 I794 L800 T801	L770-F797 HydrophobicContact CD2-CD2 3.14Å; L770-F797 HydrophobicContact CD2-CE2 3.16Å; L770-F797 HydrophobicContact CD2-CG 4.15Å; L770-F797 HydrophobicContact CD2-CZ 4.19Å; W771-F797 HydrophobicContact CE3-CE2 4.06Å; W771-F797 AromaticContact CE3-CZ 3.79Å; W771-F797 HydrophobicContact CE3-CZ 3.79Å; W771-F797 HydrophobicContact CZ3-CZ 4.19Å; L774-F797 HydrophobicContact CB-CD2 4.22Å; L774-F797 HydrophobicContact CD1-CD2 4.33Å; M775-F797 HydrophobicContact CG-CD1 4.5Å; M775-F797 HydrophobicContact CG-CD2 3.7Å; M775-F797 HydrophobicContact CG-CE2 3.88Å; M775-F797 HydrophobicContact CG-CG 4.06Å; M775-F797 HydrophobicContact CG-CZ 4.37Å; M775-F797 HydrophobicContact SD-CB 4.32Å; M775-F797 HydrophobicContact SD-CD1 4.43Å; M775-F797 HydrophobicContact SD-CD2 4.36Å; M775-F797 HydrophobicContact SD-CG 4.13Å; V793-F797 WeakPolarHBondContact O-CB 3.19Å; V793-F797 PolarHBondContact O-N 3.1Å; I794-F797 WeakPolarHBondContact O-CB 3.28Å; I794-F797 PolarHBondContact O-N 3.15Å; F797-L800 PolarHBondContact O-N 2.83Å; F797-T801 HydrophobicContact CD1-CG2 4.11Å; F797-T801 HydrophobicContact CD2-CG2 4.26Å; F797-T801 HydrophobicContact CE1-CG2 3.79Å; F797-T801 HydrophobicContact CE2-CG2 3.95Å; F797-T801 HydrophobicContact CG-CG2 4.32Å; F797-T801 HydrophobicContact CZ-CG2 3.69Å; F797-T801 WeakPolarHBondContact O-CB 3.29Å; F797-T801 WeakPolarHBondContact O-CG2 3.22Å; F797-T801 PolarHBondContact O-N 3.03Å; F797-T801 PolarHBondContact O-OG1 3.24Å
798	A	90.4	Very high	88.8	Confident	40 Å²	40	68.8 Å²	68.8	33%	0.331	37%	0.373	S	S	.	.	H	α-helix	trans	-63.6	-43.4	178	0	0	0	0	0	112.3	I794 A795 L796 T801 I802	I794-A798 WeakPolarHBondContact O-CB 3.4Å; I794-A798 PolarHBondContact O-N 2.74Å; A795-A798 PolarHBondContact O-N 3.3Å; L796-A798 PolarHBondContact O-N 3.1Å; A798-T801 VanDerWaalsContact CA-OG1 3.32Å; A798-T801 WeakPolarHBondContact CA-OG1 3.08Å; A798-T801 PolarHBondContact O-OG1 3.41Å; A798-I802 WeakPolarHBondContact O-CB 3.01Å; A798-I802 WeakPolarHBondContact O-CD1 3.38Å; A798-I802 VanDerWaalsContact O-CG1 3.26Å; A798-I802 WeakPolarHBondContact O-CG1 3.27Å; A798-I802 PolarHBondContact O-N 2.73Å
799	V	92.4	Very high	89.4	Confident	95 Å²	95	64.1 Å²	64.1	58%	0.576	35%	0.347	S	S	*	.	H	α-helix	trans	-65.4	-45.6	178.1	171.9	0	0	0	0	111.3	A795 L796 I802 F803	A795-V799 WeakPolarHBondContact O-CG2 3.26Å; A795-V799 PolarHBondContact O-N 2.86Å; L796-V799 PolarHBondContact O-N 2.92Å; V799-I802 PolarHBondContact O-N 3.28Å; V799-F803 WeakPolarHBondContact O-CB 3.43Å; V799-F803 PolarHBondContact O-N 3.25Å
800	L	91.5	Very high	90	Very high	54 Å²	54	60.7 Å²	60.7	28%	0.283	33%	0.331	S	S	.	.	H	α-helix	trans	-67.4	-38.6	179.8	-69.7	171.5	0	0	0	112.2	L770 L774 L796 F797 I804	L770-L800 HydrophobicContact CD1-CB 4.15Å; L774-L800 HydrophobicContact CD1-CD1 3.77Å; L796-L800 HydrophobicContact CD1-CD1 3.97Å; L796-L800 HydrophobicContact CD1-CG 4.17Å; L796-L800 HydrophobicContact CG-CD1 3.9Å; L796-L800 HydrophobicContact CG-CG 4.48Å; L796-L800 WeakPolarHBondContact O-CB 3.04Å; L796-L800 VanDerWaalsContact O-CG 3.29Å; L796-L800 WeakPolarHBondContact O-CG 2.9Å; L796-L800 PolarHBondContact O-N 3.24Å; F797-L800 PolarHBondContact O-N 2.83Å; L800-I804 HydrophobicContact CD2-CD1 3.92Å; L800-I804 VanDerWaalsContact O-CB 3.29Å; L800-I804 WeakPolarHBondContact O-CB 3.29Å; L800-I804 PolarHBondContact O-N 2.92Å
801	T	91.8	Very high	90.4	Very high	9 Å²	9	62.9 Å²	62.9	6%	0.055	34%	0.343	C	S	.	.	I	π-helix	trans	-65.2	-42.9	175.3	51.8	0	0	0	0	111.3	L770 F797 A798 L805 L806	L770-T801 HydrophobicContact CD1-CG2 4.31Å; L770-T801 HydrophobicContact CD2-CG2 3.71Å; F797-T801 HydrophobicContact CD1-CG2 4.11Å; F797-T801 HydrophobicContact CD2-CG2 4.26Å; F797-T801 HydrophobicContact CE1-CG2 3.79Å; F797-T801 HydrophobicContact CE2-CG2 3.95Å; F797-T801 HydrophobicContact CG-CG2 4.32Å; F797-T801 HydrophobicContact CZ-CG2 3.69Å; F797-T801 WeakPolarHBondContact O-CB 3.29Å; F797-T801 WeakPolarHBondContact O-CG2 3.22Å; F797-T801 PolarHBondContact O-N 3.03Å; F797-T801 PolarHBondContact O-OG1 3.24Å; A798-T801 VanDerWaalsContact CA-OG1 3.32Å; A798-T801 WeakPolarHBondContact CA-OG1 3.08Å; A798-T801 PolarHBondContact O-OG1 3.41Å; T801-L805 HydrophobicContact CG2-CD1 4.04Å; T801-L805 CarbonylContact O-C 3.58Å; T801-L805 WeakPolarHBondContact O-CA 3.2Å; T801-L805 WeakPolarHBondContact O-CB 3.33Å; T801-L805 PolarHBondContact O-N 3.11Å; T801-L805 VanDerWaalsContact O-N 3.08Å; T801-L806 PolarHBondContact O-N 3.42Å
802	I	91.7	Very high	90.8	Very high	87 Å²	87	58.6 Å²	58.6	45%	0.446	32%	0.324	S	S	.	.	I	π-helix	trans	-63.3	-49.6	176.3	-70.4	163.7	0	0	0	111.2	A798 V799 L806 I807	A798-I802 WeakPolarHBondContact O-CB 3.01Å; A798-I802 WeakPolarHBondContact O-CD1 3.38Å; A798-I802 VanDerWaalsContact O-CG1 3.26Å; A798-I802 WeakPolarHBondContact O-CG1 3.27Å; A798-I802 PolarHBondContact O-N 2.73Å; V799-I802 PolarHBondContact O-N 3.28Å; I802-L806 HydrophobicContact CG1-CD1 4.23Å; I802-L806 VanDerWaalsContact O-CB 3.27Å; I802-L806 WeakPolarHBondContact O-CB 3.45Å; I802-L806 PolarHBondContact O-N 3.31Å; I802-I807 HydrophobicContact CG2-CD1 4.29Å; I802-I807 WeakPolarHBondContact O-CG1 3.41Å; I802-I807 PolarHBondContact O-N 2.73Å
