A0A087Y4F6_POEFO Loading...

Chloride voltage-gated channel 1

AlphaFold DB , UniProt , Accession A0A087Y4F6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 834 aa.

						>A0A087Y4F6_POEFO|A0A087Y4F6
MAADASQRKALRYQQTLLYGEYREQLGNFARREAARLLTERQWRRQAGENTSATGRRGLGRRHHLHQNPAILESHQSHNSSTKKPQPYSKCQDCLARVRRYIVTKMGEDWIFLILLGLTMALVSWSMDYASAKSLQAYKWIHGELKGNVPLQYLAWITYPIILVVFASLFCHLVSPQAIGSGIPELKTILRGVVLKEYLTLKAFVAKVIGLTAALGSGMPVGKEGPFVHIASICAAVLSRFMSIFSGVYENPYGYTDILTVGCAVGVGCCFGTPLGGVLFSIEVTSTYFAVRNYWRGYFAATFSAFIFRVLSVWNKDAVTITALFKTNFRMDFPFDLQELPAFAIIGISCGFLGAFFVYLNRQVVLFMRRPTALTRFLTKHRLIYPGAVTLIIATFTFPPGFGQFMAGELMPRECINSLFDNFTWTKISDPVAAPGLGRSAAWLHPHVSVFLILLLFFVMKFWMSAVSTTMPIPSGAFMPVFILGAAFGRLVGEIMATLFPNGILFDGIVYRILPGGYAVIGAAAMTGAVTHTVSTAVICFELTGQISHILPMMVAVILANMVAQGLQPSLYDSIIQVKKLPYLPELALGHISKYNIFVEDIMVRKVKFLSSQSTFRELNHLLESTTLKTIPLVDSKESMILLGSIERTELQAVLDWWLSPERRVFERGSSSPGQGSKLSWESFSFVDEEGEESSDKAVSPVQEGCNGPIPAPGPQEPATNHTGSDKRKLSSVRRTLQRLFSSSSSSGQTETQEDVPPPLTDTMSPEEIKAWEEEELDKPVDMEEIRIDPSPFQLVERTSLHKARAAKTPCTVTCMKESCAFSHQLLGHKSKLI
					

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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	30.8	Very low	30.3	Very low	247 Å²	247	117.9 Å²	117.9	100%	1.217	68%	0.682	S	S	*	*				0	21.1	0	-83.5	178.6	175.7	0	0	114.5
2	A	23.9	Very low	30.9	Very low	103 Å²	103	119.3 Å²	119.3	85%	0.851	67%	0.668	S	S	*	*			trans	-102.4	6.8	-179.3	0	0	0	0	0	114.9
3	A	22.4	Very low	31.9	Very low	86 Å²	86	113.4 Å²	113.4	71%	0.711	63%	0.629	S	S	*	*	S	Bend	trans	-92.9	-14.5	-174.4	0	0	0	0	0	114.6
4	D	25.3	Very low	32.7	Very low	120 Å²	120	111.2 Å²	111.2	64%	0.642	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-95.5	-5.3	-165.8	-140.2	7.8	0	0	0	114.6	S6	D4-S6 VanDerWaalsContact C-N 3.28Å; D4-S6 PolarHBondContact O-N 2.92Å
5	A	26.3	Very low	33.6	Very low	89 Å²	89	108.7 Å²	108.7	74%	0.736	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-77.4	-10.8	175.8	0	0	0	0	0	113.5
6	S	27	Very low	34.7	Very low	97 Å²	97	103.8 Å²	103.8	68%	0.678	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-81.4	-12.6	-177.3	76.2	0	0	0	0	114.5	D4	D4-S6 VanDerWaalsContact C-N 3.28Å; D4-S6 PolarHBondContact O-N 2.92Å
7	Q	26.9	Very low	35	Very low	105 Å²	105	98.2 Å²	98.2	49%	0.491	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-93	-4.1	-175.5	-75.5	-166.3	-3.3	0	0	115.4	K9	Q7-K9 PolarHBondContact O-N 3.48Å
8	R	31.5	Very low	35.8	Very low	230 Å²	230	92.9 Å²	92.9	87%	0.868	51%	0.509	S	S	*	.			trans	-93.6	53.6	-175.9	-64.8	-176	-177.2	179	0.3	113.9
9	K	36.4	Very low	36.4	Very low	103 Å²	103	88.8 Å²	88.8	45%	0.448	49%	0.485	S	S	.	.			trans	-112.7	107.4	172.2	-71.9	-173.4	178.8	-176	0	110.5	Q7 L11	Q7-K9 PolarHBondContact O-N 3.48Å; K9-L11 PolarHBondContact O-N 3.23Å
10	A	39.2	Very low	36.9	Very low	83 Å²	83	84.7 Å²	84.7	69%	0.686	46%	0.463	S	S	*	.	S	Bend	trans	-61.4	117.2	166.7	0	0	0	0	0	108
11	L	43.8	Very low	37.1	Very low	34 Å²	34	82.3 Å²	82.3	18%	0.178	45%	0.449	C	S	.	.	S	Bend	trans	65.2	97.4	-164.9	-52.6	161.8	0	0	0	111.6	K9 Y13 Y22 L26	K9-L11 PolarHBondContact O-N 3.23Å; L11-Y13 VanDerWaalsContact C-N 3.28Å; L11-Y13 PolarHBondContact O-N 3Å; L11-Y22 HydrophobicContact CB-CD1 3.6Å; L11-Y22 HydrophobicContact CB-CE1 4.02Å; L11-Y22 HydrophobicContact CD1-CD1 4.43Å; L11-L26 HydrophobicContact CD1-CD1 4.48Å; L11-L26 HydrophobicContact CD2-CD1 3.62Å; L11-L26 HydrophobicContact CD2-CG 4.26Å
12	R	37.1	Very low	37.8	Very low	134 Å²	134	72.3 Å²	72.3	51%	0.506	40%	0.398	S	S	.	.			trans	-56.5	88.1	176.4	-71.7	-179.7	175	-168.9	-0.5	111.1	Q14 R23	R12-Q14 PolarHBondContact O-N 3.02Å; R12-Q14 VanDerWaalsContact O-N 3.09Å; R12-R23 PolarHBondContact O-N 3.31Å
13	Y	43.9	Very low	38.5	Very low	43 Å²	43	75.2 Å²	75.2	17%	0.169	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	103.1	174.3	-177	-106.5	0	0	0	108	L11 G20 Y22 Q177	L11-Y13 VanDerWaalsContact C-N 3.28Å; L11-Y13 PolarHBondContact O-N 3Å; Y13-G20 VanDerWaalsContact CZ-CA 3.43Å; Y13-G20 WeakPolarHBondContact OH-CA 3.49Å; Y13-G20 PolarHBondContact OH-N 3.16Å; Y13-Y22 HydrophobicContact CD2-CD1 4.02Å; Y13-Y22 HydrophobicContact CD2-CD2 4.14Å; Y13-Y22 AromaticContact CD2-CE1 3.66Å; Y13-Y22 HydrophobicContact CD2-CE1 3.66Å; Y13-Y22 AromaticContact CD2-CE2 3.76Å; Y13-Y22 HydrophobicContact CD2-CE2 3.76Å; Y13-Y22 HydrophobicContact CD2-CG 4.27Å; Y13-Y22 AromaticContact CD2-CZ 3.52Å; Y13-Y22 HydrophobicContact CE2-CE2 4.03Å; Y13-Y22 HydrophobicContact CG-CE1 4.22Å; Y13-Q177 VanDerWaalsContact CE1-NE2 3.3Å; Y13-Q177 PolarHBondContact OH-OE1 2.77Å
14	Q	42.8	Very low	39.2	Very low	83 Å²	83	71.6 Å²	71.6	39%	0.388	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	114.8	172.8	-176.2	169.2	-13.4	0	0	108.3	R12 T16 G20 E21 R23	R12-Q14 PolarHBondContact O-N 3.02Å; R12-Q14 VanDerWaalsContact O-N 3.09Å; Q14-T16 PolarHBondContact O-N 2.82Å; Q14-T16 VanDerWaalsContact O-N 3.16Å; Q14-G20 CarbonylContact O-C 3.09Å; Q14-G20 VanDerWaalsContact O-CA 3.32Å; Q14-G20 WeakPolarHBondContact O-CA 3.37Å; Q14-E21 PolarHBondContact N-O 2.9Å; Q14-E21 PolarHBondContact O-N 3.26Å; Q14-R23 HydrophobicContact CB-CB 4.42Å
15	Q	47	Very low	39.9	Very low	74 Å²	74	70 Å²	70	35%	0.346	34%	0.344	S	S	.	.			trans	-66.7	115.2	176.2	-160.6	172.9	-19	0	0	109.1	H172	Q15-H172 PolarHBondContact NE2-CD2 2.92Å; Q15-H172 VanDerWaalsContact NE2-CD2 3.26Å; Q15-H172 PolarHBondContact NE2-NE2 3.13Å
16	T	51.3	Low	40.5	Very low	30 Å²	30	67.4 Å²	67.4	18%	0.184	32%	0.318	C	S	.	.			trans	-102.8	174.9	171.4	84.5	0	0	0	0	110.1	Q14 L18 Y19 E21 R382	Q14-T16 PolarHBondContact O-N 2.82Å; Q14-T16 VanDerWaalsContact O-N 3.16Å; T16-L18 VanDerWaalsContact C-N 3.29Å; T16-L18 PolarHBondContact O-N 3.41Å; T16-Y19 PolarHBondContact OG1-O 3.02Å; T16-E21 HydrophobicContact CG2-CB 3.96Å; T16-R382 PolarHBondContact O-NH1 3.16Å
17	L	39	Very low	41.1	Very low	8 Å²	8	63 Å²	63	4%	0.042	29%	0.288	C	S	.	.	S	Bend	trans	-53.2	-42	-175.4	-169	86.3	0	0	0	113.2	L378 R382 Y385 P472	L17-L378 HydrophobicContact CD1-CB 4.09Å; L17-L378 WeakPolarHBondContact CD1-O 3.45Å; L17-L378 HydrophobicContact CD2-CB 4.09Å; L17-R382 HydrophobicContact CD1-CG 4.46Å; L17-R382 PolarHBondContact O-NH2 3.01Å; L17-Y385 HydrophobicContact CD2-CD1 4.06Å; L17-Y385 HydrophobicContact CD2-CD2 4.21Å; L17-Y385 HydrophobicContact CD2-CG 3.85Å; L17-P472 VanDerWaalsContact O-CB 3.27Å; L17-P472 WeakPolarHBondContact O-CB 3.28Å
18	L	49.6	Very low	41.6	Very low	3 Å²	3	60.5 Å²	60.5	2%	0.016	28%	0.278	C	S	.	.	S	Bend	trans	-104.2	-62.1	-171.3	-60	166.8	0	0	0	111.9	T16 I179 V365 M368 Y385 T470	T16-L18 VanDerWaalsContact C-N 3.29Å; T16-L18 PolarHBondContact O-N 3.41Å; L18-I179 WeakPolarHBondContact O-CG2 3.49Å; L18-V365 HydrophobicContact CD1-CG1 4.19Å; L18-M368 HydrophobicContact CD1-CB 3.35Å; L18-M368 HydrophobicContact CD1-CG 4.04Å; L18-M368 HydrophobicContact CG-CB 4.4Å; L18-Y385 HydrophobicContact CD2-CD1 4.11Å; L18-Y385 HydrophobicContact CD2-CE1 3.36Å; L18-T470 WeakPolarHBondContact CD2-O 3.49Å
19	Y	48	Very low	42.3	Very low	16 Å²	16	51.4 Å²	51.4	6%	0.063	25%	0.245	C	C	.	.	S	Bend	trans	-130.7	131.5	-179.2	-58.8	-61.8	0	0	0	107.6	T16 E21 V365 T469 K579	T16-Y19 PolarHBondContact OG1-O 3.02Å; Y19-E21 PolarHBondContact O-N 3.34Å; Y19-V365 HydrophobicContact CD2-CG1 4.24Å; Y19-V365 HydrophobicContact CE2-CG1 4.24Å; Y19-V365 HydrophobicContact CE2-CG2 4.32Å; Y19-T469 PolarHBondContact OH-O 3.23Å; Y19-K579 HydrophobicContact CD1-CD 4.45Å; Y19-K579 HydrophobicContact CD2-CG 4.4Å; Y19-K579 HydrophobicContact CG-CD 4.3Å; Y19-K579 HydrophobicContact CG-CG 4.14Å
20	G	46	Very low	42.6	Very low	5 Å²	5	48 Å²	48	5%	0.052	24%	0.236	C	C	.	.			trans	-56.9	144.6	172.3	0	0	0	0	0	110.8	Y13 Q14	Y13-G20 VanDerWaalsContact CZ-CA 3.43Å; Y13-G20 WeakPolarHBondContact OH-CA 3.49Å; Y13-G20 PolarHBondContact OH-N 3.16Å; Q14-G20 CarbonylContact O-C 3.09Å; Q14-G20 VanDerWaalsContact O-CA 3.32Å; Q14-G20 WeakPolarHBondContact O-CA 3.37Å
21	E	40	Very low	42.7	Very low	36 Å²	36	50.7 Å²	50.7	17%	0.168	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.2	177.3	-173.9	177.5	-171.2	0	0	107.7	Q14 T16 Y19 R23 K580	Q14-E21 PolarHBondContact N-O 2.9Å; Q14-E21 PolarHBondContact O-N 3.26Å; T16-E21 HydrophobicContact CG2-CB 3.96Å; Y19-E21 PolarHBondContact O-N 3.34Å; E21-R23 VanDerWaalsContact C-N 3.29Å; E21-R23 PolarHBondContact O-N 3.03Å; E21-K580 WeakPolarHBondContact OE1-CE 3.39Å; E21-K580 IonicContact OE1-NZ 2.97Å; E21-K580 PolarHBondContact OE1-NZ 3.4Å
22	Y	46.6	Very low	42.8	Very low	37 Å²	37	55.2 Å²	55.2	15%	0.145	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	93.7	162	-68.5	-79.4	0	0	0	106.7	L11 Y13 E24 L581	L11-Y22 HydrophobicContact CB-CD1 3.6Å; L11-Y22 HydrophobicContact CB-CE1 4.02Å; L11-Y22 HydrophobicContact CD1-CD1 4.43Å; Y13-Y22 HydrophobicContact CD2-CD1 4.02Å; Y13-Y22 HydrophobicContact CD2-CD2 4.14Å; Y13-Y22 AromaticContact CD2-CE1 3.66Å; Y13-Y22 HydrophobicContact CD2-CE1 3.66Å; Y13-Y22 AromaticContact CD2-CE2 3.76Å; Y13-Y22 HydrophobicContact CD2-CE2 3.76Å; Y13-Y22 HydrophobicContact CD2-CG 4.27Å; Y13-Y22 AromaticContact CD2-CZ 3.52Å; Y13-Y22 HydrophobicContact CE2-CE2 4.03Å; Y13-Y22 HydrophobicContact CG-CE1 4.22Å; Y22-E24 PolarHBondContact O-N 2.62Å; Y22-L581 HydrophobicContact CD2-CD2 3.94Å; Y22-L581 HydrophobicContact CE2-CD2 3.75Å
23	R	38.1	Very low	43.2	Very low	164 Å²	164	52.2 Å²	52.2	62%	0.619	23%	0.234	S	C	*	.			trans	-69	-22.7	-167.5	-136.5	-159.1	-172	165	-13.7	112.7	R12 Q14 E21	R12-R23 PolarHBondContact O-N 3.31Å; Q14-R23 HydrophobicContact CB-CB 4.42Å; E21-R23 VanDerWaalsContact C-N 3.29Å; E21-R23 PolarHBondContact O-N 3.03Å
24	E	37.3	Very low	43.3	Very low	9 Å²	9	52.2 Å²	52.2	4%	0.042	24%	0.244	C	C	.	.	S	Bend	trans	-90.4	110.8	169.8	-76.1	160.2	155.8	0	0	109.4	Y22 L26 F29 R32	Y22-E24 PolarHBondContact O-N 2.62Å; E24-L26 PolarHBondContact O-N 2.78Å; E24-F29 HydrophobicContact CB-CB 3.58Å; E24-F29 HydrophobicContact CG-CB 3.92Å; E24-F29 WeakPolarHBondContact OE2-CB 3.44Å; E24-F29 WeakPolarHBondContact OE2-CD2 3.35Å; E24-F29 WeakPolarHBondContact OE2-CG 3.29Å; E24-R32 IonicContact OE1-CZ 2.78Å; E24-R32 IonicContact OE1-NH1 3.96Å; E24-R32 PolarHBondContact OE1-NH1 3.04Å; E24-R32 IonicContact OE1-NH2 3.79Å; E24-R32 PolarHBondContact OE1-NH2 3.39Å
25	Q	39.3	Very low	43.3	Very low	88 Å²	88	50.6 Å²	50.6	41%	0.411	25%	0.245	S	C	.	.			trans	-45.5	130.8	146.4	-73	-175.9	-32.3	0	0	106.9	G27 N28 F29	Q25-G27 PolarHBondContact O-N 3Å; Q25-N28 PolarHBondContact O-N 3.01Å; Q25-F29 PolarHBondContact O-N 3.28Å
26	L	40.6	Very low	43.5	Very low	34 Å²	34	52.6 Å²	52.6	18%	0.178	25%	0.249	C	C	.	.	H	α-helix	trans	-45.7	-36.7	-175	-130.5	97	0	0	0	111.9	L11 E24 N28 A30 P582 L827	L11-L26 HydrophobicContact CD1-CD1 4.48Å; L11-L26 HydrophobicContact CD2-CD1 3.62Å; L11-L26 HydrophobicContact CD2-CG 4.26Å; E24-L26 PolarHBondContact O-N 2.78Å; L26-N28 PolarHBondContact O-N 2.83Å; L26-A30 WeakPolarHBondContact O-CB 3.34Å; L26-A30 PolarHBondContact O-N 3.45Å; L26-P582 HydrophobicContact CD1-CB 4.43Å; L26-L827 HydrophobicContact CD2-CB 3.67Å
27	G	39.1	Very low	43.2	Very low	5 Å²	5	55.4 Å²	55.4	5%	0.052	26%	0.262	C	S	.	.	H	α-helix	trans	-64.8	-26.8	177.4	0	0	0	0	0	117.1	Q25 R31 G828	Q25-G27 PolarHBondContact O-N 3Å; G27-R31 WeakPolarHBondContact O-CB 3.15Å; G27-R31 WeakPolarHBondContact O-CG 3.37Å; G27-R31 PolarHBondContact O-N 3.47Å; G27-R31 PolarHBondContact O-NE 3.07Å; G27-G828 VanDerWaalsContact CA-CA 3.42Å; G27-G828 WeakPolarHBondContact CA-O 3.46Å; G27-G828 VanDerWaalsContact N-CA 3.35Å
28	N	37.9	Very low	43.5	Very low	51 Å²	51	60.1 Å²	60.1	27%	0.273	29%	0.287	S	S	.	.	H	α-helix	trans	-88.7	-35.6	178.4	-69.2	-19.6	0	0	0	111.7	Q25 L26 R31 R32	Q25-N28 PolarHBondContact O-N 3.01Å; L26-N28 PolarHBondContact O-N 2.83Å; N28-R31 PolarHBondContact OD1-NH2 2.89Å; N28-R32 PolarHBondContact O-N 3.35Å
29	F	44.3	Very low	43.3	Very low	40 Å²	40	63.6 Å²	63.6	18%	0.175	31%	0.309	C	S	.	.	H	α-helix	trans	-64.4	-51.5	169.2	179.2	-116.9	0	0	0	110.1	E24 Q25 R31 R32 E33	E24-F29 HydrophobicContact CB-CB 3.58Å; E24-F29 HydrophobicContact CG-CB 3.92Å; E24-F29 WeakPolarHBondContact OE2-CB 3.44Å; E24-F29 WeakPolarHBondContact OE2-CD2 3.35Å; E24-F29 WeakPolarHBondContact OE2-CG 3.29Å; Q25-F29 PolarHBondContact O-N 3.28Å; F29-R31 VanDerWaalsContact C-N 3.26Å; F29-R31 PolarHBondContact O-N 3.36Å; F29-R32 PolarHBondContact O-N 3.05Å; F29-R32 VanDerWaalsContact O-N 3.1Å; F29-E33 WeakPolarHBondContact O-CB 3.27Å; F29-E33 PolarHBondContact O-N 2.98Å
30	A	43.6	Very low	43.4	Very low	32 Å²	32	66.5 Å²	66.5	26%	0.264	32%	0.322	S	S	.	.	H	α-helix	trans	-57.9	-38	178.4	0	0	0	0	0	112.1	L26 A34	L26-A30 WeakPolarHBondContact O-CB 3.34Å; L26-A30 PolarHBondContact O-N 3.45Å; A30-A34 WeakPolarHBondContact O-CB 3.48Å; A30-A34 PolarHBondContact O-N 3.08Å
31	R	41.7	Very low	43.5	Very low	139 Å²	139	73.9 Å²	73.9	53%	0.525	35%	0.349	S	S	.	.	H	α-helix	trans	-67.7	-42.9	174.1	-90.3	-176.1	-80.4	175	-8.3	113.6	G27 N28 F29 A35	G27-R31 WeakPolarHBondContact O-CB 3.15Å; G27-R31 WeakPolarHBondContact O-CG 3.37Å; G27-R31 PolarHBondContact O-N 3.47Å; G27-R31 PolarHBondContact O-NE 3.07Å; N28-R31 PolarHBondContact OD1-NH2 2.89Å; F29-R31 VanDerWaalsContact C-N 3.26Å; F29-R31 PolarHBondContact O-N 3.36Å; R31-A35 WeakPolarHBondContact O-CB 3.18Å; R31-A35 PolarHBondContact O-N 3.03Å
32	R	45	Very low	44.2	Very low	129 Å²	129	78 Å²	78	49%	0.487	37%	0.368	S	S	.	.	H	α-helix	trans	-71	-37.5	178.4	-91.1	-172.7	-96.8	134.4	0.4	112.1	E24 N28 F29 A35 R36	E24-R32 IonicContact OE1-CZ 2.78Å; E24-R32 IonicContact OE1-NH1 3.96Å; E24-R32 PolarHBondContact OE1-NH1 3.04Å; E24-R32 IonicContact OE1-NH2 3.79Å; E24-R32 PolarHBondContact OE1-NH2 3.39Å; N28-R32 PolarHBondContact O-N 3.35Å; F29-R32 PolarHBondContact O-N 3.05Å; F29-R32 VanDerWaalsContact O-N 3.1Å; R32-A35 PolarHBondContact O-N 3.16Å; R32-R36 WeakPolarHBondContact O-CB 3.29Å; R32-R36 PolarHBondContact O-N 3.26Å
33	E	44.9	Very low	44	Very low	70 Å²	70	85.2 Å²	85.2	33%	0.327	40%	0.395	S	S	.	.	H	α-helix	trans	-70.7	-42.1	175.9	-151.5	67.5	-174.1	0	0	110.7	F29 R36 L37	F29-E33 WeakPolarHBondContact O-CB 3.27Å; F29-E33 PolarHBondContact O-N 2.98Å; E33-R36 PolarHBondContact O-N 3.37Å; E33-L37 HydrophobicContact CG-CD1 4.47Å; E33-L37 VanDerWaalsContact O-CB 3.31Å; E33-L37 WeakPolarHBondContact O-CB 3.47Å; E33-L37 WeakPolarHBondContact O-CG 3.44Å; E33-L37 PolarHBondContact O-N 3.03Å
34	A	46.2	Very low	44.3	Very low	44 Å²	44	85.7 Å²	85.7	36%	0.364	40%	0.397	S	S	.	.	H	α-helix	trans	-63.3	-42.6	172.4	0	0	0	0	0	112	A30 L37 L38	A30-A34 WeakPolarHBondContact O-CB 3.48Å; A30-A34 PolarHBondContact O-N 3.08Å; A34-L37 PolarHBondContact O-N 3.28Å; A34-L38 WeakPolarHBondContact O-CB 3.33Å; A34-L38 WeakPolarHBondContact O-CG 3.46Å; A34-L38 PolarHBondContact O-N 2.88Å
35	A	43.1	Very low	44.9	Very low	49 Å²	49	94.7 Å²	94.7	41%	0.405	43%	0.431	S	S	.	.	H	α-helix	trans	-64	-44	175.6	0	0	0	0	0	111.4	R31 R32 L38 T39	R31-A35 WeakPolarHBondContact O-CB 3.18Å; R31-A35 PolarHBondContact O-N 3.03Å; R32-A35 PolarHBondContact O-N 3.16Å; A35-L38 WeakPolarHBondContact O-CB 3.5Å; A35-L38 PolarHBondContact O-N 3.35Å; A35-T39 PolarHBondContact O-N 3.49Å; A35-T39 PolarHBondContact O-OG1 3.11Å
36	R	51.6	Low	45.1	Very low	116 Å²	116	96.5 Å²	96.5	44%	0.438	44%	0.439	S	S	.	.	H	α-helix	trans	-62.2	-44.7	176	-172.4	-173.8	-176.6	172.6	6.4	111.4	R32 E33 L38 T39 E40	R32-R36 WeakPolarHBondContact O-CB 3.29Å; R32-R36 PolarHBondContact O-N 3.26Å; E33-R36 PolarHBondContact O-N 3.37Å; R36-L38 VanDerWaalsContact C-N 3.29Å; R36-L38 PolarHBondContact O-N 2.88Å; R36-T39 PolarHBondContact O-N 3.5Å; R36-E40 WeakPolarHBondContact O-CB 3.4Å; R36-E40 PolarHBondContact O-N 3.17Å
37	L	44.9	Very low	45.2	Very low	89 Å²	89	96.8 Å²	96.8	47%	0.466	45%	0.447	S	S	.	.	H	α-helix	trans	-65	-32.6	176.1	-71.7	168.7	0	0	0	112	E33 A34 R41	E33-L37 HydrophobicContact CG-CD1 4.47Å; E33-L37 VanDerWaalsContact O-CB 3.31Å; E33-L37 WeakPolarHBondContact O-CB 3.47Å; E33-L37 WeakPolarHBondContact O-CG 3.44Å; E33-L37 PolarHBondContact O-N 3.03Å; A34-L37 PolarHBondContact O-N 3.28Å; L37-R41 VanDerWaalsContact O-CB 3.27Å; L37-R41 WeakPolarHBondContact O-CB 3.49Å; L37-R41 WeakPolarHBondContact O-CG 3.39Å; L37-R41 PolarHBondContact O-N 3.1Å
38	L	46.2	Very low	45.4	Very low	107 Å²	107	98.8 Å²	98.8	56%	0.56	47%	0.467	S	S	*	.	H	α-helix	trans	-70.9	-41.9	171.9	-73.4	167.5	0	0	0	112	A34 A35 R36 R41 Q42	A34-L38 WeakPolarHBondContact O-CB 3.33Å; A34-L38 WeakPolarHBondContact O-CG 3.46Å; A34-L38 PolarHBondContact O-N 2.88Å; A35-L38 WeakPolarHBondContact O-CB 3.5Å; A35-L38 PolarHBondContact O-N 3.35Å; R36-L38 VanDerWaalsContact C-N 3.29Å; R36-L38 PolarHBondContact O-N 2.88Å; L38-R41 PolarHBondContact O-N 2.98Å; L38-Q42 WeakPolarHBondContact O-CG 3.5Å; L38-Q42 PolarHBondContact O-N 3.39Å
39	T	44.6	Very low	45.5	Very low	76 Å²	76	103.4 Å²	103.4	47%	0.466	49%	0.487	S	S	.	.	H	α-helix	trans	-70.2	-39.8	177.6	0.7	0	0	0	0	111.4	A35 R36 R41 Q42 W43	A35-T39 PolarHBondContact O-N 3.49Å; A35-T39 PolarHBondContact O-OG1 3.11Å; R36-T39 PolarHBondContact O-N 3.5Å; T39-R41 VanDerWaalsContact C-N 3.32Å; T39-R41 PolarHBondContact O-N 2.87Å; T39-Q42 PolarHBondContact O-N 2.98Å; T39-W43 WeakPolarHBondContact O-CB 3.13Å; T39-W43 PolarHBondContact O-N 3.18Å
40	E	49.5	Very low	45	Very low	76 Å²	76	108.3 Å²	108.3	36%	0.355	52%	0.515	S	S	.	.	H	α-helix	trans	-66.7	-34.6	175.5	-164.9	-178.8	163.7	0	0	111	R36 R44	R36-E40 WeakPolarHBondContact O-CB 3.4Å; R36-E40 PolarHBondContact O-N 3.17Å; E40-R44 VanDerWaalsContact O-CB 3.31Å; E40-R44 WeakPolarHBondContact O-CB 3.49Å; E40-R44 VanDerWaalsContact O-CG 3.28Å; E40-R44 WeakPolarHBondContact O-CG 3.24Å; E40-R44 PolarHBondContact O-N 2.65Å; E40-R44 IonicContact OE1-CZ 3.41Å; E40-R44 IonicContact OE1-NE 2.79Å; E40-R44 PolarHBondContact OE1-NE 2.83Å; E40-R44 IonicContact OE1-NH2 2.57Å; E40-R44 PolarHBondContact OE1-NH2 3.43Å
41	R	49.8	Very low	44.6	Very low	160 Å²	160	111.8 Å²	111.8	60%	0.604	53%	0.533	S	S	*	.	H	α-helix	trans	-67.7	-38.4	169.8	-81.6	175.8	-178.2	-178.9	2.1	113	L37 L38 T39 R45	L37-R41 VanDerWaalsContact O-CB 3.27Å; L37-R41 WeakPolarHBondContact O-CB 3.49Å; L37-R41 WeakPolarHBondContact O-CG 3.39Å; L37-R41 PolarHBondContact O-N 3.1Å; L38-R41 PolarHBondContact O-N 2.98Å; T39-R41 VanDerWaalsContact C-N 3.32Å; T39-R41 PolarHBondContact O-N 2.87Å; R41-R45 WeakPolarHBondContact O-CB 3.43Å; R41-R45 WeakPolarHBondContact O-CG 3.41Å; R41-R45 PolarHBondContact O-N 3.11Å
42	Q	52.9	Low	44.3	Very low	124 Å²	124	110.2 Å²	110.2	58%	0.579	54%	0.543	S	S	*	.	H	α-helix	trans	-67	-41.6	174.1	-78.1	174.5	-30.2	0	0	111.2	L38 T39 R45 Q46	L38-Q42 WeakPolarHBondContact O-CG 3.5Å; L38-Q42 PolarHBondContact O-N 3.39Å; T39-Q42 PolarHBondContact O-N 2.98Å; Q42-R45 PolarHBondContact O-N 2.71Å; Q42-Q46 PolarHBondContact O-N 3Å
43	W	42.8	Very low	43.8	Very low	187 Å²	187	107.8 Å²	107.8	71%	0.708	55%	0.551	S	S	*	*	H	α-helix	trans	-65.5	-41.2	174.7	-119.6	75.2	0	0	0	112.2	T39 Q46 A47	T39-W43 WeakPolarHBondContact O-CB 3.13Å; T39-W43 PolarHBondContact O-N 3.18Å; W43-Q46 PolarHBondContact O-N 3.38Å; W43-A47 WeakPolarHBondContact O-CB 3.48Å; W43-A47 PolarHBondContact O-N 3.04Å
44	R	45.7	Very low	43	Very low	175 Å²	175	110.9 Å²	110.9	66%	0.66	58%	0.575	S	S	*	*	H	α-helix	trans	-69.8	-30.1	175.3	-74.9	-173.6	-167.7	-155.9	6.4	113	E40 G48	E40-R44 VanDerWaalsContact O-CB 3.31Å; E40-R44 WeakPolarHBondContact O-CB 3.49Å; E40-R44 VanDerWaalsContact O-CG 3.28Å; E40-R44 WeakPolarHBondContact O-CG 3.24Å; E40-R44 PolarHBondContact O-N 2.65Å; E40-R44 IonicContact OE1-CZ 3.41Å; E40-R44 IonicContact OE1-NE 2.79Å; E40-R44 PolarHBondContact OE1-NE 2.83Å; E40-R44 IonicContact OE1-NH2 2.57Å; E40-R44 PolarHBondContact OE1-NH2 3.43Å; R44-G48 WeakPolarHBondContact O-CA 3.37Å; R44-G48 PolarHBondContact O-N 2.86Å
45	R	48.7	Very low	42.2	Very low	197 Å²	197	112.6 Å²	112.6	74%	0.743	60%	0.596	S	S	*	*	H	α-helix	trans	-68.8	-45.6	170.6	-80.6	179.3	174.7	-178.2	-4.5	111.4	R41 Q42 G48 E49	R41-R45 WeakPolarHBondContact O-CB 3.43Å; R41-R45 WeakPolarHBondContact O-CG 3.41Å; R41-R45 PolarHBondContact O-N 3.11Å; Q42-R45 PolarHBondContact O-N 2.71Å; R45-G48 PolarHBondContact O-N 2.87Å; R45-E49 PolarHBondContact O-N 3.11Å
46	Q	43.3	Very low	41.6	Very low	126 Å²	126	122.1 Å²	122.1	59%	0.589	62%	0.622	S	S	*	*	H	α-helix	trans	-69.4	-34.4	177	-76.3	-179.9	-28.2	0	0	113.3	Q42 W43 N50	Q42-Q46 PolarHBondContact O-N 3Å; W43-Q46 PolarHBondContact O-N 3.38Å; Q46-N50 PolarHBondContact O-N 3.03Å
47	A	44.3	Very low	40.5	Very low	41 Å²	41	128.8 Å²	128.8	34%	0.339	65%	0.647	S	S	.	*	H	α-helix	trans	-74.7	-32.5	173.7	0	0	0	0	0	112	W43 N50 T51	W43-A47 WeakPolarHBondContact O-CB 3.48Å; W43-A47 PolarHBondContact O-N 3.04Å; A47-N50 PolarHBondContact O-N 3.3Å; A47-T51 PolarHBondContact O-N 3.2Å; A47-T51 PolarHBondContact O-OG1 2.86Å
48	G	43.2	Very low	39.7	Very low	47 Å²	47	127.9 Å²	127.9	49%	0.485	66%	0.659	S	S	.	*	H	α-helix	trans	-68.6	-35.2	174.7	0	0	0	0	0	113.3	R44 R45	R44-G48 WeakPolarHBondContact O-CA 3.37Å; R44-G48 PolarHBondContact O-N 2.86Å; R45-G48 PolarHBondContact O-N 2.87Å
49	E	39.8	Very low	38.8	Very low	148 Å²	148	131.5 Å²	131.5	69%	0.692	68%	0.678	S	S	*	*	H	α-helix	trans	-74.4	-25.2	175.5	-77.3	176.1	163.8	0	0	113.2	R45	R45-E49 PolarHBondContact O-N 3.11Å
50	N	33.5	Very low	37.8	Very low	143 Å²	143	131 Å²	131	77%	0.765	69%	0.689	S	S	*	*	H	α-helix	trans	-91.8	-6	179.3	-81.3	-8.9	0	0	0	115	Q46 A47	Q46-N50 PolarHBondContact O-N 3.03Å; A47-N50 PolarHBondContact O-N 3.3Å
51	T	34.2	Very low	36.7	Very low	105 Å²	105	139 Å²	139	64%	0.644	72%	0.716	S	S	*	*	S	Bend	trans	-112.8	6.9	-176.8	-29.9	0	0	0	0	113.4	A47 A53	A47-T51 PolarHBondContact O-N 3.2Å; A47-T51 PolarHBondContact O-OG1 2.86Å; T51-A53 PolarHBondContact O-N 3.32Å
52	S	36.2	Very low	35.4	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	73%	0.726	S	S	*	*	S	Bend	trans	-82.1	7	174	60.2	0	0	0	0	114.1
53	A	34.5	Very low	34.1	Very low	78 Å²	78	145 Å²	145	65%	0.645	74%	0.741	S	S	*	*	S	Bend	trans	-132.6	55.8	-178.8	0	0	0	0	0	112.6	T51	T51-A53 PolarHBondContact O-N 3.32Å
54	T	29.1	Very low	33.2	Very low	136 Å²	136	144 Å²	144	83%	0.834	74%	0.744	S	S	*	*	S	Bend	trans	179.3	124.4	147.6	36.7	0	0	0	0	112.7
55	G	28	Very low	32.1	Very low	79 Å²	79	142.4 Å²	142.4	81%	0.814	75%	0.748	S	S	*	*			trans	99.6	85.1	138.9	0	0	0	0	0	119.1
56	R	32	Very low	31	Very low	249 Å²	249	142.4 Å²	142.4	94%	0.94	76%	0.756	S	S	*	*			trans	-65.6	129.1	149.4	-88.3	177	168.9	176.4	-4.4	109.6
57	R	26.8	Very low	30	Very low	256 Å²	256	143.1 Å²	143.1	97%	0.966	76%	0.759	S	S	*	*			trans	-168.2	128.3	146.6	-105.7	170.4	-167.5	-165.3	3.4	110.3
58	G	28.4	Very low	29.1	Very low	70 Å²	70	147.5 Å²	147.5	72%	0.722	78%	0.777	S	S	*	*			trans	-86.1	171.2	-174	0	0	0	0	0	115.2
59	L	26.9	Very low	28.7	Very low	183 Å²	183	150.9 Å²	150.9	96%	0.958	79%	0.79	S	S	*	*			trans	-169.9	126.7	156.5	-108.4	136.6	0	0	0	108.7
60	G	24.5	Very low	27.9	Very low	67 Å²	67	148.6 Å²	148.6	69%	0.691	80%	0.797	S	S	*	*			trans	-94.9	168	-177.6	0	0	0	0	0	114.8
61	R	25.4	Very low	27.5	Very low	243 Å²	243	149.5 Å²	149.5	92%	0.917	80%	0.8	S	S	*	*			trans	-176.8	121.8	140.4	-113.1	177.8	174.8	-173.1	-1.8	113.2
62	R	22.9	Very low	27.2	Very low	215 Å²	215	152.3 Å²	152.3	81%	0.811	81%	0.81	S	S	*	*			trans	16.6	134.3	143.2	-72.6	178.4	172.8	173.4	-2.4	120.9
63	H	25.4	Very low	26.6	Very low	194 Å²	194	156 Å²	156	90%	0.898	82%	0.816	S	S	*	*			trans	-138.9	145.1	133	-102.6	-78.7	0	0	0	111.8
64	H	24.3	Very low	26	Very low	166 Å²	166	157.7 Å²	157.7	77%	0.769	82%	0.823	S	S	*	*			trans	-75.8	141.2	-168.1	-83.6	-93.1	0	0	0	114.4
65	L	23.9	Very low	25.8	Very low	142 Å²	142	160.3 Å²	160.3	74%	0.743	83%	0.825	S	S	*	*			trans	-87.3	142.7	163	-123.8	86.3	0	0	0	109.8
66	H	24.8	Very low	25.5	Very low	197 Å²	197	165.7 Å²	165.7	91%	0.912	83%	0.829	S	S	*	*			trans	-124.6	127.8	159.3	-117.8	-61.8	0	0	0	107.8
67	Q	22.7	Very low	25.1	Very low	141 Å²	141	158.6 Å²	158.6	66%	0.659	82%	0.818	S	S	*	*			trans	-123.4	141.5	-171.2	-129.2	-178.2	-9	0	0	110.5
68	N	25.6	Very low	25.1	Very low	134 Å²	134	155.2 Å²	155.2	72%	0.717	81%	0.813	S	S	*	*			trans	70.1	168.9	140.1	-73.3	-4.5	0	0	0	121.5
69	P	33.8	Very low	24.8	Very low	117 Å²	117	158.8 Å²	158.8	76%	0.76	82%	0.815	S	S	*	*			cis	-136.4	176.3	-3	19.2	7.2	0	0	0	116.2
70	A	23.7	Very low	24.7	Very low	101 Å²	101	155.6 Å²	155.6	84%	0.835	81%	0.808	S	S	*	*			trans	-104.7	146	159.4	0	0	0	0	0	110.3
71	I	25.3	Very low	24.7	Very low	161 Å²	161	158 Å²	158	83%	0.826	81%	0.814	S	S	*	*			trans	-116.2	137.3	176.4	-66.4	173.8	0	0	0	109.1
72	L	27.5	Very low	25.1	Very low	165 Å²	165	152.3 Å²	152.3	86%	0.864	81%	0.807	S	S	*	*			trans	-103.6	138.8	167.5	-167.6	89.1	0	0	0	108.1
73	E	24.1	Very low	25.2	Very low	182 Å²	182	152.3 Å²	152.3	85%	0.85	81%	0.812	S	S	*	*			trans	-121.6	155	163.9	-102.3	-171.1	166.8	0	0	111.4