803	F	91.7	Very high	91.1	Very high	123 Å²	123	55.3 Å²	55.3	54%	0.539	30%	0.303	S	S	.	.	I	π-helix	trans	-73.9	-49.6	-173.8	-174.2	-102.1	0	0	0	112.9	V799 M808	V799-F803 WeakPolarHBondContact O-CB 3.43Å; V799-F803 PolarHBondContact O-N 3.25Å; F803-M808 WeakPolarHBondContact O-CG 3.38Å; F803-M808 PolarHBondContact O-N 2.99Å; F803-M808 VanDerWaalsContact O-N 3.16Å
804	I	91.4	Very high	91.4	Very high	70 Å²	70	55.7 Å²	55.7	36%	0.359	30%	0.302	S	S	.	.	I	π-helix	trans	-84.3	-53.8	-173.4	-57	176.4	0	0	0	110.5	L800 M808 E809	L800-I804 HydrophobicContact CD2-CD1 3.92Å; L800-I804 VanDerWaalsContact O-CB 3.29Å; L800-I804 WeakPolarHBondContact O-CB 3.29Å; L800-I804 PolarHBondContact O-N 2.92Å; I804-M808 WeakPolarHBondContact O-CB 3.47Å; I804-E809 PolarHBondContact O-N 3.16Å; I804-E809 VanDerWaalsContact O-N 3.08Å
805	L	90.4	Very high	91.6	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.01	31%	0.309	C	S	.	.	I	π-helix	trans	-80.8	-39.5	-172	-60.8	176.4	0	0	0	112.4	F412 L766 L770 T801 E809	F412-L805 WeakPolarHBondContact CE2-O 3.43Å; F412-L805 WeakPolarHBondContact CZ-O 3.49Å; L766-L805 HydrophobicContact CB-CD2 3.85Å; L770-L805 HydrophobicContact CD1-CD1 4.02Å; L770-L805 HydrophobicContact CD1-CG 4.32Å; T801-L805 HydrophobicContact CG2-CD1 4.04Å; T801-L805 CarbonylContact O-C 3.58Å; T801-L805 WeakPolarHBondContact O-CA 3.2Å; T801-L805 WeakPolarHBondContact O-CB 3.33Å; T801-L805 PolarHBondContact O-N 3.11Å; T801-L805 VanDerWaalsContact O-N 3.08Å; L805-E809 WeakPolarHBondContact O-CB 3.21Å
806	L	91	Very high	91.8	Very high	27 Å²	27	57.1 Å²	57.1	14%	0.141	30%	0.302	C	S	.	.	I	π-helix	trans	-85	-52.3	-178.7	-90.3	150.6	0	0	0	112.8	F412 H417 V420 M421 T801 I802 G810	F412-L806 HydrophobicContact CE1-CD2 4.39Å; F412-L806 HydrophobicContact CZ-CD2 4.25Å; F412-L806 HydrophobicContact CZ-CG 4.47Å; H417-L806 HydrophobicContact CB-CD2 4.22Å; H417-L806 HydrophobicContact CB-CG 4.24Å; V420-L806 HydrophobicContact CB-CD1 4.13Å; V420-L806 HydrophobicContact CG1-CD1 3.81Å; M421-L806 HydrophobicContact CB-CD2 3.96Å; T801-L806 PolarHBondContact O-N 3.42Å; I802-L806 HydrophobicContact CG1-CD1 4.23Å; I802-L806 VanDerWaalsContact O-CB 3.27Å; I802-L806 WeakPolarHBondContact O-CB 3.45Å; I802-L806 PolarHBondContact O-N 3.31Å; L806-G810 VanDerWaalsContact O-CA 3.26Å; L806-G810 WeakPolarHBondContact O-CA 3.23Å; L806-G810 PolarHBondContact O-N 3.28Å
807	I	90.7	Very high	92	Very high	88 Å²	88	52.9 Å²	52.9	45%	0.451	28%	0.279	S	S	.	.	I	π-helix	trans	-78.9	-58.3	-174.7	-64.3	171	0	0	0	111.4	I802 L811	I802-I807 HydrophobicContact CG2-CD1 4.29Å; I802-I807 WeakPolarHBondContact O-CG1 3.41Å; I802-I807 PolarHBondContact O-N 2.73Å; I807-L811 WeakPolarHBondContact O-CB 3.22Å; I807-L811 PolarHBondContact O-N 3.21Å
808	M	91.3	Very high	92.1	Very high	114 Å²	114	52.4 Å²	52.4	56%	0.562	28%	0.278	S	S	*	.	I	π-helix	trans	-69.3	-53.9	-173	-68.7	-74.5	-73.4	0	0	112.5	F803 I804 L811 S812	F803-M808 WeakPolarHBondContact O-CG 3.38Å; F803-M808 PolarHBondContact O-N 2.99Å; F803-M808 VanDerWaalsContact O-N 3.16Å; I804-M808 WeakPolarHBondContact O-CB 3.47Å; M808-L811 PolarHBondContact O-N 3.07Å; M808-S812 PolarHBondContact O-N 3.14Å
809	E	92.6	Very high	92.3	Very high	43 Å²	43	56.4 Å²	56.4	20%	0.201	28%	0.284	C	S	.	.	H	α-helix	trans	-68	-37.1	177.6	-76.4	-70	161.8	0	0	112	L766 I804 L805 S812 A813	L766-E809 HydrophobicContact CD1-CG 4.32Å; L766-E809 WeakPolarHBondContact CD1-OE1 3.24Å; I804-E809 PolarHBondContact O-N 3.16Å; I804-E809 VanDerWaalsContact O-N 3.08Å; L805-E809 WeakPolarHBondContact O-CB 3.21Å; E809-S812 WeakPolarHBondContact O-CB 3.21Å; E809-S812 PolarHBondContact O-N 3.37Å; E809-A813 WeakPolarHBondContact O-CB 3.2Å; E809-A813 PolarHBondContact O-N 3.43Å
810	G	91.8	Very high	92.3	Very high	8 Å²	8	51.9 Å²	51.9	8%	0.082	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-43.3	174.3	0	0	0	0	0	112.6	F408 L806 A813 F814	F408-G810 WeakPolarHBondContact CE2-O 3.28Å; L806-G810 VanDerWaalsContact O-CA 3.26Å; L806-G810 WeakPolarHBondContact O-CA 3.23Å; L806-G810 PolarHBondContact O-N 3.28Å; G810-A813 PolarHBondContact O-N 2.8Å; G810-F814 VanDerWaalsContact O-CB 3.3Å; G810-F814 WeakPolarHBondContact O-CB 3.43Å; G810-F814 PolarHBondContact O-N 3.27Å
811	L	92	Very high	92.4	Very high	93 Å²	93	49.5 Å²	49.5	49%	0.487	24%	0.244	S	C	.	.	H	α-helix	trans	-65.5	-40	175.5	-174.3	68.9	0	0	0	111.9	I807 M808 F814 L815	I807-L811 WeakPolarHBondContact O-CB 3.22Å; I807-L811 PolarHBondContact O-N 3.21Å; M808-L811 PolarHBondContact O-N 3.07Å; L811-F814 WeakPolarHBondContact O-CB 3.42Å; L811-F814 PolarHBondContact O-N 3.24Å; L811-L815 WeakPolarHBondContact O-CG 3.49Å; L811-L815 PolarHBondContact O-N 3.47Å
812	S	92.6	Very high	92.4	Very high	40 Å²	40	52.6 Å²	52.6	28%	0.28	26%	0.255	S	S	.	.	H	α-helix	trans	-59.8	-49.7	174.6	178.9	0	0	0	0	111.7	M808 E809 F814 L815 H816	M808-S812 PolarHBondContact O-N 3.14Å; E809-S812 WeakPolarHBondContact O-CB 3.21Å; E809-S812 PolarHBondContact O-N 3.37Å; S812-F814 VanDerWaalsContact C-N 3.31Å; S812-F814 PolarHBondContact O-N 3.08Å; S812-L815 PolarHBondContact O-N 3.23Å; S812-H816 PolarHBondContact O-CD2 2.97Å; S812-H816 PolarHBondContact O-N 3.47Å
813	A	93.9	Very high	92.3	Very high	2 Å²	2	51.1 Å²	51.1	2%	0.017	25%	0.25	C	S	.	.	H	α-helix	trans	-61.9	-38.5	176.5	0	0	0	0	0	112.2	F408 M411 F412 L759 E809 G810 H816 A817	F408-A813 HydrophobicContact CD2-CB 3.85Å; F408-A813 HydrophobicContact CE2-CB 3.65Å; M411-A813 HydrophobicContact CB-CB 4.01Å; F412-A813 HydrophobicContact CB-CB 4.45Å; L759-A813 VanDerWaalsContact CD2-CA 3.45Å; L759-A813 HydrophobicContact CD2-CB 3.73Å; E809-A813 WeakPolarHBondContact O-CB 3.2Å; E809-A813 PolarHBondContact O-N 3.43Å; G810-A813 PolarHBondContact O-N 2.8Å; A813-H816 PolarHBondContact O-N 3.39Å; A813-A817 WeakPolarHBondContact O-CB 3.24Å; A813-A817 PolarHBondContact O-N 3.03Å
814	F	93.6	Very high	92.3	Very high	36 Å²	36	45.4 Å²	45.4	16%	0.158	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-50.1	174.9	175.5	-92.7	0	0	0	111.9	I382 F404 F408 I453 M457 G810 L811 S812 H816 A817 I818	I382-F814 HydrophobicContact CD1-CZ 4.34Å; F404-F814 AromaticContact CE1-CD2 3.84Å; F404-F814 HydrophobicContact CE1-CD2 3.84Å; F404-F814 AromaticContact CE1-CE2 3.56Å; F404-F814 HydrophobicContact CE1-CE2 3.56Å; F404-F814 HydrophobicContact CE1-CZ 4.5Å; F404-F814 AromaticContact CZ-CD2 3.41Å; F404-F814 HydrophobicContact CZ-CD2 3.41Å; F404-F814 VanDerWaalsContact CZ-CD2 3.41Å; F404-F814 AromaticContact CZ-CE2 3.34Å; F404-F814 HydrophobicContact CZ-CE2 3.34Å; F404-F814 HydrophobicContact CZ-CG 4.18Å; F404-F814 HydrophobicContact CZ-CZ 4.07Å; F408-F814 HydrophobicContact CD2-CB 4.34Å; F408-F814 HydrophobicContact CE2-CB 4.35Å; I453-F814 HydrophobicContact CG2-CE2 4.27Å; M457-F814 HydrophobicContact CE-CB 4.31Å; M457-F814 HydrophobicContact CE-CD2 3.66Å; M457-F814 HydrophobicContact CE-CG 4.47Å; M457-F814 HydrophobicContact SD-CD2 3.82Å; M457-F814 HydrophobicContact SD-CE2 4.16Å; G810-F814 VanDerWaalsContact O-CB 3.3Å; G810-F814 WeakPolarHBondContact O-CB 3.43Å; G810-F814 PolarHBondContact O-N 3.27Å; L811-F814 WeakPolarHBondContact O-CB 3.42Å; L811-F814 PolarHBondContact O-N 3.24Å; S812-F814 VanDerWaalsContact C-N 3.31Å; S812-F814 PolarHBondContact O-N 3.08Å; F814-H816 PolarHBondContact O-N 2.89Å; F814-A817 PolarHBondContact O-N 2.92Å; F814-I818 HydrophobicContact CD1-CD1 3.95Å; F814-I818 HydrophobicContact CD1-CG1 4.49Å; F814-I818 HydrophobicContact CE1-CD1 3.28Å; F814-I818 HydrophobicContact CE1-CG1 4.19Å; F814-I818 HydrophobicContact CE2-CD1 4.4Å; F814-I818 HydrophobicContact CZ-CD1 3.55Å; F814-I818 HydrophobicContact CZ-CG1 4.35Å; F814-I818 WeakPolarHBondContact O-CG1 3.41Å; F814-I818 PolarHBondContact O-N 3.21Å
815	L	92.8	Very high	92.2	Very high	101 Å²	101	42.1 Å²	42.1	53%	0.529	21%	0.208	S	C	.	.	H	α-helix	trans	-64.6	-39	179	-71.9	175.2	0	0	0	112.4	L811 S812 I818 R819	L811-L815 WeakPolarHBondContact O-CG 3.49Å; L811-L815 PolarHBondContact O-N 3.47Å; S812-L815 PolarHBondContact O-N 3.23Å; L815-I818 PolarHBondContact O-N 3.39Å; L815-R819 WeakPolarHBondContact O-CB 3.23Å; L815-R819 PolarHBondContact O-N 3.31Å
816	H	94.4	Very high	92.1	Very high	54 Å²	54	42 Å²	42	25%	0.25	21%	0.207	C	C	.	.	H	α-helix	trans	-66.4	-38.5	174.8	-77.8	-57.6	0	0	0	112.5	M411 L759 S812 A813 F814 R819 L820	M411-H816 HydrophobicContact CE-CB 3.62Å; M411-H816 HydrophobicContact SD-CB 3.96Å; L759-H816 HydrophobicContact CD2-CB 4.5Å; S812-H816 PolarHBondContact O-CD2 2.97Å; S812-H816 PolarHBondContact O-N 3.47Å; A813-H816 PolarHBondContact O-N 3.39Å; F814-H816 PolarHBondContact O-N 2.89Å; H816-R819 PolarHBondContact O-N 3.37Å; H816-L820 WeakPolarHBondContact O-CG 3.4Å; H816-L820 PolarHBondContact O-N 3.04Å; H816-L820 VanDerWaalsContact O-N 3.1Å
817	A	94	Very high	91.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.8	-39.6	172.7	0	0	0	0	0	111.7	F404 F408 A813 F814 L820 H821	F404-A817 HydrophobicContact CD2-CB 4.1Å; F404-A817 HydrophobicContact CE2-CB 3.67Å; F404-A817 HydrophobicContact CZ-CB 4.4Å; F408-A817 HydrophobicContact CB-CB 4.16Å; A813-A817 WeakPolarHBondContact O-CB 3.24Å; A813-A817 PolarHBondContact O-N 3.03Å; F814-A817 PolarHBondContact O-N 2.92Å; A817-L820 PolarHBondContact O-N 3.37Å; A817-H821 PolarHBondContact O-N 3.08Å; A817-H821 PolarHBondContact O-ND1 3.46Å