74	S	21.8	Very low	25.3	Very low	114 Å²	114	152.4 Å²	152.4	80%	0.797	81%	0.81	S	S	*	*			trans	-100.8	171.1	-155.3	51.2	0	0	0	0	114.3
75	H	24.2	Very low	25.6	Very low	190 Å²	190	150.7 Å²	150.7	88%	0.88	81%	0.814	S	S	*	*			trans	-67.7	137.7	173	-86.1	-80.5	0	0	0	113.6
76	Q	22.6	Very low	26	Very low	192 Å²	192	152.6 Å²	152.6	90%	0.897	82%	0.819	S	S	*	*			trans	-148.1	148.6	143.9	-123.2	171.2	9.5	0	0	113.2
77	S	22.8	Very low	26.6	Very low	100 Å²	100	149.6 Å²	149.6	70%	0.699	82%	0.817	S	S	*	*			trans	-66.1	145.7	-164	49.6	0	0	0	0	117.5
78	H	25.8	Very low	27.6	Very low	186 Å²	186	152.2 Å²	152.2	86%	0.861	82%	0.822	S	S	*	*			trans	-147.9	130.1	146.9	-105.2	-68.3	0	0	0	114.1
79	N	23	Very low	28.6	Very low	144 Å²	144	148.9 Å²	148.9	77%	0.77	81%	0.809	S	S	*	*			trans	-12.7	144.9	169.7	-66.4	-22	0	0	0	122.6
80	S	25.5	Very low	29.5	Very low	116 Å²	116	152.4 Å²	152.4	81%	0.811	81%	0.813	S	S	*	*			trans	-44.1	135.7	163.7	54.9	0	0	0	0	116.6
81	S	24.7	Very low	30.8	Very low	117 Å²	117	151.4 Å²	151.4	82%	0.818	80%	0.798	S	S	*	*			trans	-162.6	142.2	137.9	-173.5	0	0	0	0	110.9
82	T	32.4	Very low	32.3	Very low	124 Å²	124	150.7 Å²	150.7	76%	0.761	79%	0.792	S	S	*	*			trans	-74.2	141.7	-165.3	45.6	0	0	0	0	114.1
83	K	26	Very low	34	Very low	215 Å²	215	145.7 Å²	145.7	94%	0.935	77%	0.766	S	S	*	*			trans	-168.4	143.9	142.7	-103.5	160.8	-168.5	-176.3	0	112.3
84	K	26.4	Very low	35.9	Very low	197 Å²	197	140.4 Å²	140.4	86%	0.857	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-60.5	157.4	-163.8	-66.1	172	174.6	179.1	0	115.8
85	P	31.9	Very low	38	Very low	130 Å²	130	140.3 Å²	140.3	84%	0.844	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-81.4	136.4	178.7	32.7	-31.7	0	0	0	112.2
86	Q	31	Very low	40	Very low	182 Å²	182	132.8 Å²	132.8	85%	0.85	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-97.7	147.7	163.6	-83.8	-179.7	-22.6	0	0	109.7	Y88	Q86-Y88 PolarHBondContact O-N 3.24Å
87	P	38.8	Very low	42.3	Very low	133 Å²	133	131 Å²	131	86%	0.864	69%	0.694	S	S	*	*			trans	-75	111.4	-172.8	29.6	-31.7	0	0	0	110.8	S89	P87-S89 PolarHBondContact O-N 2.73Å
88	Y	43.3	Very low	44.4	Very low	197 Å²	197	129.5 Å²	129.5	77%	0.773	68%	0.68	S	S	*	*			trans	-76.9	114.8	179.1	-143.2	-103.4	0	0	0	109.7	Q86 K90	Q86-Y88 PolarHBondContact O-N 3.24Å; Y88-K90 PolarHBondContact O-N 2.98Å
89	S	45.4	Very low	46	Very low	64 Å²	64	129.6 Å²	129.6	45%	0.448	67%	0.673	S	S	.	*			trans	-80.2	113.4	-177.3	172.6	0	0	0	0	111.1	P87 C91 Q92	P87-S89 PolarHBondContact O-N 2.73Å; S89-C91 PolarHBondContact O-N 3.43Å; S89-C91 WeakPolarHBondContact OG-CB 3.41Å; S89-C91 PolarHBondContact OG-N 3.21Å; S89-Q92 PolarHBondContact O-N 3.08Å
90	K	54	Low	48	Very low	191 Å²	191	130.6 Å²	130.6	83%	0.83	67%	0.666	S	S	*	*	H	α-helix	trans	-51.7	-18	172.9	-70.5	-178.5	175.3	-179.5	0	114	Y88 C94	Y88-K90 PolarHBondContact O-N 2.98Å; K90-C94 WeakPolarHBondContact O-CB 3.38Å; K90-C94 PolarHBondContact O-N 3.4Å
91	C	50.5	Low	49.7	Very low	79 Å²	79	130.8 Å²	130.8	53%	0.534	65%	0.65	S	S	.	*	H	α-helix	trans	-72.6	-32.2	178.6	-160.2	0	0	0	0	112.7	S89 L95	S89-C91 PolarHBondContact O-N 3.43Å; S89-C91 WeakPolarHBondContact OG-CB 3.41Å; S89-C91 PolarHBondContact OG-N 3.21Å; C91-L95 WeakPolarHBondContact O-CB 3.35Å; C91-L95 WeakPolarHBondContact O-CG 3.45Å; C91-L95 PolarHBondContact O-N 3.47Å
92	Q	56.8	Low	51.3	Low	146 Å²	146	129.1 Å²	129.1	68%	0.682	63%	0.631	S	S	*	*	H	α-helix	trans	-73	-36.2	178.7	-91.8	-178.5	-23.9	0	0	112.9	S89 L95 A96	S89-Q92 PolarHBondContact O-N 3.08Å; Q92-L95 PolarHBondContact O-N 3.35Å; Q92-A96 WeakPolarHBondContact O-CB 3.12Å; Q92-A96 PolarHBondContact O-N 2.9Å
93	D	64.2	Low	52.5	Low	61 Å²	61	127.7 Å²	127.7	33%	0.326	62%	0.622	S	S	.	*	H	α-helix	trans	-73.3	-31.9	174.4	-84.7	-26.1	0	0	0	112.7	R97	D93-R97 WeakPolarHBondContact O-CB 3.42Å; D93-R97 PolarHBondContact O-N 2.92Å; D93-R97 PolarHBondContact O-NE 3.37Å
94	C	63.8	Low	54.4	Low	71 Å²	71	121.3 Å²	121.3	48%	0.48	60%	0.601	S	S	.	*	H	α-helix	trans	-67.2	-46.8	171.4	-164.3	0	0	0	0	110.2	K90 A96 R97 V98	K90-C94 WeakPolarHBondContact O-CB 3.38Å; K90-C94 PolarHBondContact O-N 3.4Å; C94-A96 VanDerWaalsContact C-N 3.33Å; C94-A96 PolarHBondContact O-N 3.38Å; C94-R97 PolarHBondContact O-N 3.23Å; C94-V98 VanDerWaalsContact O-CB 3.29Å; C94-V98 WeakPolarHBondContact O-CB 3.1Å; C94-V98 WeakPolarHBondContact O-CG2 3.43Å; C94-V98 PolarHBondContact O-N 2.6Å
95	L	64.9	Low	55.8	Low	112 Å²	112	116.3 Å²	116.3	59%	0.586	58%	0.579	S	S	*	*	H	α-helix	trans	-62.8	-35.9	173.4	-84.6	161.1	0	0	0	112.7	C91 Q92 R99	C91-L95 WeakPolarHBondContact O-CB 3.35Å; C91-L95 WeakPolarHBondContact O-CG 3.45Å; C91-L95 PolarHBondContact O-N 3.47Å; Q92-L95 PolarHBondContact O-N 3.35Å; L95-R99 WeakPolarHBondContact O-CA 3.5Å; L95-R99 WeakPolarHBondContact O-CB 3.4Å; L95-R99 PolarHBondContact O-N 2.88Å
96	A	66.7	Low	57.1	Low	31 Å²	31	114.9 Å²	114.9	26%	0.256	56%	0.563	S	S	.	*	H	α-helix	trans	-73.9	-33.1	177.6	0	0	0	0	0	112.7	Q92 C94 R100	Q92-A96 WeakPolarHBondContact O-CB 3.12Å; Q92-A96 PolarHBondContact O-N 2.9Å; C94-A96 VanDerWaalsContact C-N 3.33Å; C94-A96 PolarHBondContact O-N 3.38Å; A96-R100 VanDerWaalsContact O-CB 3.3Å; A96-R100 WeakPolarHBondContact O-CB 3.45Å; A96-R100 PolarHBondContact O-N 3.18Å
97	R	70	Confident	58.7	Low	156 Å²	156	107.2 Å²	107.2	59%	0.589	53%	0.532	S	S	*	.	H	α-helix	trans	-72.4	-46.9	171.7	-89.9	-179	-87	-170.3	-9.4	111.8	D93 C94 R99 R100 Y101	D93-R97 WeakPolarHBondContact O-CB 3.42Å; D93-R97 PolarHBondContact O-N 2.92Å; D93-R97 PolarHBondContact O-NE 3.37Å; C94-R97 PolarHBondContact O-N 3.23Å; R97-R99 VanDerWaalsContact C-N 3.32Å; R97-R99 PolarHBondContact O-N 2.87Å; R97-R100 PolarHBondContact O-N 3.38Å; R97-Y101 WeakPolarHBondContact O-CB 3.5Å; R97-Y101 PolarHBondContact O-N 2.91Å
98	V	67.9	Low	60.3	Low	68 Å²	68	103.6 Å²	103.6	41%	0.412	50%	0.504	S	S	.	.	H	α-helix	trans	-61.4	-41.8	174.1	171.7	0	0	0	0	110.4	C94 Y101 I102	C94-V98 VanDerWaalsContact O-CB 3.29Å; C94-V98 WeakPolarHBondContact O-CB 3.1Å; C94-V98 WeakPolarHBondContact O-CG2 3.43Å; C94-V98 PolarHBondContact O-N 2.6Å; V98-Y101 PolarHBondContact O-N 2.96Å; V98-I102 HydrophobicContact CG1-CD1 3.53Å; V98-I102 HydrophobicContact CG1-CG1 4.24Å; V98-I102 VanDerWaalsContact O-CB 3.26Å; V98-I102 WeakPolarHBondContact O-CB 3.41Å; V98-I102 WeakPolarHBondContact O-CG1 3.48Å; V98-I102 PolarHBondContact O-N 2.92Å
99	R	58.9	Low	62	Low	187 Å²	187	96 Å²	96	71%	0.706	48%	0.477	S	S	*	.	H	α-helix	trans	-65.9	-43.5	174.7	-176.2	-179.2	-177.8	-161.6	1.1	112.1	L95 R97 V103	L95-R99 WeakPolarHBondContact O-CA 3.5Å; L95-R99 WeakPolarHBondContact O-CB 3.4Å; L95-R99 PolarHBondContact O-N 2.88Å; R97-R99 VanDerWaalsContact C-N 3.32Å; R97-R99 PolarHBondContact O-N 2.87Å; R99-V103 HydrophobicContact CG-CG2 4.32Å; R99-V103 VanDerWaalsContact O-CB 3.23Å; R99-V103 WeakPolarHBondContact O-CB 3.09Å; R99-V103 WeakPolarHBondContact O-CG2 3.47Å; R99-V103 PolarHBondContact O-N 3.43Å
100	R	65.3	Low	64	Low	165 Å²	165	97.7 Å²	97.7	62%	0.623	47%	0.473	S	S	*	.	H	α-helix	trans	-62	-48.9	174.9	-94.4	-178.5	-86.9	175.9	-8.1	110.5	A96 R97 I102 V103 T104	A96-R100 VanDerWaalsContact O-CB 3.3Å; A96-R100 WeakPolarHBondContact O-CB 3.45Å; A96-R100 PolarHBondContact O-N 3.18Å; R97-R100 PolarHBondContact O-N 3.38Å; R100-I102 PolarHBondContact O-N 2.72Å; R100-V103 PolarHBondContact O-N 3.48Å; R100-T104 PolarHBondContact O-N 3.45Å; R100-T104 PolarHBondContact O-OG1 3.04Å
101	Y	61	Low	65.5	Low	120 Å²	120	93.3 Å²	93.3	47%	0.471	46%	0.458	S	S	.	.	H	α-helix	trans	-60.2	-44.5	178.5	-176	-99.4	0	0	0	113.2	R97 V98 K105	R97-Y101 WeakPolarHBondContact O-CB 3.5Å; R97-Y101 PolarHBondContact O-N 2.91Å; V98-Y101 PolarHBondContact O-N 2.96Å; Y101-K105 HydrophobicContact CD2-CD 4.49Å; Y101-K105 HydrophobicContact CE1-CD 4.36Å; Y101-K105 HydrophobicContact CE2-CB 4.49Å; Y101-K105 HydrophobicContact CE2-CD 3.6Å; Y101-K105 VanDerWaalsContact O-CB 3.26Å; Y101-K105 WeakPolarHBondContact O-CB 3.5Å; Y101-K105 PolarHBondContact O-N 3.1Å; Y101-K105 WeakPolarHBondContact OH-CD 3.36Å; Y101-K105 PolarHBondContact OH-NZ 2.78Å; Y101-K105 VanDerWaalsContact OH-NZ 3.12Å
102	I	58.2	Low	67.4	Low	82 Å²	82	89.8 Å²	89.8	42%	0.421	43%	0.434	S	S	.	.	I	π-helix	trans	-64.5	-44.2	174.5	-69.8	169.4	0	0	0	110.2	V98 R100 M106 G107	V98-I102 HydrophobicContact CG1-CD1 3.53Å; V98-I102 HydrophobicContact CG1-CG1 4.24Å; V98-I102 VanDerWaalsContact O-CB 3.26Å; V98-I102 WeakPolarHBondContact O-CB 3.41Å; V98-I102 WeakPolarHBondContact O-CG1 3.48Å; V98-I102 PolarHBondContact O-N 2.92Å; R100-I102 PolarHBondContact O-N 2.72Å; I102-M106 WeakPolarHBondContact O-CA 3.31Å; I102-M106 WeakPolarHBondContact O-CB 3.35Å; I102-M106 PolarHBondContact O-N 3.41Å; I102-M106 VanDerWaalsContact O-N 3.08Å; I102-G107 PolarHBondContact O-N 3.02Å
103	V	58.5	Low	69.1	Low	94 Å²	94	83.1 Å²	83.1	57%	0.57	40%	0.402	S	S	*	.	I	π-helix	trans	-71.6	-38.1	-177	171.4	0	0	0	0	112.4	R99 R100 G107	R99-V103 HydrophobicContact CG-CG2 4.32Å; R99-V103 VanDerWaalsContact O-CB 3.23Å; R99-V103 WeakPolarHBondContact O-CB 3.09Å; R99-V103 WeakPolarHBondContact O-CG2 3.47Å; R99-V103 PolarHBondContact O-N 3.43Å; R100-V103 PolarHBondContact O-N 3.48Å; V103-G107 WeakPolarHBondContact O-CA 3.44Å; V103-G107 PolarHBondContact O-N 3.24Å
104	T	64.5	Low	70.5	Confident	82 Å²	82	83.3 Å²	83.3	50%	0.503	40%	0.403	S	S	.	.	I	π-helix	trans	-79.5	-54	177.9	48.1	0	0	0	0	111.8	R100 E108	R100-T104 PolarHBondContact O-N 3.45Å; R100-T104 PolarHBondContact O-OG1 3.04Å; T104-E108 VanDerWaalsContact O-CG 3.29Å; T104-E108 WeakPolarHBondContact O-CG 3.28Å; T104-E108 PolarHBondContact O-N 3.24Å
105	K	57.1	Low	71.8	Confident	91 Å²	91	82.4 Å²	82.4	40%	0.396	39%	0.393	S	S	.	.	I	π-helix	trans	-79.6	-40.8	-172.3	-151.5	-179	-175.8	174.1	0	113.1	Y101 E690	Y101-K105 HydrophobicContact CD2-CD 4.49Å; Y101-K105 HydrophobicContact CE1-CD 4.36Å; Y101-K105 HydrophobicContact CE2-CB 4.49Å; Y101-K105 HydrophobicContact CE2-CD 3.6Å; Y101-K105 VanDerWaalsContact O-CB 3.26Å; Y101-K105 WeakPolarHBondContact O-CB 3.5Å; Y101-K105 PolarHBondContact O-N 3.1Å; Y101-K105 WeakPolarHBondContact OH-CD 3.36Å; Y101-K105 PolarHBondContact OH-NZ 2.78Å; Y101-K105 VanDerWaalsContact OH-NZ 3.12Å; K105-E690 IonicContact NZ-OE1 2.73Å
106	M	58.3	Low	73.2	Confident	101 Å²	101	77.1 Å²	77.1	50%	0.498	37%	0.365	S	S	.	.	I	π-helix	trans	-78.4	-38.1	175.2	-58.8	-117.8	-70.4	0	0	111.1	I102 E108 D109 W110	I102-M106 WeakPolarHBondContact O-CA 3.31Å; I102-M106 WeakPolarHBondContact O-CB 3.35Å; I102-M106 PolarHBondContact O-N 3.41Å; I102-M106 VanDerWaalsContact O-N 3.08Å; M106-E108 PolarHBondContact O-N 3.31Å; M106-D109 PolarHBondContact O-N 3.05Å; M106-W110 PolarHBondContact O-N 3.22Å
107	G	64	Low	74.6	Confident	21 Å²	21	75.6 Å²	75.6	22%	0.216	35%	0.353	C	S	.	.	H	α-helix	trans	-55.7	-48.2	-179.5	0	0	0	0	0	113.4	I102 V103 D109 W110 I111	I102-G107 PolarHBondContact O-N 3.02Å; V103-G107 WeakPolarHBondContact O-CA 3.44Å; V103-G107 PolarHBondContact O-N 3.24Å; G107-D109 PolarHBondContact O-N 3.3Å; G107-W110 PolarHBondContact O-N 3.26Å; G107-I111 WeakPolarHBondContact O-CB 3.21Å; G107-I111 VanDerWaalsContact O-CD1 3.3Å; G107-I111 WeakPolarHBondContact O-CD1 3.28Å; G107-I111 WeakPolarHBondContact O-CG1 3.35Å; G107-I111 PolarHBondContact O-N 3.18Å
108	E	73.9	Confident	75.8	Confident	57 Å²	57	71.2 Å²	71.2	27%	0.266	34%	0.341	S	S	.	.	H	α-helix	trans	-63.1	-44.5	-176.2	-71.9	-176.9	162.6	0	0	113.3	T104 M106 I111 F112 S246 V248	T104-E108 VanDerWaalsContact O-CG 3.29Å; T104-E108 WeakPolarHBondContact O-CG 3.28Å; T104-E108 PolarHBondContact O-N 3.24Å; M106-E108 PolarHBondContact O-N 3.31Å; E108-I111 PolarHBondContact O-N 2.67Å; E108-F112 WeakPolarHBondContact O-CB 3.41Å; E108-F112 PolarHBondContact O-N 3.17Å; E108-S246 VanDerWaalsContact CD-OG 3.25Å; E108-S246 VanDerWaalsContact OE1-CB 3.31Å; E108-S246 WeakPolarHBondContact OE1-CB 3.48Å; E108-S246 PolarHBondContact OE1-OG 3.08Å; E108-V248 WeakPolarHBondContact OE2-CG2 3.23Å
109	D	79.3	Confident	77.1	Confident	37 Å²	37	69.8 Å²	69.8	20%	0.198	33%	0.332	C	S	.	.	H	α-helix	trans	-61.9	-46.5	176.4	-89.5	-8.8	0	0	0	112.1	M106 G107 F112 L113 Y249 R296	M106-D109 PolarHBondContact O-N 3.05Å; G107-D109 PolarHBondContact O-N 3.3Å; D109-F112 WeakPolarHBondContact O-CB 3.39Å; D109-F112 PolarHBondContact O-N 3.39Å; D109-L113 VanDerWaalsContact O-CG 3.28Å; D109-L113 WeakPolarHBondContact O-CG 3.42Å; D109-L113 PolarHBondContact O-N 2.92Å; D109-L113 VanDerWaalsContact O-N 3.09Å; D109-Y249 WeakPolarHBondContact CA-OH 2.97Å; D109-Y249 PolarHBondContact OD1-OH 2.81Å; D109-R296 IonicContact OD2-CZ 3.82Å; D109-R296 IonicContact OD2-NE 3.34Å; D109-R296 IonicContact OD2-NH2 2.81Å; D109-R296 PolarHBondContact OD2-NH2 3.02Å
110	W	85.4	Confident	78.9	Confident	99 Å²	99	60.9 Å²	60.9	38%	0.375	30%	0.299	S	S	.	.	H	α-helix	trans	-68.6	-35.9	179.1	-65.8	113.5	0	0	0	111.8	M106 G107 L113 I114 F299	M106-W110 PolarHBondContact O-N 3.22Å; G107-W110 PolarHBondContact O-N 3.26Å; W110-L113 HydrophobicContact CE3-CD1 3.94Å; W110-L113 HydrophobicContact CZ3-CD1 4.26Å; W110-L113 PolarHBondContact O-N 2.85Å; W110-I114 VanDerWaalsContact O-CG1 3.29Å; W110-I114 WeakPolarHBondContact O-CG1 3.46Å; W110-I114 PolarHBondContact O-N 2.9Å; W110-F299 AromaticContact CE3-CD1 3.53Å; W110-F299 HydrophobicContact CE3-CD1 3.53Å; W110-F299 HydrophobicContact CE3-CD2 4.23Å; W110-F299 AromaticContact CE3-CE1 3.62Å; W110-F299 HydrophobicContact CE3-CE1 3.62Å; W110-F299 HydrophobicContact CE3-CE2 4.31Å; W110-F299 AromaticContact CE3-CG 3.84Å; W110-F299 HydrophobicContact CE3-CG 3.84Å; W110-F299 HydrophobicContact CE3-CZ 4.02Å; W110-F299 HydrophobicContact CZ3-CB 3.74Å; W110-F299 AromaticContact CZ3-CD1 3.62Å; W110-F299 HydrophobicContact CZ3-CD1 3.62Å; W110-F299 AromaticContact CZ3-CD2 3.84Å; W110-F299 HydrophobicContact CZ3-CD2 3.84Å; W110-F299 HydrophobicContact CZ3-CE1 4.13Å; W110-F299 HydrophobicContact CZ3-CE2 4.32Å; W110-F299 AromaticContact CZ3-CG 3.44Å; W110-F299 HydrophobicContact CZ3-CG 3.44Å; W110-F299 VanDerWaalsContact CZ3-CG 3.44Å; W110-F299 HydrophobicContact CZ3-CZ 4.46Å
111	I	86.6	Confident	80.3	Confident	99 Å²	99	53 Å²	53	51%	0.508	27%	0.269	S	S	.	.	H	α-helix	trans	-62.2	-44.3	174	-71.1	162.9	0	0	0	110.4	G107 E108 L113 I114 L115	G107-I111 WeakPolarHBondContact O-CB 3.21Å; G107-I111 VanDerWaalsContact O-CD1 3.3Å; G107-I111 WeakPolarHBondContact O-CD1 3.28Å; G107-I111 WeakPolarHBondContact O-CG1 3.35Å; G107-I111 PolarHBondContact O-N 3.18Å; E108-I111 PolarHBondContact O-N 2.67Å; I111-L113 VanDerWaalsContact C-N 3.32Å; I111-L113 PolarHBondContact O-N 3.23Å; I111-I114 PolarHBondContact O-N 2.74Å; I111-L115 WeakPolarHBondContact O-CB 2.92Å; I111-L115 PolarHBondContact O-N 3.25Å
112	F	89.4	Confident	81.9	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.026	27%	0.267	C	S	.	.	H	α-helix	trans	-57	-46.2	174.9	170.5	-95.6	0	0	0	111.5	E108 D109 L115 L116 L238 M242 I258	E108-F112 WeakPolarHBondContact O-CB 3.41Å; E108-F112 PolarHBondContact O-N 3.17Å; D109-F112 WeakPolarHBondContact O-CB 3.39Å; D109-F112 PolarHBondContact O-N 3.39Å; F112-L115 PolarHBondContact O-N 3.02Å; F112-L116 HydrophobicContact CE1-CD2 4.21Å; F112-L116 HydrophobicContact CZ-CD2 4.38Å; F112-L116 WeakPolarHBondContact O-CB 3.26Å; F112-L116 PolarHBondContact O-N 3.29Å; F112-L238 HydrophobicContact CD2-CD2 3.76Å; F112-L238 HydrophobicContact CD2-CG 3.89Å; F112-L238 HydrophobicContact CE2-CB 3.82Å; F112-L238 HydrophobicContact CE2-CD2 3.64Å; F112-L238 HydrophobicContact CE2-CG 3.67Å; F112-L238 HydrophobicContact CZ-CD2 4.41Å; F112-M242 HydrophobicContact CD2-CG 4.19Å; F112-I258 HydrophobicContact CE1-CG1 4.37Å; F112-I258 HydrophobicContact CE1-CG2 4.02Å; F112-I258 HydrophobicContact CZ-CG2 3.61Å
113	L	92.9	Very high	83.7	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-65	-41.4	179.5	-66	174	0	0	0	113	D109 W110 I111 L116 G117 V261 R296 F299 A300	D109-L113 VanDerWaalsContact O-CG 3.28Å; D109-L113 WeakPolarHBondContact O-CG 3.42Å; D109-L113 PolarHBondContact O-N 2.92Å; D109-L113 VanDerWaalsContact O-N 3.09Å; W110-L113 HydrophobicContact CE3-CD1 3.94Å; W110-L113 HydrophobicContact CZ3-CD1 4.26Å; W110-L113 PolarHBondContact O-N 2.85Å; I111-L113 VanDerWaalsContact C-N 3.32Å; I111-L113 PolarHBondContact O-N 3.23Å; L113-L116 PolarHBondContact O-N 3.02Å; L113-G117 PolarHBondContact O-N 2.91Å; L113-V261 HydrophobicContact CD2-CG1 3.55Å; L113-R296 HydrophobicContact CD1-CB 3.82Å; L113-R296 HydrophobicContact CD1-CG 3.89Å; L113-R296 HydrophobicContact CD2-CB 4.08Å; L113-F299 HydrophobicContact CB-CD1 3.98Å; L113-F299 HydrophobicContact CB-CE1 4.18Å; L113-F299 HydrophobicContact CD1-CD1 4.17Å; L113-A300 HydrophobicContact CB-CB 4.12Å; L113-A300 HydrophobicContact CD2-CB 4.07Å
114	I	93.2	Very high	85.4	Confident	65 Å²	65	43.9 Å²	43.9	33%	0.333	23%	0.226	S	C	.	.	H	α-helix	trans	-61.6	-47.7	175.2	-71.5	171.5	0	0	0	110	W110 I111 L116 G117 L118 F299 F303	W110-I114 VanDerWaalsContact O-CG1 3.29Å; W110-I114 WeakPolarHBondContact O-CG1 3.46Å; W110-I114 PolarHBondContact O-N 2.9Å; I111-I114 PolarHBondContact O-N 2.74Å; I114-L116 PolarHBondContact O-N 2.83Å; I114-G117 PolarHBondContact O-N 3.28Å; I114-L118 WeakPolarHBondContact O-CB 3.24Å; I114-L118 PolarHBondContact O-N 3.31Å; I114-F299 HydrophobicContact CD1-CE1 4.45Å; I114-F299 HydrophobicContact CD1-CZ 4.25Å; I114-F299 HydrophobicContact CG1-CE1 3.73Å; I114-F299 HydrophobicContact CG1-CZ 3.9Å; I114-F303 HydrophobicContact CB-CE1 4.39Å; I114-F303 HydrophobicContact CG2-CD1 4.25Å; I114-F303 HydrophobicContact CG2-CE1 3.61Å; I114-F303 HydrophobicContact CG2-CE2 4.47Å; I114-F303 HydrophobicContact CG2-CZ 3.75Å; I114-F303 WeakPolarHBondContact O-CE1 3.42Å
115	L	92.7	Very high	86.7	Confident	53 Å²	53	42.8 Å²	42.8	28%	0.277	21%	0.213	S	C	.	.	H	α-helix	trans	-64.2	-42	-179.3	-176.7	60.7	0	0	0	111.3	I111 F112 L118 T119 L238 M242	I111-L115 WeakPolarHBondContact O-CB 2.92Å; I111-L115 PolarHBondContact O-N 3.25Å; F112-L115 PolarHBondContact O-N 3.02Å; L115-L118 PolarHBondContact O-N 3.4Å; L115-T119 HydrophobicContact CD1-CG2 4.23Å; L115-T119 VanDerWaalsContact O-CG2 3.27Å; L115-T119 WeakPolarHBondContact O-CG2 3.26Å; L115-T119 PolarHBondContact O-N 3Å; L115-T119 PolarHBondContact O-OG1 3.12Å; L115-T119 VanDerWaalsContact O-OG1 3.07Å; L115-L238 HydrophobicContact CB-CD2 4.08Å; L115-L238 HydrophobicContact CD2-CD1 3.34Å; L115-L238 HydrophobicContact CD2-CD2 3.99Å; L115-L238 HydrophobicContact CD2-CG 4.15Å; L115-L238 HydrophobicContact CG-CD1 3.91Å; L115-L238 HydrophobicContact CG-CD2 3.86Å; L115-M242 HydrophobicContact CD2-CE 3.4Å; L115-M242 VanDerWaalsContact CD2-CE 3.4Å
116	L	94.3	Very high	88.5	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-45.2	173.5	-179	62.3	0	0	0	111.8	F112 L113 I114 T119 M120 C234 A235 L238 V261 V265	F112-L116 HydrophobicContact CE1-CD2 4.21Å; F112-L116 HydrophobicContact CZ-CD2 4.38Å; F112-L116 WeakPolarHBondContact O-CB 3.26Å; F112-L116 PolarHBondContact O-N 3.29Å; L113-L116 PolarHBondContact O-N 3.02Å; I114-L116 PolarHBondContact O-N 2.83Å; L116-T119 PolarHBondContact O-OG1 3.18Å; L116-M120 HydrophobicContact CD1-CG 4.16Å; L116-M120 WeakPolarHBondContact O-CB 3.47Å; L116-M120 VanDerWaalsContact O-CG 3.23Å; L116-M120 WeakPolarHBondContact O-CG 3.45Å; L116-M120 PolarHBondContact O-N 2.61Å; L116-M120 VanDerWaalsContact O-N 3.1Å; L116-C234 HydrophobicContact CD1-CB 4.25Å; L116-A235 HydrophobicContact CD1-CB 3.94Å; L116-A235 HydrophobicContact CD2-CB 4Å; L116-L238 HydrophobicContact CB-CD2 4.03Å; L116-V261 HydrophobicContact CD2-CG1 4.04Å; L116-V265 HydrophobicContact CD2-CG2 4.26Å
117	G	95.6	Very high	90.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-42.1	177.7	0	0	0	0	0	112.7	L113 I114 A121 S304	L113-G117 PolarHBondContact O-N 2.91Å; I114-G117 PolarHBondContact O-N 3.28Å; G117-A121 WeakPolarHBondContact O-CB 3.47Å; G117-A121 PolarHBondContact O-N 3.28Å; G117-S304 WeakPolarHBondContact O-CA 3.36Å; G117-S304 WeakPolarHBondContact O-CB 3.47Å; G117-S304 PolarHBondContact O-OG 3.32Å
118	L	95.6	Very high	91.5	Very high	63 Å²	63	36.8 Å²	36.8	33%	0.33	19%	0.187	S	C	.	.	H	α-helix	trans	-63.7	-50.5	178	-178	59.5	0	0	0	112.1	I114 L115 M120 A121 L122 F303 I307	I114-L118 WeakPolarHBondContact O-CB 3.24Å; I114-L118 PolarHBondContact O-N 3.31Å; L115-L118 PolarHBondContact O-N 3.4Å; L118-M120 VanDerWaalsContact C-N 3.32Å; L118-M120 PolarHBondContact O-N 2.96Å; L118-A121 PolarHBondContact O-N 3.08Å; L118-L122 HydrophobicContact CD1-CD1 4.27Å; L118-L122 HydrophobicContact CG-CD1 4.19Å; L118-L122 WeakPolarHBondContact O-CG 3.46Å; L118-L122 PolarHBondContact O-N 3.3Å; L118-L122 VanDerWaalsContact O-N 3.08Å; L118-F303 HydrophobicContact CB-CE1 4.11Å; L118-I307 HydrophobicContact CD1-CG1 4.34Å; L118-I307 HydrophobicContact CD1-CG2 3.98Å
119	T	95.1	Very high	92.4	Very high	39 Å²	39	38.3 Å²	38.3	24%	0.239	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-43.1	-179	54.8	0	0	0	0	110.6	L115 L116 L122 V123 C234	L115-T119 HydrophobicContact CD1-CG2 4.23Å; L115-T119 VanDerWaalsContact O-CG2 3.27Å; L115-T119 WeakPolarHBondContact O-CG2 3.26Å; L115-T119 PolarHBondContact O-N 3Å; L115-T119 PolarHBondContact O-OG1 3.12Å; L115-T119 VanDerWaalsContact O-OG1 3.07Å; L116-T119 PolarHBondContact O-OG1 3.18Å; T119-L122 PolarHBondContact O-N 2.95Å; T119-V123 VanDerWaalsContact O-CG2 3.26Å; T119-V123 WeakPolarHBondContact O-CG2 3.33Å; T119-V123 PolarHBondContact O-N 2.9Å; T119-C234 PolarHBondContact OG1-SG 3.36Å; T119-C234 VanDerWaalsContact OG1-SG 3.41Å
120	M	95.6	Very high	93.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.8	-38.4	178.8	-67.8	-48.8	-51.6	0	0	112.9	L116 L118 V123 S124 F227 I230 A231 C234 V265 C269	L116-M120 HydrophobicContact CD1-CG 4.16Å; L116-M120 WeakPolarHBondContact O-CB 3.47Å; L116-M120 VanDerWaalsContact O-CG 3.23Å; L116-M120 WeakPolarHBondContact O-CG 3.45Å; L116-M120 PolarHBondContact O-N 2.61Å; L116-M120 VanDerWaalsContact O-N 3.1Å; L118-M120 VanDerWaalsContact C-N 3.32Å; L118-M120 PolarHBondContact O-N 2.96Å; M120-V123 PolarHBondContact O-N 3.45Å; M120-S124 PolarHBondContact O-N 2.9Å; M120-F227 HydrophobicContact CE-CD1 4.05Å; M120-F227 HydrophobicContact CE-CE1 3.32Å; M120-F227 HydrophobicContact CE-CE2 4.06Å; M120-F227 HydrophobicContact CE-CZ 3.31Å; M120-I230 HydrophobicContact CE-CG2 4.06Å; M120-A231 HydrophobicContact CE-CB 3.6Å; M120-A231 HydrophobicContact CG-CB 4.3Å; M120-A231 VanDerWaalsContact SD-CA 3.56Å; M120-A231 HydrophobicContact SD-CB 3.99Å; M120-C234 HydrophobicContact SD-CB 3.62Å; M120-V265 HydrophobicContact CB-CG1 3.88Å; M120-V265 HydrophobicContact CG-CG1 3.91Å; M120-C269 PolarHBondContact O-SG 2.94Å
121	A	95.2	Very high	93.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-44.2	175.5	0	0	0	0	0	111.9	G117 L118 S124 W125 S304 I307 F308	G117-A121 WeakPolarHBondContact O-CB 3.47Å; G117-A121 PolarHBondContact O-N 3.28Å; L118-A121 PolarHBondContact O-N 3.08Å; A121-S124 PolarHBondContact O-N 3.48Å; A121-W125 VanDerWaalsContact O-CB 3.31Å; A121-W125 WeakPolarHBondContact O-CB 3.11Å; A121-W125 PolarHBondContact O-N 3.04Å; A121-S304 WeakPolarHBondContact CB-O 3.41Å; A121-S304 PolarHBondContact N-OG 3.37Å; A121-I307 HydrophobicContact CB-CB 3.77Å; A121-I307 HydrophobicContact CB-CG2 3.6Å; A121-F308 HydrophobicContact CB-CB 4.38Å
122	L	94.9	Very high	93.7	Very high	80 Å²	80	32.5 Å²	32.5	42%	0.419	18%	0.182	S	C	.	.	H	α-helix	trans	-63.4	-42.3	176.9	-70.7	168.8	0	0	0	112	L118 T119 S126 L311	L118-L122 HydrophobicContact CD1-CD1 4.27Å; L118-L122 HydrophobicContact CG-CD1 4.19Å; L118-L122 WeakPolarHBondContact O-CG 3.46Å; L118-L122 PolarHBondContact O-N 3.3Å; L118-L122 VanDerWaalsContact O-N 3.08Å; T119-L122 PolarHBondContact O-N 2.95Å; L122-S126 VanDerWaalsContact O-CB 3.3Å; L122-S126 WeakPolarHBondContact O-CB 3.49Å; L122-S126 PolarHBondContact O-N 3.44Å; L122-S126 PolarHBondContact O-OG 3.45Å; L122-L311 HydrophobicContact CD2-CD1 3.75Å
123	V	95.6	Very high	93.9	Very high	24 Å²	24	36.8 Å²	36.8	15%	0.145	20%	0.201	C	C	.	.	H	α-helix	trans	-65.9	-44.2	177.2	174.7	0	0	0	0	111.1	T119 M120 S126 M127 F204 V208 F227 I230	T119-V123 VanDerWaalsContact O-CG2 3.26Å; T119-V123 WeakPolarHBondContact O-CG2 3.33Å; T119-V123 PolarHBondContact O-N 2.9Å; M120-V123 PolarHBondContact O-N 3.45Å; V123-S126 PolarHBondContact O-OG 3.39Å; V123-S126 VanDerWaalsContact O-OG 3.06Å; V123-M127 VanDerWaalsContact O-CB 3.31Å; V123-M127 WeakPolarHBondContact O-CB 3.43Å; V123-M127 PolarHBondContact O-N 2.84Å; V123-M127 VanDerWaalsContact O-N 3.11Å; V123-F204 HydrophobicContact CG2-CZ 4.11Å; V123-V208 HydrophobicContact CG1-CG2 4.09Å; V123-F227 HydrophobicContact CG1-CE2 4.09Å; V123-I230 HydrophobicContact CG1-CG2 4.3Å