818	I	92.8	Very high	91.6	Very high	14 Å²	14	41 Å²	41	7%	0.072	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-47	176.7	-74	-172.7	0	0	0	109.5	I382 F404 F814 L815 L820 H821 W822	I382-I818 HydrophobicContact CG2-CD1 4.19Å; I382-I818 HydrophobicContact CG2-CG1 4.46Å; F404-I818 HydrophobicContact CD2-CG1 4.27Å; F404-I818 HydrophobicContact CE2-CB 4.18Å; F404-I818 HydrophobicContact CE2-CD1 4.41Å; F404-I818 HydrophobicContact CE2-CG1 3.29Å; F404-I818 HydrophobicContact CZ-CD1 4.37Å; F404-I818 HydrophobicContact CZ-CG1 3.66Å; F814-I818 HydrophobicContact CD1-CD1 3.95Å; F814-I818 HydrophobicContact CD1-CG1 4.49Å; F814-I818 HydrophobicContact CE1-CD1 3.28Å; F814-I818 HydrophobicContact CE1-CG1 4.19Å; F814-I818 HydrophobicContact CE2-CD1 4.4Å; F814-I818 HydrophobicContact CZ-CD1 3.55Å; F814-I818 HydrophobicContact CZ-CG1 4.35Å; F814-I818 WeakPolarHBondContact O-CG1 3.41Å; F814-I818 PolarHBondContact O-N 3.21Å; L815-I818 PolarHBondContact O-N 3.39Å; I818-L820 VanDerWaalsContact C-N 3.3Å; I818-L820 PolarHBondContact O-N 3.41Å; I818-H821 WeakPolarHBondContact O-CA 3.03Å; I818-H821 WeakPolarHBondContact O-CB 3.21Å; I818-H821 PolarHBondContact O-N 3.48Å; I818-W822 HydrophobicContact CG2-CD2 3.41Å; I818-W822 VanDerWaalsContact CG2-CD2 3.41Å; I818-W822 HydrophobicContact CG2-CE3 3.63Å; I818-W822 HydrophobicContact CG2-CG 4.09Å; I818-W822 HydrophobicContact CG2-CH2 3.7Å; I818-W822 HydrophobicContact CG2-CZ2 3.49Å; I818-W822 VanDerWaalsContact CG2-CZ2 3.49Å; I818-W822 HydrophobicContact CG2-CZ3 3.76Å; I818-W822 PolarHBondContact O-N 3.06Å
819	R	93.8	Very high	91.4	Very high	125 Å²	125	36.2 Å²	36.2	47%	0.472	18%	0.178	S	C	.	.	H	α-helix	trans	-55.7	-46.4	179.4	-176.4	171.3	179.5	167	2.6	111.7	L815 H816 H821 W822 V823	L815-R819 WeakPolarHBondContact O-CB 3.23Å; L815-R819 PolarHBondContact O-N 3.31Å; H816-R819 PolarHBondContact O-N 3.37Å; R819-H821 PolarHBondContact O-N 3.03Å; R819-H821 VanDerWaalsContact O-N 3.15Å; R819-W822 PolarHBondContact O-N 2.99Å; R819-V823 HydrophobicContact CG-CG2 4.42Å; R819-V823 PolarHBondContact O-N 2.95Å
820	L	93.4	Very high	91	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.172	C	C	.	.	I	π-helix	trans	-57.8	-24.1	176.1	-70.2	175.4	0	0	0	113.9	L407 M411 Y753 L756 H816 A817 I818 E824 F825	L407-L820 HydrophobicContact CD1-CB 4.49Å; M411-L820 HydrophobicContact CE-CD1 4.25Å; Y753-L820 HydrophobicContact CD1-CD1 4.05Å; Y753-L820 HydrophobicContact CD1-CD2 3.8Å; Y753-L820 HydrophobicContact CD1-CG 4.46Å; Y753-L820 HydrophobicContact CE1-CB 4.21Å; Y753-L820 HydrophobicContact CE1-CD1 4.07Å; Y753-L820 HydrophobicContact CE1-CD2 3.76Å; Y753-L820 HydrophobicContact CE1-CG 4.22Å; Y753-L820 HydrophobicContact CG-CD2 4.23Å; Y753-L820 PolarHBondContact OH-O 3.35Å; L756-L820 HydrophobicContact CD2-CD1 3.7Å; L756-L820 HydrophobicContact CG-CD1 3.98Å; H816-L820 WeakPolarHBondContact O-CG 3.4Å; H816-L820 PolarHBondContact O-N 3.04Å; H816-L820 VanDerWaalsContact O-N 3.1Å; A817-L820 PolarHBondContact O-N 3.37Å; I818-L820 VanDerWaalsContact C-N 3.3Å; I818-L820 PolarHBondContact O-N 3.41Å; L820-E824 WeakPolarHBondContact CA-OE2 3.34Å; L820-E824 HydrophobicContact CD2-CG 4.31Å; L820-E824 WeakPolarHBondContact O-CB 3.37Å; L820-F825 PolarHBondContact O-N 2.97Å
821	H	92.2	Very high	90.4	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.019	20%	0.2	C	C	.	.	I	π-helix	trans	-88.2	-44.1	174.9	-71.1	79.7	0	0	0	112.1	T403 F404 H562 A817 I818 R819 F825 Q826	T403-H821 PolarHBondContact OG1-NE2 3.32Å; F404-H821 WeakPolarHBondContact CA-CE1 3.36Å; F404-H821 AromaticContact CD2-CE1 3.93Å; F404-H821 AromaticContact CD2-ND1 3.79Å; F404-H821 PolarHBondContact N-NE2 3.07Å; H562-H821 AromaticContact CE1-CD2 3.94Å; H562-H821 AromaticContact CE1-NE2 3.87Å; H562-H821 AromaticContact NE2-CD2 3.99Å; H562-H821 AromaticContact NE2-NE2 3.85Å; A817-H821 PolarHBondContact O-N 3.08Å; A817-H821 PolarHBondContact O-ND1 3.46Å; I818-H821 WeakPolarHBondContact O-CA 3.03Å; I818-H821 WeakPolarHBondContact O-CB 3.21Å; I818-H821 PolarHBondContact O-N 3.48Å; R819-H821 PolarHBondContact O-N 3.03Å; R819-H821 VanDerWaalsContact O-N 3.15Å; H821-F825 WeakPolarHBondContact O-CB 3.35Å; H821-F825 PolarHBondContact O-N 3.48Å; H821-Q826 WeakPolarHBondContact O-CB 3.49Å; H821-Q826 VanDerWaalsContact O-CG 3.3Å; H821-Q826 WeakPolarHBondContact O-CG 3.41Å; H821-Q826 PolarHBondContact O-N 3.04Å
822	W	91.9	Very high	89.8	Confident	73 Å²	73	36.5 Å²	36.5	28%	0.277	19%	0.188	S	C	.	.	I	π-helix	trans	-69.2	-47.2	-177.8	-69.2	-11.9	0	0	0	112.9	I382 A385 Y386 I818 R819	I382-W822 HydrophobicContact CG2-CZ2 4.4Å; I382-W822 WeakPolarHBondContact O-CZ2 3.21Å; I382-W822 PolarHBondContact O-NE1 3.23Å; A385-W822 HydrophobicContact CB-CZ2 4.3Å; Y386-W822 HydrophobicContact CD2-CB 3.66Å; Y386-W822 AromaticContact CD2-CD2 3.93Å; Y386-W822 HydrophobicContact CD2-CD2 3.93Å; Y386-W822 HydrophobicContact CD2-CE3 4.23Å; Y386-W822 AromaticContact CD2-CG 3.71Å; Y386-W822 HydrophobicContact CD2-CG 3.71Å; Y386-W822 HydrophobicContact CE2-CB 3.88Å; Y386-W822 HydrophobicContact CE2-CG 4.43Å; Y386-W822 HydrophobicContact CG-CB 4.14Å; Y386-W822 HydrophobicContact CG-CD2 4.3Å; Y386-W822 AromaticContact CG-CG 3.92Å; Y386-W822 HydrophobicContact CG-CG 3.92Å; I818-W822 HydrophobicContact CG2-CD2 3.41Å; I818-W822 VanDerWaalsContact CG2-CD2 3.41Å; I818-W822 HydrophobicContact CG2-CE3 3.63Å; I818-W822 HydrophobicContact CG2-CG 4.09Å; I818-W822 HydrophobicContact CG2-CH2 3.7Å; I818-W822 HydrophobicContact CG2-CZ2 3.49Å; I818-W822 VanDerWaalsContact CG2-CZ2 3.49Å; I818-W822 HydrophobicContact CG2-CZ3 3.76Å; I818-W822 PolarHBondContact O-N 3.06Å; R819-W822 PolarHBondContact O-N 2.99Å
823	V	90.3	Very high	89.5	Confident	57 Å²	57	38.6 Å²	38.6	35%	0.345	21%	0.207	S	C	.	.	I	π-helix	trans	-91.9	-44.4	-172.5	175.5	0	0	0	0	111.3	R819 N827	R819-V823 HydrophobicContact CG-CG2 4.42Å; R819-V823 PolarHBondContact O-N 2.95Å; V823-N827 WeakPolarHBondContact O-CB 3.35Å
824	E	90.8	Very high	89.1	Confident	3 Å²	3	39.6 Å²	39.6	1%	0.014	22%	0.218	C	C	.	.	I	π-helix	trans	-90	-33.3	-172.1	-65.5	83.6	164.5	0	0	113.5	N749 S752 Y753 R755 L820	N749-E824 HydrophobicContact CB-CB 4.32Å; N749-E824 HydrophobicContact CB-CG 3.75Å; S752-E824 VanDerWaalsContact CB-OE1 3.25Å; S752-E824 WeakPolarHBondContact CB-OE1 3.25Å; S752-E824 PolarHBondContact OG-OE1 2.61Å; Y753-E824 HydrophobicContact CE2-CB 3.84Å; Y753-E824 HydrophobicContact CE2-CG 4.12Å; Y753-E824 WeakPolarHBondContact OH-CB 3.46Å; R755-E824 IonicContact NH1-OE1 3.92Å; L820-E824 WeakPolarHBondContact CA-OE2 3.34Å; L820-E824 HydrophobicContact CD2-CG 4.31Å; L820-E824 WeakPolarHBondContact O-CB 3.37Å
825	F	90.2	Very high	88.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.234	C	C	.	.	I	π-helix	trans	-93.9	-54.5	-179	-178.2	-112	0	0	0	113.2	F399 H562 F565 L569 L820 H821 N827 K828 F829	F399-F825 HydrophobicContact CB-CE1 4.5Å; F399-F825 HydrophobicContact CB-CZ 4.34Å; H562-F825 AromaticContact CD2-CD2 3.71Å; H562-F825 AromaticContact CD2-CE2 3.99Å; H562-F825 AromaticContact CE1-CD2 3.84Å; H562-F825 AromaticContact CE1-CG 3.79Å; H562-F825 AromaticContact NE2-CD2 3.4Å; H562-F825 WeakPolarHBondContact NE2-CD2 3.46Å; H562-F825 AromaticContact NE2-CE2 3.88Å; H562-F825 AromaticContact NE2-CG 3.6Å; F565-F825 AromaticContact CD1-CE2 3.65Å; F565-F825 HydrophobicContact CD1-CE2 3.65Å; F565-F825 AromaticContact CD1-CZ 3.95Å; F565-F825 HydrophobicContact CD1-CZ 3.95Å; F565-F825 HydrophobicContact CE1-CE2 4.18Å; F565-F825 AromaticContact CE1-CZ 3.98Å; F565-F825 HydrophobicContact CE1-CZ 3.98Å; L569-F825 HydrophobicContact CD1-CE2 4.3Å; L569-F825 HydrophobicContact CD1-CZ 3.66Å; L820-F825 PolarHBondContact O-N 2.97Å; H821-F825 WeakPolarHBondContact O-CB 3.35Å; H821-F825 PolarHBondContact O-N 3.48Å; F825-N827 PolarHBondContact O-N 3.3Å; F825-K828 PolarHBondContact O-N 3.41Å; F825-F829 AromaticContact CD1-CE1 3.8Å; F825-F829 HydrophobicContact CD1-CE1 3.8Å; F825-F829 HydrophobicContact CD1-CZ 4.09Å; F825-F829 HydrophobicContact CD2-CE1 4.31Å; F825-F829 AromaticContact CE1-CE1 3.54Å; F825-F829 HydrophobicContact CE1-CE1 3.54Å; F825-F829 AromaticContact CE1-CZ 3.57Å; F825-F829 HydrophobicContact CE1-CZ 3.57Å; F825-F829 HydrophobicContact CE2-CE1 4.05Å; F825-F829 HydrophobicContact CG-CE1 4.19Å; F825-F829 AromaticContact CZ-CE1 3.67Å; F825-F829 HydrophobicContact CZ-CE1 3.67Å; F825-F829 AromaticContact CZ-CZ 3.96Å; F825-F829 HydrophobicContact CZ-CZ 3.96Å; F825-F829 WeakPolarHBondContact O-CD1 3.25Å; F825-F829 WeakPolarHBondContact O-CE1 3.37Å
826	Q	88.7	Confident	88.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-67.6	-36.1	-174.7	-74.4	171.6	-1.3	0	0	112.6	Y386 P396 H821 K828 F829 Y830	Y386-Q826 HydrophobicContact CE1-CB 4.41Å; P396-Q826 HydrophobicContact CB-CG 4.19Å; P396-Q826 HydrophobicContact CG-CG 4.18Å; H821-Q826 WeakPolarHBondContact O-CB 3.49Å; H821-Q826 VanDerWaalsContact O-CG 3.3Å; H821-Q826 WeakPolarHBondContact O-CG 3.41Å; H821-Q826 PolarHBondContact O-N 3.04Å; Q826-K828 PolarHBondContact O-N 3.37Å; Q826-F829 PolarHBondContact O-N 2.67Å; Q826-F829 VanDerWaalsContact O-N 3.1Å; Q826-Y830 HydrophobicContact CB-CD1 4.36Å; Q826-Y830 HydrophobicContact CB-CG 4.47Å; Q826-Y830 WeakPolarHBondContact O-CA 3.44Å; Q826-Y830 VanDerWaalsContact O-CB 3.22Å; Q826-Y830 WeakPolarHBondContact O-CB 3.2Å; Q826-Y830 PolarHBondContact O-N 3.19Å
827	N	86	Confident	88.5	Confident	75 Å²	75	39.4 Å²	39.4	40%	0.401	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-57.3	-14.7	178	-165	16.8	0	0	0	114.2	V823 F825	V823-N827 WeakPolarHBondContact O-CB 3.35Å; F825-N827 PolarHBondContact O-N 3.3Å
828	K	85.1	Confident	88.2	Confident	19 Å²	19	43.4 Å²	43.4	8%	0.083	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-86.7	-19.9	-180	-60.3	-54.1	-173.4	-177.3	0	114.9	V567 Y742 C746 F825 Q826	V567-K828 HydrophobicContact CG2-CB 4.14Å; V567-K828 HydrophobicContact CG2-CD 4.26Å; V567-K828 HydrophobicContact CG2-CG 4.17Å; Y742-K828 HydrophobicContact CD2-CD 4.36Å; Y742-K828 HydrophobicContact CE2-CD 3.91Å; C746-K828 PolarHBondContact SG-NZ 3.29Å; C746-K828 VanDerWaalsContact SG-NZ 3.42Å; F825-K828 PolarHBondContact O-N 3.41Å; Q826-K828 PolarHBondContact O-N 3.37Å