124	S	94.4	Very high	93.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64	-47.9	177.1	-169.2	0	0	0	0	111.6	M120 A121 M127 D128 K223 F227 C269	M120-S124 PolarHBondContact O-N 2.9Å; A121-S124 PolarHBondContact O-N 3.48Å; S124-M127 PolarHBondContact O-N 3.35Å; S124-D128 WeakPolarHBondContact O-CB 3.05Å; S124-D128 VanDerWaalsContact O-CG 3.26Å; S124-D128 PolarHBondContact O-N 3.03Å; S124-K223 PolarHBondContact OG-NZ 3.28Å; S124-F227 VanDerWaalsContact CB-CZ 3.45Å; S124-C269 WeakPolarHBondContact CB-SG 3.27Å
125	W	92.7	Very high	93.9	Very high	58 Å²	58	36 Å²	36	22%	0.22	20%	0.2	C	C	.	.	H	α-helix	trans	-63.3	-45.8	-177.6	174.8	82.9	0	0	0	111.7	A121 M127 D128 Y129 F308 L311 N315	A121-W125 VanDerWaalsContact O-CB 3.31Å; A121-W125 WeakPolarHBondContact O-CB 3.11Å; A121-W125 PolarHBondContact O-N 3.04Å; W125-M127 PolarHBondContact O-N 3.01Å; W125-D128 PolarHBondContact O-N 2.8Å; W125-Y129 VanDerWaalsContact O-CB 3.25Å; W125-Y129 WeakPolarHBondContact O-CB 3.41Å; W125-Y129 PolarHBondContact O-N 2.82Å; W125-F308 HydrophobicContact CB-CD2 3.98Å; W125-F308 HydrophobicContact CB-CE2 4.13Å; W125-L311 HydrophobicContact CB-CD1 4.32Å; W125-L311 HydrophobicContact CD2-CB 4.39Å; W125-L311 HydrophobicContact CG-CB 4.16Å; W125-L311 HydrophobicContact CG-CD1 4.35Å; W125-N315 HydrophobicContact CZ2-CB 3.93Å
126	S	93.3	Very high	93.9	Very high	54 Å²	54	39 Å²	39	38%	0.378	21%	0.212	S	C	.	.	H	α-helix	trans	-62.9	-40.1	178.2	56.9	0	0	0	0	112.7	L122 V123 A130	L122-S126 VanDerWaalsContact O-CB 3.3Å; L122-S126 WeakPolarHBondContact O-CB 3.49Å; L122-S126 PolarHBondContact O-N 3.44Å; L122-S126 PolarHBondContact O-OG 3.45Å; V123-S126 PolarHBondContact O-OG 3.39Å; V123-S126 VanDerWaalsContact O-OG 3.06Å; S126-A130 VanDerWaalsContact O-CB 3.29Å; S126-A130 WeakPolarHBondContact O-CB 3.18Å; S126-A130 PolarHBondContact O-N 3.04Å
127	M	94.3	Very high	93.9	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-64.7	-47.4	175.1	178.3	174.4	69.5	0	0	112.1	V123 S124 W125 A130 S131 L211 T212 L215 K223 F227	V123-M127 VanDerWaalsContact O-CB 3.31Å; V123-M127 WeakPolarHBondContact O-CB 3.43Å; V123-M127 PolarHBondContact O-N 2.84Å; V123-M127 VanDerWaalsContact O-N 3.11Å; S124-M127 PolarHBondContact O-N 3.35Å; W125-M127 PolarHBondContact O-N 3.01Å; M127-A130 PolarHBondContact O-N 3.34Å; M127-S131 VanDerWaalsContact O-CB 3.28Å; M127-S131 WeakPolarHBondContact O-CB 3.27Å; M127-S131 PolarHBondContact O-N 3.05Å; M127-L211 HydrophobicContact CE-CD2 4.12Å; M127-L211 HydrophobicContact SD-CB 4.25Å; M127-L211 HydrophobicContact SD-CD2 3.62Å; M127-L211 HydrophobicContact SD-CG 3.86Å; M127-T212 WeakPolarHBondContact CG-OG1 3.37Å; M127-L215 HydrophobicContact CE-CD1 4.29Å; M127-L215 HydrophobicContact CG-CD1 4.16Å; M127-L215 HydrophobicContact SD-CD1 4.07Å; M127-K223 HydrophobicContact CE-CB 3.97Å; M127-K223 HydrophobicContact CE-CD 3.57Å; M127-K223 HydrophobicContact CE-CG 4.37Å; M127-F227 HydrophobicContact CE-CD2 3.62Å; M127-F227 HydrophobicContact CE-CE2 3.9Å
128	D	92	Very high	93.8	Very high	32 Å²	32	41.3 Å²	41.3	17%	0.171	23%	0.23	C	C	.	.	H	α-helix	trans	-65.5	-39.6	179.8	-70.1	-17.5	0	0	0	111	S124 W125 A132 K223	S124-D128 WeakPolarHBondContact O-CB 3.05Å; S124-D128 VanDerWaalsContact O-CG 3.26Å; S124-D128 PolarHBondContact O-N 3.03Å; W125-D128 PolarHBondContact O-N 2.8Å; D128-A132 VanDerWaalsContact O-CB 3.24Å; D128-A132 WeakPolarHBondContact O-CB 3.22Å; D128-A132 PolarHBondContact O-N 3.05Å; D128-K223 WeakPolarHBondContact OD1-CD 3.3Å; D128-K223 IonicContact OD1-NZ 3.5Å; D128-K223 PolarHBondContact OD1-NZ 2.8Å; D128-K223 IonicContact OD2-NZ 2.82Å; D128-K223 PolarHBondContact OD2-NZ 3.05Å
129	Y	91.9	Very high	93.6	Very high	89 Å²	89	40.8 Å²	40.8	35%	0.349	23%	0.225	S	C	.	.	H	α-helix	trans	-63.4	-49.7	175.4	179.4	-99.6	0	0	0	111.9	W125 S131 A132 K133 N315	W125-Y129 VanDerWaalsContact O-CB 3.25Å; W125-Y129 WeakPolarHBondContact O-CB 3.41Å; W125-Y129 PolarHBondContact O-N 2.82Å; Y129-S131 PolarHBondContact O-N 3.14Å; Y129-A132 PolarHBondContact O-N 3.3Å; Y129-K133 HydrophobicContact CE1-CG 4.15Å; Y129-K133 HydrophobicContact CE2-CG 4.21Å; Y129-K133 WeakPolarHBondContact O-CG 3.5Å; Y129-K133 PolarHBondContact O-N 3.32Å; Y129-K133 WeakPolarHBondContact OH-CE 3.46Å; Y129-N315 VanDerWaalsContact CE2-ND2 3.34Å; Y129-N315 WeakPolarHBondContact CE2-ND2 3.28Å
130	A	94.4	Very high	93.5	Very high	42 Å²	42	46.7 Å²	46.7	35%	0.347	24%	0.243	S	C	.	.	H	α-helix	trans	-62.1	-43.9	178	0	0	0	0	0	111.7	S126 M127 A132 K133 S134 T212	S126-A130 VanDerWaalsContact O-CB 3.29Å; S126-A130 WeakPolarHBondContact O-CB 3.18Å; S126-A130 PolarHBondContact O-N 3.04Å; M127-A130 PolarHBondContact O-N 3.34Å; A130-A132 PolarHBondContact O-N 3.05Å; A130-K133 PolarHBondContact O-N 3.46Å; A130-S134 VanDerWaalsContact O-CB 3.31Å; A130-S134 WeakPolarHBondContact O-CB 3Å; A130-S134 PolarHBondContact O-N 3.28Å; A130-T212 HydrophobicContact CB-CG2 3.72Å
131	S	93.6	Very high	93.3	Very high	15 Å²	15	49.6 Å²	49.6	11%	0.105	26%	0.258	C	S	.	.	H	α-helix	trans	-62.4	-42.1	175.9	-177.7	0	0	0	0	111.9	M127 Y129 S134 L135 L215 G216	M127-S131 VanDerWaalsContact O-CB 3.28Å; M127-S131 WeakPolarHBondContact O-CB 3.27Å; M127-S131 PolarHBondContact O-N 3.05Å; Y129-S131 PolarHBondContact O-N 3.14Å; S131-S134 WeakPolarHBondContact O-CB 3.44Å; S131-S134 PolarHBondContact O-N 2.98Å; S131-L135 WeakPolarHBondContact O-CB 3.47Å; S131-L135 PolarHBondContact O-N 2.84Å; S131-L215 VanDerWaalsContact OG-C 3.25Å; S131-L215 VanDerWaalsContact OG-CB 3.22Å; S131-L215 WeakPolarHBondContact OG-CB 3.46Å; S131-G216 PolarHBondContact OG-N 3.24Å
132	A	90.8	Very high	93.1	Very high	55 Å²	55	50.3 Å²	50.3	46%	0.455	26%	0.261	S	S	.	.	H	α-helix	trans	-65.7	-42.8	179.4	0	0	0	0	0	111.9	D128 Y129 A130 L135 Q136	D128-A132 VanDerWaalsContact O-CB 3.24Å; D128-A132 WeakPolarHBondContact O-CB 3.22Å; D128-A132 PolarHBondContact O-N 3.05Å; Y129-A132 PolarHBondContact O-N 3.3Å; A130-A132 PolarHBondContact O-N 3.05Å; A132-L135 PolarHBondContact O-N 2.67Å; A132-Q136 WeakPolarHBondContact O-CB 3.41Å; A132-Q136 PolarHBondContact O-N 3.3Å
133	K	92.9	Very high	92.9	Very high	96 Å²	96	47.8 Å²	47.8	42%	0.417	25%	0.254	S	S	.	.	H	α-helix	trans	-66.3	-40.4	176.1	-70	-64.9	178.1	-170.9	0	112.5	Y129 A130 L135 Q136 A137	Y129-K133 HydrophobicContact CE1-CG 4.15Å; Y129-K133 HydrophobicContact CE2-CG 4.21Å; Y129-K133 WeakPolarHBondContact O-CG 3.5Å; Y129-K133 PolarHBondContact O-N 3.32Å; Y129-K133 WeakPolarHBondContact OH-CE 3.46Å; A130-K133 PolarHBondContact O-N 3.46Å; K133-L135 VanDerWaalsContact C-N 3.34Å; K133-L135 PolarHBondContact O-N 2.99Å; K133-Q136 PolarHBondContact O-N 2.95Å; K133-A137 WeakPolarHBondContact O-CB 3.49Å; K133-A137 PolarHBondContact O-N 3.13Å
134	S	94.8	Very high	92.8	Very high	29 Å²	29	52.9 Å²	52.9	20%	0.203	28%	0.276	C	S	.	.	H	α-helix	trans	-55.8	-50.8	172	-168.1	0	0	0	0	110.5	A130 S131 Q136 A137 Y138 Y159	A130-S134 VanDerWaalsContact O-CB 3.31Å; A130-S134 WeakPolarHBondContact O-CB 3Å; A130-S134 PolarHBondContact O-N 3.28Å; S131-S134 WeakPolarHBondContact O-CB 3.44Å; S131-S134 PolarHBondContact O-N 2.98Å; S134-Q136 PolarHBondContact O-N 2.99Å; S134-A137 WeakPolarHBondContact O-CB 3.4Å; S134-A137 PolarHBondContact O-N 3.23Å; S134-Y138 PolarHBondContact O-N 3.44Å; S134-Y159 VanDerWaalsContact C-OH 3.32Å; S134-Y159 PolarHBondContact O-OH 3.26Å; S134-Y159 PolarHBondContact OG-OH 2.96Å
135	L	92.4	Very high	92.6	Very high	26 Å²	26	54.8 Å²	54.8	14%	0.136	29%	0.286	C	S	.	.	H	α-helix	trans	-69	-33	-178.3	-153	66.2	0	0	0	113.2	S131 A132 K133 Y138 K139 M411	S131-L135 WeakPolarHBondContact O-CB 3.47Å; S131-L135 PolarHBondContact O-N 2.84Å; A132-L135 PolarHBondContact O-N 2.67Å; K133-L135 VanDerWaalsContact C-N 3.34Å; K133-L135 PolarHBondContact O-N 2.99Å; L135-Y138 HydrophobicContact CD1-CD1 4.21Å; L135-Y138 WeakPolarHBondContact O-CB 3.09Å; L135-Y138 PolarHBondContact O-N 3.46Å; L135-K139 PolarHBondContact O-N 3.38Å; L135-M411 HydrophobicContact CD1-CE 4.43Å; L135-M411 HydrophobicContact CD1-CG 4.26Å; L135-M411 HydrophobicContact CD1-SD 3.62Å; L135-M411 HydrophobicContact CD2-CB 3.51Å; L135-M411 HydrophobicContact CD2-CG 3.35Å; L135-M411 HydrophobicContact CD2-SD 3.76Å; L135-M411 HydrophobicContact CG-CB 4.44Å; L135-M411 HydrophobicContact CG-CG 3.74Å; L135-M411 HydrophobicContact CG-SD 3.79Å
136	Q	92.4	Very high	92.3	Very high	115 Å²	115	59.3 Å²	59.3	54%	0.537	31%	0.308	S	S	.	.	H	α-helix	trans	-64	-43.7	171.8	-175.2	178.7	4.8	0	0	110.9	A132 K133 S134 Y138 K139 W140	A132-Q136 WeakPolarHBondContact O-CB 3.41Å; A132-Q136 PolarHBondContact O-N 3.3Å; K133-Q136 PolarHBondContact O-N 2.95Å; S134-Q136 PolarHBondContact O-N 2.99Å; Q136-Y138 VanDerWaalsContact C-N 3.33Å; Q136-Y138 PolarHBondContact O-N 3.07Å; Q136-K139 PolarHBondContact O-N 3.07Å; Q136-W140 WeakPolarHBondContact O-CB 3.07Å; Q136-W140 PolarHBondContact O-N 2.94Å
137	A	93.9	Very high	92	Very high	40 Å²	40	60.5 Å²	60.5	33%	0.331	33%	0.329	S	S	.	.	H	α-helix	trans	-62.6	-40.7	175	0	0	0	0	0	111.5	K133 S134 K139 W140 I141	K133-A137 WeakPolarHBondContact O-CB 3.49Å; K133-A137 PolarHBondContact O-N 3.13Å; S134-A137 WeakPolarHBondContact O-CB 3.4Å; S134-A137 PolarHBondContact O-N 3.23Å; A137-K139 PolarHBondContact O-N 2.8Å; A137-W140 PolarHBondContact O-N 3.41Å; A137-I141 VanDerWaalsContact O-CG1 3.27Å; A137-I141 WeakPolarHBondContact O-CG1 3.17Å; A137-I141 PolarHBondContact O-N 3.27Å
138	Y	93.4	Very high	91.9	Very high	9 Å²	9	64.3 Å²	64.3	4%	0.035	35%	0.349	C	S	.	.	H	α-helix	trans	-57.3	-48.2	174.6	177.7	-130.2	0	0	0	112.5	S134 L135 Q136 I141 H142 W156 Y159 P160 M411	S134-Y138 PolarHBondContact O-N 3.44Å; L135-Y138 HydrophobicContact CD1-CD1 4.21Å; L135-Y138 WeakPolarHBondContact O-CB 3.09Å; L135-Y138 PolarHBondContact O-N 3.46Å; Q136-Y138 VanDerWaalsContact C-N 3.33Å; Q136-Y138 PolarHBondContact O-N 3.07Å; Y138-I141 PolarHBondContact O-N 3.41Å; Y138-H142 PolarHBondContact O-N 3.34Å; Y138-H142 VanDerWaalsContact O-N 3.15Å; Y138-W156 HydrophobicContact CE1-CE3 4.17Å; Y138-W156 HydrophobicContact CE1-CH2 4.15Å; Y138-W156 AromaticContact CE1-CZ3 3.97Å; Y138-W156 HydrophobicContact CE1-CZ3 3.97Å; Y138-W156 HydrophobicContact CE2-CE3 4.34Å; Y138-W156 AromaticContact CZ-CD2 3.84Å; Y138-W156 AromaticContact CZ-CE3 3.71Å; Y138-W156 VanDerWaalsContact OH-CE2 3.24Å; Y138-W156 PolarHBondContact OH-O 3.2Å; Y138-Y159 AromaticContact CD2-CD1 3.32Å; Y138-Y159 HydrophobicContact CD2-CD1 3.32Å; Y138-Y159 HydrophobicContact CD2-CD2 4.15Å; Y138-Y159 HydrophobicContact CD2-CE1 4.03Å; Y138-Y159 AromaticContact CD2-CG 3.42Å; Y138-Y159 HydrophobicContact CD2-CG 3.42Å; Y138-Y159 VanDerWaalsContact CD2-CG 3.42Å; Y138-Y159 AromaticContact CE2-CD1 3.95Å; Y138-Y159 HydrophobicContact CE2-CD1 3.95Å; Y138-Y159 HydrophobicContact CE2-CG 4.02Å; Y138-Y159 AromaticContact CG-CD1 3.66Å; Y138-Y159 HydrophobicContact CG-CD1 3.66Å; Y138-Y159 AromaticContact CG-CE1 3.91Å; Y138-Y159 HydrophobicContact CG-CE1 3.91Å; Y138-Y159 HydrophobicContact CG-CG 4.15Å; Y138-P160 HydrophobicContact CE2-CG 4.18Å; Y138-M411 HydrophobicContact CD1-CE 3.92Å; Y138-M411 HydrophobicContact CE1-CE 3.84Å
139	K	91.3	Very high	91.9	Very high	51 Å²	51	66.6 Å²	66.6	22%	0.222	36%	0.364	C	S	.	.	H	α-helix	trans	-65.4	-39.7	176.2	-72.9	-174.9	173	-166.7	0	112.9	L135 Q136 A137 H142 G143 M411 E414	L135-K139 PolarHBondContact O-N 3.38Å; Q136-K139 PolarHBondContact O-N 3.07Å; A137-K139 PolarHBondContact O-N 2.8Å; K139-H142 PolarHBondContact O-N 3.46Å; K139-G143 PolarHBondContact O-N 3.02Å; K139-M411 HydrophobicContact CG-CE 4.3Å; K139-E414 IonicContact NZ-OE1 2.92Å; K139-E414 PolarHBondContact NZ-OE1 3.37Å; K139-E414 IonicContact NZ-OE2 2.57Å; K139-E414 PolarHBondContact NZ-OE2 3.06Å
140	W	93.5	Very high	92	Very high	164 Å²	164	66.8 Å²	66.8	62%	0.621	38%	0.376	S	S	*	.	H	α-helix	trans	-61.6	-47.8	177.7	176.3	67.5	0	0	0	111	Q136 A137 H142 G143 E144	Q136-W140 WeakPolarHBondContact O-CB 3.07Å; Q136-W140 PolarHBondContact O-N 2.94Å; A137-W140 PolarHBondContact O-N 3.41Å; W140-H142 VanDerWaalsContact C-N 3.34Å; W140-H142 PolarHBondContact O-N 3.39Å; W140-G143 WeakPolarHBondContact O-CA 3.06Å; W140-G143 PolarHBondContact O-N 3.45Å; W140-E144 HydrophobicContact CD2-CG 4.21Å; W140-E144 HydrophobicContact CZ2-CG 3.83Å; W140-E144 PolarHBondContact NE1-OE1 3.03Å; W140-E144 WeakPolarHBondContact O-CG 3.33Å; W140-E144 PolarHBondContact O-N 3.35Å
141	I	92.6	Very high	92	Very high	61 Å²	61	68.4 Å²	68.4	31%	0.313	38%	0.379	S	S	.	.	H	α-helix	trans	-56.4	-47.9	175.5	-67.2	163.6	0	0	0	111	A137 Y138 G143 E144 L145 A155 Y159	A137-I141 VanDerWaalsContact O-CG1 3.27Å; A137-I141 WeakPolarHBondContact O-CG1 3.17Å; A137-I141 PolarHBondContact O-N 3.27Å; Y138-I141 PolarHBondContact O-N 3.41Å; I141-G143 VanDerWaalsContact C-N 3.28Å; I141-G143 PolarHBondContact O-N 2.78Å; I141-E144 PolarHBondContact O-N 3.39Å; I141-L145 HydrophobicContact CG2-CD1 3.84Å; I141-L145 VanDerWaalsContact O-CD1 3.29Å; I141-L145 WeakPolarHBondContact O-CD1 2.89Å; I141-L145 VanDerWaalsContact O-CG 3.28Å; I141-L145 WeakPolarHBondContact O-CG 3.32Å; I141-L145 PolarHBondContact O-N 3.35Å; I141-A155 HydrophobicContact CG2-CB 3.99Å; I141-Y159 HydrophobicContact CD1-CD2 4.31Å; I141-Y159 HydrophobicContact CD1-CE2 4.43Å
142	H	90.4	Very high	92	Very high	14 Å²	14	68.3 Å²	68.3	7%	0.065	38%	0.377	C	S	.	.	H	α-helix	trans	-62.1	-35.8	177.1	176.8	-99.6	0	0	0	112.8	Y138 K139 W140 Q152 W156	Y138-H142 PolarHBondContact O-N 3.34Å; Y138-H142 VanDerWaalsContact O-N 3.15Å; K139-H142 PolarHBondContact O-N 3.46Å; W140-H142 VanDerWaalsContact C-N 3.34Å; W140-H142 PolarHBondContact O-N 3.39Å; H142-Q152 PolarHBondContact O-NE2 2.78Å; H142-W156 HydrophobicContact CB-CE3 4.35Å; H142-W156 AromaticContact CD2-CE3 3.64Å; H142-W156 AromaticContact CG-CE3 3.91Å
143	G	89.8	Confident	92.2	Very high	27 Å²	27	70 Å²	70	28%	0.278	37%	0.372	S	S	.	.	H	α-helix	trans	-69	-43.7	178.7	0	0	0	0	0	114	K139 W140 I141 L145 K146	K139-G143 PolarHBondContact O-N 3.02Å; W140-G143 WeakPolarHBondContact O-CA 3.06Å; W140-G143 PolarHBondContact O-N 3.45Å; I141-G143 VanDerWaalsContact C-N 3.28Å; I141-G143 PolarHBondContact O-N 2.78Å; G143-L145 PolarHBondContact O-N 3.23Å; G143-K146 VanDerWaalsContact O-CB 3.32Å; G143-K146 WeakPolarHBondContact O-CB 3.4Å; G143-K146 WeakPolarHBondContact O-CD 3.33Å; G143-K146 WeakPolarHBondContact O-CG 3.28Å; G143-K146 PolarHBondContact O-N 2.84Å
144	E	93.1	Very high	92.2	Very high	131 Å²	131	70.4 Å²	70.4	61%	0.612	38%	0.378	S	S	*	.	H	α-helix	trans	-66.1	-27.1	177.4	-68.3	-61	150	0	0	112.3	W140 I141 K146	W140-E144 HydrophobicContact CD2-CG 4.21Å; W140-E144 HydrophobicContact CZ2-CG 3.83Å; W140-E144 PolarHBondContact NE1-OE1 3.03Å; W140-E144 WeakPolarHBondContact O-CG 3.33Å; W140-E144 PolarHBondContact O-N 3.35Å; I141-E144 PolarHBondContact O-N 3.39Å; E144-K146 PolarHBondContact O-N 2.93Å
145	L	92	Very high	92.2	Very high	40 Å²	40	69.9 Å²	69.9	21%	0.209	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	6.8	179.4	-70.2	166.7	0	0	0	113.5	I141 G143 G147 N148 L151 Q152 A155	I141-L145 HydrophobicContact CG2-CD1 3.84Å; I141-L145 VanDerWaalsContact O-CD1 3.29Å; I141-L145 WeakPolarHBondContact O-CD1 2.89Å; I141-L145 VanDerWaalsContact O-CG 3.28Å; I141-L145 WeakPolarHBondContact O-CG 3.32Å; I141-L145 PolarHBondContact O-N 3.35Å; G143-L145 PolarHBondContact O-N 3.23Å; L145-G147 PolarHBondContact O-N 3.42Å; L145-N148 PolarHBondContact O-N 3.23Å; L145-L151 HydrophobicContact CD1-CG 4.49Å; L145-L151 HydrophobicContact CD2-CB 4.38Å; L145-L151 HydrophobicContact CD2-CD2 3.3Å; L145-L151 HydrophobicContact CD2-CG 3.54Å; L145-Q152 HydrophobicContact CB-CG 3.73Å; L145-Q152 WeakPolarHBondContact O-CG 3.5Å; L145-A155 HydrophobicContact CD1-CB 3.43Å; L145-A155 VanDerWaalsContact CD1-CB 3.43Å
146	K	86.3	Confident	92.3	Very high	153 Å²	153	68.9 Å²	68.9	67%	0.665	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	123.1	177.6	-79.9	177.7	179.8	-174.6	0	111.3	G143 E144 Q152	G143-K146 VanDerWaalsContact O-CB 3.32Å; G143-K146 WeakPolarHBondContact O-CB 3.4Å; G143-K146 WeakPolarHBondContact O-CD 3.33Å; G143-K146 WeakPolarHBondContact O-CG 3.28Å; G143-K146 PolarHBondContact O-N 2.84Å; E144-K146 PolarHBondContact O-N 2.93Å; K146-Q152 VanDerWaalsContact CA-NE2 3.27Å
147	G	85.4	Confident	92.5	Very high	80 Å²	80	64 Å²	64	83%	0.825	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.7	-26.8	-179	0	0	0	0	0	113.7	L145	L145-G147 PolarHBondContact O-N 3.42Å
148	N	93.2	Very high	92.5	Very high	82 Å²	82	64.9 Å²	64.9	44%	0.439	35%	0.348	S	S	.	.			trans	-117.3	88.8	178.5	-166.3	-17.3	0	0	0	111.5	L145 P150 L151 Q152	L145-N148 PolarHBondContact O-N 3.23Å; N148-P150 WeakPolarHBondContact OD1-CD 3.32Å; N148-P150 WeakPolarHBondContact OD1-CG 3.24Å; N148-L151 HydrophobicContact CB-CB 4.16Å; N148-L151 PolarHBondContact O-N 3.41Å; N148-L151 VanDerWaalsContact O-N 3.1Å; N148-Q152 WeakPolarHBondContact O-CG 3.46Å; N148-Q152 PolarHBondContact O-N 2.94Å
149	V	92.5	Very high	92.6	Very high	80 Å²	80	66.8 Å²	66.8	49%	0.485	36%	0.356	S	S	.	.	H	α-helix	trans	-51.8	-47.6	-175.4	-176.8	0	0	0	0	114.3	L151 Q152 Y153 F398	V149-L151 VanDerWaalsContact C-N 3.3Å; V149-L151 PolarHBondContact O-N 3.02Å; V149-Q152 PolarHBondContact O-N 2.89Å; V149-Y153 WeakPolarHBondContact O-CB 3.14Å; V149-Y153 PolarHBondContact O-N 3.3Å; V149-F398 HydrophobicContact CG1-CE1 4.32Å; V149-F398 HydrophobicContact CG1-CZ 4.31Å
150	P	93.6	Very high	92.9	Very high	92 Å²	92	64.4 Å²	64.4	60%	0.597	35%	0.345	S	S	*	.	H	α-helix	trans	-64.8	-34.2	179.5	23.4	-33.8	0	0	0	112.7	N148 Y153 L154	N148-P150 WeakPolarHBondContact OD1-CD 3.32Å; N148-P150 WeakPolarHBondContact OD1-CG 3.24Å; P150-Y153 PolarHBondContact O-N 3.46Å; P150-L154 WeakPolarHBondContact O-CB 3.47Å; P150-L154 PolarHBondContact O-N 2.94Å
151	L	93.4	Very high	93	Very high	77 Å²	77	58.6 Å²	58.6	40%	0.403	33%	0.326	S	S	.	.	H	α-helix	trans	-73.1	-37.3	177.4	-166.6	59.8	0	0	0	111.7	L145 N148 V149 L154 A155	L145-L151 HydrophobicContact CD1-CG 4.49Å; L145-L151 HydrophobicContact CD2-CB 4.38Å; L145-L151 HydrophobicContact CD2-CD2 3.3Å; L145-L151 HydrophobicContact CD2-CG 3.54Å; N148-L151 HydrophobicContact CB-CB 4.16Å; N148-L151 PolarHBondContact O-N 3.41Å; N148-L151 VanDerWaalsContact O-N 3.1Å; V149-L151 VanDerWaalsContact C-N 3.3Å; V149-L151 PolarHBondContact O-N 3.02Å; L151-L154 PolarHBondContact O-N 3.27Å; L151-A155 WeakPolarHBondContact O-CB 3.32Å; L151-A155 PolarHBondContact O-N 3.46Å
152	Q	93.6	Very high	93.2	Very high	13 Å²	13	60.7 Å²	60.7	6%	0.061	34%	0.337	C	S	.	.	H	α-helix	trans	-60.4	-45	170.6	-70.1	-172.3	-50	0	0	112	H142 L145 K146 N148 V149 A155 W156 F398	H142-Q152 PolarHBondContact O-NE2 2.78Å; L145-Q152 HydrophobicContact CB-CG 3.73Å; L145-Q152 WeakPolarHBondContact O-CG 3.5Å; K146-Q152 VanDerWaalsContact CA-NE2 3.27Å; N148-Q152 WeakPolarHBondContact O-CG 3.46Å; N148-Q152 PolarHBondContact O-N 2.94Å; V149-Q152 PolarHBondContact O-N 2.89Å; Q152-A155 PolarHBondContact O-N 2.65Å; Q152-W156 VanDerWaalsContact O-CB 3.23Å; Q152-W156 WeakPolarHBondContact O-CB 3.36Å; Q152-W156 PolarHBondContact O-N 2.6Å; Q152-F398 HydrophobicContact CB-CE2 4.24Å; Q152-F398 HydrophobicContact CB-CZ 4.32Å
153	Y	94.8	Very high	93.5	Very high	90 Å²	90	61.6 Å²	61.6	35%	0.353	34%	0.342	S	S	.	.	H	α-helix	trans	-61.8	-45.2	177.8	178.8	-103.2	0	0	0	111.6	V149 P150 A155 W156 I157 T395 F398	V149-Y153 WeakPolarHBondContact O-CB 3.14Å; V149-Y153 PolarHBondContact O-N 3.3Å; P150-Y153 PolarHBondContact O-N 3.46Å; Y153-A155 PolarHBondContact O-N 3.35Å; Y153-W156 PolarHBondContact O-N 3.13Å; Y153-I157 HydrophobicContact CD1-CD1 4.12Å; Y153-I157 HydrophobicContact CD2-CD1 3.99Å; Y153-I157 HydrophobicContact CE1-CD1 3.5Å; Y153-I157 VanDerWaalsContact CE1-CD1 3.5Å; Y153-I157 HydrophobicContact CE2-CD1 3.35Å; Y153-I157 HydrophobicContact CE2-CG1 4.33Å; Y153-I157 HydrophobicContact CG-CD1 4.35Å; Y153-I157 PolarHBondContact O-N 2.81Å; Y153-I157 WeakPolarHBondContact OH-CD1 3.41Å; Y153-T395 HydrophobicContact CE2-CG2 4.25Å; Y153-T395 WeakPolarHBondContact OH-CG2 3.41Å; Y153-T395 PolarHBondContact OH-OG1 3.19Å; Y153-F398 HydrophobicContact CD2-CB 4.41Å; Y153-F398 AromaticContact CD2-CD1 3.87Å; Y153-F398 HydrophobicContact CD2-CD1 3.87Å; Y153-F398 HydrophobicContact CD2-CD2 4.15Å; Y153-F398 HydrophobicContact CD2-CE1 4.12Å; Y153-F398 HydrophobicContact CD2-CE2 4.39Å; Y153-F398 AromaticContact CD2-CG 3.89Å; Y153-F398 HydrophobicContact CD2-CG 3.89Å; Y153-F398 HydrophobicContact CD2-CZ 4.36Å
154	L	94.8	Very high	93.9	Very high	105 Å²	105	60.3 Å²	60.3	55%	0.55	33%	0.329	S	S	.	.	H	α-helix	trans	-61.6	-44.8	177.3	-171.4	129.3	0	0	0	111.6	P150 L151 T158	P150-L154 WeakPolarHBondContact O-CB 3.47Å; P150-L154 PolarHBondContact O-N 2.94Å; L151-L154 PolarHBondContact O-N 3.27Å; L154-T158 WeakPolarHBondContact O-CB 3.17Å; L154-T158 PolarHBondContact O-N 2.91Å; L154-T158 PolarHBondContact O-OG1 2.98Å
155	A	93.8	Very high	94	Very high	17 Å²	17	55.9 Å²	55.9	14%	0.14	31%	0.311	C	S	.	.	H	α-helix	trans	-64.8	-40.9	175.6	0	0	0	0	0	112.5	I141 L145 L151 Q152 Y153 I157 Y159	I141-A155 HydrophobicContact CG2-CB 3.99Å; L145-A155 HydrophobicContact CD1-CB 3.43Å; L145-A155 VanDerWaalsContact CD1-CB 3.43Å; L151-A155 WeakPolarHBondContact O-CB 3.32Å; L151-A155 PolarHBondContact O-N 3.46Å; Q152-A155 PolarHBondContact O-N 2.65Å; Y153-A155 PolarHBondContact O-N 3.35Å; A155-I157 VanDerWaalsContact C-N 3.31Å; A155-I157 PolarHBondContact O-N 3.23Å; A155-Y159 PolarHBondContact O-N 2.96Å
156	W	94.6	Very high	94.2	Very high	6 Å²	6	58.6 Å²	58.6	2%	0.023	32%	0.321	C	S	.	.	H	α-helix	trans	-60.7	-39.5	179.6	-173.8	-96.1	0	0	0	112.3	Y138 H142 Q152 Y153 P160 A394 T397 F398 P399 M411	Y138-W156 HydrophobicContact CE1-CE3 4.17Å; Y138-W156 HydrophobicContact CE1-CH2 4.15Å; Y138-W156 AromaticContact CE1-CZ3 3.97Å; Y138-W156 HydrophobicContact CE1-CZ3 3.97Å; Y138-W156 HydrophobicContact CE2-CE3 4.34Å; Y138-W156 AromaticContact CZ-CD2 3.84Å; Y138-W156 AromaticContact CZ-CE3 3.71Å; Y138-W156 VanDerWaalsContact OH-CE2 3.24Å; Y138-W156 PolarHBondContact OH-O 3.2Å; H142-W156 HydrophobicContact CB-CE3 4.35Å; H142-W156 AromaticContact CD2-CE3 3.64Å; H142-W156 AromaticContact CG-CE3 3.91Å; Q152-W156 VanDerWaalsContact O-CB 3.23Å; Q152-W156 WeakPolarHBondContact O-CB 3.36Å; Q152-W156 PolarHBondContact O-N 2.6Å; Y153-W156 PolarHBondContact O-N 3.13Å; W156-P160 WeakPolarHBondContact O-CD 3.31Å; W156-P160 WeakPolarHBondContact O-CG 3.17Å; W156-A394 VanDerWaalsContact CD1-O 3.28Å; W156-A394 PolarHBondContact NE1-O 2.82Å; W156-A394 VanDerWaalsContact NE1-O 3.1Å; W156-T397 HydrophobicContact CZ2-CG2 4.25Å; W156-F398 HydrophobicContact CB-CD2 3.88Å; W156-F398 HydrophobicContact CB-CE2 4.21Å; W156-F398 AromaticContact CD1-CD2 3.87Å; W156-F398 HydrophobicContact CD2-CD2 4.25Å; W156-F398 AromaticContact CG-CD2 3.72Å; W156-F398 HydrophobicContact CG-CD2 3.72Å; W156-F398 HydrophobicContact CG-CE2 4.46Å; W156-P399 HydrophobicContact CE3-CG 4.35Å; W156-P399 HydrophobicContact CH2-CG 3.63Å; W156-P399 HydrophobicContact CZ2-CG 3.95Å; W156-P399 HydrophobicContact CZ3-CG 3.85Å; W156-M411 HydrophobicContact CH2-CE 4.13Å
157	I	95.8	Very high	94.6	Very high	12 Å²	12	51.3 Å²	51.3	6%	0.062	29%	0.289	C	S	.	.	H	α-helix	trans	-85.8	-42.5	-178.1	-74.4	178.7	0	0	0	112.5	Y153 A155 Y159 P160 I161 L391 A394	Y153-I157 HydrophobicContact CD1-CD1 4.12Å; Y153-I157 HydrophobicContact CD2-CD1 3.99Å; Y153-I157 HydrophobicContact CE1-CD1 3.5Å; Y153-I157 VanDerWaalsContact CE1-CD1 3.5Å; Y153-I157 HydrophobicContact CE2-CD1 3.35Å; Y153-I157 HydrophobicContact CE2-CG1 4.33Å; Y153-I157 HydrophobicContact CG-CD1 4.35Å; Y153-I157 PolarHBondContact O-N 2.81Å; Y153-I157 WeakPolarHBondContact OH-CD1 3.41Å; A155-I157 VanDerWaalsContact C-N 3.31Å; A155-I157 PolarHBondContact O-N 3.23Å; I157-Y159 VanDerWaalsContact C-N 3.31Å; I157-Y159 PolarHBondContact O-N 2.79Å; I157-P160 WeakPolarHBondContact O-CD 3.19Å; I157-I161 HydrophobicContact CG2-CD1 3.42Å; I157-I161 VanDerWaalsContact CG2-CD1 3.42Å; I157-I161 HydrophobicContact CG2-CG1 4.32Å; I157-I161 VanDerWaalsContact O-CG1 3.28Å; I157-I161 WeakPolarHBondContact O-CG1 3.28Å; I157-I161 PolarHBondContact O-N 2.74Å; I157-L391 HydrophobicContact CD1-CD1 4.08Å; I157-L391 HydrophobicContact CG2-CD1 3.36Å; I157-A394 HydrophobicContact CG1-CB 3.97Å
158	T	95.3	Very high	95	Very high	58 Å²	58	47.5 Å²	47.5	36%	0.356	25%	0.25	S	C	.	.	H	α-helix	trans	-64.9	-38.9	-172.1	-58.6	0	0	0	0	111.2	L154 I161 I162	L154-T158 WeakPolarHBondContact O-CB 3.17Å; L154-T158 PolarHBondContact O-N 2.91Å; L154-T158 PolarHBondContact O-OG1 2.98Å; T158-I161 PolarHBondContact O-N 2.48Å; T158-I162 HydrophobicContact CG2-CD1 3.58Å; T158-I162 HydrophobicContact CG2-CG1 4.2Å; T158-I162 VanDerWaalsContact O-CG1 3.28Å; T158-I162 WeakPolarHBondContact O-CG1 3.22Å; T158-I162 PolarHBondContact O-N 2.99Å
159	Y	95.8	Very high	95.1	Very high	50 Å²	50	46.7 Å²	46.7	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-53.3	-176.6	-177	-77	0	0	0	113.4	S134 Y138 I141 A155 I157 I161 I162 L163	S134-Y159 VanDerWaalsContact C-OH 3.32Å; S134-Y159 PolarHBondContact O-OH 3.26Å; S134-Y159 PolarHBondContact OG-OH 2.96Å; Y138-Y159 AromaticContact CD2-CD1 3.32Å; Y138-Y159 HydrophobicContact CD2-CD1 3.32Å; Y138-Y159 HydrophobicContact CD2-CD2 4.15Å; Y138-Y159 HydrophobicContact CD2-CE1 4.03Å; Y138-Y159 AromaticContact CD2-CG 3.42Å; Y138-Y159 HydrophobicContact CD2-CG 3.42Å; Y138-Y159 VanDerWaalsContact CD2-CG 3.42Å; Y138-Y159 AromaticContact CE2-CD1 3.95Å; Y138-Y159 HydrophobicContact CE2-CD1 3.95Å; Y138-Y159 HydrophobicContact CE2-CG 4.02Å; Y138-Y159 AromaticContact CG-CD1 3.66Å; Y138-Y159 HydrophobicContact CG-CD1 3.66Å; Y138-Y159 AromaticContact CG-CE1 3.91Å; Y138-Y159 HydrophobicContact CG-CE1 3.91Å; Y138-Y159 HydrophobicContact CG-CG 4.15Å; I141-Y159 HydrophobicContact CD1-CD2 4.31Å; I141-Y159 HydrophobicContact CD1-CE2 4.43Å; A155-Y159 PolarHBondContact O-N 2.96Å; I157-Y159 VanDerWaalsContact C-N 3.31Å; I157-Y159 PolarHBondContact O-N 2.79Å; Y159-I161 VanDerWaalsContact C-N 3.33Å; Y159-I161 PolarHBondContact O-N 3.43Å; Y159-I162 PolarHBondContact O-N 2.93Å; Y159-L163 HydrophobicContact CD1-CD1 4.02Å; Y159-L163 HydrophobicContact CE1-CD1 3.33Å; Y159-L163 HydrophobicContact CE1-CG 4.28Å; Y159-L163 PolarHBondContact O-N 3.13Å
160	P	96.2	Very high	95.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.7	-38.8	174.5	-25.1	35	0	0	0	113.4	Y138 W156 I157 L163 V164 M219 T390	Y138-P160 HydrophobicContact CE2-CG 4.18Å; W156-P160 WeakPolarHBondContact O-CD 3.31Å; W156-P160 WeakPolarHBondContact O-CG 3.17Å; I157-P160 WeakPolarHBondContact O-CD 3.19Å; P160-L163 PolarHBondContact O-N 3.38Å; P160-V164 WeakPolarHBondContact O-CB 3.14Å; P160-V164 VanDerWaalsContact O-CG2 3.29Å; P160-V164 WeakPolarHBondContact O-CG2 3.15Å; P160-V164 PolarHBondContact O-N 2.91Å; P160-M219 HydrophobicContact CB-CE 4Å; P160-M219 HydrophobicContact CG-CE 4.48Å; P160-T390 HydrophobicContact CB-CG2 3.67Å
161	I	96.6	Very high	95.1	Very high	42 Å²	42	40.8 Å²	40.8	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-47.7	179.5	-70.9	176.6	0	0	0	110.8	I157 T158 Y159 L163 V164 V165 T390 L391	I157-I161 HydrophobicContact CG2-CD1 3.42Å; I157-I161 VanDerWaalsContact CG2-CD1 3.42Å; I157-I161 HydrophobicContact CG2-CG1 4.32Å; I157-I161 VanDerWaalsContact O-CG1 3.28Å; I157-I161 WeakPolarHBondContact O-CG1 3.28Å; I157-I161 PolarHBondContact O-N 2.74Å; T158-I161 PolarHBondContact O-N 2.48Å; Y159-I161 VanDerWaalsContact C-N 3.33Å; Y159-I161 PolarHBondContact O-N 3.43Å; I161-L163 VanDerWaalsContact C-N 3.34Å; I161-L163 PolarHBondContact O-N 2.82Å; I161-V164 PolarHBondContact O-N 3.05Å; I161-V165 HydrophobicContact CG2-CG2 4.11Å; I161-V165 VanDerWaalsContact O-CB 3.27Å; I161-V165 WeakPolarHBondContact O-CB 3.46Å; I161-V165 VanDerWaalsContact O-CG2 3.22Å; I161-V165 WeakPolarHBondContact O-CG2 3.37Å; I161-V165 PolarHBondContact O-N 2.83Å; I161-T390 HydrophobicContact CG1-CG2 3.91Å; I161-L391 HydrophobicContact CD1-CB 3.85Å; I161-L391 HydrophobicContact CD1-CD1 3.88Å; I161-L391 HydrophobicContact CD1-CG 4.44Å
162	I	96.8	Very high	94.9	Very high	105 Å²	105	40.7 Å²	40.7	54%	0.538	20%	0.201	S	C	.	.	H	α-helix	trans	-58.7	-48.1	179.6	-71.1	171	0	0	0	110.3	T158 Y159 F166	T158-I162 HydrophobicContact CG2-CD1 3.58Å; T158-I162 HydrophobicContact CG2-CG1 4.2Å; T158-I162 VanDerWaalsContact O-CG1 3.28Å; T158-I162 WeakPolarHBondContact O-CG1 3.22Å; T158-I162 PolarHBondContact O-N 2.99Å; Y159-I162 PolarHBondContact O-N 2.93Å; I162-F166 WeakPolarHBondContact O-CB 3.31Å; I162-F166 PolarHBondContact O-N 3.32Å
163	L	96.8	Very high	94.8	Very high	33 Å²	33	46.2 Å²	46.2	17%	0.173	23%	0.23	C	C	.	.	H	α-helix	trans	-66.4	-42	-178.4	-70.8	-176.5	0	0	0	113.1	Y159 P160 I161 F166 A167	Y159-L163 HydrophobicContact CD1-CD1 4.02Å; Y159-L163 HydrophobicContact CE1-CD1 3.33Å; Y159-L163 HydrophobicContact CE1-CG 4.28Å; Y159-L163 PolarHBondContact O-N 3.13Å; P160-L163 PolarHBondContact O-N 3.38Å; I161-L163 VanDerWaalsContact C-N 3.34Å; I161-L163 PolarHBondContact O-N 2.82Å; L163-F166 PolarHBondContact O-N 3.05Å; L163-A167 WeakPolarHBondContact O-CB 3.17Å; L163-A167 PolarHBondContact O-N 3.38Å
164	V	96.6	Very high	94.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-71.4	-40	-179.9	174.1	0	0	0	0	111.5	P160 I161 F166 A167 S168 M219 P386 T390 M471 I473	P160-V164 WeakPolarHBondContact O-CB 3.14Å; P160-V164 VanDerWaalsContact O-CG2 3.29Å; P160-V164 WeakPolarHBondContact O-CG2 3.15Å; P160-V164 PolarHBondContact O-N 2.91Å; I161-V164 PolarHBondContact O-N 3.05Å; V164-F166 VanDerWaalsContact C-N 3.34Å; V164-A167 PolarHBondContact O-N 3Å; V164-S168 WeakPolarHBondContact O-CB 3.35Å; V164-S168 PolarHBondContact O-N 3.49Å; V164-M219 HydrophobicContact CG2-CG 3.89Å; V164-P386 HydrophobicContact CG1-CB 3.93Å; V164-T390 HydrophobicContact CB-CG2 4.42Å; V164-T390 WeakPolarHBondContact CG1-OG1 3.3Å; V164-T390 HydrophobicContact CG2-CG2 4.14Å; V164-M471 HydrophobicContact CG1-SD 4.23Å; V164-I473 HydrophobicContact CG1-CD1 4.35Å; V164-I473 HydrophobicContact CG1-CG2 4.32Å
165	V	95.9	Very high	94.4	Very high	39 Å²	39	40 Å²	40	24%	0.236	21%	0.207	C	C	.	.	H	α-helix	trans	-64.8	-41.7	174.3	171.8	0	0	0	0	110.3	I161 S168 L169	I161-V165 HydrophobicContact CG2-CG2 4.11Å; I161-V165 VanDerWaalsContact O-CB 3.27Å; I161-V165 WeakPolarHBondContact O-CB 3.46Å; I161-V165 VanDerWaalsContact O-CG2 3.22Å; I161-V165 WeakPolarHBondContact O-CG2 3.37Å; I161-V165 PolarHBondContact O-N 2.83Å; V165-S168 PolarHBondContact O-N 2.79Å; V165-L169 VanDerWaalsContact O-CB 3.25Å; V165-L169 WeakPolarHBondContact O-CB 3.15Å; V165-L169 PolarHBondContact O-N 3.21Å
166	F	96.2	Very high	94	Very high	96 Å²	96	40.9 Å²	40.9	42%	0.421	21%	0.211	S	C	.	.	H	α-helix	trans	-59.4	-48.6	173.1	172.9	-99.7	0	0	0	111.8	I162 L163 V164 S168 L169 F170 I209 A213	I162-F166 WeakPolarHBondContact O-CB 3.31Å; I162-F166 PolarHBondContact O-N 3.32Å; L163-F166 PolarHBondContact O-N 3.05Å; V164-F166 VanDerWaalsContact C-N 3.34Å; F166-S168 VanDerWaalsContact C-N 3.34Å; F166-S168 PolarHBondContact O-N 2.9Å; F166-L169 PolarHBondContact O-N 3.3Å; F166-F170 HydrophobicContact CZ-CD2 4.5Å; F166-F170 VanDerWaalsContact O-CB 3.31Å; F166-F170 WeakPolarHBondContact O-CB 3.34Å; F166-F170 PolarHBondContact O-N 3.33Å; F166-I209 HydrophobicContact CE1-CG2 4.01Å; F166-I209 HydrophobicContact CZ-CG2 4.31Å; F166-A213 HydrophobicContact CD1-CB 3.93Å; F166-A213 HydrophobicContact CE1-CB 4.35Å
167	A	95.8	Very high	93.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57.7	-46.8	177.2	0	0	0	0	0	111.7	L163 V164 C171 G210 A213 I473	L163-A167 WeakPolarHBondContact O-CB 3.17Å; L163-A167 PolarHBondContact O-N 3.38Å; V164-A167 PolarHBondContact O-N 3Å; A167-C171 PolarHBondContact O-N 3.34Å; A167-C171 PolarHBondContact O-SG 3.45Å; A167-G210 WeakPolarHBondContact CB-O 3.35Å; A167-A213 HydrophobicContact CB-CB 4.01Å; A167-I473 HydrophobicContact CB-CG2 4.3Å
168	S	94.1	Very high	93.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-40.7	178	-176.9	0	0	0	0	112.4	V164 V165 F166 H172	V164-S168 WeakPolarHBondContact O-CB 3.35Å; V164-S168 PolarHBondContact O-N 3.49Å; V165-S168 PolarHBondContact O-N 2.79Å; F166-S168 VanDerWaalsContact C-N 3.34Å; F166-S168 PolarHBondContact O-N 2.9Å; S168-H172 VanDerWaalsContact O-CB 3.27Å; S168-H172 WeakPolarHBondContact O-CB 3.29Å; S168-H172 PolarHBondContact O-N 2.85Å; S168-H172 VanDerWaalsContact O-N 3.09Å
169	L	94	Very high	92.8	Very high	66 Å²	66	38.7 Å²	38.7	35%	0.346	20%	0.197	S	C	.	.	H	α-helix	trans	-67	-45.7	178.8	177.6	61.1	0	0	0	110.9	V165 F166 H172 L173 L383	V165-L169 VanDerWaalsContact O-CB 3.25Å; V165-L169 WeakPolarHBondContact O-CB 3.15Å; V165-L169 PolarHBondContact O-N 3.21Å; F166-L169 PolarHBondContact O-N 3.3Å; L169-H172 WeakPolarHBondContact O-CB 3.32Å; L169-H172 PolarHBondContact O-N 3.27Å; L169-L173 HydrophobicContact CD1-CD1 3.81Å; L169-L173 HydrophobicContact CD1-CG 3.96Å; L169-L173 HydrophobicContact CG-CD1 3.91Å; L169-L173 HydrophobicContact CG-CG 4.4Å; L169-L173 WeakPolarHBondContact O-CG 3.46Å; L169-L173 PolarHBondContact O-N 2.85Å; L169-L383 HydrophobicContact CB-CD2 3.99Å; L169-L383 HydrophobicContact CD1-CD1 4.13Å; L169-L383 HydrophobicContact CD1-CD2 4.4Å
170	F	94.5	Very high	92.6	Very high	47 Å²	47	36.3 Å²	36.3	21%	0.206	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-46.6	-179.1	-168.6	-105.9	0	0	0	111.8	F166 H172 L173 V174 I209	F166-F170 HydrophobicContact CZ-CD2 4.5Å; F166-F170 VanDerWaalsContact O-CB 3.31Å; F166-F170 WeakPolarHBondContact O-CB 3.34Å; F166-F170 PolarHBondContact O-N 3.33Å; F170-H172 VanDerWaalsContact C-N 3.28Å; F170-H172 PolarHBondContact O-N 3.4Å; F170-L173 PolarHBondContact O-N 3.48Å; F170-V174 HydrophobicContact CD1-CG2 4.38Å; F170-V174 HydrophobicContact CD2-CG2 4.07Å; F170-V174 HydrophobicContact CE1-CG2 4.09Å; F170-V174 HydrophobicContact CE2-CG2 3.75Å; F170-V174 HydrophobicContact CG-CG2 4.37Å; F170-V174 HydrophobicContact CZ-CG2 3.77Å; F170-V174 WeakPolarHBondContact O-CB 3.19Å; F170-V174 WeakPolarHBondContact O-CG2 3.2Å; F170-V174 PolarHBondContact O-N 3.1Å; F170-I209 HydrophobicContact CD1-CB 3.96Å; F170-I209 HydrophobicContact CD1-CG2 3.83Å; F170-I209 HydrophobicContact CE1-CB 3.59Å; F170-I209 HydrophobicContact CE1-CD1 3.67Å; F170-I209 HydrophobicContact CE1-CG1 4.17Å; F170-I209 HydrophobicContact CE1-CG2 3.75Å; F170-I209 HydrophobicContact CG-CG2 4.38Å; F170-I209 HydrophobicContact CZ-CB 4.32Å; F170-I209 HydrophobicContact CZ-CD1 3.59Å; F170-I209 HydrophobicContact CZ-CG2 4.25Å
171	C	91.5	Very high	92.3	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.6	-37.2	174.7	-65.7	0	0	0	0	111.9	A167 S175 I179 P474	A167-C171 PolarHBondContact O-N 3.34Å; A167-C171 PolarHBondContact O-SG 3.45Å; C171-S175 CarbonylContact O-C 3.56Å; C171-S175 PolarHBondContact O-N 3.39Å; C171-S175 VanDerWaalsContact O-N 3.14Å; C171-I179 HydrophobicContact CB-CG1 4.12Å; C171-P474 VanDerWaalsContact SG-CD 3.52Å
172	H	90.1	Very high	91.9	Very high	76 Å²	76	35 Å²	35	35%	0.352	18%	0.182	S	C	.	.	H	α-helix	trans	-66.3	-41.4	177.5	-175.8	-94.1	0	0	0	113	Q15 S168 L169 F170 R382	Q15-H172 PolarHBondContact NE2-CD2 2.92Å; Q15-H172 VanDerWaalsContact NE2-CD2 3.26Å; Q15-H172 PolarHBondContact NE2-NE2 3.13Å; S168-H172 VanDerWaalsContact O-CB 3.27Å; S168-H172 WeakPolarHBondContact O-CB 3.29Å; S168-H172 PolarHBondContact O-N 2.85Å; S168-H172 VanDerWaalsContact O-N 3.09Å; L169-H172 WeakPolarHBondContact O-CB 3.32Å; L169-H172 PolarHBondContact O-N 3.27Å; F170-H172 VanDerWaalsContact C-N 3.28Å; F170-H172 PolarHBondContact O-N 3.4Å; H172-R382 VanDerWaalsContact CD2-CD 3.45Å; H172-R382 WeakPolarHBondContact CD2-CD 3.36Å
173	L	91.1	Very high	91.6	Very high	128 Å²	128	30.2 Å²	30.2	67%	0.67	16%	0.157	S	C	*	.	H	α-helix	trans	-76.1	-40.1	-178.2	-68.4	175.9	0	0	0	112.9	L169 F170	L169-L173 HydrophobicContact CD1-CD1 3.81Å; L169-L173 HydrophobicContact CD1-CG 3.96Å; L169-L173 HydrophobicContact CG-CD1 3.91Å; L169-L173 HydrophobicContact CG-CG 4.4Å; L169-L173 WeakPolarHBondContact O-CG 3.46Å; L169-L173 PolarHBondContact O-N 2.85Å; F170-L173 PolarHBondContact O-N 3.48Å
174	V	92.4	Very high	91.3	Very high	57 Å²	57	28.7 Å²	28.7	35%	0.345	15%	0.149	S	C	.	.	H	α-helix	trans	-89.1	-53.1	-172.6	-178.4	0	0	0	0	112.3	F170 A206	F170-V174 HydrophobicContact CD1-CG2 4.38Å; F170-V174 HydrophobicContact CD2-CG2 4.07Å; F170-V174 HydrophobicContact CE1-CG2 4.09Å; F170-V174 HydrophobicContact CE2-CG2 3.75Å; F170-V174 HydrophobicContact CG-CG2 4.37Å; F170-V174 HydrophobicContact CZ-CG2 3.77Å; F170-V174 WeakPolarHBondContact O-CB 3.19Å; F170-V174 WeakPolarHBondContact O-CG2 3.2Å; F170-V174 PolarHBondContact O-N 3.1Å; V174-A206 HydrophobicContact CB-CB 3.94Å; V174-A206 HydrophobicContact CG1-CB 3.84Å
175	S	88.5	Confident	91	Very high	9 Å²	9	29.4 Å²	29.4	6%	0.063	15%	0.153	C	C	.	.			trans	-159.1	106.2	-179.2	-177.8	0	0	0	0	111.3	C171 Q177 A178	C171-S175 CarbonylContact O-C 3.56Å; C171-S175 PolarHBondContact O-N 3.39Å; C171-S175 VanDerWaalsContact O-N 3.14Å; S175-Q177 PolarHBondContact O-N 3.47Å; S175-Q177 VanDerWaalsContact O-N 3.07Å; S175-A178 WeakPolarHBondContact O-CB 3.34Å; S175-A178 PolarHBondContact O-N 2.97Å
176	P	85.4	Confident	90.7	Very high	34 Å²	34	27.7 Å²	27.7	22%	0.221	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-66.7	-12.8	-180	28.4	-35.9	0	0	0	113.1	A178 I179	P176-A178 PolarHBondContact O-N 2.85Å; P176-I179 WeakPolarHBondContact O-CG1 3.48Å
177	Q	83.7	Confident	90.3	Very high	19 Å²	19	23.9 Å²	23.9	9%	0.089	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-73.8	-14.8	174.9	-54.5	-56.4	-14.1	0	0	112.8	Y13 S175 I179 Y198	Y13-Q177 VanDerWaalsContact CE1-NE2 3.3Å; Y13-Q177 PolarHBondContact OH-OE1 2.77Å; S175-Q177 PolarHBondContact O-N 3.47Å; S175-Q177 VanDerWaalsContact O-N 3.07Å; Q177-I179 PolarHBondContact O-N 2.81Å; Q177-Y198 HydrophobicContact CB-CD2 3.95Å; Q177-Y198 HydrophobicContact CB-CE2 4.14Å; Q177-Y198 VanDerWaalsContact O-CE2 3.25Å; Q177-Y198 WeakPolarHBondContact O-CE2 3.47Å
178	A	87.7	Confident	89.9	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-72.5	-11.1	176.8	0	0	0	0	0	113.6	S175 P176 A206 K207	S175-A178 WeakPolarHBondContact O-CB 3.34Å; S175-A178 PolarHBondContact O-N 2.97Å; P176-A178 PolarHBondContact O-N 2.85Å; A178-A206 HydrophobicContact CB-CB 3.83Å; A178-K207 HydrophobicContact CB-CB 3.96Å; A178-K207 HydrophobicContact CB-CG 4.32Å; A178-K207 WeakPolarHBondContact O-CE 3.2Å
179	I	90.3	Very high	89.5	Confident	11 Å²	11	24.3 Å²	24.3	6%	0.056	13%	0.128	C	C	.	.	S	Bend	trans	-72.8	137.5	-173.2	-63.3	176.4	0	0	0	111.9	L18 C171 P176 Q177 P472	L18-I179 WeakPolarHBondContact O-CG2 3.49Å; C171-I179 HydrophobicContact CB-CG1 4.12Å; P176-I179 WeakPolarHBondContact O-CG1 3.48Å; Q177-I179 PolarHBondContact O-N 2.81Å; I179-P472 HydrophobicContact CD1-CB 4.36Å; I179-P472 HydrophobicContact CG2-CB 4.12Å
180	G	90.3	Very high	88.9	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	77.3	-169.8	179.3	0	0	0	0	0	114.7	K207 I473 S475	G180-K207 VanDerWaalsContact O-CE 3.28Å; G180-K207 WeakPolarHBondContact O-CE 2.95Å; G180-K207 PolarHBondContact O-NZ 2.88Å; G180-I473 PolarHBondContact N-O 2.88Å; G180-S475 CarbonylContact C-O 3.46Å
181	S	89.6	Confident	88.2	Confident	14 Å²	14	22.7 Å²	22.7	10%	0.098	12%	0.117	C	C	.	.			trans	-62.5	-57.1	-173.3	168.9	0	0	0	0	113.2	I183 K207 G225 P226 S475	S181-I183 PolarHBondContact OG-N 3.3Å; S181-K207 PolarHBondContact O-NZ 3.35Å; S181-G225 CarbonylContact O-C 3.45Å; S181-G225 WeakPolarHBondContact OG-CA 3.46Å; S181-P226 WeakPolarHBondContact O-CA 3.5Å; S181-P226 VanDerWaalsContact O-N 3.08Å; S181-S475 VanDerWaalsContact CA-O 3.3Å; S181-S475 WeakPolarHBondContact CA-O 3.47Å; S181-S475 PolarHBondContact N-O 3.21Å
182	G	88.2	Confident	87.4	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.124	C	C	.	.			trans	91	-10.8	-175.6	0	0	0	0	0	115.6	E185 L186 Y198	G182-E185 WeakPolarHBondContact CA-OE2 3.36Å; G182-L186 VanDerWaalsContact O-CB 3.27Å; G182-L186 WeakPolarHBondContact O-CB 3.21Å; G182-L186 PolarHBondContact O-N 3.48Å; G182-Y198 WeakPolarHBondContact CA-OH 3.37Å
183	I	91.6	Very high	86.9	Confident	6 Å²	6	21.6 Å²	21.6	3%	0.031	12%	0.118	C	C	.	.	H	α-helix	trans	-59.6	-45.1	166.5	-68.1	173.3	0	0	0	111.8	S181 E185 L186 K187 V228 V284 Y572	S181-I183 PolarHBondContact OG-N 3.3Å; I183-E185 VanDerWaalsContact C-N 3.35Å; I183-E185 PolarHBondContact O-N 3.18Å; I183-L186 PolarHBondContact O-N 2.89Å; I183-K187 WeakPolarHBondContact O-CB 3.24Å; I183-K187 PolarHBondContact O-N 3.27Å; I183-V228 HydrophobicContact CD1-CG2 4.18Å; I183-V228 HydrophobicContact CG1-CB 4.16Å; I183-V228 HydrophobicContact CG1-CG1 4.41Å; I183-V228 HydrophobicContact CG1-CG2 4.29Å; I183-V284 HydrophobicContact CG2-CG1 3.6Å; I183-Y572 HydrophobicContact CB-CD1 3.88Å; I183-Y572 HydrophobicContact CB-CE1 3.81Å; I183-Y572 HydrophobicContact CD1-CE1 3.66Å; I183-Y572 HydrophobicContact CD1-CE2 4.43Å; I183-Y572 WeakPolarHBondContact CD1-OH 3.46Å; I183-Y572 HydrophobicContact CG1-CE1 4.29Å; I183-Y572 HydrophobicContact CG2-CD1 3.66Å; I183-Y572 HydrophobicContact CG2-CD2 4.17Å; I183-Y572 HydrophobicContact CG2-CE1 3.83Å; I183-Y572 HydrophobicContact CG2-CE2 4.32Å; I183-Y572 HydrophobicContact CG2-CG 3.84Å
184	P	90.8	Very high	86.1	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-55.9	-44.8	178.2	-30.8	39.9	0	0	0	114	T188 Y572 I575 I576 L581	P184-T188 PolarHBondContact O-N 3.36Å; P184-T188 VanDerWaalsContact O-N 3.17Å; P184-T188 PolarHBondContact O-OG1 2.97Å; P184-Y572 HydrophobicContact CG-CD1 4.21Å; P184-I575 HydrophobicContact CB-CG2 4.09Å; P184-I575 HydrophobicContact CG-CB 3.97Å; P184-I575 HydrophobicContact CG-CD1 4.37Å; P184-I575 HydrophobicContact CG-CG2 3.7Å; P184-I576 HydrophobicContact CB-CD1 4.46Å; P184-I576 HydrophobicContact CB-CG1 3.68Å; P184-L581 HydrophobicContact CB-CD1 4.41Å
185	E	89.7	Confident	85.5	Confident	16 Å²	16	16.9 Å²	16.9	8%	0.075	9%	0.094	C	C	.	.	H	α-helix	trans	-66.7	-42.4	177	-71.2	85.4	168.7	0	0	111.7	G182 I183 T188 I189 L195 Y198 K579 L581	G182-E185 WeakPolarHBondContact CA-OE2 3.36Å; I183-E185 VanDerWaalsContact C-N 3.35Å; I183-E185 PolarHBondContact O-N 3.18Å; E185-T188 WeakPolarHBondContact O-CA 3.4Å; E185-T188 VanDerWaalsContact O-CB 3.28Å; E185-T188 WeakPolarHBondContact O-CB 3.44Å; E185-T188 PolarHBondContact O-N 2.99Å; E185-T188 VanDerWaalsContact O-N 3.08Å; E185-I189 WeakPolarHBondContact O-CG1 3.41Å; E185-I189 PolarHBondContact O-N 3.31Å; E185-L195 HydrophobicContact CB-CD1 4.18Å; E185-L195 HydrophobicContact CG-CD1 4.39Å; E185-Y198 HydrophobicContact CB-CD1 3.87Å; E185-Y198 HydrophobicContact CB-CE1 3.37Å; E185-Y198 HydrophobicContact CB-CE2 4.11Å; E185-Y198 HydrophobicContact CB-CG 4.43Å; E185-Y198 HydrophobicContact CG-CD2 4.32Å; E185-Y198 HydrophobicContact CG-CE1 3.98Å; E185-Y198 HydrophobicContact CG-CE2 3.76Å; E185-K579 IonicContact OE1-NZ 3.56Å; E185-K579 PolarHBondContact OE1-NZ 3.31Å; E185-K579 IonicContact OE2-NZ 3.87Å; E185-K579 PolarHBondContact OE2-NZ 2.92Å; E185-L581 HydrophobicContact CG-CD1 4.13Å
186	L	88.6	Confident	84.3	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-65.3	-41.2	178.4	-172.2	56.8	0	0	0	112.5	G182 I183 T188 I189 L190 V228 S232 L259 C263	G182-L186 VanDerWaalsContact O-CB 3.27Å; G182-L186 WeakPolarHBondContact O-CB 3.21Å; G182-L186 PolarHBondContact O-N 3.48Å; I183-L186 PolarHBondContact O-N 2.89Å; L186-T188 PolarHBondContact O-N 3.25Å; L186-I189 PolarHBondContact O-N 2.93Å; L186-I189 VanDerWaalsContact O-N 3.12Å; L186-L190 HydrophobicContact CD1-CD1 4.45Å; L186-L190 HydrophobicContact CG-CD1 4.23Å; L186-L190 WeakPolarHBondContact O-CG 3.25Å; L186-L190 PolarHBondContact O-N 3.42Å; L186-V228 HydrophobicContact CD2-CG1 3.64Å; L186-S232 WeakPolarHBondContact CD2-OG 3.3Å; L186-L259 HydrophobicContact CD1-CD2 4.09Å; L186-C263 WeakPolarHBondContact CD2-SG 3.45Å
187	K	88.3	Confident	83.7	Confident	16 Å²	16	28.4 Å²	28.4	7%	0.07	14%	0.141	C	C	.	.	H	α-helix	trans	-58.4	-35.3	170.6	-169.4	177.2	-172.1	179.5	0	111.5	I183 R191 V284 D573 I576 Y583	I183-K187 WeakPolarHBondContact O-CB 3.24Å; I183-K187 PolarHBondContact O-N 3.27Å; K187-R191 WeakPolarHBondContact O-CG 3.42Å; K187-R191 PolarHBondContact O-N 2.73Å; K187-V284 WeakPolarHBondContact CD-O 3.45Å; K187-V284 VanDerWaalsContact CE-O 3.25Å; K187-V284 WeakPolarHBondContact CE-O 3.35Å; K187-D573 IonicContact NZ-OD1 3.31Å; K187-D573 PolarHBondContact NZ-OD1 3.18Å; K187-D573 IonicContact NZ-OD2 3.48Å; K187-D573 PolarHBondContact NZ-OD2 3.09Å; K187-I576 HydrophobicContact CB-CD1 4.37Å; K187-I576 HydrophobicContact CD-CD1 3.93Å; K187-I576 HydrophobicContact CG-CD1 4.41Å; K187-Y583 HydrophobicContact CD-CE2 4.21Å; K187-Y583 VanDerWaalsContact CE-OH 3.24Å; K187-Y583 WeakPolarHBondContact CE-OH 2.87Å; K187-Y583 HydrophobicContact CG-CE2 4.16Å; K187-Y583 PolarHBondContact NZ-OH 2.93Å
188	T	86.7	Confident	83.7	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-71	-38.9	175.8	-55.5	0	0	0	0	111.9	P184 E185 L186 R191 V193 L581 P582	P184-T188 PolarHBondContact O-N 3.36Å; P184-T188 VanDerWaalsContact O-N 3.17Å; P184-T188 PolarHBondContact O-OG1 2.97Å; E185-T188 WeakPolarHBondContact O-CA 3.4Å; E185-T188 VanDerWaalsContact O-CB 3.28Å; E185-T188 WeakPolarHBondContact O-CB 3.44Å; E185-T188 PolarHBondContact O-N 2.99Å; E185-T188 VanDerWaalsContact O-N 3.08Å; L186-T188 PolarHBondContact O-N 3.25Å; T188-R191 PolarHBondContact O-N 3.42Å; T188-V193 HydrophobicContact CG2-CB 3.93Å; T188-V193 HydrophobicContact CG2-CG1 4.39Å; T188-V193 PolarHBondContact O-N 3.24Å; T188-L581 HydrophobicContact CG2-CB 4.46Å; T188-P582 HydrophobicContact CG2-CG 4.34Å; T188-P582 WeakPolarHBondContact CG2-O 3.42Å
189	I	86.1	Confident	83.6	Confident	9 Å²	9	28.1 Å²	28.1	5%	0.046	14%	0.14	C	C	.	.	H	α-helix	trans	-66.3	-45.8	176.4	-65.1	166	0	0	0	111.5	E185 L186 R191 G192 V193 L195 Y198 L199 L259	E185-I189 WeakPolarHBondContact O-CG1 3.41Å; E185-I189 PolarHBondContact O-N 3.31Å; L186-I189 PolarHBondContact O-N 2.93Å; L186-I189 VanDerWaalsContact O-N 3.12Å; I189-R191 VanDerWaalsContact C-N 3.26Å; I189-R191 PolarHBondContact O-N 3.47Å; I189-G192 WeakPolarHBondContact O-CA 3.36Å; I189-G192 PolarHBondContact O-N 2.64Å; I189-V193 VanDerWaalsContact CA-O 3.3Å; I189-V193 WeakPolarHBondContact CA-O 3.43Å; I189-L195 HydrophobicContact CD1-CB 4.13Å; I189-L195 HydrophobicContact CD1-CD1 4.34Å; I189-L195 HydrophobicContact CG1-CB 4.1Å; I189-L195 HydrophobicContact CG1-CD1 4.05Å; I189-L195 HydrophobicContact CG1-CG 4.19Å; I189-Y198 HydrophobicContact CD1-CD1 4.18Å; I189-L199 HydrophobicContact CD1-CD1 4.1Å; I189-L199 HydrophobicContact CD1-CG 4.37Å; I189-L259 HydrophobicContact CG2-CD2 3.66Å
190	L	82.6	Confident	83.6	Confident	20 Å²	20	29.9 Å²	29.9	11%	0.105	15%	0.151	C	C	.	.	H	α-helix	trans	-67.9	-25.3	-179.7	-69.7	170.7	0	0	0	112.7	L186 G192 L259 T260 T285	L186-L190 HydrophobicContact CD1-CD1 4.45Å; L186-L190 HydrophobicContact CG-CD1 4.23Å; L186-L190 WeakPolarHBondContact O-CG 3.25Å; L186-L190 PolarHBondContact O-N 3.42Å; L190-G192 PolarHBondContact O-N 3.21Å; L190-L259 HydrophobicContact CD2-CB 3.91Å; L190-T260 WeakPolarHBondContact CD2-OG1 3.25Å; L190-T285 HydrophobicContact CD1-CG2 3.91Å
191	R	78.4	Confident	83.6	Confident	59 Å²	59	34.8 Å²	34.8	22%	0.223	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	5	167.9	-71	-166.5	-176.6	-164.7	-6.2	114.5	K187 T188 I189 Y583 L584 E586	K187-R191 WeakPolarHBondContact O-CG 3.42Å; K187-R191 PolarHBondContact O-N 2.73Å; T188-R191 PolarHBondContact O-N 3.42Å; I189-R191 VanDerWaalsContact C-N 3.26Å; I189-R191 PolarHBondContact O-N 3.47Å; R191-Y583 VanDerWaalsContact CZ-CZ 3.47Å; R191-Y583 VanDerWaalsContact NH1-CE2 3.26Å; R191-Y583 PolarHBondContact NH1-OH 3.19Å; R191-Y583 PolarHBondContact NH2-OH 3.41Å; R191-L584 PolarHBondContact NH1-O 3.5Å; R191-E586 IonicContact CZ-OE1 2.87Å; R191-E586 IonicContact NH1-OE1 2.91Å; R191-E586 IonicContact NH2-OE1 3.24Å; R191-E586 PolarHBondContact NH2-OE1 3.07Å
192	G	75.4	Confident	83.7	Confident	13 Å²	13	41.5 Å²	41.5	13%	0.134	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	106	-4.4	169.3	0	0	0	0	0	115.5	I189 L190 V194 K817	I189-G192 WeakPolarHBondContact O-CA 3.36Å; I189-G192 PolarHBondContact O-N 2.64Å; L190-G192 PolarHBondContact O-N 3.21Å; G192-V194 PolarHBondContact O-N 3.5Å; G192-K817 WeakPolarHBondContact O-CE 3.47Å; G192-K817 PolarHBondContact O-NZ 3.38Å
193	V	80.6	Confident	83.9	Confident	39 Å²	39	41.5 Å²	41.5	24%	0.236	20%	0.204	C	C	.	.			trans	-88.1	111.6	179.7	-179.1	0	0	0	0	111.6	T188 I189 L195 P582	T188-V193 HydrophobicContact CG2-CB 3.93Å; T188-V193 HydrophobicContact CG2-CG1 4.39Å; T188-V193 PolarHBondContact O-N 3.24Å; I189-V193 VanDerWaalsContact CA-O 3.3Å; I189-V193 WeakPolarHBondContact CA-O 3.43Å; V193-L195 PolarHBondContact O-N 2.96Å; V193-P582 HydrophobicContact CB-CG 4.44Å; V193-P582 HydrophobicContact CG1-CB 4.25Å; V193-P582 HydrophobicContact CG1-CG 3.59Å; V193-P582 HydrophobicContact CG2-CB 4.49Å; V193-P582 WeakPolarHBondContact CG2-O 3.31Å
194	V	73	Confident	84	Confident	71 Å²	71	43.1 Å²	43.1	43%	0.43	21%	0.211	S	C	.	.			trans	-79.6	112.5	-173.7	-172.7	0	0	0	0	111.2	G192 K196 K817	G192-V194 PolarHBondContact O-N 3.5Å; V194-K196 HydrophobicContact CG1-CG 3.7Å; V194-K817 VanDerWaalsContact CG2-NZ 3.32Å