829	F	85.8	Confident	88	Confident	13 Å²	13	44.3 Å²	44.3	6%	0.057	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-148.6	-15.1	-174.8	69	-88.3	0	0	0	115.1	E393 P396 G566 L569 N573 F825 Q826	E393-F829 VanDerWaalsContact OE1-O 3.05Å; P396-F829 HydrophobicContact CB-CE2 4.33Å; P396-F829 HydrophobicContact CB-CZ 4.01Å; P396-F829 HydrophobicContact CG-CE2 3.84Å; P396-F829 HydrophobicContact CG-CZ 3.95Å; G566-F829 WeakPolarHBondContact O-CD1 3.49Å; L569-F829 HydrophobicContact CB-CB 4.32Å; L569-F829 HydrophobicContact CB-CD1 4.13Å; L569-F829 HydrophobicContact CB-CD2 4.12Å; L569-F829 HydrophobicContact CB-CE1 4.5Å; L569-F829 HydrophobicContact CB-CE2 4.48Å; L569-F829 HydrophobicContact CB-CG 3.93Å; L569-F829 HydrophobicContact CD1-CD1 4.39Å; L569-F829 HydrophobicContact CD1-CE1 3.96Å; L569-F829 HydrophobicContact CD1-CE2 4.25Å; L569-F829 HydrophobicContact CD1-CZ 3.87Å; N573-F829 PolarHBondContact ND2-O 2.86Å; F825-F829 AromaticContact CD1-CE1 3.8Å; F825-F829 HydrophobicContact CD1-CE1 3.8Å; F825-F829 HydrophobicContact CD1-CZ 4.09Å; F825-F829 HydrophobicContact CD2-CE1 4.31Å; F825-F829 AromaticContact CE1-CE1 3.54Å; F825-F829 HydrophobicContact CE1-CE1 3.54Å; F825-F829 AromaticContact CE1-CZ 3.57Å; F825-F829 HydrophobicContact CE1-CZ 3.57Å; F825-F829 HydrophobicContact CE2-CE1 4.05Å; F825-F829 HydrophobicContact CG-CE1 4.19Å; F825-F829 AromaticContact CZ-CE1 3.67Å; F825-F829 HydrophobicContact CZ-CE1 3.67Å; F825-F829 AromaticContact CZ-CZ 3.96Å; F825-F829 HydrophobicContact CZ-CZ 3.96Å; F825-F829 WeakPolarHBondContact O-CD1 3.25Å; F825-F829 WeakPolarHBondContact O-CE1 3.37Å; Q826-F829 PolarHBondContact O-N 2.67Å; Q826-F829 VanDerWaalsContact O-N 3.1Å
830	Y	85.8	Confident	87.7	Confident	19 Å²	19	39.4 Å²	39.4	8%	0.075	23%	0.232	C	C	.	.			trans	-102.4	115	-172.8	-171.1	-109.7	0	0	0	110.6	Y386 G387 V388 G389 E393 P396 Q826	Y386-Y830 HydrophobicContact CD1-CD1 4.24Å; Y386-Y830 HydrophobicContact CD1-CE1 4.23Å; Y386-Y830 HydrophobicContact CE1-CD1 4.4Å; G387-Y830 PolarHBondContact O-OH 2.91Å; V388-Y830 VanDerWaalsContact C-OH 3.3Å; G389-Y830 VanDerWaalsContact CA-CE2 3.46Å; G389-Y830 VanDerWaalsContact CA-OH 3.24Å; G389-Y830 WeakPolarHBondContact CA-OH 3.45Å; G389-Y830 PolarHBondContact N-OH 2.68Å; E393-Y830 VanDerWaalsContact OE1-CA 3.32Å; E393-Y830 WeakPolarHBondContact OE1-CA 3.18Å; P396-Y830 HydrophobicContact CG-CD2 3.47Å; P396-Y830 VanDerWaalsContact CG-CD2 3.47Å; P396-Y830 HydrophobicContact CG-CE2 3.73Å; P396-Y830 HydrophobicContact CG-CG 3.95Å; Q826-Y830 HydrophobicContact CB-CD1 4.36Å; Q826-Y830 HydrophobicContact CB-CG 4.47Å; Q826-Y830 WeakPolarHBondContact O-CA 3.44Å; Q826-Y830 VanDerWaalsContact O-CB 3.22Å; Q826-Y830 WeakPolarHBondContact O-CB 3.2Å; Q826-Y830 PolarHBondContact O-N 3.19Å
831	V	79.3	Confident	87.3	Confident	109 Å²	109	40.4 Å²	40.4	66%	0.661	24%	0.239	S	C	*	.			trans	-83.5	-32.8	-177.8	-176.9	0	0	0	0	112.1	E393 A833	E393-V831 PolarHBondContact OE1-N 3.41Å; V831-A833 VanDerWaalsContact C-N 3.31Å; V831-A833 HydrophobicContact CG1-CB 4.25Å; V831-A833 PolarHBondContact O-N 3.32Å
832	G	79.5	Confident	86.7	Confident	23 Å²	23	40.8 Å²	40.8	24%	0.237	24%	0.241	C	C	.	.			trans	68.2	18.5	170.7	0	0	0	0	0	116.7	V388	V388-G832 CarbonylContact O-C 3.55Å; V388-G832 VanDerWaalsContact O-CA 3.31Å; V388-G832 WeakPolarHBondContact O-CA 3.46Å
833	A	84.6	Confident	85.5	Confident	83 Å²	83	42.4 Å²	42.4	69%	0.686	26%	0.263	S	S	*	.	B	Isolated β-bridge	trans	-99.9	19.1	-175.9	0	0	0	0	0	114.7	V388 V831	V388-A833 PolarHBondContact O-N 3.46Å; V831-A833 VanDerWaalsContact C-N 3.31Å; V831-A833 HydrophobicContact CG1-CB 4.25Å; V831-A833 PolarHBondContact O-N 3.32Å
834	G	86.2	Confident	84	Confident	24 Å²	24	45.2 Å²	45.2	25%	0.247	28%	0.276	C	S	.	.			trans	-86.6	169.2	-177.5	0	0	0	0	0	114.5	V388 G389	V388-G834 PolarHBondContact O-N 2.77Å; G389-G834 WeakPolarHBondContact O-CA 3.41Å
835	T	88.9	Confident	82.6	Confident	81 Å²	81	48.1 Å²	48.1	50%	0.497	29%	0.291	S	S	.	.			trans	-105.3	131.4	171.6	53.6	0	0	0	0	110.2	P367 T368	P367-T835 CarbonylContact C-O 3.57Å; P367-T835 WeakPolarHBondContact CA-O 3.38Å; T368-T835 PolarHBondContact N-O 3.41Å; T368-T835 PolarHBondContact OG1-O 3.02Å
836	K	89.1	Confident	80.9	Confident	94 Å²	94	51.4 Å²	51.4	41%	0.409	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-69.9	133.6	179.3	-174.7	165.8	179.2	155.4	0	109.8	D384 V388 V838	D384-K836 IonicContact OD2-NZ 3.77Å; D384-K836 PolarHBondContact OD2-NZ 3.04Å; V388-K836 HydrophobicContact CG1-CB 4.13Å; V388-K836 HydrophobicContact CG2-CB 3.92Å; K836-V838 PolarHBondContact O-N 3.31Å
837	F	90.3	Very high	79	Confident	12 Å²	12	54.4 Å²	54.4	5%	0.053	34%	0.335	C	S	.	.			trans	-70.9	113.7	171.5	-178.8	-102.4	0	0	0	110	M10 Q36 W329 P367 T368 R369 P839	M10-F837 HydrophobicContact CE-CB 4.24Å; M10-F837 HydrophobicContact CE-CD1 4.4Å; M10-F837 HydrophobicContact CE-CD2 3.67Å; M10-F837 HydrophobicContact CE-CE2 4.06Å; M10-F837 HydrophobicContact CE-CG 3.85Å; M10-F837 HydrophobicContact SD-CD2 4.48Å; M10-F837 HydrophobicContact SD-CE2 4.46Å; Q36-F837 HydrophobicContact CB-CD2 3.94Å; Q36-F837 HydrophobicContact CB-CE2 3.52Å; Q36-F837 HydrophobicContact CB-CZ 4.24Å; W329-F837 HydrophobicContact CB-CE2 4.37Å; P367-F837 HydrophobicContact CB-CB 4.11Å; P367-F837 HydrophobicContact CB-CD2 4.2Å; P367-F837 HydrophobicContact CG-CD2 3.77Å; T368-F837 VanDerWaalsContact O-CB 3.31Å; T368-F837 WeakPolarHBondContact O-CB 3.4Å; T368-F837 PolarHBondContact O-N 3.11Å; R369-F837 HydrophobicContact CB-CB 3.76Å; R369-F837 HydrophobicContact CB-CD1 3.85Å; R369-F837 HydrophobicContact CB-CG 3.9Å; R369-F837 HydrophobicContact CG-CB 4.41Å; R369-F837 HydrophobicContact CG-CD1 3.68Å; R369-F837 HydrophobicContact CG-CE1 4.3Å; R369-F837 HydrophobicContact CG-CG 4.26Å; F837-P839 HydrophobicContact CD1-CB 4.44Å; F837-P839 HydrophobicContact CD1-CG 4.33Å; F837-P839 HydrophobicContact CE1-CB 3.63Å; F837-P839 HydrophobicContact CE1-CG 3.9Å; F837-P839 HydrophobicContact CZ-CB 4.01Å