195	L	79.2	Confident	84.2	Confident	15 Å²	15	46.2 Å²	46.2	8%	0.079	23%	0.23	C	C	.	.			trans	-98.2	80.8	171.2	-63.2	170.5	0	0	0	109.9	E185 I189 V193 E197 Y198	E185-L195 HydrophobicContact CB-CD1 4.18Å; E185-L195 HydrophobicContact CG-CD1 4.39Å; I189-L195 HydrophobicContact CD1-CB 4.13Å; I189-L195 HydrophobicContact CD1-CD1 4.34Å; I189-L195 HydrophobicContact CG1-CB 4.1Å; I189-L195 HydrophobicContact CG1-CD1 4.05Å; I189-L195 HydrophobicContact CG1-CG 4.19Å; V193-L195 PolarHBondContact O-N 2.96Å; L195-E197 PolarHBondContact O-N 3.03Å; L195-E197 VanDerWaalsContact O-N 3.11Å; L195-Y198 WeakPolarHBondContact O-CB 3.3Å; L195-Y198 PolarHBondContact O-N 2.77Å
196	K	63.8	Low	84.5	Confident	177 Å²	177	45.4 Å²	45.4	77%	0.77	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-29.4	-171.2	-67.4	-171.5	179.4	-178	0	114.8	V194	V194-K196 HydrophobicContact CG1-CG 3.7Å
197	E	73.6	Confident	84.8	Confident	108 Å²	108	45.3 Å²	45.3	51%	0.505	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-8	-178.4	-62.9	-174.7	175.3	0	0	113.8	L195	L195-E197 PolarHBondContact O-N 3.03Å; L195-E197 VanDerWaalsContact O-N 3.11Å
198	Y	83.1	Confident	85.2	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.016	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-38.2	-172.9	-156	-111.6	0	0	0	112.5	Q177 G182 E185 I189 L195 T200 H229	Q177-Y198 HydrophobicContact CB-CD2 3.95Å; Q177-Y198 HydrophobicContact CB-CE2 4.14Å; Q177-Y198 VanDerWaalsContact O-CE2 3.25Å; Q177-Y198 WeakPolarHBondContact O-CE2 3.47Å; G182-Y198 WeakPolarHBondContact CA-OH 3.37Å; E185-Y198 HydrophobicContact CB-CD1 3.87Å; E185-Y198 HydrophobicContact CB-CE1 3.37Å; E185-Y198 HydrophobicContact CB-CE2 4.11Å; E185-Y198 HydrophobicContact CB-CG 4.43Å; E185-Y198 HydrophobicContact CG-CD2 4.32Å; E185-Y198 HydrophobicContact CG-CE1 3.98Å; E185-Y198 HydrophobicContact CG-CE2 3.76Å; I189-Y198 HydrophobicContact CD1-CD1 4.18Å; L195-Y198 WeakPolarHBondContact O-CB 3.3Å; L195-Y198 PolarHBondContact O-N 2.77Å; Y198-T200 PolarHBondContact O-N 3.4Å; Y198-H229 AromaticContact CD1-CD2 3.83Å; Y198-H229 AromaticContact CD1-CE1 3.64Å; Y198-H229 AromaticContact CD1-NE2 3.12Å; Y198-H229 WeakPolarHBondContact CD1-NE2 3.32Å; Y198-H229 AromaticContact CE1-CD2 3.42Å; Y198-H229 VanDerWaalsContact CE1-CD2 3.42Å; Y198-H229 WeakPolarHBondContact CE1-CD2 3.4Å; Y198-H229 AromaticContact CE1-CE1 3.22Å; Y198-H229 WeakPolarHBondContact CE1-CE1 3.29Å; Y198-H229 AromaticContact CE1-CG 3.86Å; Y198-H229 AromaticContact CE1-ND1 3.76Å; Y198-H229 AromaticContact CE1-NE2 3Å; Y198-H229 WeakPolarHBondContact CE1-NE2 3.38Å; Y198-H229 AromaticContact CG-NE2 3.98Å; Y198-H229 AromaticContact CZ-CE1 3.46Å; Y198-H229 VanDerWaalsContact CZ-CE1 3.46Å; Y198-H229 AromaticContact CZ-ND1 3.89Å; Y198-H229 AromaticContact CZ-NE2 3.77Å; Y198-H229 PolarHBondContact O-NE2 3.33Å
199	L	86.6	Confident	85.7	Confident	9 Å²	9	48.8 Å²	48.8	5%	0.047	25%	0.245	C	C	.	.	S	Bend	trans	-95.7	59.8	-174.8	-63.5	168.7	0	0	0	112.3	I189 I233 Y255 L259	I189-L199 HydrophobicContact CD1-CD1 4.1Å; I189-L199 HydrophobicContact CD1-CG 4.37Å; L199-I233 HydrophobicContact CD2-CG1 3.81Å; L199-Y255 HydrophobicContact CD1-CE1 4.46Å; L199-Y255 WeakPolarHBondContact CD1-OH 3.22Å; L199-L259 HydrophobicContact CD1-CD2 3.72Å; L199-L259 HydrophobicContact CD1-CG 4.43Å
200	T	89.3	Confident	86.2	Confident	48 Å²	48	48.4 Å²	48.4	29%	0.294	24%	0.243	S	C	.	.			trans	-113.3	149.2	-177.4	61.2	0	0	0	0	112.6	Y198 K202 A203 F204	Y198-T200 PolarHBondContact O-N 3.4Å; T200-K202 PolarHBondContact O-N 3.26Å; T200-A203 WeakPolarHBondContact O-CB 3.31Å; T200-A203 PolarHBondContact O-N 3.1Å; T200-A203 WeakPolarHBondContact OG1-CB 3.41Å; T200-A203 PolarHBondContact OG1-N 3.25Å; T200-F204 PolarHBondContact O-N 3.04Å; T200-F204 VanDerWaalsContact O-N 3.1Å
201	L	90.7	Very high	86.8	Confident	104 Å²	104	47.4 Å²	47.4	55%	0.545	24%	0.238	S	C	.	.	H	α-helix	trans	-61	-31.3	176.2	-171.6	67.5	0	0	0	112.4	A203 F204 V205	L201-A203 VanDerWaalsContact C-N 3.34Å; L201-A203 PolarHBondContact O-N 2.79Å; L201-F204 HydrophobicContact CD1-CB 4.44Å; L201-F204 HydrophobicContact CD1-CD1 4.26Å; L201-F204 WeakPolarHBondContact O-CB 3.35Å; L201-F204 PolarHBondContact O-N 3.49Å; L201-V205 PolarHBondContact O-N 2.84Å; L201-V205 VanDerWaalsContact O-N 3.15Å
202	K	91.1	Very high	87.7	Confident	154 Å²	154	46 Å²	46	67%	0.67	24%	0.236	S	C	*	.	H	α-helix	trans	-61.9	-42	173	-65.4	-176	-179.6	-179	0	111.7	T200 F204 A206	T200-K202 PolarHBondContact O-N 3.26Å; K202-F204 VanDerWaalsContact C-N 3.34Å; K202-A206 WeakPolarHBondContact O-CB 3.16Å; K202-A206 PolarHBondContact O-N 2.85Å; K202-A206 VanDerWaalsContact O-N 3.11Å
203	A	91.9	Very high	88.7	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-35.6	175.1	0	0	0	0	0	112	T200 L201 K207 I233	T200-A203 WeakPolarHBondContact O-CB 3.31Å; T200-A203 PolarHBondContact O-N 3.1Å; T200-A203 WeakPolarHBondContact OG1-CB 3.41Å; T200-A203 PolarHBondContact OG1-N 3.25Å; L201-A203 VanDerWaalsContact C-N 3.34Å; L201-A203 PolarHBondContact O-N 2.79Å; A203-K207 WeakPolarHBondContact O-CB 3.28Å; A203-K207 PolarHBondContact O-N 3.37Å; A203-I233 HydrophobicContact CB-CD1 4.23Å
204	F	94.8	Very high	89.4	Confident	41 Å²	41	44.1 Å²	44.1	18%	0.18	22%	0.223	C	C	.	.	H	α-helix	trans	-57.6	-55.2	174.5	172.9	-89.4	0	0	0	111.7	V123 T200 L201 K202 A206 K207 V208 I230 I233	V123-F204 HydrophobicContact CG2-CZ 4.11Å; T200-F204 PolarHBondContact O-N 3.04Å; T200-F204 VanDerWaalsContact O-N 3.1Å; L201-F204 HydrophobicContact CD1-CB 4.44Å; L201-F204 HydrophobicContact CD1-CD1 4.26Å; L201-F204 WeakPolarHBondContact O-CB 3.35Å; L201-F204 PolarHBondContact O-N 3.49Å; K202-F204 VanDerWaalsContact C-N 3.34Å; F204-A206 PolarHBondContact O-N 2.83Å; F204-K207 PolarHBondContact O-N 2.8Å; F204-V208 HydrophobicContact CE1-CG2 4.29Å; F204-V208 HydrophobicContact CE2-CG2 4.31Å; F204-V208 HydrophobicContact CZ-CG2 4.16Å; F204-V208 WeakPolarHBondContact O-CG2 3.46Å; F204-V208 PolarHBondContact O-N 2.89Å; F204-I230 HydrophobicContact CD2-CG2 3.68Å; F204-I230 HydrophobicContact CE2-CG2 3.44Å; F204-I230 VanDerWaalsContact CE2-CG2 3.44Å; F204-I230 HydrophobicContact CZ-CG2 4.43Å; F204-I233 HydrophobicContact CB-CB 4.48Å; F204-I233 HydrophobicContact CB-CD1 4.32Å; F204-I233 HydrophobicContact CB-CG2 3.83Å
205	V	95	Very high	90.4	Very high	64 Å²	64	42.1 Å²	42.1	39%	0.388	21%	0.21	S	C	.	.	H	α-helix	trans	-63	-44.5	-178.6	177.9	0	0	0	0	111.3	L201 K207 I209	L201-V205 PolarHBondContact O-N 2.84Å; L201-V205 VanDerWaalsContact O-N 3.15Å; V205-K207 VanDerWaalsContact C-N 3.28Å; V205-K207 PolarHBondContact O-N 2.75Å; V205-I209 HydrophobicContact CG1-CD1 3.81Å; V205-I209 PolarHBondContact O-N 2.82Å
206	A	94.9	Very high	91.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-57.6	-41.7	176.7	0	0	0	0	0	112.3	V174 A178 K202 F204 G210	V174-A206 HydrophobicContact CB-CB 3.94Å; V174-A206 HydrophobicContact CG1-CB 3.84Å; A178-A206 HydrophobicContact CB-CB 3.83Å; K202-A206 WeakPolarHBondContact O-CB 3.16Å; K202-A206 PolarHBondContact O-N 2.85Å; K202-A206 VanDerWaalsContact O-N 3.11Å; F204-A206 PolarHBondContact O-N 2.83Å; A206-G210 PolarHBondContact O-N 3.25Å; A206-G210 VanDerWaalsContact O-N 3.08Å
207	K	95.7	Very high	92.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-77	-40.6	-175.3	-156	159.8	-161.7	173.5	0	112.2	A178 G180 S181 A203 F204 V205 L211 P226 H229 I230 P474	A178-K207 HydrophobicContact CB-CB 3.96Å; A178-K207 HydrophobicContact CB-CG 4.32Å; A178-K207 WeakPolarHBondContact O-CE 3.2Å; G180-K207 VanDerWaalsContact O-CE 3.28Å; G180-K207 WeakPolarHBondContact O-CE 2.95Å; G180-K207 PolarHBondContact O-NZ 2.88Å; S181-K207 PolarHBondContact O-NZ 3.35Å; A203-K207 WeakPolarHBondContact O-CB 3.28Å; A203-K207 PolarHBondContact O-N 3.37Å; F204-K207 PolarHBondContact O-N 2.8Å; V205-K207 VanDerWaalsContact C-N 3.28Å; V205-K207 PolarHBondContact O-N 2.75Å; K207-L211 WeakPolarHBondContact O-CB 3.42Å; K207-L211 PolarHBondContact O-N 2.82Å; K207-P226 HydrophobicContact CD-CB 4.47Å; K207-P226 HydrophobicContact CG-CB 4.42Å; K207-H229 HydrophobicContact CD-CB 4.35Å; K207-H229 WeakPolarHBondContact CD-ND1 3.37Å; K207-H229 PolarHBondContact NZ-ND1 3.28Å; K207-H229 VanDerWaalsContact NZ-ND1 3.15Å; K207-I230 HydrophobicContact CB-CD1 4.29Å; K207-I230 HydrophobicContact CB-CG1 4.1Å; K207-I230 HydrophobicContact CD-CG1 4.29Å; K207-I230 HydrophobicContact CG-CD1 4.15Å; K207-I230 HydrophobicContact CG-CG1 4.11Å; K207-P474 HydrophobicContact CG-CB 3.94Å
208	V	96.5	Very high	93.4	Very high	25 Å²	25	28.6 Å²	28.6	15%	0.152	15%	0.153	C	C	.	.	H	α-helix	trans	-61.2	-55	176.4	172.4	0	0	0	0	110.4	V123 F204 G210 L211 T212 I230	V123-V208 HydrophobicContact CG1-CG2 4.09Å; F204-V208 HydrophobicContact CE1-CG2 4.29Å; F204-V208 HydrophobicContact CE2-CG2 4.31Å; F204-V208 HydrophobicContact CZ-CG2 4.16Å; F204-V208 WeakPolarHBondContact O-CG2 3.46Å; F204-V208 PolarHBondContact O-N 2.89Å; V208-G210 PolarHBondContact O-N 3.05Å; V208-L211 PolarHBondContact O-N 2.95Å; V208-T212 PolarHBondContact O-N 2.83Å; V208-T212 PolarHBondContact O-OG1 2.87Å; V208-I230 HydrophobicContact CG2-CD1 3.84Å; V208-I230 HydrophobicContact CG2-CG1 4.24Å; V208-I230 HydrophobicContact CG2-CG2 3.96Å
209	I	96.7	Very high	93.8	Very high	65 Å²	65	29 Å²	29	33%	0.333	16%	0.155	S	C	.	.	H	α-helix	trans	-65.6	-44.8	-177	-65.4	170.2	0	0	0	111.4	F166 F170 V205 L211 T212 A213	F166-I209 HydrophobicContact CE1-CG2 4.01Å; F166-I209 HydrophobicContact CZ-CG2 4.31Å; F170-I209 HydrophobicContact CD1-CB 3.96Å; F170-I209 HydrophobicContact CD1-CG2 3.83Å; F170-I209 HydrophobicContact CE1-CB 3.59Å; F170-I209 HydrophobicContact CE1-CD1 3.67Å; F170-I209 HydrophobicContact CE1-CG1 4.17Å; F170-I209 HydrophobicContact CE1-CG2 3.75Å; F170-I209 HydrophobicContact CG-CG2 4.38Å; F170-I209 HydrophobicContact CZ-CB 4.32Å; F170-I209 HydrophobicContact CZ-CD1 3.59Å; F170-I209 HydrophobicContact CZ-CG2 4.25Å; V205-I209 HydrophobicContact CG1-CD1 3.81Å; V205-I209 PolarHBondContact O-N 2.82Å; I209-L211 VanDerWaalsContact C-N 3.29Å; I209-L211 PolarHBondContact O-N 2.97Å; I209-T212 PolarHBondContact O-N 3.26Å; I209-A213 PolarHBondContact O-N 3.5Å; I209-A213 VanDerWaalsContact O-N 3.07Å
210	G	96.3	Very high	94.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.1	-37.8	178.1	0	0	0	0	0	112.3	A167 A206 V208 A214 P474	A167-G210 WeakPolarHBondContact CB-O 3.35Å; A206-G210 PolarHBondContact O-N 3.25Å; A206-G210 VanDerWaalsContact O-N 3.08Å; V208-G210 PolarHBondContact O-N 3.05Å; G210-A214 WeakPolarHBondContact O-CB 3.45Å; G210-A214 PolarHBondContact O-N 2.96Å; G210-P474 VanDerWaalsContact C-CG 3.41Å
211	L	96	Very high	94.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-72.2	-42.1	178.2	-174.9	61.6	0	0	0	111.8	M127 K207 V208 I209 A213 A214 L215 K223 P226 I230 P474	M127-L211 HydrophobicContact CE-CD2 4.12Å; M127-L211 HydrophobicContact SD-CB 4.25Å; M127-L211 HydrophobicContact SD-CD2 3.62Å; M127-L211 HydrophobicContact SD-CG 3.86Å; K207-L211 WeakPolarHBondContact O-CB 3.42Å; K207-L211 PolarHBondContact O-N 2.82Å; V208-L211 PolarHBondContact O-N 2.95Å; I209-L211 VanDerWaalsContact C-N 3.29Å; I209-L211 PolarHBondContact O-N 2.97Å; L211-A213 VanDerWaalsContact C-N 3.31Å; L211-A213 PolarHBondContact O-N 2.72Å; L211-A214 PolarHBondContact O-N 2.79Å; L211-L215 HydrophobicContact CD1-CD1 4.41Å; L211-L215 HydrophobicContact CD1-CG 4.26Å; L211-L215 HydrophobicContact CG-CD1 4.03Å; L211-L215 HydrophobicContact CG-CG 4.34Å; L211-L215 VanDerWaalsContact O-CG 3.29Å; L211-L215 WeakPolarHBondContact O-CG 3.26Å; L211-L215 PolarHBondContact O-N 3.15Å; L211-K223 HydrophobicContact CD2-CB 3.99Å; L211-K223 HydrophobicContact CG-CB 4.43Å; L211-P226 HydrophobicContact CD1-CB 4.06Å; L211-P226 HydrophobicContact CD1-CG 4.05Å; L211-P226 HydrophobicContact CD2-CB 3.56Å; L211-P226 HydrophobicContact CD2-CG 4.41Å; L211-P226 HydrophobicContact CG-CB 4.37Å; L211-I230 HydrophobicContact CD2-CD1 4.21Å; L211-P474 HydrophobicContact CB-CB 4.27Å; L211-P474 HydrophobicContact CB-CG 4.1Å; L211-P474 HydrophobicContact CD1-CB 4.43Å; L211-P474 VanDerWaalsContact CD1-O 3.32Å; L211-P474 WeakPolarHBondContact CD1-O 3.35Å
212	T	96.6	Very high	94.4	Very high	30 Å²	30	22.5 Å²	22.5	18%	0.184	12%	0.121	C	C	.	.	H	α-helix	trans	-56.8	-45.7	174.5	-53.5	0	0	0	0	111.2	M127 A130 V208 I209 L215 G216	M127-T212 WeakPolarHBondContact CG-OG1 3.37Å; A130-T212 HydrophobicContact CB-CG2 3.72Å; V208-T212 PolarHBondContact O-N 2.83Å; V208-T212 PolarHBondContact O-OG1 2.87Å; I209-T212 PolarHBondContact O-N 3.26Å; T212-L215 PolarHBondContact O-N 3.12Å; T212-G216 PolarHBondContact O-N 3.44Å
213	A	96.4	Very high	94.5	Very high	11 Å²	11	16 Å²	16	9%	0.091	9%	0.093	C	C	.	.	H	α-helix	trans	-66	-39.9	176.8	0	0	0	0	0	112.3	F166 A167 I209 L211 G216 S217	F166-A213 HydrophobicContact CD1-CB 3.93Å; F166-A213 HydrophobicContact CE1-CB 4.35Å; A167-A213 HydrophobicContact CB-CB 4.01Å; I209-A213 PolarHBondContact O-N 3.5Å; I209-A213 VanDerWaalsContact O-N 3.07Å; L211-A213 VanDerWaalsContact C-N 3.31Å; L211-A213 PolarHBondContact O-N 2.72Å; A213-G216 PolarHBondContact O-N 3.5Å; A213-S217 PolarHBondContact O-N 3.14Å; A213-S217 VanDerWaalsContact O-N 3.11Å
214	A	95.6	Very high	94.4	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-63.8	-43.2	176.3	0	0	0	0	0	112.4	G210 L211 S217 V221 I473	G210-A214 WeakPolarHBondContact O-CB 3.45Å; G210-A214 PolarHBondContact O-N 2.96Å; L211-A214 PolarHBondContact O-N 2.79Å; A214-S217 PolarHBondContact O-N 2.92Å; A214-S217 PolarHBondContact O-OG 3.3Å; A214-V221 HydrophobicContact CB-CG2 4.29Å; A214-I473 HydrophobicContact CB-CD1 4.03Å
215	L	94.4	Very high	94.3	Very high	29 Å²	29	14.4 Å²	14.4	15%	0.152	9%	0.086	C	C	.	.	H	α-helix	trans	-68.4	-40.5	175.7	-63.4	167.8	0	0	0	111.7	M127 S131 L211 T212 S217 G218 K223	M127-L215 HydrophobicContact CE-CD1 4.29Å; M127-L215 HydrophobicContact CG-CD1 4.16Å; M127-L215 HydrophobicContact SD-CD1 4.07Å; S131-L215 VanDerWaalsContact OG-C 3.25Å; S131-L215 VanDerWaalsContact OG-CB 3.22Å; S131-L215 WeakPolarHBondContact OG-CB 3.46Å; L211-L215 HydrophobicContact CD1-CD1 4.41Å; L211-L215 HydrophobicContact CD1-CG 4.26Å; L211-L215 HydrophobicContact CG-CD1 4.03Å; L211-L215 HydrophobicContact CG-CG 4.34Å; L211-L215 VanDerWaalsContact O-CG 3.29Å; L211-L215 WeakPolarHBondContact O-CG 3.26Å; L211-L215 PolarHBondContact O-N 3.15Å; T212-L215 PolarHBondContact O-N 3.12Å; L215-S217 PolarHBondContact O-N 2.8Å; L215-G218 PolarHBondContact O-N 2.91Å; L215-K223 HydrophobicContact CD1-CB 3.77Å; L215-K223 HydrophobicContact CD2-CB 4.18Å
216	G	94.6	Very high	94.3	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-63.9	-19.9	177.1	0	0	0	0	0	114.1	S131 T212 A213 G218	S131-G216 PolarHBondContact OG-N 3.24Å; T212-G216 PolarHBondContact O-N 3.44Å; A213-G216 PolarHBondContact O-N 3.5Å; G216-G218 VanDerWaalsContact C-N 3.3Å; G216-G218 PolarHBondContact O-N 3.46Å
217	S	94.3	Very high	94.3	Very high	1 Å²	1	11.4 Å²	11.4	1%	0.007	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-14.7	176.2	77.1	0	0	0	0	114.6	A213 A214 L215 M219	A213-S217 PolarHBondContact O-N 3.14Å; A213-S217 VanDerWaalsContact O-N 3.11Å; A214-S217 PolarHBondContact O-N 2.92Å; A214-S217 PolarHBondContact O-OG 3.3Å; L215-S217 PolarHBondContact O-N 2.8Å; S217-M219 PolarHBondContact O-N 3.49Å; S217-M219 WeakPolarHBondContact OG-CB 3.13Å; S217-M219 VanDerWaalsContact OG-CG 3.29Å; S217-M219 WeakPolarHBondContact OG-CG 3.26Å; S217-M219 PolarHBondContact OG-N 2.91Å
218	G	91.1	Very high	94.3	Very high	16 Å²	16	11.7 Å²	11.7	17%	0.165	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	4.1	-174.8	0	0	0	0	0	114.8	L215 G216	L215-G218 PolarHBondContact O-N 2.91Å; G216-G218 VanDerWaalsContact C-N 3.3Å; G216-G218 PolarHBondContact O-N 3.46Å
219	M	92.2	Very high	94.2	Very high	11 Å²	11	10.5 Å²	10.5	5%	0.054	6%	0.062	C	C	.	.			trans	-59.9	151.4	173.5	-72.5	-58.8	95.8	0	0	111.6	P160 V164 S217 V221 T390 I393	P160-M219 HydrophobicContact CB-CE 4Å; P160-M219 HydrophobicContact CG-CE 4.48Å; V164-M219 HydrophobicContact CG2-CG 3.89Å; S217-M219 PolarHBondContact O-N 3.49Å; S217-M219 WeakPolarHBondContact OG-CB 3.13Å; S217-M219 VanDerWaalsContact OG-CG 3.29Å; S217-M219 WeakPolarHBondContact OG-CG 3.26Å; S217-M219 PolarHBondContact OG-N 2.91Å; M219-V221 HydrophobicContact CB-CG1 4.34Å; M219-V221 HydrophobicContact CB-CG2 4.37Å; M219-V221 PolarHBondContact O-N 3.4Å; M219-T390 HydrophobicContact CE-CG2 4.26Å; M219-T390 HydrophobicContact CG-CG2 4.34Å; M219-T390 HydrophobicContact SD-CG2 3.87Å; M219-I393 HydrophobicContact CE-CG2 4.13Å; M219-I393 HydrophobicContact SD-CB 4.14Å; M219-I393 HydrophobicContact SD-CD1 4.43Å; M219-I393 HydrophobicContact SD-CG2 3.9Å
220	P	92.4	Very high	94.1	Very high	15 Å²	15	7.4 Å²	7.4	10%	0.097	5%	0.047	C	C	.	.	S	Bend	trans	-73.4	74.7	178	30.3	-33.2	0	0	0	110.1	S468 P480	P220-S468 PolarHBondContact O-OG 3.41Å; P220-P480 VanDerWaalsContact O-CG 3.25Å; P220-P480 WeakPolarHBondContact O-CG 3.35Å
221	V	93.1	Very high	94.1	Very high	8 Å²	8	7.4 Å²	7.4	5%	0.048	5%	0.047	C	C	.	.			trans	-133.2	146.3	178.3	-62.3	0	0	0	0	109.5	A214 M219 M471 I473	A214-V221 HydrophobicContact CB-CG2 4.29Å; M219-V221 HydrophobicContact CB-CG1 4.34Å; M219-V221 HydrophobicContact CB-CG2 4.37Å; M219-V221 PolarHBondContact O-N 3.4Å; V221-M471 HydrophobicContact CG1-CE 4.45Å; V221-I473 HydrophobicContact CG1-CD1 4.46Å
222	G	92.3	Very high	94	Very high	2 Å²	2	7.4 Å²	7.4	2%	0.021	5%	0.047	C	C	.	.	B	Isolated β-bridge	trans	-108.3	156.4	177.5	0	0	0	0	0	113.1	G476	G222-G476 WeakPolarHBondContact CA-O 3.28Å; G222-G476 PolarHBondContact N-O 2.92Å; G222-G476 WeakPolarHBondContact O-CA 3.27Å; G222-G476 PolarHBondContact O-N 2.97Å
223	K	93.4	Very high	93.9	Very high	17 Å²	17	6 Å²	6	7%	0.074	4%	0.038	C	C	.	.	S	Bend	trans	-82.5	-22.5	175.5	68.2	171.5	-179.7	165.3	0	114.5	S124 M127 D128 L211 L215 G225 P226 F227 C270	S124-K223 PolarHBondContact OG-NZ 3.28Å; M127-K223 HydrophobicContact CE-CB 3.97Å; M127-K223 HydrophobicContact CE-CD 3.57Å; M127-K223 HydrophobicContact CE-CG 4.37Å; D128-K223 WeakPolarHBondContact OD1-CD 3.3Å; D128-K223 IonicContact OD1-NZ 3.5Å; D128-K223 PolarHBondContact OD1-NZ 2.8Å; D128-K223 IonicContact OD2-NZ 2.82Å; D128-K223 PolarHBondContact OD2-NZ 3.05Å; L211-K223 HydrophobicContact CD2-CB 3.99Å; L211-K223 HydrophobicContact CG-CB 4.43Å; L215-K223 HydrophobicContact CD1-CB 3.77Å; L215-K223 HydrophobicContact CD2-CB 4.18Å; K223-G225 PolarHBondContact O-N 2.64Å; K223-P226 VanDerWaalsContact O-CD 3.29Å; K223-P226 WeakPolarHBondContact O-CD 3.45Å; K223-F227 VanDerWaalsContact O-CB 3.27Å; K223-F227 WeakPolarHBondContact O-CB 3.47Å; K223-F227 PolarHBondContact O-N 2.75Å; K223-C270 WeakPolarHBondContact CE-O 3.12Å; K223-C270 PolarHBondContact NZ-O 2.88Å
224	E	90.8	Very high	93.8	Very high	8 Å²	8	6.3 Å²	6.3	4%	0.037	4%	0.039	C	C	.	.	H	α-helix	trans	-51	-63.3	-164.2	-52.1	-52.9	142.4	0	0	114.1	F227 V228 C270 F271 F478	E224-F227 PolarHBondContact O-N 3.29Å; E224-F227 VanDerWaalsContact O-N 3.14Å; E224-V228 WeakPolarHBondContact O-CG2 3.34Å; E224-V228 PolarHBondContact O-N 3.33Å; E224-V228 VanDerWaalsContact O-N 3.08Å; E224-C270 WeakPolarHBondContact OE2-CB 2.97Å; E224-C270 PolarHBondContact OE2-SG 3.45Å; E224-F271 HydrophobicContact CB-CZ 4.16Å; E224-F271 HydrophobicContact CG-CE1 3.68Å; E224-F271 HydrophobicContact CG-CE2 4.17Å; E224-F271 HydrophobicContact CG-CZ 3.35Å; E224-F271 WeakPolarHBondContact OE1-CE1 3.37Å; E224-F271 VanDerWaalsContact OE2-CE2 3.26Å; E224-F271 WeakPolarHBondContact OE2-CE2 3.41Å; E224-F271 WeakPolarHBondContact OE2-CZ 3.48Å; E224-F478 HydrophobicContact CB-CB 4.02Å; E224-F478 HydrophobicContact CG-CB 3.98Å; E224-F478 HydrophobicContact CG-CD1 4.28Å; E224-F478 HydrophobicContact CG-CG 4.29Å
225	G	91.9	Very high	93.6	Very high	1 Å²	1	6.3 Å²	6.3	1%	0.01	4%	0.039	C	C	.	.	H	α-helix	trans	-57.3	-54.4	-179.4	0	0	0	0	0	113.8	S181 K223 F227 V228 H229	S181-G225 CarbonylContact O-C 3.45Å; S181-G225 WeakPolarHBondContact OG-CA 3.46Å; K223-G225 PolarHBondContact O-N 2.64Å; G225-F227 PolarHBondContact O-N 3.36Å; G225-V228 PolarHBondContact O-N 3.26Å; G225-H229 PolarHBondContact O-N 3.41Å
226	P	95.2	Very high	93.4	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-52	-38.2	173.7	-33.3	40.1	0	0	0	114.5	S181 K207 L211 K223 H229 I230 P474 S475	S181-P226 WeakPolarHBondContact O-CA 3.5Å; S181-P226 VanDerWaalsContact O-N 3.08Å; K207-P226 HydrophobicContact CD-CB 4.47Å; K207-P226 HydrophobicContact CG-CB 4.42Å; L211-P226 HydrophobicContact CD1-CB 4.06Å; L211-P226 HydrophobicContact CD1-CG 4.05Å; L211-P226 HydrophobicContact CD2-CB 3.56Å; L211-P226 HydrophobicContact CD2-CG 4.41Å; L211-P226 HydrophobicContact CG-CB 4.37Å; K223-P226 VanDerWaalsContact O-CD 3.29Å; K223-P226 WeakPolarHBondContact O-CD 3.45Å; P226-H229 WeakPolarHBondContact O-CB 3.45Å; P226-H229 PolarHBondContact O-N 3.01Å; P226-I230 VanDerWaalsContact O-CG1 3.32Å; P226-I230 WeakPolarHBondContact O-CG1 3.39Å; P226-I230 PolarHBondContact O-N 3.49Å; P226-P474 HydrophobicContact CB-CB 4.38Å; P226-P474 HydrophobicContact CG-CB 4.35Å; P226-S475 VanDerWaalsContact CG-C 3.5Å
227	F	95.2	Very high	93.2	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-73.3	-34	-177.8	-159.4	-92.7	0	0	0	113.2	M120 V123 S124 M127 K223 E224 G225 H229 I230 A231 G266 C269 C270	M120-F227 HydrophobicContact CE-CD1 4.05Å; M120-F227 HydrophobicContact CE-CE1 3.32Å; M120-F227 HydrophobicContact CE-CE2 4.06Å; M120-F227 HydrophobicContact CE-CZ 3.31Å; V123-F227 HydrophobicContact CG1-CE2 4.09Å; S124-F227 VanDerWaalsContact CB-CZ 3.45Å; M127-F227 HydrophobicContact CE-CD2 3.62Å; M127-F227 HydrophobicContact CE-CE2 3.9Å; K223-F227 VanDerWaalsContact O-CB 3.27Å; K223-F227 WeakPolarHBondContact O-CB 3.47Å; K223-F227 PolarHBondContact O-N 2.75Å; E224-F227 PolarHBondContact O-N 3.29Å; E224-F227 VanDerWaalsContact O-N 3.14Å; G225-F227 PolarHBondContact O-N 3.36Å; F227-H229 PolarHBondContact O-N 2.89Å; F227-I230 HydrophobicContact CD2-CD1 4.36Å; F227-I230 PolarHBondContact O-N 3.33Å; F227-I230 VanDerWaalsContact O-N 3.17Å; F227-A231 WeakPolarHBondContact O-CB 3.4Å; F227-A231 PolarHBondContact O-N 2.76Å; F227-G266 VanDerWaalsContact CD1-O 3.31Å; F227-G266 WeakPolarHBondContact CD1-O 3.4Å; F227-C269 HydrophobicContact CE1-CB 3.99Å; F227-C270 WeakPolarHBondContact CB-SG 3.41Å; F227-C270 WeakPolarHBondContact CD1-SG 3.49Å; F227-C270 WeakPolarHBondContact CG-SG 3.23Å
228	V	94.8	Very high	92.9	Very high	6 Å²	6	8.4 Å²	8.4	4%	0.036	5%	0.053	C	C	.	.	H	α-helix	trans	-56.9	-41	169	-174.2	0	0	0	0	110.8	I183 L186 E224 G225 A231 S232 C263 V267	I183-V228 HydrophobicContact CD1-CG2 4.18Å; I183-V228 HydrophobicContact CG1-CB 4.16Å; I183-V228 HydrophobicContact CG1-CG1 4.41Å; I183-V228 HydrophobicContact CG1-CG2 4.29Å; L186-V228 HydrophobicContact CD2-CG1 3.64Å; E224-V228 WeakPolarHBondContact O-CG2 3.34Å; E224-V228 PolarHBondContact O-N 3.33Å; E224-V228 VanDerWaalsContact O-N 3.08Å; G225-V228 PolarHBondContact O-N 3.26Å; V228-A231 PolarHBondContact O-N 3.31Å; V228-S232 PolarHBondContact O-N 3.34Å; V228-S232 PolarHBondContact O-OG 3.19Å; V228-C263 HydrophobicContact CG1-CB 3.98Å; V228-V267 HydrophobicContact CG2-CG2 3.42Å; V228-V267 VanDerWaalsContact CG2-CG2 3.42Å
229	H	94.6	Very high	92.7	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-67.5	-44.3	175.7	-176.5	-141.5	0	0	0	112.2	Y198 K207 G225 P226 F227 A231 S232 I233	Y198-H229 AromaticContact CD1-CD2 3.83Å; Y198-H229 AromaticContact CD1-CE1 3.64Å; Y198-H229 AromaticContact CD1-NE2 3.12Å; Y198-H229 WeakPolarHBondContact CD1-NE2 3.32Å; Y198-H229 AromaticContact CE1-CD2 3.42Å; Y198-H229 VanDerWaalsContact CE1-CD2 3.42Å; Y198-H229 WeakPolarHBondContact CE1-CD2 3.4Å; Y198-H229 AromaticContact CE1-CE1 3.22Å; Y198-H229 WeakPolarHBondContact CE1-CE1 3.29Å; Y198-H229 AromaticContact CE1-CG 3.86Å; Y198-H229 AromaticContact CE1-ND1 3.76Å; Y198-H229 AromaticContact CE1-NE2 3Å; Y198-H229 WeakPolarHBondContact CE1-NE2 3.38Å; Y198-H229 AromaticContact CG-NE2 3.98Å; Y198-H229 AromaticContact CZ-CE1 3.46Å; Y198-H229 VanDerWaalsContact CZ-CE1 3.46Å; Y198-H229 AromaticContact CZ-ND1 3.89Å; Y198-H229 AromaticContact CZ-NE2 3.77Å; Y198-H229 PolarHBondContact O-NE2 3.33Å; K207-H229 HydrophobicContact CD-CB 4.35Å; K207-H229 WeakPolarHBondContact CD-ND1 3.37Å; K207-H229 PolarHBondContact NZ-ND1 3.28Å; K207-H229 VanDerWaalsContact NZ-ND1 3.15Å; G225-H229 PolarHBondContact O-N 3.41Å; P226-H229 WeakPolarHBondContact O-CB 3.45Å; P226-H229 PolarHBondContact O-N 3.01Å; F227-H229 PolarHBondContact O-N 2.89Å; H229-A231 VanDerWaalsContact C-N 3.29Å; H229-A231 PolarHBondContact O-N 3.23Å; H229-S232 PolarHBondContact O-N 3.36Å; H229-I233 WeakPolarHBondContact NE2-CD1 3.28Å; H229-I233 WeakPolarHBondContact O-CG1 3.4Å; H229-I233 PolarHBondContact O-N 3.45Å