838	V	87.9	Confident	77.4	Confident	84 Å²	84	55.2 Å²	55.2	51%	0.509	34%	0.335	S	S	.	.			trans	-113.2	99.4	174.6	-177.7	0	0	0	0	107.4	Q36 K836	Q36-V838 WeakPolarHBondContact CB-O 3.36Å; Q36-V838 WeakPolarHBondContact CG-O 3.48Å; K836-V838 PolarHBondContact O-N 3.31Å
839	P	87.8	Confident	75.8	Confident	33 Å²	33	56.9 Å²	56.9	21%	0.214	34%	0.342	C	S	.	.			trans	-70.3	147.5	178.5	26.3	-30	0	0	0	110.9	G33 F837 S841	G33-P839 WeakPolarHBondContact O-CB 3.44Å; F837-P839 HydrophobicContact CD1-CB 4.44Å; F837-P839 HydrophobicContact CD1-CG 4.33Å; F837-P839 HydrophobicContact CE1-CB 3.63Å; F837-P839 HydrophobicContact CE1-CG 3.9Å; F837-P839 HydrophobicContact CZ-CB 4.01Å; P839-S841 PolarHBondContact O-N 3.5Å
840	F	87.4	Confident	73.7	Confident	22 Å²	22	61.6 Å²	61.6	10%	0.096	37%	0.368	C	S	.	.			trans	-70.6	95.1	166.1	177.3	-112	0	0	0	109.2	G30 G33 V35 F37 A307 I308 M311 F842	G30-F840 VanDerWaalsContact CA-CE1 3.47Å; G33-F840 WeakPolarHBondContact CA-O 3.37Å; V35-F840 WeakPolarHBondContact O-CB 3.4Å; V35-F840 PolarHBondContact O-N 3.37Å; F37-F840 HydrophobicContact CD2-CB 3.95Å; F37-F840 HydrophobicContact CD2-CG 4.27Å; F37-F840 HydrophobicContact CE2-CB 3.97Å; F37-F840 AromaticContact CE2-CD1 3.89Å; F37-F840 HydrophobicContact CE2-CD1 3.89Å; F37-F840 HydrophobicContact CE2-CG 4.03Å; A307-F840 HydrophobicContact CB-CE2 4.05Å; I308-F840 HydrophobicContact CG1-CZ 4.35Å; M311-F840 HydrophobicContact CB-CE2 4.47Å; M311-F840 HydrophobicContact CG-CD1 4.35Å; M311-F840 HydrophobicContact CG-CD2 3.4Å; M311-F840 HydrophobicContact CG-CE1 4.23Å; M311-F840 HydrophobicContact CG-CE2 3.26Å; M311-F840 HydrophobicContact CG-CG 3.96Å; M311-F840 HydrophobicContact CG-CZ 3.71Å; M311-F840 HydrophobicContact SD-CD2 3.73Å; M311-F840 HydrophobicContact SD-CE2 4.19Å; M311-F840 HydrophobicContact SD-CG 4.21Å; F840-F842 HydrophobicContact CE1-CE1 4.4Å; F840-F842 HydrophobicContact CE1-CZ 4.42Å; F840-F842 HydrophobicContact CE2-CE1 4.43Å; F840-F842 AromaticContact CZ-CE1 3.8Å; F840-F842 HydrophobicContact CZ-CE1 3.8Å; F840-F842 HydrophobicContact CZ-CZ 4.16Å
841	S	85.1	Confident	71.4	Confident	21 Å²	21	66.1 Å²	66.1	15%	0.147	39%	0.394	C	S	.	.			trans	-130.4	137.9	178.9	-177.8	0	0	0	0	111.2	G30 P839 S843 L844	G30-S841 WeakPolarHBondContact O-CA 3.4Å; P839-S841 PolarHBondContact O-N 3.5Å; S841-S843 PolarHBondContact O-N 2.87Å; S841-S843 PolarHBondContact OG-N 3.3Å; S841-S843 PolarHBondContact OG-OG 2.99Å; S841-L844 PolarHBondContact O-N 3.09Å
842	F	80.4	Confident	69.1	Low	11 Å²	11	69 Å²	69	5%	0.048	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-72.7	-15.4	172.5	-60.8	-44.4	0	0	0	113.8	S27 G30 E31 K304 A307 I308 F840 L844 L845	S27-F842 WeakPolarHBondContact O-CE2 3.49Å; G30-F842 WeakPolarHBondContact O-CD2 3.38Å; G30-F842 PolarHBondContact O-N 3.29Å; E31-F842 HydrophobicContact CG-CD2 3.95Å; E31-F842 HydrophobicContact CG-CE2 4.1Å; K304-F842 HydrophobicContact CB-CD1 4.18Å; K304-F842 HydrophobicContact CB-CE1 4.02Å; K304-F842 HydrophobicContact CB-CZ 4.36Å; K304-F842 HydrophobicContact CD-CB 4.37Å; K304-F842 HydrophobicContact CD-CD1 4.38Å; K304-F842 HydrophobicContact CD-CD2 4Å; K304-F842 HydrophobicContact CD-CE2 4.37Å; K304-F842 HydrophobicContact CD-CG 4.01Å; K304-F842 HydrophobicContact CG-CB 4.28Å; K304-F842 HydrophobicContact CG-CD1 3.77Å; K304-F842 HydrophobicContact CG-CD2 4.29Å; K304-F842 HydrophobicContact CG-CE1 4.12Å; K304-F842 HydrophobicContact CG-CG 3.87Å; A307-F842 HydrophobicContact CB-CE1 4.41Å; I308-F842 HydrophobicContact CD1-CZ 3.86Å; I308-F842 HydrophobicContact CG1-CE1 4.1Å; I308-F842 HydrophobicContact CG1-CZ 3.74Å; F840-F842 HydrophobicContact CE1-CE1 4.4Å; F840-F842 HydrophobicContact CE1-CZ 4.42Å; F840-F842 HydrophobicContact CE2-CE1 4.43Å; F840-F842 AromaticContact CZ-CE1 3.8Å; F840-F842 HydrophobicContact CZ-CE1 3.8Å; F840-F842 HydrophobicContact CZ-CZ 4.16Å; F842-L844 PolarHBondContact O-N 3.31Å; F842-L845 HydrophobicContact CB-CD1 4.24Å; F842-L845 HydrophobicContact CD1-CD1 3.65Å; F842-L845 HydrophobicContact CG-CD1 4.38Å; F842-L845 WeakPolarHBondContact O-CB 3.37Å; F842-L845 PolarHBondContact O-N 3.26Å
843	S	66.6	Low	66.8	Low	107 Å²	107	73.3 Å²	73.3	75%	0.748	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-66.2	-20.2	176.5	68.3	0	0	0	0	113.4	S841	S841-S843 PolarHBondContact O-N 2.87Å; S841-S843 PolarHBondContact OG-N 3.3Å; S841-S843 PolarHBondContact OG-OG 2.99Å