230	I	95.8	Very high	92.3	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-57.1	-44.2	175.9	-68.1	164.1	0	0	0	110.5	M120 V123 F204 K207 V208 L211 P226 F227 S232 I233 C234	M120-I230 HydrophobicContact CE-CG2 4.06Å; V123-I230 HydrophobicContact CG1-CG2 4.3Å; F204-I230 HydrophobicContact CD2-CG2 3.68Å; F204-I230 HydrophobicContact CE2-CG2 3.44Å; F204-I230 VanDerWaalsContact CE2-CG2 3.44Å; F204-I230 HydrophobicContact CZ-CG2 4.43Å; K207-I230 HydrophobicContact CB-CD1 4.29Å; K207-I230 HydrophobicContact CB-CG1 4.1Å; K207-I230 HydrophobicContact CD-CG1 4.29Å; K207-I230 HydrophobicContact CG-CD1 4.15Å; K207-I230 HydrophobicContact CG-CG1 4.11Å; V208-I230 HydrophobicContact CG2-CD1 3.84Å; V208-I230 HydrophobicContact CG2-CG1 4.24Å; V208-I230 HydrophobicContact CG2-CG2 3.96Å; L211-I230 HydrophobicContact CD2-CD1 4.21Å; P226-I230 VanDerWaalsContact O-CG1 3.32Å; P226-I230 WeakPolarHBondContact O-CG1 3.39Å; P226-I230 PolarHBondContact O-N 3.49Å; F227-I230 HydrophobicContact CD2-CD1 4.36Å; F227-I230 PolarHBondContact O-N 3.33Å; F227-I230 VanDerWaalsContact O-N 3.17Å; I230-S232 PolarHBondContact O-N 3.49Å; I230-I233 PolarHBondContact O-N 3.41Å; I230-C234 WeakPolarHBondContact O-CB 3.34Å; I230-C234 PolarHBondContact O-N 2.67Å
231	A	95.6	Very high	91.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-63.9	-40.2	177.9	0	0	0	0	0	112.9	M120 F227 V228 H229 C234 A235 G262 G266	M120-A231 HydrophobicContact CE-CB 3.6Å; M120-A231 HydrophobicContact CG-CB 4.3Å; M120-A231 VanDerWaalsContact SD-CA 3.56Å; M120-A231 HydrophobicContact SD-CB 3.99Å; F227-A231 WeakPolarHBondContact O-CB 3.4Å; F227-A231 PolarHBondContact O-N 2.76Å; V228-A231 PolarHBondContact O-N 3.31Å; H229-A231 VanDerWaalsContact C-N 3.29Å; H229-A231 PolarHBondContact O-N 3.23Å; A231-C234 PolarHBondContact O-N 2.9Å; A231-A235 WeakPolarHBondContact O-CB 3.23Å; A231-A235 PolarHBondContact O-N 2.98Å; A231-G262 WeakPolarHBondContact CB-O 3.37Å; A231-G266 VanDerWaalsContact CB-CA 3.45Å
232	S	93.9	Very high	91	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-69.2	-36.1	176.8	-57.6	0	0	0	0	112.6	L186 V228 H229 I230 A236	L186-S232 WeakPolarHBondContact CD2-OG 3.3Å; V228-S232 PolarHBondContact O-N 3.34Å; V228-S232 PolarHBondContact O-OG 3.19Å; H229-S232 PolarHBondContact O-N 3.36Å; I230-S232 PolarHBondContact O-N 3.49Å; S232-A236 WeakPolarHBondContact O-CB 3.4Å; S232-A236 PolarHBondContact O-N 2.89Å
233	I	94.1	Very high	90.1	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-64.8	-44.8	171.4	-62.2	161.7	0	0	0	110	L199 A203 F204 H229 I230 A235 A236 V237	L199-I233 HydrophobicContact CD2-CG1 3.81Å; A203-I233 HydrophobicContact CB-CD1 4.23Å; F204-I233 HydrophobicContact CB-CB 4.48Å; F204-I233 HydrophobicContact CB-CD1 4.32Å; F204-I233 HydrophobicContact CB-CG2 3.83Å; H229-I233 WeakPolarHBondContact NE2-CD1 3.28Å; H229-I233 WeakPolarHBondContact O-CG1 3.4Å; H229-I233 PolarHBondContact O-N 3.45Å; I230-I233 PolarHBondContact O-N 3.41Å; I233-A235 VanDerWaalsContact C-N 3.35Å; I233-A235 PolarHBondContact O-N 2.71Å; I233-A236 PolarHBondContact O-N 2.76Å; I233-V237 HydrophobicContact CG2-CG2 4.06Å; I233-V237 WeakPolarHBondContact O-CB 3.28Å; I233-V237 VanDerWaalsContact O-CG2 3.31Å; I233-V237 WeakPolarHBondContact O-CG2 3.33Å; I233-V237 PolarHBondContact O-N 3.49Å
234	C	94.2	Very high	89.2	Confident	18 Å²	18	28.1 Å²	28.1	12%	0.122	14%	0.138	C	C	.	.	H	α-helix	trans	-59.8	-46.3	178.4	-170.7	0	0	0	0	111.1	L116 T119 M120 I230 A231 A236 V237 L238	L116-C234 HydrophobicContact CD1-CB 4.25Å; T119-C234 PolarHBondContact OG1-SG 3.36Å; T119-C234 VanDerWaalsContact OG1-SG 3.41Å; M120-C234 HydrophobicContact SD-CB 3.62Å; I230-C234 WeakPolarHBondContact O-CB 3.34Å; I230-C234 PolarHBondContact O-N 2.67Å; A231-C234 PolarHBondContact O-N 2.9Å; C234-A236 PolarHBondContact O-N 3.47Å; C234-V237 PolarHBondContact O-N 3.41Å; C234-L238 WeakPolarHBondContact O-CB 3.38Å; C234-L238 PolarHBondContact O-N 3.4Å
235	A	92.6	Very high	88.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.9	-44.6	175.7	0	0	0	0	0	112.2	L116 A231 I233 S239 I258	L116-A235 HydrophobicContact CD1-CB 3.94Å; L116-A235 HydrophobicContact CD2-CB 4Å; A231-A235 WeakPolarHBondContact O-CB 3.23Å; A231-A235 PolarHBondContact O-N 2.98Å; I233-A235 VanDerWaalsContact C-N 3.35Å; I233-A235 PolarHBondContact O-N 2.71Å; A235-S239 VanDerWaalsContact O-CB 3.24Å; A235-S239 WeakPolarHBondContact O-CB 3.43Å; A235-S239 PolarHBondContact O-N 3.45Å; A235-I258 HydrophobicContact CB-CG2 3.73Å
236	A	90.5	Very high	86.6	Confident	2 Å²	2	36.1 Å²	36.1	2%	0.017	18%	0.178	C	C	.	.	H	α-helix	trans	-67.1	-40.2	178	0	0	0	0	0	113.3	S232 I233 C234 R240 Y255 L259	S232-A236 WeakPolarHBondContact O-CB 3.4Å; S232-A236 PolarHBondContact O-N 2.89Å; I233-A236 PolarHBondContact O-N 2.76Å; C234-A236 PolarHBondContact O-N 3.47Å; A236-R240 WeakPolarHBondContact O-CG 3.31Å; A236-R240 PolarHBondContact O-N 3.43Å; A236-Y255 HydrophobicContact CB-CE2 4.24Å; A236-L259 HydrophobicContact CB-CD1 4.46Å
237	V	89.8	Confident	84.8	Confident	52 Å²	52	38.2 Å²	38.2	32%	0.315	20%	0.2	S	C	.	.	H	α-helix	trans	-69.4	-42.9	177.3	171.1	0	0	0	0	110.6	I233 C234 S239 R240 F241	I233-V237 HydrophobicContact CG2-CG2 4.06Å; I233-V237 WeakPolarHBondContact O-CB 3.28Å; I233-V237 VanDerWaalsContact O-CG2 3.31Å; I233-V237 WeakPolarHBondContact O-CG2 3.33Å; I233-V237 PolarHBondContact O-N 3.49Å; C234-V237 PolarHBondContact O-N 3.41Å; V237-S239 VanDerWaalsContact C-N 3.33Å; V237-S239 PolarHBondContact O-N 3.17Å; V237-R240 PolarHBondContact O-N 3.15Å; V237-F241 PolarHBondContact O-N 2.94Å
238	L	88.1	Confident	82.9	Confident	20 Å²	20	42.1 Å²	42.1	11%	0.105	22%	0.223	C	C	.	.	H	α-helix	trans	-67.2	-36.5	179.8	-171.1	68.4	0	0	0	111.6	F112 L115 L116 C234 F241 M242	F112-L238 HydrophobicContact CD2-CD2 3.76Å; F112-L238 HydrophobicContact CD2-CG 3.89Å; F112-L238 HydrophobicContact CE2-CB 3.82Å; F112-L238 HydrophobicContact CE2-CD2 3.64Å; F112-L238 HydrophobicContact CE2-CG 3.67Å; F112-L238 HydrophobicContact CZ-CD2 4.41Å; L115-L238 HydrophobicContact CB-CD2 4.08Å; L115-L238 HydrophobicContact CD2-CD1 3.34Å; L115-L238 HydrophobicContact CD2-CD2 3.99Å; L115-L238 HydrophobicContact CD2-CG 4.15Å; L115-L238 HydrophobicContact CG-CD1 3.91Å; L115-L238 HydrophobicContact CG-CD2 3.86Å; L116-L238 HydrophobicContact CB-CD2 4.03Å; C234-L238 WeakPolarHBondContact O-CB 3.38Å; C234-L238 PolarHBondContact O-N 3.4Å; L238-F241 PolarHBondContact O-N 3.04Å; L238-M242 WeakPolarHBondContact O-CG 3.37Å; L238-M242 PolarHBondContact O-N 3.29Å
239	S	85.9	Confident	81	Confident	11 Å²	11	43.4 Å²	43.4	8%	0.077	23%	0.228	C	C	.	.	H	α-helix	trans	-62.6	-43.5	174	168.4	0	0	0	0	111.6	A235 V237 F241 M242 S243 I258	A235-S239 VanDerWaalsContact O-CB 3.24Å; A235-S239 WeakPolarHBondContact O-CB 3.43Å; A235-S239 PolarHBondContact O-N 3.45Å; V237-S239 VanDerWaalsContact C-N 3.33Å; V237-S239 PolarHBondContact O-N 3.17Å; S239-F241 VanDerWaalsContact C-N 3.34Å; S239-F241 PolarHBondContact O-N 3.35Å; S239-M242 PolarHBondContact O-N 3.12Å; S239-S243 WeakPolarHBondContact O-CB 3.49Å; S239-S243 PolarHBondContact O-N 2.92Å; S239-I258 WeakPolarHBondContact OG-CD1 3.43Å
240	R	83.7	Confident	79.2	Confident	160 Å²	160	51.2 Å²	51.2	60%	0.604	26%	0.264	S	S	*	.	H	α-helix	trans	-63.8	-39.6	174.2	-72	178.4	-178.7	179.4	2.6	112.6	A236 V237 S243 I244	A236-R240 WeakPolarHBondContact O-CG 3.31Å; A236-R240 PolarHBondContact O-N 3.43Å; V237-R240 PolarHBondContact O-N 3.15Å; R240-S243 WeakPolarHBondContact O-CB 3.49Å; R240-S243 PolarHBondContact O-N 3.35Å; R240-I244 WeakPolarHBondContact O-CG1 3.37Å; R240-I244 PolarHBondContact O-N 3.09Å
241	F	81.6	Confident	77.4	Confident	109 Å²	109	56 Å²	56	48%	0.478	29%	0.29	S	S	.	.	H	α-helix	trans	-62.7	-48.2	176.1	-175.9	-98.2	0	0	0	110.5	V237 L238 S239 S243 I244 F245	V237-F241 PolarHBondContact O-N 2.94Å; L238-F241 PolarHBondContact O-N 3.04Å; S239-F241 VanDerWaalsContact C-N 3.34Å; S239-F241 PolarHBondContact O-N 3.35Å; F241-S243 VanDerWaalsContact C-N 3.32Å; F241-S243 PolarHBondContact O-N 3.33Å; F241-I244 WeakPolarHBondContact O-CB 3.41Å; F241-I244 PolarHBondContact O-N 3.4Å; F241-I244 VanDerWaalsContact O-N 3.13Å; F241-F245 HydrophobicContact CD1-CD2 4.01Å; F241-F245 AromaticContact CD1-CE2 3.8Å; F241-F245 HydrophobicContact CD1-CE2 3.8Å; F241-F245 AromaticContact CD2-CE2 3.96Å; F241-F245 HydrophobicContact CD2-CE2 3.96Å; F241-F245 AromaticContact CE1-CD2 3.82Å; F241-F245 HydrophobicContact CE1-CD2 3.82Å; F241-F245 AromaticContact CE1-CE2 3.34Å; F241-F245 HydrophobicContact CE1-CE2 3.34Å; F241-F245 HydrophobicContact CE1-CZ 4.18Å; F241-F245 AromaticContact CE2-CE2 3.53Å; F241-F245 HydrophobicContact CE2-CE2 3.53Å; F241-F245 HydrophobicContact CE2-CZ 4.11Å; F241-F245 HydrophobicContact CG-CD2 4.49Å; F241-F245 HydrophobicContact CG-CE2 4.1Å; F241-F245 HydrophobicContact CZ-CD2 4.15Å; F241-F245 AromaticContact CZ-CE2 3.2Å; F241-F245 HydrophobicContact CZ-CE2 3.2Å; F241-F245 AromaticContact CZ-CZ 3.72Å; F241-F245 HydrophobicContact CZ-CZ 3.72Å; F241-F245 WeakPolarHBondContact O-CD2 3.25Å
242	M	76.9	Confident	75.6	Confident	32 Å²	32	58.9 Å²	58.9	16%	0.158	31%	0.308	C	S	.	.	H	α-helix	trans	-65.3	-32.4	178	-71.7	-60.1	177.9	0	0	113.4	F112 L115 L238 S239 I244 F245 S246 Y249	F112-M242 HydrophobicContact CD2-CG 4.19Å; L115-M242 HydrophobicContact CD2-CE 3.4Å; L115-M242 VanDerWaalsContact CD2-CE 3.4Å; L238-M242 WeakPolarHBondContact O-CG 3.37Å; L238-M242 PolarHBondContact O-N 3.29Å; S239-M242 PolarHBondContact O-N 3.12Å; M242-I244 PolarHBondContact O-N 3.23Å; M242-F245 PolarHBondContact O-N 2.64Å; M242-S246 PolarHBondContact O-N 2.78Å; M242-Y249 HydrophobicContact CB-CD2 3.99Å; M242-Y249 HydrophobicContact CB-CE2 4.17Å
243	S	74.3	Confident	73.7	Confident	31 Å²	31	62.9 Å²	62.9	22%	0.217	32%	0.324	C	S	.	.	H	α-helix	trans	-58.2	-32.9	173	-166.7	0	0	0	0	112.7	S239 R240 F241 F245 G247	S239-S243 WeakPolarHBondContact O-CB 3.49Å; S239-S243 PolarHBondContact O-N 2.92Å; R240-S243 WeakPolarHBondContact O-CB 3.49Å; R240-S243 PolarHBondContact O-N 3.35Å; F241-S243 VanDerWaalsContact C-N 3.32Å; F241-S243 PolarHBondContact O-N 3.33Å; S243-F245 VanDerWaalsContact C-N 3.34Å; S243-G247 PolarHBondContact O-N 3.18Å; S243-G247 VanDerWaalsContact O-N 3.12Å
244	I	74.2	Confident	72.4	Confident	139 Å²	139	64 Å²	64	71%	0.713	34%	0.336	S	S	*	.	H	α-helix	trans	-70.9	-31	177.8	-62.4	165.6	0	0	0	111.3	R240 F241 M242	R240-I244 WeakPolarHBondContact O-CG1 3.37Å; R240-I244 PolarHBondContact O-N 3.09Å; F241-I244 WeakPolarHBondContact O-CB 3.41Å; F241-I244 PolarHBondContact O-N 3.4Å; F241-I244 VanDerWaalsContact O-N 3.13Å; M242-I244 PolarHBondContact O-N 3.23Å
245	F	68.4	Low	71.7	Confident	136 Å²	136	66.5 Å²	66.5	60%	0.596	34%	0.343	S	S	*	.	H	α-helix	trans	-92.6	-33.8	-177	-68.7	-79.3	0	0	0	113.9	F241 M242 S243	F241-F245 HydrophobicContact CD1-CD2 4.01Å; F241-F245 AromaticContact CD1-CE2 3.8Å; F241-F245 HydrophobicContact CD1-CE2 3.8Å; F241-F245 AromaticContact CD2-CE2 3.96Å; F241-F245 HydrophobicContact CD2-CE2 3.96Å; F241-F245 AromaticContact CE1-CD2 3.82Å; F241-F245 HydrophobicContact CE1-CD2 3.82Å; F241-F245 AromaticContact CE1-CE2 3.34Å; F241-F245 HydrophobicContact CE1-CE2 3.34Å; F241-F245 HydrophobicContact CE1-CZ 4.18Å; F241-F245 AromaticContact CE2-CE2 3.53Å; F241-F245 HydrophobicContact CE2-CE2 3.53Å; F241-F245 HydrophobicContact CE2-CZ 4.11Å; F241-F245 HydrophobicContact CG-CD2 4.49Å; F241-F245 HydrophobicContact CG-CE2 4.1Å; F241-F245 HydrophobicContact CZ-CD2 4.15Å; F241-F245 AromaticContact CZ-CE2 3.2Å; F241-F245 HydrophobicContact CZ-CE2 3.2Å; F241-F245 AromaticContact CZ-CZ 3.72Å; F241-F245 HydrophobicContact CZ-CZ 3.72Å; F241-F245 WeakPolarHBondContact O-CD2 3.25Å; M242-F245 PolarHBondContact O-N 2.64Å; S243-F245 VanDerWaalsContact C-N 3.34Å
246	S	59.7	Low	71.2	Confident	41 Å²	41	68.4 Å²	68.4	29%	0.287	36%	0.355	S	S	.	.	H	α-helix	trans	-120.7	-10	-170.2	-72.5	0	0	0	0	114.9	E108 M242 V248	E108-S246 VanDerWaalsContact CD-OG 3.25Å; E108-S246 VanDerWaalsContact OE1-CB 3.31Å; E108-S246 WeakPolarHBondContact OE1-CB 3.48Å; E108-S246 PolarHBondContact OE1-OG 3.08Å; M242-S246 PolarHBondContact O-N 2.78Å; S246-V248 WeakPolarHBondContact O-CG2 3.48Å; S246-V248 PolarHBondContact O-N 3.18Å
247	G	57.4	Low	71	Confident	45 Å²	45	69.6 Å²	69.6	46%	0.464	36%	0.361	S	S	.	.	S	Bend	trans	66.4	-22.7	178.9	0	0	0	0	0	116.3	S243 Y249	S243-G247 PolarHBondContact O-N 3.18Å; S243-G247 VanDerWaalsContact O-N 3.12Å; G247-Y249 VanDerWaalsContact C-N 3.27Å; G247-Y249 PolarHBondContact O-N 2.89Å
248	V	55.3	Low	70.9	Confident	82 Å²	82	67.7 Å²	67.7	50%	0.497	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-66.2	-19.7	-174	174.9	0	0	0	0	114.3	E108 S246	E108-V248 WeakPolarHBondContact OE2-CG2 3.23Å; S246-V248 WeakPolarHBondContact O-CG2 3.48Å; S246-V248 PolarHBondContact O-N 3.18Å
249	Y	55	Low	71	Confident	32 Å²	32	66.8 Å²	66.8	13%	0.125	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-96.8	14.5	-172	-74	-76.3	0	0	0	115.5	D109 M242 G247 N251 I258	D109-Y249 WeakPolarHBondContact CA-OH 2.97Å; D109-Y249 PolarHBondContact OD1-OH 2.81Å; M242-Y249 HydrophobicContact CB-CD2 3.99Å; M242-Y249 HydrophobicContact CB-CE2 4.17Å; G247-Y249 VanDerWaalsContact C-N 3.27Å; G247-Y249 PolarHBondContact O-N 2.89Å; Y249-N251 PolarHBondContact O-N 3.49Å; Y249-I258 HydrophobicContact CD1-CD1 3.77Å; Y249-I258 HydrophobicContact CE1-CD1 3.97Å
250	E	56.1	Low	71.2	Confident	164 Å²	164	66.6 Å²	66.6	77%	0.766	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-73.1	-15.4	-178.9	-135.4	165	-171.5	0	0	113.4	P252	E250-P252 WeakPolarHBondContact O-CD 3.22Å
251	N	58.6	Low	71.6	Confident	100 Å²	100	59.2 Å²	59.2	54%	0.535	32%	0.315	S	S	.	.			trans	-77.5	121.8	-171	-151	-15.7	0	0	0	113	Y249 Y253 G254	Y249-N251 PolarHBondContact O-N 3.49Å; N251-Y253 PolarHBondContact O-N 2.77Å; N251-Y253 VanDerWaalsContact O-N 3.14Å; N251-Y253 WeakPolarHBondContact OD1-CD2 3.27Å; N251-G254 PolarHBondContact O-N 2.78Å
252	P	56.7	Low	72.2	Confident	61 Å²	61	54 Å²	54	40%	0.396	29%	0.293	S	S	.	.	H	α-helix	trans	-58.8	-26.4	-177.7	16.2	-29.6	0	0	0	115.1	E250 G254 Y255 E818	E250-P252 WeakPolarHBondContact O-CD 3.22Å; P252-G254 VanDerWaalsContact C-N 3.27Å; P252-G254 PolarHBondContact O-N 3.48Å; P252-Y255 VanDerWaalsContact O-CB 3.31Å; P252-Y255 WeakPolarHBondContact O-CB 3.26Å; P252-Y255 PolarHBondContact O-N 3.18Å; P252-Y255 VanDerWaalsContact O-N 3.17Å; P252-E818 WeakPolarHBondContact CG-OE1 3.12Å
253	Y	55.6	Low	73	Confident	84 Å²	84	52.5 Å²	52.5	33%	0.329	29%	0.285	S	S	.	.	H	α-helix	trans	-64.3	-30.5	175.9	-61.9	-85.2	0	0	0	112.7	N251 Y255 T256 T814 E818	N251-Y253 PolarHBondContact O-N 2.77Å; N251-Y253 VanDerWaalsContact O-N 3.14Å; N251-Y253 WeakPolarHBondContact OD1-CD2 3.27Å; Y253-Y255 VanDerWaalsContact C-N 3.27Å; Y253-Y255 PolarHBondContact O-N 2.91Å; Y253-T256 PolarHBondContact O-OG1 3.26Å; Y253-T814 HydrophobicContact CD1-CG2 3.8Å; Y253-T814 HydrophobicContact CE1-CG2 3.56Å; Y253-T814 HydrophobicContact CG-CG2 4.44Å; Y253-E818 PolarHBondContact OH-OE2 3.38Å
254	G	66.8	Low	73.9	Confident	25 Å²	25	51.1 Å²	51.1	26%	0.258	28%	0.276	S	S	.	.	H	α-helix	trans	-70.2	-22.9	175.7	0	0	0	0	0	113.2	N251 P252 D257 I258	N251-G254 PolarHBondContact O-N 2.78Å; P252-G254 VanDerWaalsContact C-N 3.27Å; P252-G254 PolarHBondContact O-N 3.48Å; G254-D257 PolarHBondContact O-N 3.23Å; G254-I258 WeakPolarHBondContact O-CB 3.4Å; G254-I258 WeakPolarHBondContact O-CD1 3.43Å; G254-I258 WeakPolarHBondContact O-CG1 3.37Å; G254-I258 PolarHBondContact O-N 2.8Å
255	Y	78.5	Confident	74.9	Confident	70 Å²	70	44.5 Å²	44.5	28%	0.275	24%	0.242	S	C	.	.	H	α-helix	trans	-64.4	-49.2	-173.7	-171.4	-105.3	0	0	0	112.3	L199 A236 P252 Y253 D257 I258 L259	L199-Y255 HydrophobicContact CD1-CE1 4.46Å; L199-Y255 WeakPolarHBondContact CD1-OH 3.22Å; A236-Y255 HydrophobicContact CB-CE2 4.24Å; P252-Y255 VanDerWaalsContact O-CB 3.31Å; P252-Y255 WeakPolarHBondContact O-CB 3.26Å; P252-Y255 PolarHBondContact O-N 3.18Å; P252-Y255 VanDerWaalsContact O-N 3.17Å; Y253-Y255 VanDerWaalsContact C-N 3.27Å; Y253-Y255 PolarHBondContact O-N 2.91Å; Y255-D257 VanDerWaalsContact C-N 3.34Å; Y255-D257 PolarHBondContact O-N 3.11Å; Y255-I258 PolarHBondContact O-N 2.82Å; Y255-L259 HydrophobicContact CD1-CD1 3.84Å; Y255-L259 HydrophobicContact CD2-CD1 3.99Å; Y255-L259 HydrophobicContact CE1-CD1 3.61Å; Y255-L259 HydrophobicContact CE1-CD2 4.04Å; Y255-L259 HydrophobicContact CE2-CD1 3.75Å; Y255-L259 HydrophobicContact CG-CD1 4.03Å; Y255-L259 WeakPolarHBondContact O-CD1 3.03Å; Y255-L259 PolarHBondContact O-N 3.33Å
256	T	82.1	Confident	76.2	Confident	41 Å²	41	38 Å²	38	25%	0.252	21%	0.213	S	C	.	.	H	α-helix	trans	-66.9	-36	178.4	45.2	0	0	0	0	112.3	Y253 L259 T260	Y253-T256 PolarHBondContact O-OG1 3.26Å; T256-L259 PolarHBondContact O-N 2.79Å; T256-T260 WeakPolarHBondContact O-CB 3.26Å; T256-T260 PolarHBondContact O-N 2.73Å; T256-T260 PolarHBondContact O-OG1 3.09Å
257	D	85.8	Confident	77.8	Confident	26 Å²	26	36.2 Å²	36.2	14%	0.139	20%	0.201	C	C	.	.	H	α-helix	trans	-61.2	-47.3	175.7	-77.3	1.7	0	0	0	110.6	G254 Y255 T260 V261 R292 N293	G254-D257 PolarHBondContact O-N 3.23Å; Y255-D257 VanDerWaalsContact C-N 3.34Å; Y255-D257 PolarHBondContact O-N 3.11Å; D257-T260 WeakPolarHBondContact O-CB 3.06Å; D257-T260 PolarHBondContact O-N 2.96Å; D257-V261 WeakPolarHBondContact O-CG2 3.48Å; D257-V261 PolarHBondContact O-N 2.68Å; D257-R292 IonicContact OD2-CZ 2.96Å; D257-R292 IonicContact OD2-NH2 3.52Å; D257-R292 PolarHBondContact OD2-NH2 3.42Å; D257-N293 WeakPolarHBondContact CB-OD1 3.42Å; D257-N293 VanDerWaalsContact CG-OD1 3.28Å; D257-N293 PolarHBondContact OD1-ND2 3Å; D257-N293 PolarHBondContact OD2-OD1 3.34Å
258	I	88.4	Confident	79.4	Confident	13 Å²	13	34.1 Å²	34.1	7%	0.067	18%	0.179	C	C	.	.	H	α-helix	trans	-65.7	-41.3	179.5	-68.8	164.4	0	0	0	111.6	F112 A235 S239 Y249 G254 Y255 T260 V261 G262	F112-I258 HydrophobicContact CE1-CG1 4.37Å; F112-I258 HydrophobicContact CE1-CG2 4.02Å; F112-I258 HydrophobicContact CZ-CG2 3.61Å; A235-I258 HydrophobicContact CB-CG2 3.73Å; S239-I258 WeakPolarHBondContact OG-CD1 3.43Å; Y249-I258 HydrophobicContact CD1-CD1 3.77Å; Y249-I258 HydrophobicContact CE1-CD1 3.97Å; G254-I258 WeakPolarHBondContact O-CB 3.4Å; G254-I258 WeakPolarHBondContact O-CD1 3.43Å; G254-I258 WeakPolarHBondContact O-CG1 3.37Å; G254-I258 PolarHBondContact O-N 2.8Å; Y255-I258 PolarHBondContact O-N 2.82Å; I258-T260 VanDerWaalsContact C-N 3.3Å; I258-T260 PolarHBondContact O-N 3.37Å; I258-V261 PolarHBondContact O-N 3.2Å; I258-G262 PolarHBondContact O-N 3.35Å
259	L	89.7	Confident	81.2	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.1	-40.7	174.9	-91.8	74	0	0	0	111.3	L186 I189 L190 L199 A236 Y255 T256 G262 C263	L186-L259 HydrophobicContact CD1-CD2 4.09Å; I189-L259 HydrophobicContact CG2-CD2 3.66Å; L190-L259 HydrophobicContact CD2-CB 3.91Å; L199-L259 HydrophobicContact CD1-CD2 3.72Å; L199-L259 HydrophobicContact CD1-CG 4.43Å; A236-L259 HydrophobicContact CB-CD1 4.46Å; Y255-L259 HydrophobicContact CD1-CD1 3.84Å; Y255-L259 HydrophobicContact CD2-CD1 3.99Å; Y255-L259 HydrophobicContact CE1-CD1 3.61Å; Y255-L259 HydrophobicContact CE1-CD2 4.04Å; Y255-L259 HydrophobicContact CE2-CD1 3.75Å; Y255-L259 HydrophobicContact CG-CD1 4.03Å; Y255-L259 WeakPolarHBondContact O-CD1 3.03Å; Y255-L259 PolarHBondContact O-N 3.33Å; T256-L259 PolarHBondContact O-N 2.79Å; L259-G262 CarbonylContact O-C 3.59Å; L259-G262 PolarHBondContact O-N 2.65Å; L259-C263 PolarHBondContact O-N 3.39Å; L259-C263 PolarHBondContact O-SG 3.33Å
260	T	90.2	Very high	82.9	Confident	8 Å²	8	28.7 Å²	28.7	5%	0.049	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-42.7	178.5	-58.9	0	0	0	0	111.6	L190 T256 D257 I258 C263 A264 F289	L190-T260 WeakPolarHBondContact CD2-OG1 3.25Å; T256-T260 WeakPolarHBondContact O-CB 3.26Å; T256-T260 PolarHBondContact O-N 2.73Å; T256-T260 PolarHBondContact O-OG1 3.09Å; D257-T260 WeakPolarHBondContact O-CB 3.06Å; D257-T260 PolarHBondContact O-N 2.96Å; I258-T260 VanDerWaalsContact C-N 3.3Å; I258-T260 PolarHBondContact O-N 3.37Å; T260-C263 WeakPolarHBondContact O-CB 3.39Å; T260-C263 PolarHBondContact O-N 3.01Å; T260-A264 PolarHBondContact O-N 3.44Å; T260-F289 HydrophobicContact CG2-CD2 3.79Å; T260-F289 HydrophobicContact CG2-CE2 3.01Å; T260-F289 HydrophobicContact CG2-CZ 3.51Å
261	V	92.5	Very high	84.4	Confident	4 Å²	4	21.1 Å²	21.1	2%	0.024	11%	0.114	C	C	.	.	H	α-helix	trans	-62.1	-45.6	171.6	170.6	0	0	0	0	110.6	L113 L116 D257 I258 C263 A264 V265 R296 A300	L113-V261 HydrophobicContact CD2-CG1 3.55Å; L116-V261 HydrophobicContact CD2-CG1 4.04Å; D257-V261 WeakPolarHBondContact O-CG2 3.48Å; D257-V261 PolarHBondContact O-N 2.68Å; I258-V261 PolarHBondContact O-N 3.2Å; V261-C263 VanDerWaalsContact C-N 3.28Å; V261-C263 PolarHBondContact O-N 3.27Å; V261-A264 PolarHBondContact O-N 3.47Å; V261-A264 VanDerWaalsContact O-N 3.13Å; V261-V265 HydrophobicContact CG1-CG2 4.27Å; V261-V265 WeakPolarHBondContact O-CG2 3.47Å; V261-V265 PolarHBondContact O-N 2.97Å; V261-R296 HydrophobicContact CG2-CB 3.79Å; V261-A300 HydrophobicContact CG1-CB 4.34Å
262	G	94	Very high	85.8	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-56.7	-39.7	175.2	0	0	0	0	0	112.9	A231 I258 L259 G266	A231-G262 WeakPolarHBondContact CB-O 3.37Å; I258-G262 PolarHBondContact O-N 3.35Å; L259-G262 CarbonylContact O-C 3.59Å; L259-G262 PolarHBondContact O-N 2.65Å; G262-G266 PolarHBondContact O-N 3.49Å
263	C	93.3	Very high	87.5	Confident	1 Å²	1	13.9 Å²	13.9	1%	0.007	7%	0.074	C	C	.	.	H	α-helix	trans	-59.8	-49.8	174.1	-62.3	0	0	0	0	111.7	L186 V228 L259 T260 V261 G266 V267 S281 T285	L186-C263 WeakPolarHBondContact CD2-SG 3.45Å; V228-C263 HydrophobicContact CG1-CB 3.98Å; L259-C263 PolarHBondContact O-N 3.39Å; L259-C263 PolarHBondContact O-SG 3.33Å; T260-C263 WeakPolarHBondContact O-CB 3.39Å; T260-C263 PolarHBondContact O-N 3.01Å; V261-C263 VanDerWaalsContact C-N 3.28Å; V261-C263 PolarHBondContact O-N 3.27Å; C263-G266 PolarHBondContact O-N 3.17Å; C263-V267 WeakPolarHBondContact O-CG2 3.45Å; C263-V267 PolarHBondContact O-N 2.94Å; C263-V267 VanDerWaalsContact O-N 3.15Å; C263-S281 WeakPolarHBondContact CB-OG 3.36Å; C263-T285 HydrophobicContact CB-CG2 4.19Å
264	A	93.9	Very high	89.3	Confident	1 Å²	1	11 Å²	11	1%	0.008	7%	0.065	C	C	.	.	H	α-helix	trans	-62.8	-44.4	-179	0	0	0	0	0	112.1	T260 V261 G266 V267 G268 V278 S281	T260-A264 PolarHBondContact O-N 3.44Å; V261-A264 PolarHBondContact O-N 3.47Å; V261-A264 VanDerWaalsContact O-N 3.13Å; A264-G266 VanDerWaalsContact C-N 3.34Å; A264-G266 PolarHBondContact O-N 3.46Å; A264-V267 PolarHBondContact O-N 3.48Å; A264-G268 PolarHBondContact O-N 2.87Å; A264-V278 HydrophobicContact CB-CB 4.42Å; A264-V278 HydrophobicContact CB-CG2 4.01Å; A264-S281 PolarHBondContact N-OG 3.18Å
265	V	95.8	Very high	90.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-62.4	-41.5	175.8	176.6	0	0	0	0	111	L116 M120 V261 G268 C269 A300	L116-V265 HydrophobicContact CD2-CG2 4.26Å; M120-V265 HydrophobicContact CB-CG1 3.88Å; M120-V265 HydrophobicContact CG-CG1 3.91Å; V261-V265 HydrophobicContact CG1-CG2 4.27Å; V261-V265 WeakPolarHBondContact O-CG2 3.47Å; V261-V265 PolarHBondContact O-N 2.97Å; V265-G268 PolarHBondContact O-N 3.43Å; V265-C269 WeakPolarHBondContact O-CB 3.39Å; V265-C269 PolarHBondContact O-N 3.26Å; V265-A300 HydrophobicContact CG2-CB 3.31Å
266	G	94.7	Very high	91.3	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-58.5	-51.4	178.3	0	0	0	0	0	112.4	F227 A231 G262 C263 A264 C270	F227-G266 VanDerWaalsContact CD1-O 3.31Å; F227-G266 WeakPolarHBondContact CD1-O 3.4Å; A231-G266 VanDerWaalsContact CB-CA 3.45Å; G262-G266 PolarHBondContact O-N 3.49Å; C263-G266 PolarHBondContact O-N 3.17Å; A264-G266 VanDerWaalsContact C-N 3.34Å; A264-G266 PolarHBondContact O-N 3.46Å; G266-C270 PolarHBondContact O-N 3.2Å; G266-C270 VanDerWaalsContact O-N 3.12Å; G266-C270 PolarHBondContact O-SG 3.2Å
267	V	92.6	Very high	91.8	Very high	4 Å²	4	7.3 Å²	7.3	2%	0.024	4%	0.043	C	C	.	.	H	α-helix	trans	-67	-45.8	179	-173.3	0	0	0	0	110.9	V228 C263 A264 C269 C270 F271 F280 I539	V228-V267 HydrophobicContact CG2-CG2 3.42Å; V228-V267 VanDerWaalsContact CG2-CG2 3.42Å; C263-V267 WeakPolarHBondContact O-CG2 3.45Å; C263-V267 PolarHBondContact O-N 2.94Å; C263-V267 VanDerWaalsContact O-N 3.15Å; A264-V267 PolarHBondContact O-N 3.48Å; V267-C269 PolarHBondContact O-N 2.96Å; V267-C270 PolarHBondContact O-N 3.34Å; V267-F271 HydrophobicContact CG1-CD2 3.85Å; V267-F271 HydrophobicContact CG1-CE2 3.81Å; V267-F271 WeakPolarHBondContact O-CD2 3.49Å; V267-F271 PolarHBondContact O-N 2.93Å; V267-F280 HydrophobicContact CG1-CB 4.26Å; V267-F280 HydrophobicContact CG1-CD1 3.99Å; V267-F280 HydrophobicContact CG1-CG 4.28Å; V267-F280 HydrophobicContact CG2-CD1 3.8Å; V267-F280 HydrophobicContact CG2-CE1 4.27Å; V267-I539 HydrophobicContact CG1-CD1 4.29Å
268	G	92.7	Very high	92.2	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-62.7	-39.8	-178.9	0	0	0	0	0	113.1	A264 V265 G272 T273	A264-G268 PolarHBondContact O-N 2.87Å; V265-G268 PolarHBondContact O-N 3.43Å; G268-G272 CarbonylContact O-C 3.45Å; G268-G272 WeakPolarHBondContact O-CA 3.24Å; G268-G272 PolarHBondContact O-N 3.48Å; G268-T273 WeakPolarHBondContact CA-O 3.28Å; G268-T273 PolarHBondContact O-N 3.03Å
269	C	92.8	Very high	92.5	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-69.2	-39.5	176.5	-179.2	0	0	0	0	112.4	M120 S124 F227 V265 V267 F271 G272 S304	M120-C269 PolarHBondContact O-SG 2.94Å; S124-C269 WeakPolarHBondContact CB-SG 3.27Å; F227-C269 HydrophobicContact CE1-CB 3.99Å; V265-C269 WeakPolarHBondContact O-CB 3.39Å; V265-C269 PolarHBondContact O-N 3.26Å; V267-C269 PolarHBondContact O-N 2.96Å; C269-F271 PolarHBondContact O-N 3.21Å; C269-G272 PolarHBondContact O-N 3.1Å; C269-S304 WeakPolarHBondContact CB-OG 3.4Å; C269-S304 PolarHBondContact SG-OG 2.99Å; C269-S304 VanDerWaalsContact SG-OG 3.34Å
270	C	89.7	Confident	92.6	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.007	5%	0.049	C	C	.	.	H	α-helix	trans	-61.2	-48	-176.7	-91.6	0	0	0	0	113.6	K223 E224 F227 G266 V267	K223-C270 WeakPolarHBondContact CE-O 3.12Å; K223-C270 PolarHBondContact NZ-O 2.88Å; E224-C270 WeakPolarHBondContact OE2-CB 2.97Å; E224-C270 PolarHBondContact OE2-SG 3.45Å; F227-C270 WeakPolarHBondContact CB-SG 3.41Å; F227-C270 WeakPolarHBondContact CD1-SG 3.49Å; F227-C270 WeakPolarHBondContact CG-SG 3.23Å; G266-C270 PolarHBondContact O-N 3.2Å; G266-C270 VanDerWaalsContact O-N 3.12Å; G266-C270 PolarHBondContact O-SG 3.2Å; V267-C270 PolarHBondContact O-N 3.34Å
271	F	87.4	Confident	92.7	Very high	4 Å²	4	8.3 Å²	8.3	2%	0.018	5%	0.048	C	C	.	.	H	α-helix	trans	-89.9	-17.5	-178	-63.8	-59.9	0	0	0	111.8	E224 V267 C269 T273 F478 M479 I539 L543	E224-F271 HydrophobicContact CB-CZ 4.16Å; E224-F271 HydrophobicContact CG-CE1 3.68Å; E224-F271 HydrophobicContact CG-CE2 4.17Å; E224-F271 HydrophobicContact CG-CZ 3.35Å; E224-F271 WeakPolarHBondContact OE1-CE1 3.37Å; E224-F271 VanDerWaalsContact OE2-CE2 3.26Å; E224-F271 WeakPolarHBondContact OE2-CE2 3.41Å; E224-F271 WeakPolarHBondContact OE2-CZ 3.48Å; V267-F271 HydrophobicContact CG1-CD2 3.85Å; V267-F271 HydrophobicContact CG1-CE2 3.81Å; V267-F271 WeakPolarHBondContact O-CD2 3.49Å; V267-F271 PolarHBondContact O-N 2.93Å; C269-F271 PolarHBondContact O-N 3.21Å; F271-T273 VanDerWaalsContact C-N 3.31Å; F271-T273 HydrophobicContact CB-CG2 3.73Å; F271-T273 WeakPolarHBondContact CB-OG1 3.31Å; F271-F478 AromaticContact CE1-CD1 3.86Å; F271-F478 HydrophobicContact CE1-CD1 3.86Å; F271-F478 AromaticContact CE1-CE1 3.67Å; F271-F478 HydrophobicContact CE1-CE1 3.67Å; F271-F478 HydrophobicContact CE1-CZ 4.43Å; F271-F478 HydrophobicContact CE2-CE1 4.18Å; F271-F478 HydrophobicContact CE2-CZ 4.2Å; F271-F478 AromaticContact CZ-CD1 3.41Å; F271-F478 HydrophobicContact CZ-CD1 3.41Å; F271-F478 VanDerWaalsContact CZ-CD1 3.41Å; F271-F478 HydrophobicContact CZ-CD2 4.36Å; F271-F478 AromaticContact CZ-CE1 3.25Å; F271-F478 HydrophobicContact CZ-CE1 3.25Å; F271-F478 HydrophobicContact CZ-CE2 4.23Å; F271-F478 AromaticContact CZ-CG 3.98Å; F271-F478 HydrophobicContact CZ-CG 3.98Å; F271-F478 AromaticContact CZ-CZ 3.69Å; F271-F478 HydrophobicContact CZ-CZ 3.69Å; F271-M479 HydrophobicContact CE1-CE 4.37Å; F271-I539 HydrophobicContact CB-CG2 4.27Å; F271-I539 HydrophobicContact CD1-CG2 4.26Å; F271-I539 HydrophobicContact CD2-CD1 4.35Å; F271-I539 HydrophobicContact CD2-CG2 3.79Å; F271-I539 HydrophobicContact CE2-CD1 4.15Å; F271-I539 HydrophobicContact CE2-CG2 4.09Å; F271-I539 HydrophobicContact CG-CG2 3.87Å; F271-I539 HydrophobicContact CZ-CG2 4.44Å; F271-L543 HydrophobicContact CB-CD2 3.85Å; F271-L543 HydrophobicContact CB-CG 4.32Å; F271-L543 HydrophobicContact CD1-CD1 3.95Å; F271-L543 HydrophobicContact CD1-CD2 4.28Å; F271-L543 HydrophobicContact CG-CD1 4.47Å; F271-L543 WeakPolarHBondContact O-CD2 3.23Å
272	G	89.3	Confident	92.5	Very high	10 Å²	10	10.2 Å²	10.2	10%	0.103	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	37.1	-167.8	0	0	0	0	0	111.4	G268 C269	G268-G272 CarbonylContact O-C 3.45Å; G268-G272 WeakPolarHBondContact O-CA 3.24Å; G268-G272 PolarHBondContact O-N 3.48Å; C269-G272 PolarHBondContact O-N 3.1Å
273	T	91.5	Very high	92.4	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.076	C	C	.	.			trans	-127.7	85	-173.9	62.2	0	0	0	0	110	G268 F271 G277 I539 E542 L543	G268-T273 WeakPolarHBondContact CA-O 3.28Å; G268-T273 PolarHBondContact O-N 3.03Å; F271-T273 VanDerWaalsContact C-N 3.31Å; F271-T273 HydrophobicContact CB-CG2 3.73Å; F271-T273 WeakPolarHBondContact CB-OG1 3.31Å; T273-G277 PolarHBondContact O-N 2.88Å; T273-I539 HydrophobicContact CG2-CG2 4.45Å; T273-E542 WeakPolarHBondContact CA-OE2 3.36Å; T273-E542 WeakPolarHBondContact CB-OE2 3.37Å; T273-E542 HydrophobicContact CG2-CB 3.36Å; T273-L543 HydrophobicContact CG2-CD2 3.92Å; T273-L543 HydrophobicContact CG2-CG 3.77Å
274	P	94.4	Very high	91.9	Very high	22 Å²	22	14.5 Å²	14.5	14%	0.143	8%	0.078	C	C	.	.	H	α-helix	trans	-66.7	-41	-172.7	26	-33.1	0	0	0	113.5	V278 Y298 A301 T302	P274-V278 VanDerWaalsContact O-CG2 3.24Å; P274-V278 WeakPolarHBondContact O-CG2 3.43Å; P274-V278 PolarHBondContact O-N 3.35Å; P274-Y298 HydrophobicContact CB-CE2 4.33Å; P274-A301 HydrophobicContact CB-CB 4.1Å; P274-T302 HydrophobicContact CB-CG2 3.49Å; P274-T302 VanDerWaalsContact CB-CG2 3.49Å; P274-T302 HydrophobicContact CG-CG2 3.78Å
275	L	93.8	Very high	91.1	Very high	59 Å²	59	14.8 Å²	14.8	31%	0.309	8%	0.079	S	C	.	.	H	α-helix	trans	-69.4	-47.9	179	-65.6	167.9	0	0	0	110.2	G277 V278 L279 Y298 V538 E542	L275-G277 VanDerWaalsContact C-N 3.29Å; L275-G277 PolarHBondContact O-N 3.29Å; L275-V278 PolarHBondContact O-N 3.46Å; L275-L279 WeakPolarHBondContact O-CG 3.29Å; L275-L279 PolarHBondContact O-N 3.5Å; L275-L279 VanDerWaalsContact O-N 3.14Å; L275-Y298 HydrophobicContact CD2-CD2 3.9Å; L275-Y298 HydrophobicContact CD2-CE2 3.2Å; L275-Y298 HydrophobicContact CG-CE2 3.76Å; L275-V538 HydrophobicContact CB-CG1 4.21Å; L275-E542 WeakPolarHBondContact CB-OE1 3.34Å; L275-E542 WeakPolarHBondContact CD1-OE1 3.39Å; L275-E542 WeakPolarHBondContact CG-OE1 3.38Å; L275-E542 PolarHBondContact N-OE1 3.26Å; L275-E542 PolarHBondContact N-OE2 3.24Å
276	G	92.6	Very high	89.8	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.7	-40.2	178.9	0	0	0	0	0	112.5	F280 V538 E542	G276-F280 VanDerWaalsContact O-CB 3.24Å; G276-F280 WeakPolarHBondContact O-CB 3.16Å; G276-F280 PolarHBondContact O-N 3.25Å; G276-V538 VanDerWaalsContact CA-CG1 3.5Å; G276-E542 PolarHBondContact N-OE2 3.17Å
277	G	92.4	Very high	88.5	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-68.3	-40.1	-178.5	0	0	0	0	0	114.1	T273 L275 S281	T273-G277 PolarHBondContact O-N 2.88Å; L275-G277 VanDerWaalsContact C-N 3.29Å; L275-G277 PolarHBondContact O-N 3.29Å; G277-S281 WeakPolarHBondContact O-CB 3.23Å; G277-S281 PolarHBondContact O-N 3.37Å
278	V	94.3	Very high	87.7	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-68.8	-45.1	177	179.1	0	0	0	0	110.7	A264 P274 L275 F280 S281 I282 Y294 Y298 A301	A264-V278 HydrophobicContact CB-CB 4.42Å; A264-V278 HydrophobicContact CB-CG2 4.01Å; P274-V278 VanDerWaalsContact O-CG2 3.24Å; P274-V278 WeakPolarHBondContact O-CG2 3.43Å; P274-V278 PolarHBondContact O-N 3.35Å; L275-V278 PolarHBondContact O-N 3.46Å; V278-F280 VanDerWaalsContact C-N 3.34Å; V278-F280 PolarHBondContact O-N 2.9Å; V278-S281 WeakPolarHBondContact O-CB 3.36Å; V278-S281 PolarHBondContact O-N 2.91Å; V278-I282 HydrophobicContact CG1-CD1 4.17Å; V278-I282 WeakPolarHBondContact O-CG1 3.41Å; V278-I282 PolarHBondContact O-N 2.83Å; V278-Y294 HydrophobicContact CG1-CD2 3.41Å; V278-Y294 VanDerWaalsContact CG1-CD2 3.41Å; V278-Y294 HydrophobicContact CG1-CE2 3.65Å; V278-Y294 HydrophobicContact CG1-CG 4.4Å; V278-Y298 HydrophobicContact CG2-CD2 4.39Å; V278-A301 HydrophobicContact CG2-CB 4.29Å
279	L	94.3	Very high	87	Confident	58 Å²	58	28.3 Å²	28.3	30%	0.304	15%	0.146	S	C	.	.	H	α-helix	trans	-62.7	-41.9	177.6	-68.4	176.9	0	0	0	111.7	L275 S281 I282 E283 V538	L275-L279 WeakPolarHBondContact O-CG 3.29Å; L275-L279 PolarHBondContact O-N 3.5Å; L275-L279 VanDerWaalsContact O-N 3.14Å; L279-S281 VanDerWaalsContact C-N 3.32Å; L279-S281 PolarHBondContact O-N 2.95Å; L279-I282 HydrophobicContact CD2-CD1 4.41Å; L279-I282 WeakPolarHBondContact O-CB 3.46Å; L279-I282 PolarHBondContact O-N 2.89Å; L279-E283 WeakPolarHBondContact O-CG 3.48Å; L279-E283 PolarHBondContact O-N 3.23Å; L279-V538 HydrophobicContact CD1-CB 4.39Å; L279-V538 HydrophobicContact CD1-CG1 4.08Å; L279-V538 HydrophobicContact CD1-CG2 3.98Å
280	F	92.9	Very high	86.6	Confident	8 Å²	8	30.5 Å²	30.5	4%	0.035	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-40	174.7	-175.8	-87.2	0	0	0	112.2	V267 G276 V278 I282 E283 V284 F478 T531 T533 S535 I539 Y572	V267-F280 HydrophobicContact CG1-CB 4.26Å; V267-F280 HydrophobicContact CG1-CD1 3.99Å; V267-F280 HydrophobicContact CG1-CG 4.28Å; V267-F280 HydrophobicContact CG2-CD1 3.8Å; V267-F280 HydrophobicContact CG2-CE1 4.27Å; G276-F280 VanDerWaalsContact O-CB 3.24Å; G276-F280 WeakPolarHBondContact O-CB 3.16Å; G276-F280 PolarHBondContact O-N 3.25Å; V278-F280 VanDerWaalsContact C-N 3.34Å; V278-F280 PolarHBondContact O-N 2.9Å; F280-I282 VanDerWaalsContact C-N 3.33Å; F280-I282 PolarHBondContact O-N 3.44Å; F280-E283 PolarHBondContact O-N 2.74Å; F280-V284 HydrophobicContact CD1-CG2 4.05Å; F280-V284 HydrophobicContact CD2-CG2 4.22Å; F280-V284 HydrophobicContact CE1-CB 4.37Å; F280-V284 HydrophobicContact CE1-CG2 3.73Å; F280-V284 HydrophobicContact CE2-CG2 3.89Å; F280-V284 HydrophobicContact CG-CG2 4.31Å; F280-V284 HydrophobicContact CZ-CG2 3.65Å; F280-V284 WeakPolarHBondContact O-CB 3.5Å; F280-V284 WeakPolarHBondContact O-CG2 3.3Å; F280-V284 PolarHBondContact O-N 2.85Å; F280-F478 HydrophobicContact CE2-CD2 4.35Å; F280-F478 AromaticContact CE2-CE2 3.99Å; F280-F478 HydrophobicContact CE2-CE2 3.99Å; F280-F478 HydrophobicContact CZ-CD2 4.43Å; F280-F478 HydrophobicContact CZ-CE2 4.47Å; F280-T531 HydrophobicContact CE2-CG2 4.34Å; F280-T533 HydrophobicContact CD2-CG2 4.29Å; F280-T533 HydrophobicContact CE2-CG2 4.22Å; F280-S535 VanDerWaalsContact CA-OG 3.23Å; F280-S535 WeakPolarHBondContact CA-OG 3.26Å; F280-S535 WeakPolarHBondContact CB-OG 3.27Å; F280-S535 WeakPolarHBondContact CD2-OG 3.19Å; F280-I539 HydrophobicContact CB-CD1 3.93Å; F280-I539 HydrophobicContact CD2-CD1 4.04Å; F280-I539 HydrophobicContact CG-CD1 4.13Å; F280-Y572 HydrophobicContact CZ-CE2 4.26Å
281	S	91.1	Very high	86.5	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-59.5	-45	173.6	-173.7	0	0	0	0	111.2	C263 A264 G277 V278 L279 T285	C263-S281 WeakPolarHBondContact CB-OG 3.36Å; A264-S281 PolarHBondContact N-OG 3.18Å; G277-S281 WeakPolarHBondContact O-CB 3.23Å; G277-S281 PolarHBondContact O-N 3.37Å; V278-S281 WeakPolarHBondContact O-CB 3.36Å; V278-S281 PolarHBondContact O-N 2.91Å; L279-S281 VanDerWaalsContact C-N 3.32Å; L279-S281 PolarHBondContact O-N 2.95Å; S281-T285 VanDerWaalsContact O-CB 3.22Å; S281-T285 WeakPolarHBondContact O-CB 3.3Å; S281-T285 VanDerWaalsContact O-CG2 3.26Å; S281-T285 WeakPolarHBondContact O-CG2 3.5Å; S281-T285 PolarHBondContact O-N 3.12Å; S281-T285 PolarHBondContact O-OG1 3.49Å
282	I	90.1	Very high	86.5	Confident	44 Å²	44	42 Å²	42	23%	0.226	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-52.7	177.3	-67	164.2	0	0	0	110.7	V278 L279 F280 V284 F289 Y294	V278-I282 HydrophobicContact CG1-CD1 4.17Å; V278-I282 WeakPolarHBondContact O-CG1 3.41Å; V278-I282 PolarHBondContact O-N 2.83Å; L279-I282 HydrophobicContact CD2-CD1 4.41Å; L279-I282 WeakPolarHBondContact O-CB 3.46Å; L279-I282 PolarHBondContact O-N 2.89Å; F280-I282 VanDerWaalsContact C-N 3.33Å; F280-I282 PolarHBondContact O-N 3.44Å; I282-V284 PolarHBondContact O-N 2.97Å; I282-F289 HydrophobicContact CB-CD2 4.24Å; I282-F289 HydrophobicContact CB-CE2 4.39Å; I282-F289 HydrophobicContact CD1-CD1 4.15Å; I282-F289 HydrophobicContact CD1-CE1 4.06Å; I282-F289 HydrophobicContact CD1-CG 4.47Å; I282-F289 HydrophobicContact CD1-CZ 4.29Å; I282-F289 HydrophobicContact CG1-CD1 3.85Å; I282-F289 HydrophobicContact CG1-CD2 3.59Å; I282-F289 HydrophobicContact CG1-CE1 3.79Å; I282-F289 HydrophobicContact CG1-CE2 3.48Å; I282-F289 VanDerWaalsContact CG1-CE2 3.48Å; I282-F289 HydrophobicContact CG1-CG 3.75Å; I282-F289 HydrophobicContact CG1-CZ 3.63Å; I282-F289 HydrophobicContact CG2-CB 4.29Å; I282-F289 HydrophobicContact CG2-CD2 4.4Å; I282-F289 HydrophobicContact CG2-CG 4.35Å; I282-Y294 HydrophobicContact CD1-CD2 3.72Å; I282-Y294 HydrophobicContact CD1-CE2 4.28Å
283	E	90.1	Very high	86.5	Confident	83 Å²	83	41.8 Å²	41.8	39%	0.388	22%	0.215	S	C	.	.	H	α-helix	trans	-65.4	-37.1	-174	-69.7	175.2	-175.8	0	0	112.9	L279 F280 T533 V534 S535	L279-E283 WeakPolarHBondContact O-CG 3.48Å; L279-E283 PolarHBondContact O-N 3.23Å; F280-E283 PolarHBondContact O-N 2.74Å; E283-T533 HydrophobicContact CB-CG2 3.84Å; E283-T533 WeakPolarHBondContact OE2-CA 3.4Å; E283-T533 WeakPolarHBondContact OE2-CB 3.29Å; E283-T533 WeakPolarHBondContact OE2-CG2 3.36Å; E283-V534 PolarHBondContact OE2-N 2.98Å; E283-S535 PolarHBondContact OE1-N 2.93Å; E283-S535 VanDerWaalsContact OE1-N 3.13Å; E283-S535 VanDerWaalsContact OE2-CB 3.27Å; E283-S535 WeakPolarHBondContact OE2-CB 3.36Å; E283-S535 PolarHBondContact OE2-N 3.36Å; E283-S535 PolarHBondContact OE2-OG 3.21Å
284	V	84.1	Confident	86.5	Confident	8 Å²	8	44.9 Å²	44.9	5%	0.048	23%	0.227	C	C	.	.	H	α-helix	trans	-88	-34.7	-174.5	178	0	0	0	0	113	I183 K187 F280 I282 T533 Y572	I183-V284 HydrophobicContact CG2-CG1 3.6Å; K187-V284 WeakPolarHBondContact CD-O 3.45Å; K187-V284 VanDerWaalsContact CE-O 3.25Å; K187-V284 WeakPolarHBondContact CE-O 3.35Å; F280-V284 HydrophobicContact CD1-CG2 4.05Å; F280-V284 HydrophobicContact CD2-CG2 4.22Å; F280-V284 HydrophobicContact CE1-CB 4.37Å; F280-V284 HydrophobicContact CE1-CG2 3.73Å; F280-V284 HydrophobicContact CE2-CG2 3.89Å; F280-V284 HydrophobicContact CG-CG2 4.31Å; F280-V284 HydrophobicContact CZ-CG2 3.65Å; F280-V284 WeakPolarHBondContact O-CB 3.5Å; F280-V284 WeakPolarHBondContact O-CG2 3.3Å; F280-V284 PolarHBondContact O-N 2.85Å; I282-V284 PolarHBondContact O-N 2.97Å; V284-T533 HydrophobicContact CG2-CG2 3.46Å; V284-T533 VanDerWaalsContact CG2-CG2 3.46Å; V284-Y572 HydrophobicContact CG1-CD2 3.97Å; V284-Y572 HydrophobicContact CG1-CE2 4.21Å
285	T	75.8	Confident	86.4	Confident	6 Å²	6	51 Å²	51	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-93.7	-38.2	-164.4	68.1	0	0	0	0	114.7	L190 C263 S281	L190-T285 HydrophobicContact CD1-CG2 3.91Å; C263-T285 HydrophobicContact CB-CG2 4.19Å; S281-T285 VanDerWaalsContact O-CB 3.22Å; S281-T285 WeakPolarHBondContact O-CB 3.3Å; S281-T285 VanDerWaalsContact O-CG2 3.26Å; S281-T285 WeakPolarHBondContact O-CG2 3.5Å; S281-T285 PolarHBondContact O-N 3.12Å; S281-T285 PolarHBondContact O-OG1 3.49Å
286	S	69.3	Low	86.3	Confident	29 Å²	29	50.7 Å²	50.7	20%	0.203	24%	0.242	C	C	.	.			trans	-142.2	143.5	-164.5	-55.8	0	0	0	0	112.6	Y288	S286-Y288 VanDerWaalsContact CB-O 3.29Å; S286-Y288 WeakPolarHBondContact CB-O 3.36Å
287	T	68.2	Low	86.3	Confident	87 Å²	87	50.7 Å²	50.7	53%	0.534	24%	0.242	S	C	.	.	S	Bend	trans	-81.3	-27.2	171.9	55.2	0	0	0	0	112.1	E586	T287-E586 WeakPolarHBondContact CG2-OE1 3.31Å
288	Y	74.2	Confident	86.5	Confident	126 Å²	126	53.9 Å²	53.9	49%	0.494	26%	0.255	S	S	.	.	S	Bend	trans	-123.5	134.9	175.4	-60.5	-81.3	0	0	0	108.2	S286 T809 P810	S286-Y288 VanDerWaalsContact CB-O 3.29Å; S286-Y288 WeakPolarHBondContact CB-O 3.36Å; Y288-T809 HydrophobicContact CE1-CG2 4.36Å; Y288-T809 HydrophobicContact CE2-CG2 4.05Å; Y288-P810 HydrophobicContact CD2-CG 4.18Å; Y288-P810 HydrophobicContact CG-CG 4.35Å
289	F	78.9	Confident	86.5	Confident	46 Å²	46	57 Å²	57	20%	0.202	27%	0.268	C	S	.	.			trans	-138.3	119.3	-176.1	-163.4	-82	0	0	0	109.4	T260 I282 V291 N293 Y294	T260-F289 HydrophobicContact CG2-CD2 3.79Å; T260-F289 HydrophobicContact CG2-CE2 3.01Å; T260-F289 HydrophobicContact CG2-CZ 3.51Å; I282-F289 HydrophobicContact CB-CD2 4.24Å; I282-F289 HydrophobicContact CB-CE2 4.39Å; I282-F289 HydrophobicContact CD1-CD1 4.15Å; I282-F289 HydrophobicContact CD1-CE1 4.06Å; I282-F289 HydrophobicContact CD1-CG 4.47Å; I282-F289 HydrophobicContact CD1-CZ 4.29Å; I282-F289 HydrophobicContact CG1-CD1 3.85Å; I282-F289 HydrophobicContact CG1-CD2 3.59Å; I282-F289 HydrophobicContact CG1-CE1 3.79Å; I282-F289 HydrophobicContact CG1-CE2 3.48Å; I282-F289 VanDerWaalsContact CG1-CE2 3.48Å; I282-F289 HydrophobicContact CG1-CG 3.75Å; I282-F289 HydrophobicContact CG1-CZ 3.63Å; I282-F289 HydrophobicContact CG2-CB 4.29Å; I282-F289 HydrophobicContact CG2-CD2 4.4Å; I282-F289 HydrophobicContact CG2-CG 4.35Å; F289-V291 PolarHBondContact O-N 2.92Å; F289-N293 HydrophobicContact CE1-CB 3.9Å; F289-N293 HydrophobicContact CZ-CB 4.11Å; F289-Y294 VanDerWaalsContact CE1-N 3.35Å
290	A	84.3	Confident	86.6	Confident	46 Å²	46	54.2 Å²	54.2	38%	0.38	25%	0.254	S	S	.	.			trans	-69.9	131.7	178.5	0	0	0	0	0	110.4	R292 N293 Y294	A290-R292 PolarHBondContact O-N 3.31Å; A290-R292 VanDerWaalsContact O-N 3.15Å; A290-N293 WeakPolarHBondContact O-CB 3.25Å; A290-N293 PolarHBondContact O-N 3.31Å; A290-Y294 PolarHBondContact O-N 3.13Å
291	V	88.1	Confident	86.7	Confident	102 Å²	102	53.8 Å²	53.8	62%	0.618	25%	0.252	S	S	*	.	H	α-helix	trans	-58.3	-29.8	178	-173.4	0	0	0	0	111.5	F289 N293 Y294 W295	F289-V291 PolarHBondContact O-N 2.92Å; V291-N293 VanDerWaalsContact C-N 3.33Å; V291-N293 PolarHBondContact O-N 2.92Å; V291-Y294 VanDerWaalsContact O-CB 3.28Å; V291-Y294 WeakPolarHBondContact O-CB 3.41Å; V291-Y294 PolarHBondContact O-N 3.02Å; V291-Y294 VanDerWaalsContact O-N 3.12Å; V291-W295 PolarHBondContact O-N 3.08Å
292	R	87.3	Confident	86.9	Confident	145 Å²	145	55.8 Å²	55.8	55%	0.547	26%	0.264	S	S	.	.	H	α-helix	trans	-58.4	-44.2	172.2	-174.6	176.3	67.7	-172.5	1.7	112.2	D257 A290 Y294 W295 R296	D257-R292 IonicContact OD2-CZ 2.96Å; D257-R292 IonicContact OD2-NH2 3.52Å; D257-R292 PolarHBondContact OD2-NH2 3.42Å; A290-R292 PolarHBondContact O-N 3.31Å; A290-R292 VanDerWaalsContact O-N 3.15Å; R292-Y294 PolarHBondContact O-N 2.91Å; R292-W295 PolarHBondContact O-N 3.05Å; R292-R296 WeakPolarHBondContact O-CG 3.32Å; R292-R296 PolarHBondContact O-N 3.21Å; R292-R296 VanDerWaalsContact O-N 3.09Å
293	N	88.6	Confident	87.1	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.027	27%	0.265	C	S	.	.	H	α-helix	trans	-68.9	-25	178.6	-62.9	-16.9	0	0	0	111.7	D257 F289 A290 V291 G297	D257-N293 WeakPolarHBondContact CB-OD1 3.42Å; D257-N293 VanDerWaalsContact CG-OD1 3.28Å; D257-N293 PolarHBondContact OD1-ND2 3Å; D257-N293 PolarHBondContact OD2-OD1 3.34Å; F289-N293 HydrophobicContact CE1-CB 3.9Å; F289-N293 HydrophobicContact CZ-CB 4.11Å; A290-N293 WeakPolarHBondContact O-CB 3.25Å; A290-N293 PolarHBondContact O-N 3.31Å; V291-N293 VanDerWaalsContact C-N 3.33Å; V291-N293 PolarHBondContact O-N 2.92Å; N293-G297 PolarHBondContact O-N 3.43Å
294	Y	91.4	Very high	87.3	Confident	65 Å²	65	52.4 Å²	52.4	26%	0.255	25%	0.246	S	C	.	.	H	α-helix	trans	-66.5	-51.4	176.5	171.1	-97.9	0	0	0	109.8	V278 I282 F289 A290 V291 R292 R296 G297 Y298	V278-Y294 HydrophobicContact CG1-CD2 3.41Å; V278-Y294 VanDerWaalsContact CG1-CD2 3.41Å; V278-Y294 HydrophobicContact CG1-CE2 3.65Å; V278-Y294 HydrophobicContact CG1-CG 4.4Å; I282-Y294 HydrophobicContact CD1-CD2 3.72Å; I282-Y294 HydrophobicContact CD1-CE2 4.28Å; F289-Y294 VanDerWaalsContact CE1-N 3.35Å; A290-Y294 PolarHBondContact O-N 3.13Å; V291-Y294 VanDerWaalsContact O-CB 3.28Å; V291-Y294 WeakPolarHBondContact O-CB 3.41Å; V291-Y294 PolarHBondContact O-N 3.02Å; V291-Y294 VanDerWaalsContact O-N 3.12Å; R292-Y294 PolarHBondContact O-N 2.91Å; Y294-R296 PolarHBondContact O-N 3.4Å; Y294-G297 PolarHBondContact O-N 2.94Å; Y294-Y298 VanDerWaalsContact O-CB 3.23Å; Y294-Y298 WeakPolarHBondContact O-CB 3.49Å; Y294-Y298 PolarHBondContact O-N 3.48Å
295	W	92.3	Very high	87.6	Confident	152 Å²	152	52.4 Å²	52.4	58%	0.576	25%	0.247	S	C	*	.	H	α-helix	trans	-62.9	-43.7	177.7	-74.3	111.1	0	0	0	112.7	V291 R292 Y298 F299	V291-W295 PolarHBondContact O-N 3.08Å; R292-W295 PolarHBondContact O-N 3.05Å; W295-Y298 HydrophobicContact CE3-CD1 4.45Å; W295-Y298 HydrophobicContact CZ3-CD1 4.43Å; W295-Y298 PolarHBondContact O-N 3.12Å; W295-F299 WeakPolarHBondContact O-CB 3.27Å; W295-F299 PolarHBondContact O-N 2.66Å
296	R	92.3	Very high	88.4	Confident	51 Å²	51	57.5 Å²	57.5	19%	0.192	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-46.8	176.3	-69.7	-179.1	169.7	163.5	-6.6	111.9	D109 L113 V261 R292 Y294 A300	D109-R296 IonicContact OD2-CZ 3.82Å; D109-R296 IonicContact OD2-NE 3.34Å; D109-R296 IonicContact OD2-NH2 2.81Å; D109-R296 PolarHBondContact OD2-NH2 3.02Å; L113-R296 HydrophobicContact CD1-CB 3.82Å; L113-R296 HydrophobicContact CD1-CG 3.89Å; L113-R296 HydrophobicContact CD2-CB 4.08Å; V261-R296 HydrophobicContact CG2-CB 3.79Å; R292-R296 WeakPolarHBondContact O-CG 3.32Å; R292-R296 PolarHBondContact O-N 3.21Å; R292-R296 VanDerWaalsContact O-N 3.09Å; Y294-R296 PolarHBondContact O-N 3.4Å; R296-A300 WeakPolarHBondContact O-CB 3.29Å; R296-A300 PolarHBondContact O-N 3.04Å
297	G	93.3	Very high	89.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.8	-45.2	176.9	0	0	0	0	0	112.5	N293 Y294 A300 A301	N293-G297 PolarHBondContact O-N 3.43Å; Y294-G297 PolarHBondContact O-N 2.94Å; G297-A300 PolarHBondContact O-N 2.58Å; G297-A301 WeakPolarHBondContact O-CB 3.22Å; G297-A301 PolarHBondContact O-N 3Å
298	Y	95.1	Very high	90.6	Very high	68 Å²	68	53.7 Å²	53.7	27%	0.267	24%	0.243	S	C	.	.	H	α-helix	trans	-62.4	-47.1	178.4	-179.5	-111.3	0	0	0	112.3	P274 L275 V278 Y294 W295 A301 T302	P274-Y298 HydrophobicContact CB-CE2 4.33Å; L275-Y298 HydrophobicContact CD2-CD2 3.9Å; L275-Y298 HydrophobicContact CD2-CE2 3.2Å; L275-Y298 HydrophobicContact CG-CE2 3.76Å; V278-Y298 HydrophobicContact CG2-CD2 4.39Å; Y294-Y298 VanDerWaalsContact O-CB 3.23Å; Y294-Y298 WeakPolarHBondContact O-CB 3.49Å; Y294-Y298 PolarHBondContact O-N 3.48Å; W295-Y298 HydrophobicContact CE3-CD1 4.45Å; W295-Y298 HydrophobicContact CZ3-CD1 4.43Å; W295-Y298 PolarHBondContact O-N 3.12Å; Y298-A301 PolarHBondContact O-N 2.93Å; Y298-T302 HydrophobicContact CD1-CG2 4.42Å; Y298-T302 HydrophobicContact CD2-CG2 4.1Å; Y298-T302 HydrophobicContact CE1-CG2 4.03Å; Y298-T302 HydrophobicContact CE2-CG2 3.64Å; Y298-T302 HydrophobicContact CG-CG2 4.46Å; Y298-T302 VanDerWaalsContact O-CG2 3.29Å; Y298-T302 WeakPolarHBondContact O-CG2 3.48Å; Y298-T302 PolarHBondContact O-N 3.09Å; Y298-T302 PolarHBondContact O-OG1 3.14Å; Y298-T302 VanDerWaalsContact O-OG1 3.07Å
299	F	95.2	Very high	91.2	Very high	65 Å²	65	49.2 Å²	49.2	29%	0.285	23%	0.225	S	C	.	.	H	α-helix	trans	-62.1	-46.9	176.8	175.2	-96.7	0	0	0	112.5	W110 L113 I114 W295 A301 T302 F303	W110-F299 AromaticContact CE3-CD1 3.53Å; W110-F299 HydrophobicContact CE3-CD1 3.53Å; W110-F299 HydrophobicContact CE3-CD2 4.23Å; W110-F299 AromaticContact CE3-CE1 3.62Å; W110-F299 HydrophobicContact CE3-CE1 3.62Å; W110-F299 HydrophobicContact CE3-CE2 4.31Å; W110-F299 AromaticContact CE3-CG 3.84Å; W110-F299 HydrophobicContact CE3-CG 3.84Å; W110-F299 HydrophobicContact CE3-CZ 4.02Å; W110-F299 HydrophobicContact CZ3-CB 3.74Å; W110-F299 AromaticContact CZ3-CD1 3.62Å; W110-F299 HydrophobicContact CZ3-CD1 3.62Å; W110-F299 AromaticContact CZ3-CD2 3.84Å; W110-F299 HydrophobicContact CZ3-CD2 3.84Å; W110-F299 HydrophobicContact CZ3-CE1 4.13Å; W110-F299 HydrophobicContact CZ3-CE2 4.32Å; W110-F299 AromaticContact CZ3-CG 3.44Å; W110-F299 HydrophobicContact CZ3-CG 3.44Å; W110-F299 VanDerWaalsContact CZ3-CG 3.44Å; W110-F299 HydrophobicContact CZ3-CZ 4.46Å; L113-F299 HydrophobicContact CB-CD1 3.98Å; L113-F299 HydrophobicContact CB-CE1 4.18Å; L113-F299 HydrophobicContact CD1-CD1 4.17Å; I114-F299 HydrophobicContact CD1-CE1 4.45Å; I114-F299 HydrophobicContact CD1-CZ 4.25Å; I114-F299 HydrophobicContact CG1-CE1 3.73Å; I114-F299 HydrophobicContact CG1-CZ 3.9Å; W295-F299 WeakPolarHBondContact O-CB 3.27Å; W295-F299 PolarHBondContact O-N 2.66Å; F299-A301 VanDerWaalsContact C-N 3.34Å; F299-A301 PolarHBondContact O-N 3.47Å; F299-T302 PolarHBondContact O-N 3.32Å; F299-T302 PolarHBondContact O-OG1 3.44Å; F299-F303 WeakPolarHBondContact O-CB 3.32Å; F299-F303 PolarHBondContact O-N 3.22Å