844	L	58.6	Low	63.9	Low	117 Å²	117	74.5 Å²	74.5	61%	0.613	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-83.9	-13.9	177.6	-72.6	160.9	0	0	0	112.7	S841 F842 S846	S841-L844 PolarHBondContact O-N 3.09Å; F842-L844 PolarHBondContact O-N 3.31Å; L844-S846 PolarHBondContact O-N 3.23Å; L844-S846 VanDerWaalsContact O-N 3.08Å
845	L	62.4	Low	61	Low	64 Å²	64	79.9 Å²	79.9	34%	0.335	45%	0.454	S	S	.	.	S	Bend	trans	-72.5	104.9	176.5	-71.7	162.5	0	0	0	108.7	K303 K304 A307 F842 S847	K303-L845 HydrophobicContact CB-CD2 4.37Å; K304-L845 HydrophobicContact CG-CD1 4.03Å; A307-L845 HydrophobicContact CB-CD1 4.43Å; F842-L845 HydrophobicContact CB-CD1 4.24Å; F842-L845 HydrophobicContact CD1-CD1 3.65Å; F842-L845 HydrophobicContact CG-CD1 4.38Å; F842-L845 WeakPolarHBondContact O-CB 3.37Å; F842-L845 PolarHBondContact O-N 3.26Å; L845-S847 PolarHBondContact O-N 3.45Å
846	S	54	Low	58	Low	68 Å²	68	84.4 Å²	84.4	48%	0.476	50%	0.5	S	S	.	.			trans	-54.1	124.9	176.8	176.5	0	0	0	0	111	K303 L844 K848	K303-S846 PolarHBondContact NZ-O 3.44Å; L844-S846 PolarHBondContact O-N 3.23Å; L844-S846 VanDerWaalsContact O-N 3.08Å; S846-K848 PolarHBondContact O-N 3.17Å; S846-K848 WeakPolarHBondContact OG-CB 3.36Å; S846-K848 PolarHBondContact OG-N 3.12Å; S846-K848 VanDerWaalsContact OG-N 3.11Å
847	S	49.1	Very low	56.4	Low	64 Å²	64	84 Å²	84	45%	0.448	50%	0.504	S	S	.	.			trans	-71.3	-4.2	169.1	57.8	0	0	0	0	112.8	L845 F849	L845-S847 PolarHBondContact O-N 3.45Å; S847-F849 VanDerWaalsContact O-CD2 3.25Å; S847-F849 WeakPolarHBondContact O-CD2 3.43Å; S847-F849 WeakPolarHBondContact O-CE2 3.38Å; S847-F849 PolarHBondContact O-N 3.48Å
848	K	51.2	Low	54.6	Low	91 Å²	91	87.7 Å²	87.7	40%	0.396	53%	0.528	S	S	.	.			trans	-70.6	126.5	178.1	-63.6	-169.9	174.1	-169.3	0	110.2	K303 S846	K303-K848 PolarHBondContact NZ-O 3.03Å; S846-K848 PolarHBondContact O-N 3.17Å; S846-K848 WeakPolarHBondContact OG-CB 3.36Å; S846-K848 PolarHBondContact OG-N 3.12Å; S846-K848 VanDerWaalsContact OG-N 3.11Å
849	F	52.7	Low	52.8	Low	54 Å²	54	87.9 Å²	87.9	24%	0.237	53%	0.529	C	S	.	.	S	Bend	trans	-82.6	-26.2	177.8	-66.4	-93.2	0	0	0	112.5	V69 Y296 V299 S847	V69-F849 HydrophobicContact CG1-CB 4.19Å; V69-F849 HydrophobicContact CG2-CD1 3.86Å; V69-F849 HydrophobicContact CG2-CE1 4.45Å; Y296-F849 AromaticContact CD2-CE2 3.28Å; Y296-F849 HydrophobicContact CD2-CE2 3.28Å; Y296-F849 AromaticContact CD2-CZ 3.29Å; Y296-F849 HydrophobicContact CD2-CZ 3.29Å; Y296-F849 AromaticContact CE2-CE2 3.51Å; Y296-F849 HydrophobicContact CE2-CE2 3.51Å; Y296-F849 AromaticContact CE2-CZ 3.86Å; Y296-F849 HydrophobicContact CE2-CZ 3.86Å; Y296-F849 HydrophobicContact CG-CE2 4.34Å; Y296-F849 AromaticContact CG-CZ 3.93Å; Y296-F849 HydrophobicContact CG-CZ 3.93Å; V299-F849 HydrophobicContact CB-CD1 4.33Å; V299-F849 HydrophobicContact CB-CE1 3.54Å; V299-F849 HydrophobicContact CB-CZ 4.24Å; V299-F849 HydrophobicContact CG1-CD1 4.09Å; V299-F849 HydrophobicContact CG1-CE1 3.65Å; V299-F849 HydrophobicContact CG1-CZ 4.31Å; V299-F849 HydrophobicContact CG2-CD1 4.09Å; V299-F849 HydrophobicContact CG2-CE1 3.57Å; S847-F849 VanDerWaalsContact O-CD2 3.25Å; S847-F849 WeakPolarHBondContact O-CD2 3.43Å; S847-F849 WeakPolarHBondContact O-CE2 3.38Å; S847-F849 PolarHBondContact O-N 3.48Å
850	N	40.8	Very low	50.7	Low	113 Å²	113	91.2 Å²	91.2	60%	0.604	55%	0.548	S	S	*	.			trans	-108.2	107.3	173.9	-74.3	-9	0	0	0	108
851	N	37	Very low	48.4	Very low	114 Å²	114	95.5 Å²	95.5	61%	0.61	58%	0.576	S	S	*	*			trans	-152.1	126.6	136	-99.8	11.9	0	0	0	106.2	D853	N851-D853 HydrophobicContact CB-CB 4.18Å; N851-D853 WeakPolarHBondContact CB-OD2 3.3Å; N851-D853 PolarHBondContact ND2-OD2 3.02Å; N851-D853 PolarHBondContact O-N 2.71Å
852	D	31.5	Very low	46	Very low	168 Å²	168	100.5 Å²	100.5	90%	0.898	61%	0.605	S	S	*	*			trans	-62.5	39.3	161.2	-76.9	-43.1	0	0	0	111.6	S854	D852-S854 PolarHBondContact O-N 3.2Å; D852-S854 VanDerWaalsContact O-N 3.08Å
853	D	30.6	Very low	43.5	Very low	114 Å²	114	106.9 Å²	106.9	61%	0.61	64%	0.644	S	S	*	*			trans	-89.5	71.9	175.1	-68.3	-24.1	0	0	0	107.8	N851 V855	N851-D853 HydrophobicContact CB-CB 4.18Å; N851-D853 WeakPolarHBondContact CB-OD2 3.3Å; N851-D853 PolarHBondContact ND2-OD2 3.02Å; N851-D853 PolarHBondContact O-N 2.71Å; D853-V855 PolarHBondContact O-N 2.72Å; D853-V855 VanDerWaalsContact O-N 3.15Å
854	S	23.9	Very low	41.7	Very low	108 Å²	108	106.8 Å²	106.8	76%	0.755	64%	0.636	S	S	*	*			trans	-54.6	112	141.1	55.8	0	0	0	0	106.6	D852	D852-S854 PolarHBondContact O-N 3.2Å; D852-S854 VanDerWaalsContact O-N 3.08Å
855	V	26.4	Very low	40.3	Very low	138 Å²	138	106 Å²	106	84%	0.836	64%	0.638	S	S	*	*			trans	125.5	94.1	170.8	179	0	0	0	0	111.4	D853	D853-V855 PolarHBondContact O-N 2.72Å; D853-V855 VanDerWaalsContact O-N 3.15Å
856	A	24.6	Very low	38.3	Very low	176 Å²	176	109.8 Å²	109.8	100%	1.455	67%	0.666	S	S	*	*			trans	-161.1	0	135.3	0	0	0	0	0	109

Retrieved 856 of 856 residues in 2119.2 ms (Link to these results)

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