300	A	95.4	Very high	91.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.6	-37.8	178.9	0	0	0	0	0	112.1	L113 V261 V265 R296 G297 S304	L113-A300 HydrophobicContact CB-CB 4.12Å; L113-A300 HydrophobicContact CD2-CB 4.07Å; V261-A300 HydrophobicContact CG1-CB 4.34Å; V265-A300 HydrophobicContact CG2-CB 3.31Å; R296-A300 WeakPolarHBondContact O-CB 3.29Å; R296-A300 PolarHBondContact O-N 3.04Å; G297-A300 PolarHBondContact O-N 2.58Å; A300-S304 WeakPolarHBondContact O-CB 3.11Å; A300-S304 PolarHBondContact O-N 3.17Å
301	A	95.7	Very high	91.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-69	-41	177.5	0	0	0	0	0	112.4	P274 V278 G297 Y298 F299 S304 A305	P274-A301 HydrophobicContact CB-CB 4.1Å; V278-A301 HydrophobicContact CG2-CB 4.29Å; G297-A301 WeakPolarHBondContact O-CB 3.22Å; G297-A301 PolarHBondContact O-N 3Å; Y298-A301 PolarHBondContact O-N 2.93Å; F299-A301 VanDerWaalsContact C-N 3.34Å; F299-A301 PolarHBondContact O-N 3.47Å; A301-S304 PolarHBondContact O-N 3.19Å; A301-A305 WeakPolarHBondContact O-CB 3.44Å; A301-A305 PolarHBondContact O-N 3.44Å
302	T	94.8	Very high	91.5	Very high	43 Å²	43	44.8 Å²	44.8	26%	0.264	20%	0.196	S	C	.	.	H	α-helix	trans	-64.3	-44.4	175.6	52.3	0	0	0	0	110.9	P274 Y298 F299 S304 A305 F306	P274-T302 HydrophobicContact CB-CG2 3.49Å; P274-T302 VanDerWaalsContact CB-CG2 3.49Å; P274-T302 HydrophobicContact CG-CG2 3.78Å; Y298-T302 HydrophobicContact CD1-CG2 4.42Å; Y298-T302 HydrophobicContact CD2-CG2 4.1Å; Y298-T302 HydrophobicContact CE1-CG2 4.03Å; Y298-T302 HydrophobicContact CE2-CG2 3.64Å; Y298-T302 HydrophobicContact CG-CG2 4.46Å; Y298-T302 VanDerWaalsContact O-CG2 3.29Å; Y298-T302 WeakPolarHBondContact O-CG2 3.48Å; Y298-T302 PolarHBondContact O-N 3.09Å; Y298-T302 PolarHBondContact O-OG1 3.14Å; Y298-T302 VanDerWaalsContact O-OG1 3.07Å; F299-T302 PolarHBondContact O-N 3.32Å; F299-T302 PolarHBondContact O-OG1 3.44Å; T302-S304 VanDerWaalsContact C-N 3.34Å; T302-S304 PolarHBondContact O-N 2.97Å; T302-A305 PolarHBondContact O-N 3.19Å; T302-F306 VanDerWaalsContact O-CB 3.28Å; T302-F306 WeakPolarHBondContact O-CB 3.35Å; T302-F306 PolarHBondContact O-N 2.98Å
303	F	94.6	Very high	91.5	Very high	56 Å²	56	40.3 Å²	40.3	25%	0.246	19%	0.185	C	C	.	.	H	α-helix	trans	-61	-44.2	175.8	-169.9	-103.9	0	0	0	111.6	I114 L118 F299 F306 I307	I114-F303 HydrophobicContact CB-CE1 4.39Å; I114-F303 HydrophobicContact CG2-CD1 4.25Å; I114-F303 HydrophobicContact CG2-CE1 3.61Å; I114-F303 HydrophobicContact CG2-CE2 4.47Å; I114-F303 HydrophobicContact CG2-CZ 3.75Å; I114-F303 WeakPolarHBondContact O-CE1 3.42Å; L118-F303 HydrophobicContact CB-CE1 4.11Å; F299-F303 WeakPolarHBondContact O-CB 3.32Å; F299-F303 PolarHBondContact O-N 3.22Å; F303-F306 PolarHBondContact O-N 2.86Å; F303-I307 HydrophobicContact CD1-CG1 4.27Å; F303-I307 HydrophobicContact CE1-CD1 4.42Å; F303-I307 HydrophobicContact CE1-CG1 3.89Å; F303-I307 HydrophobicContact CE2-CD1 4.43Å; F303-I307 HydrophobicContact CE2-CG1 4.44Å; F303-I307 HydrophobicContact CZ-CD1 4.04Å; F303-I307 HydrophobicContact CZ-CG1 3.98Å; F303-I307 WeakPolarHBondContact O-CG1 3.5Å; F303-I307 PolarHBondContact O-N 3.38Å
304	S	94.6	Very high	91.4	Very high	0 Å²	0	50 Å²	50	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-47.6	176.6	-161.2	0	0	0	0	112.6	G117 A121 C269 A300 A301 T302 F306 I307 F308	G117-S304 WeakPolarHBondContact O-CA 3.36Å; G117-S304 WeakPolarHBondContact O-CB 3.47Å; G117-S304 PolarHBondContact O-OG 3.32Å; A121-S304 WeakPolarHBondContact CB-O 3.41Å; A121-S304 PolarHBondContact N-OG 3.37Å; C269-S304 WeakPolarHBondContact CB-OG 3.4Å; C269-S304 PolarHBondContact SG-OG 2.99Å; C269-S304 VanDerWaalsContact SG-OG 3.34Å; A300-S304 WeakPolarHBondContact O-CB 3.11Å; A300-S304 PolarHBondContact O-N 3.17Å; A301-S304 PolarHBondContact O-N 3.19Å; T302-S304 VanDerWaalsContact C-N 3.34Å; T302-S304 PolarHBondContact O-N 2.97Å; S304-F306 VanDerWaalsContact C-N 3.33Å; S304-F306 PolarHBondContact O-N 3.19Å; S304-I307 PolarHBondContact O-N 2.81Å; S304-F308 WeakPolarHBondContact O-CB 3.27Å; S304-F308 PolarHBondContact O-N 3.42Å
305	A	91.1	Very high	90.9	Very high	8 Å²	8	49.9 Å²	49.9	7%	0.066	23%	0.225	C	C	.	.	H	α-helix	trans	-62.4	-39.8	177.4	0	0	0	0	0	112	A301 T302 F308 R309	A301-A305 WeakPolarHBondContact O-CB 3.44Å; A301-A305 PolarHBondContact O-N 3.44Å; T302-A305 PolarHBondContact O-N 3.19Å; A305-F308 PolarHBondContact O-N 3.45Å; A305-R309 VanDerWaalsContact O-CG 3.23Å; A305-R309 WeakPolarHBondContact O-CG 3.29Å; A305-R309 PolarHBondContact O-N 3.23Å; A305-R309 VanDerWaalsContact O-N 3.1Å
306	F	92	Very high	90	Very high	113 Å²	113	51.7 Å²	51.7	50%	0.496	24%	0.237	S	C	.	.	H	α-helix	trans	-61	-52.7	175.5	175	-105.3	0	0	0	111.6	T302 F303 S304 F308 R309 V310	T302-F306 VanDerWaalsContact O-CB 3.28Å; T302-F306 WeakPolarHBondContact O-CB 3.35Å; T302-F306 PolarHBondContact O-N 2.98Å; F303-F306 PolarHBondContact O-N 2.86Å; S304-F306 VanDerWaalsContact C-N 3.33Å; S304-F306 PolarHBondContact O-N 3.19Å; F306-F308 VanDerWaalsContact C-N 3.33Å; F306-F308 PolarHBondContact O-N 3.37Å; F306-R309 PolarHBondContact O-N 3.02Å; F306-V310 HydrophobicContact CD1-CG2 4.41Å; F306-V310 HydrophobicContact CD2-CG2 4.22Å; F306-V310 HydrophobicContact CE1-CG2 4.03Å; F306-V310 HydrophobicContact CE2-CG2 3.82Å; F306-V310 HydrophobicContact CZ-CG2 3.72Å; F306-V310 WeakPolarHBondContact O-CG2 3.25Å; F306-V310 PolarHBondContact O-N 2.86Å
307	I	93.2	Very high	88.8	Confident	29 Å²	29	53.7 Å²	53.7	15%	0.149	25%	0.252	C	S	.	.	H	α-helix	trans	-60.1	-43.2	178.7	-65.6	-61.4	0	0	0	111.2	L118 A121 F303 S304 R309 V310 L311	L118-I307 HydrophobicContact CD1-CG1 4.34Å; L118-I307 HydrophobicContact CD1-CG2 3.98Å; A121-I307 HydrophobicContact CB-CB 3.77Å; A121-I307 HydrophobicContact CB-CG2 3.6Å; F303-I307 HydrophobicContact CD1-CG1 4.27Å; F303-I307 HydrophobicContact CE1-CD1 4.42Å; F303-I307 HydrophobicContact CE1-CG1 3.89Å; F303-I307 HydrophobicContact CE2-CD1 4.43Å; F303-I307 HydrophobicContact CE2-CG1 4.44Å; F303-I307 HydrophobicContact CZ-CD1 4.04Å; F303-I307 HydrophobicContact CZ-CG1 3.98Å; F303-I307 WeakPolarHBondContact O-CG1 3.5Å; F303-I307 PolarHBondContact O-N 3.38Å; S304-I307 PolarHBondContact O-N 2.81Å; I307-R309 VanDerWaalsContact C-N 3.31Å; I307-R309 PolarHBondContact O-N 3.5Å; I307-V310 PolarHBondContact O-N 3.09Å; I307-L311 HydrophobicContact CG2-CD1 3.77Å; I307-L311 HydrophobicContact CG2-CG 4.17Å; I307-L311 WeakPolarHBondContact O-CB 3.27Å; I307-L311 VanDerWaalsContact O-CG 3.31Å; I307-L311 WeakPolarHBondContact O-CG 3.17Å; I307-L311 PolarHBondContact O-N 3.35Å
308	F	89.7	Confident	87.4	Confident	8 Å²	8	55.2 Å²	55.2	4%	0.035	26%	0.264	C	S	.	.	H	α-helix	trans	-57.5	-42.9	177.5	178.4	-93.3	0	0	0	112.4	A121 W125 S304 A305 F306 S312 L324	A121-F308 HydrophobicContact CB-CB 4.38Å; W125-F308 HydrophobicContact CB-CD2 3.98Å; W125-F308 HydrophobicContact CB-CE2 4.13Å; S304-F308 WeakPolarHBondContact O-CB 3.27Å; S304-F308 PolarHBondContact O-N 3.42Å; A305-F308 PolarHBondContact O-N 3.45Å; F306-F308 VanDerWaalsContact C-N 3.33Å; F306-F308 PolarHBondContact O-N 3.37Å; F308-S312 PolarHBondContact O-N 2.87Å; F308-S312 PolarHBondContact O-OG 3.37Å; F308-L324 HydrophobicContact CE1-CD1 4.5Å
309	R	86.4	Confident	85.7	Confident	31 Å²	31	58.6 Å²	58.6	12%	0.117	29%	0.291	C	S	.	.	H	α-helix	trans	-70.4	-42	177.8	-63.9	-79	-176.8	-160.9	-8.3	112.1	A305 F306 I307 S312 V313 I321 T322 L324	A305-R309 VanDerWaalsContact O-CG 3.23Å; A305-R309 WeakPolarHBondContact O-CG 3.29Å; A305-R309 PolarHBondContact O-N 3.23Å; A305-R309 VanDerWaalsContact O-N 3.1Å; F306-R309 PolarHBondContact O-N 3.02Å; I307-R309 VanDerWaalsContact C-N 3.31Å; I307-R309 PolarHBondContact O-N 3.5Å; R309-S312 WeakPolarHBondContact O-CB 3.3Å; R309-S312 PolarHBondContact O-N 3.12Å; R309-V313 WeakPolarHBondContact O-CG2 3.4Å; R309-V313 PolarHBondContact O-N 3.05Å; R309-V313 VanDerWaalsContact O-N 3.13Å; R309-I321 HydrophobicContact CB-CG2 3.88Å; R309-I321 HydrophobicContact CG-CG2 4.22Å; R309-T322 WeakPolarHBondContact CD-O 3.34Å; R309-T322 PolarHBondContact NE-O 2.94Å; R309-T322 PolarHBondContact NH1-O 2.58Å; R309-L324 VanDerWaalsContact NH1-CA 3.33Å
310	V	89.6	Confident	84.6	Confident	49 Å²	49	59.3 Å²	59.3	30%	0.297	30%	0.301	S	S	.	.	H	α-helix	trans	-62.6	-44.3	178.2	170.6	0	0	0	0	111.2	F306 I307 S312 V313 W314 I321	F306-V310 HydrophobicContact CD1-CG2 4.41Å; F306-V310 HydrophobicContact CD2-CG2 4.22Å; F306-V310 HydrophobicContact CE1-CG2 4.03Å; F306-V310 HydrophobicContact CE2-CG2 3.82Å; F306-V310 HydrophobicContact CZ-CG2 3.72Å; F306-V310 WeakPolarHBondContact O-CG2 3.25Å; F306-V310 PolarHBondContact O-N 2.86Å; I307-V310 PolarHBondContact O-N 3.09Å; V310-S312 VanDerWaalsContact C-N 3.28Å; V310-S312 PolarHBondContact O-N 2.88Å; V310-V313 PolarHBondContact O-N 3.49Å; V310-W314 PolarHBondContact O-N 3.39Å; V310-I321 HydrophobicContact CG2-CD1 4.29Å
311	L	86.8	Confident	83.5	Confident	32 Å²	32	64.3 Å²	64.3	17%	0.168	33%	0.327	C	S	.	.	H	α-helix	trans	-60.3	-39.1	175.9	-72.9	171.6	0	0	0	112.1	L122 W125 I307 V313 W314 N315	L122-L311 HydrophobicContact CD2-CD1 3.75Å; W125-L311 HydrophobicContact CB-CD1 4.32Å; W125-L311 HydrophobicContact CD2-CB 4.39Å; W125-L311 HydrophobicContact CG-CB 4.16Å; W125-L311 HydrophobicContact CG-CD1 4.35Å; I307-L311 HydrophobicContact CG2-CD1 3.77Å; I307-L311 HydrophobicContact CG2-CG 4.17Å; I307-L311 WeakPolarHBondContact O-CB 3.27Å; I307-L311 VanDerWaalsContact O-CG 3.31Å; I307-L311 WeakPolarHBondContact O-CG 3.17Å; I307-L311 PolarHBondContact O-N 3.35Å; L311-V313 VanDerWaalsContact C-N 3.32Å; L311-V313 PolarHBondContact O-N 3.49Å; L311-W314 PolarHBondContact O-N 3.38Å; L311-N315 WeakPolarHBondContact O-CB 3.13Å; L311-N315 PolarHBondContact O-N 2.73Å
312	S	83	Confident	82.4	Confident	20 Å²	20	66.5 Å²	66.5	14%	0.14	34%	0.341	C	S	.	.	H	α-helix	trans	-64.5	-36	177	-57.8	0	0	0	0	112.6	F308 R309 V310 D317 A318	F308-S312 PolarHBondContact O-N 2.87Å; F308-S312 PolarHBondContact O-OG 3.37Å; R309-S312 WeakPolarHBondContact O-CB 3.3Å; R309-S312 PolarHBondContact O-N 3.12Å; V310-S312 VanDerWaalsContact C-N 3.28Å; V310-S312 PolarHBondContact O-N 2.88Å; S312-D317 PolarHBondContact O-N 3.18Å; S312-A318 PolarHBondContact O-N 3.11Å
313	V	86.1	Confident	81.3	Confident	51 Å²	51	65.6 Å²	65.6	31%	0.309	34%	0.337	S	S	.	.	H	α-helix	trans	-72	-42.5	174.8	175.7	0	0	0	0	111	R309 V310 L311 N315 K316 I321	R309-V313 WeakPolarHBondContact O-CG2 3.4Å; R309-V313 PolarHBondContact O-N 3.05Å; R309-V313 VanDerWaalsContact O-N 3.13Å; V310-V313 PolarHBondContact O-N 3.49Å; L311-V313 VanDerWaalsContact C-N 3.32Å; L311-V313 PolarHBondContact O-N 3.49Å; V313-N315 VanDerWaalsContact C-N 3.31Å; V313-N315 PolarHBondContact O-N 3.33Å; V313-K316 PolarHBondContact O-N 3.37Å; V313-I321 HydrophobicContact CG2-CG1 4.17Å
314	W	85.8	Confident	80.4	Confident	210 Å²	210	64.3 Å²	64.3	80%	0.795	33%	0.333	S	S	*	.	H	α-helix	trans	-62.9	-39.1	180	-161.7	-6.8	0	0	0	111.9	V310 L311 K316	V310-W314 PolarHBondContact O-N 3.39Å; L311-W314 PolarHBondContact O-N 3.38Å; W314-K316 PolarHBondContact O-N 2.92Å
315	N	80.8	Confident	79.7	Confident	62 Å²	62	64.5 Å²	64.5	33%	0.332	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	3.8	176.2	-158.4	43.6	0	0	0	114	W125 Y129 L311 V313 D317	W125-N315 HydrophobicContact CZ2-CB 3.93Å; Y129-N315 VanDerWaalsContact CE2-ND2 3.34Å; Y129-N315 WeakPolarHBondContact CE2-ND2 3.28Å; L311-N315 WeakPolarHBondContact O-CB 3.13Å; L311-N315 PolarHBondContact O-N 2.73Å; V313-N315 VanDerWaalsContact C-N 3.31Å; V313-N315 PolarHBondContact O-N 3.33Å; N315-D317 PolarHBondContact ND2-OD2 3.16Å; N315-D317 PolarHBondContact O-N 3.44Å
316	K	74.7	Confident	79.3	Confident	190 Å²	190	70 Å²	70	83%	0.826	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	19.7	-176	-53.2	-178.2	-179.5	178.7	0	114.6	V313 W314 A318	V313-K316 PolarHBondContact O-N 3.37Å; W314-K316 PolarHBondContact O-N 2.92Å; K316-A318 VanDerWaalsContact C-N 3.27Å
317	D	66.3	Low	78.9	Confident	93 Å²	93	65 Å²	65	50%	0.497	34%	0.335	S	S	.	.	S	Bend	trans	-75.4	-21.1	174.1	-66.3	-43.7	0	0	0	111.5	S312 N315	S312-D317 PolarHBondContact O-N 3.18Å; N315-D317 PolarHBondContact ND2-OD2 3.16Å; N315-D317 PolarHBondContact O-N 3.44Å
318	A	64.2	Low	78.3	Confident	31 Å²	31	68.6 Å²	68.6	26%	0.256	35%	0.354	S	S	.	.			trans	-136.8	143.2	174.8	0	0	0	0	0	111.3	S312 K316	S312-A318 PolarHBondContact O-N 3.11Å; K316-A318 VanDerWaalsContact C-N 3.27Å
319	V	60.3	Low	77.9	Confident	139 Å²	139	68.8 Å²	68.8	84%	0.842	36%	0.355	S	S	*	.	S	Bend	trans	-72.4	-35.6	179.9	-175.5	0	0	0	0	111.4
320	T	71.3	Confident	77.5	Confident	81 Å²	81	70.2 Å²	70.2	50%	0.497	36%	0.36	S	S	.	.	S	Bend	trans	-148.7	166	-178.4	48.4	0	0	0	0	111	T322	T320-T322 PolarHBondContact O-N 2.91Å; T320-T322 PolarHBondContact O-OG1 3.33Å; T320-T322 VanDerWaalsContact OG1-CG2 3.27Å; T320-T322 WeakPolarHBondContact OG1-CG2 3.43Å
321	I	73.1	Confident	76.6	Confident	105 Å²	105	72.5 Å²	72.5	54%	0.538	37%	0.369	S	S	.	.	S	Bend	trans	-65.9	84.8	171.6	-57.9	175.1	0	0	0	108.1	R309 V310 V313	R309-I321 HydrophobicContact CB-CG2 3.88Å; R309-I321 HydrophobicContact CG-CG2 4.22Å; V310-I321 HydrophobicContact CG2-CD1 4.29Å; V313-I321 HydrophobicContact CG2-CG1 4.17Å
322	T	72	Confident	75.6	Confident	46 Å²	46	78.8 Å²	78.8	28%	0.282	40%	0.403	S	S	.	.			trans	-117.8	159.2	179.8	45.2	0	0	0	0	110	R309 T320 K326	R309-T322 WeakPolarHBondContact CD-O 3.34Å; R309-T322 PolarHBondContact NE-O 2.94Å; R309-T322 PolarHBondContact NH1-O 2.58Å; T320-T322 PolarHBondContact O-N 2.91Å; T320-T322 PolarHBondContact O-OG1 3.33Å; T320-T322 VanDerWaalsContact OG1-CG2 3.27Å; T320-T322 WeakPolarHBondContact OG1-CG2 3.43Å; T322-K326 HydrophobicContact CG2-CD 4.22Å
323	A	71.9	Confident	74.9	Confident	23 Å²	23	79.9 Å²	79.9	19%	0.19	41%	0.405	C	S	.	.			trans	-58	156.6	174.2	0	0	0	0	0	111.7	F325 L543	A323-F325 VanDerWaalsContact C-N 3.31Å; A323-F325 PolarHBondContact O-N 2.85Å; A323-L543 WeakPolarHBondContact CB-O 3.48Å
324	L	74.8	Confident	74.4	Confident	30 Å²	30	78.7 Å²	78.7	16%	0.157	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-33.6	-168.8	-165.8	69.3	0	0	0	112.3	F308 R309 L543	F308-L324 HydrophobicContact CE1-CD1 4.5Å; R309-L324 VanDerWaalsContact NH1-CA 3.33Å; L324-L543 HydrophobicContact CB-CD2 3.99Å; L324-L543 HydrophobicContact CD2-CD2 4.18Å; L324-L543 PolarHBondContact N-O 2.98Å
325	F	80.3	Confident	73.9	Confident	4 Å²	4	70.6 Å²	70.6	2%	0.018	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.7	58	179.7	-58.8	-62.9	0	0	0	109	A323 T327 R413 I416 N417 F420 L543 T544	A323-F325 VanDerWaalsContact C-N 3.31Å; A323-F325 PolarHBondContact O-N 2.85Å; F325-T327 PolarHBondContact O-N 3.32Å; F325-T327 VanDerWaalsContact O-N 3.12Å; F325-R413 HydrophobicContact CE1-CG 3.67Å; F325-R413 HydrophobicContact CZ-CG 4.19Å; F325-I416 HydrophobicContact CD1-CB 4.43Å; F325-I416 HydrophobicContact CD1-CG2 3.92Å; F325-I416 HydrophobicContact CD2-CG2 4.34Å; F325-I416 HydrophobicContact CE1-CB 4.13Å; F325-I416 HydrophobicContact CE1-CD1 4.34Å; F325-I416 HydrophobicContact CE1-CG2 4Å; F325-I416 HydrophobicContact CE2-CD1 4.42Å; F325-I416 HydrophobicContact CE2-CG2 4.44Å; F325-I416 HydrophobicContact CG-CG2 4.08Å; F325-I416 HydrophobicContact CZ-CB 4.49Å; F325-I416 HydrophobicContact CZ-CD1 3.91Å; F325-I416 HydrophobicContact CZ-CG2 4.28Å; F325-N417 VanDerWaalsContact CD1-OD1 3.31Å; F325-N417 WeakPolarHBondContact CD1-OD1 3.18Å; F325-F420 HydrophobicContact CB-CD2 4.34Å; F325-F420 HydrophobicContact CB-CE2 4.47Å; F325-L543 CarbonylContact C-O 3.13Å; F325-L543 HydrophobicContact CD2-CB 4.25Å; F325-L543 HydrophobicContact CD2-CD1 4.36Å; F325-L543 HydrophobicContact CD2-CD2 4.1Å; F325-L543 HydrophobicContact CD2-CG 4.49Å; F325-L543 HydrophobicContact CE2-CD1 4.45Å; F325-L543 HydrophobicContact CE2-CD2 4.29Å; F325-L543 PolarHBondContact N-O 3.48Å; F325-T544 WeakPolarHBondContact O-CA 3.35Å
326	K	82.3	Confident	73.9	Confident	124 Å²	124	67.7 Å²	67.7	54%	0.539	35%	0.354	S	S	.	.			trans	-54.5	121	-177.2	-176.7	-179.8	177.6	-178.3	0	110.2	T322 N328	T322-K326 HydrophobicContact CG2-CD 4.22Å; K326-N328 VanDerWaalsContact CE-OD1 3.31Å; K326-N328 WeakPolarHBondContact CE-OD1 3.42Å
327	T	83.9	Confident	74.2	Confident	7 Å²	7	64.6 Å²	64.6	4%	0.043	35%	0.345	C	S	.	.			trans	-106.3	153	171.8	52.5	0	0	0	0	109.3	F325 F329 F420 T544 Q546	F325-T327 PolarHBondContact O-N 3.32Å; F325-T327 VanDerWaalsContact O-N 3.12Å; T327-F329 VanDerWaalsContact CB-CE2 3.45Å; T327-F329 HydrophobicContact CG2-CE1 4.41Å; T327-F329 HydrophobicContact CG2-CE2 3.73Å; T327-F329 HydrophobicContact CG2-CZ 3.61Å; T327-F329 WeakPolarHBondContact OG1-CE2 3.27Å; T327-F420 HydrophobicContact CG2-CB 3.82Å; T327-F420 HydrophobicContact CG2-CD2 4.26Å; T327-F420 HydrophobicContact CG2-CG 4.39Å; T327-T544 HydrophobicContact CG2-CG2 4.33Å; T327-T544 PolarHBondContact N-O 2.79Å; T327-T544 VanDerWaalsContact N-O 3.17Å; T327-T544 PolarHBondContact OG1-O 3.24Å; T327-Q546 WeakPolarHBondContact O-CG 3.4Å; T327-Q546 PolarHBondContact O-NE2 3.35Å; T327-Q546 PolarHBondContact O-OE1 3.36Å; T327-Q546 PolarHBondContact OG1-OE1 3.42Å
328	N	81.3	Confident	75.1	Confident	104 Å²	104	66 Å²	66	56%	0.556	35%	0.349	S	S	*	.			trans	-123.4	54.5	177.8	-72.9	-31.9	0	0	0	109.2	K326 N422	K326-N328 VanDerWaalsContact CE-OD1 3.31Å; K326-N328 WeakPolarHBondContact CE-OD1 3.42Å; N328-N422 PolarHBondContact O-ND2 3.46Å
329	F	82	Confident	76.2	Confident	12 Å²	12	64.7 Å²	64.7	5%	0.053	34%	0.337	C	S	.	.			trans	-66.9	154.2	170.8	-51.9	-50.7	0	0	0	110.4	T327 N422 L514 V520 Q546	T327-F329 VanDerWaalsContact CB-CE2 3.45Å; T327-F329 HydrophobicContact CG2-CE1 4.41Å; T327-F329 HydrophobicContact CG2-CE2 3.73Å; T327-F329 HydrophobicContact CG2-CZ 3.61Å; T327-F329 WeakPolarHBondContact OG1-CE2 3.27Å; F329-N422 WeakPolarHBondContact CD1-OD1 3.22Å; F329-N422 WeakPolarHBondContact CE1-OD1 3Å; F329-L514 HydrophobicContact CD1-CD2 4.26Å; F329-V520 HydrophobicContact CE2-CG2 3.91Å; F329-V520 HydrophobicContact CZ-CG2 3.88Å; F329-Q546 PolarHBondContact O-NE2 2.89Å
330	R	76.4	Confident	77.5	Confident	61 Å²	61	61 Å²	61	23%	0.23	31%	0.313	C	S	.	.			trans	-62	137.9	172.9	64	-177.4	-176.2	-157.1	-4.7	110.6	F333 R512 L514	R330-F333 WeakPolarHBondContact CD-O 3.12Å; R330-F333 PolarHBondContact NE-O 3.09Å; R330-R512 PolarHBondContact NH1-O 3.07Å; R330-R512 PolarHBondContact NH2-O 3.32Å; R330-L514 HydrophobicContact CG-CD1 4.35Å
331	M	71	Confident	78.5	Confident	98 Å²	98	61 Å²	61	48%	0.483	31%	0.314	S	S	.	.	S	Bend	trans	-100.5	-31.8	-177.7	-64.2	-65.9	-75.9	0	0	112.8	F333 Q546	M331-F333 VanDerWaalsContact C-N 3.26Å; M331-F333 PolarHBondContact O-N 2.92Å; M331-Q546 HydrophobicContact SD-CB 4.5Å
332	D	65.4	Low	79.4	Confident	163 Å²	163	56.5 Å²	56.5	87%	0.872	29%	0.292	S	S	*	.	S	Bend	trans	-67.5	-28.7	-171.8	-51.4	-42.9	0	0	0	112.7
333	F	70.3	Confident	80.4	Confident	43 Å²	43	54.5 Å²	54.5	19%	0.189	28%	0.28	C	S	.	.	S	Bend	trans	-153	85.9	175.2	-161.6	-93.4	0	0	0	111	R330 M331 D336 F506 Y511	R330-F333 WeakPolarHBondContact CD-O 3.12Å; R330-F333 PolarHBondContact NE-O 3.09Å; M331-F333 VanDerWaalsContact C-N 3.26Å; M331-F333 PolarHBondContact O-N 2.92Å; F333-D336 HydrophobicContact CE1-CB 4.24Å; F333-D336 WeakPolarHBondContact CE1-OD1 3.43Å; F333-D336 WeakPolarHBondContact CZ-OD1 3.33Å; F333-F506 HydrophobicContact CE2-CD1 4.09Å; F333-F506 HydrophobicContact CE2-CE1 4.25Å; F333-F506 HydrophobicContact CZ-CD1 4.1Å; F333-F506 HydrophobicContact CZ-CG 4.16Å; F333-Y511 HydrophobicContact CB-CD1 4.35Å; F333-Y511 HydrophobicContact CB-CE1 3.93Å; F333-Y511 HydrophobicContact CD1-CD1 4.22Å; F333-Y511 AromaticContact CD1-CD2 3.95Å; F333-Y511 HydrophobicContact CD1-CD2 3.95Å; F333-Y511 HydrophobicContact CD1-CE1 4.38Å; F333-Y511 HydrophobicContact CD1-CE2 4.13Å; F333-Y511 HydrophobicContact CD1-CG 4Å; F333-Y511 HydrophobicContact CE1-CD2 4.16Å; F333-Y511 HydrophobicContact CE1-CE2 4.44Å; F333-Y511 HydrophobicContact CG-CE1 4.29Å; F333-Y511 HydrophobicContact CG-CE2 4.27Å
334	P	73.8	Confident	81.5	Confident	27 Å²	27	54.7 Å²	54.7	18%	0.175	28%	0.282	C	S	.	.			trans	-74.7	-40.5	-168.1	25	-30.4	0	0	0	113.8	S548 H549	P334-S548 WeakPolarHBondContact CB-O 3.48Å; P334-S548 VanDerWaalsContact CG-O 3.26Å; P334-S548 WeakPolarHBondContact CG-O 3.37Å; P334-H549 PolarHBondContact O-NE2 3.33Å
335	F	76.4	Confident	82.5	Confident	40 Å²	40	58.2 Å²	58.2	18%	0.175	30%	0.299	C	S	.	.			trans	-148.3	146.2	-180	61.8	-88.4	0	0	0	111	L340 F343 P552	F335-L340 HydrophobicContact CD2-CD2 4.11Å; F335-L340 HydrophobicContact CE2-CD2 3.9Å; F335-F343 HydrophobicContact CB-CE2 3.84Å; F335-F343 HydrophobicContact CB-CZ 4.13Å; F335-F343 HydrophobicContact CD2-CE2 4.33Å; F335-F343 HydrophobicContact CG-CE2 4.19Å; F335-P552 HydrophobicContact CD1-CG 3.73Å; F335-P552 HydrophobicContact CD2-CG 4.22Å; F335-P552 VanDerWaalsContact CE1-CD 3.47Å; F335-P552 HydrophobicContact CE1-CG 3.63Å; F335-P552 HydrophobicContact CE2-CG 4.12Å; F335-P552 HydrophobicContact CG-CG 4.05Å; F335-P552 VanDerWaalsContact CZ-CD 3.47Å; F335-P552 HydrophobicContact CZ-CG 3.84Å
336	D	79.8	Confident	83.3	Confident	1 Å²	1	58 Å²	58	1%	0.005	30%	0.299	C	S	.	.			trans	-81.4	152.7	171.2	-85.2	-64.8	0	0	0	112.1	F333 Q338 E339 I504	F333-D336 HydrophobicContact CE1-CB 4.24Å; F333-D336 WeakPolarHBondContact CE1-OD1 3.43Å; F333-D336 WeakPolarHBondContact CZ-OD1 3.33Å; D336-Q338 PolarHBondContact O-N 3.46Å; D336-E339 HydrophobicContact CB-CG 4.12Å; D336-E339 WeakPolarHBondContact O-CB 3.36Å; D336-E339 PolarHBondContact O-N 3.28Å; D336-I504 HydrophobicContact CB-CD1 4.07Å; D336-I504 HydrophobicContact CB-CG2 4.1Å; D336-I504 WeakPolarHBondContact OD2-CB 3.32Å
337	L	82.1	Confident	84	Confident	124 Å²	124	52.1 Å²	52.1	65%	0.649	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-57.8	-30.2	169.7	-79.1	147.1	0	0	0	112	E339 L340	L337-E339 PolarHBondContact O-N 3.36Å; L337-L340 HydrophobicContact CD2-CD1 3.87Å; L337-L340 WeakPolarHBondContact O-CB 3.32Å; L337-L340 WeakPolarHBondContact O-CG 3.24Å; L337-L340 PolarHBondContact O-N 3.5Å
338	Q	85.1	Confident	84.7	Confident	123 Å²	123	55.1 Å²	55.1	58%	0.575	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-69.8	-18.4	176.6	-62.7	-176.2	11.3	0	0	113.1	D336 P341 I504	D336-Q338 PolarHBondContact O-N 3.46Å; Q338-P341 WeakPolarHBondContact O-CD 3.2Å; Q338-I504 HydrophobicContact CB-CD1 4.47Å; Q338-I504 HydrophobicContact CB-CG2 4.37Å; Q338-I504 HydrophobicContact CG-CG2 4.47Å
339	E	86.4	Confident	85.5	Confident	3 Å²	3	51.9 Å²	51.9	1%	0.014	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-82.8	-16.9	175.8	-62.6	-175.7	-142.6	0	0	112.5	D336 L337 A342 F343 I504 Y518	D336-E339 HydrophobicContact CB-CG 4.12Å; D336-E339 WeakPolarHBondContact O-CB 3.36Å; D336-E339 PolarHBondContact O-N 3.28Å; L337-E339 PolarHBondContact O-N 3.36Å; E339-A342 WeakPolarHBondContact O-CA 3.38Å; E339-A342 WeakPolarHBondContact O-CB 3.23Å; E339-A342 PolarHBondContact O-N 2.81Å; E339-F343 HydrophobicContact CB-CD2 4.37Å; E339-F343 HydrophobicContact CB-CE2 3.69Å; E339-F343 HydrophobicContact CB-CZ 3.87Å; E339-F343 WeakPolarHBondContact O-CD2 3.44Å; E339-F343 PolarHBondContact O-N 2.99Å; E339-I504 HydrophobicContact CG-CD1 3.45Å; E339-I504 VanDerWaalsContact CG-CD1 3.45Å; E339-Y518 WeakPolarHBondContact CB-OH 3.28Å; E339-Y518 VanDerWaalsContact CG-OH 3.24Å; E339-Y518 WeakPolarHBondContact CG-OH 3.33Å; E339-Y518 WeakPolarHBondContact OE2-CE2 3.47Å; E339-Y518 VanDerWaalsContact OE2-CZ 3.23Å; E339-Y518 PolarHBondContact OE2-OH 3.44Å
340	L	88.4	Confident	86.2	Confident	62 Å²	62	51.3 Å²	51.3	33%	0.325	27%	0.271	S	S	.	.	H	α-helix	trans	-56.8	-42.6	-178	-66.5	179.7	0	0	0	114.2	F335 L337 A342 F343 A344 P552	F335-L340 HydrophobicContact CD2-CD2 4.11Å; F335-L340 HydrophobicContact CE2-CD2 3.9Å; L337-L340 HydrophobicContact CD2-CD1 3.87Å; L337-L340 WeakPolarHBondContact O-CB 3.32Å; L337-L340 WeakPolarHBondContact O-CG 3.24Å; L337-L340 PolarHBondContact O-N 3.5Å; L340-A342 VanDerWaalsContact C-N 3.28Å; L340-A342 PolarHBondContact O-N 2.86Å; L340-F343 HydrophobicContact CD2-CD2 4.17Å; L340-F343 PolarHBondContact O-N 3.42Å; L340-A344 PolarHBondContact O-N 3.49Å; L340-P552 HydrophobicContact CD2-CB 4.17Å
341	P	91.5	Very high	87.2	Confident	80 Å²	80	48.4 Å²	48.4	52%	0.519	26%	0.26	S	S	.	.	H	α-helix	trans	-60	-37.3	174.2	-24.1	35.6	0	0	0	112.7	Q338 A344 I345	Q338-P341 WeakPolarHBondContact O-CD 3.2Å; P341-A344 PolarHBondContact O-N 3.34Å; P341-I345 VanDerWaalsContact O-CG1 3.27Å; P341-I345 WeakPolarHBondContact O-CG1 3.46Å; P341-I345 PolarHBondContact O-N 3.44Å
342	A	91.8	Very high	88.5	Confident	11 Å²	11	49.2 Å²	49.2	9%	0.091	26%	0.261	C	S	.	.	H	α-helix	trans	-66.3	-41.2	177	0	0	0	0	0	111.4	E339 L340 A344 I345 I346 M496 Y518	E339-A342 WeakPolarHBondContact O-CA 3.38Å; E339-A342 WeakPolarHBondContact O-CB 3.23Å; E339-A342 PolarHBondContact O-N 2.81Å; L340-A342 VanDerWaalsContact C-N 3.28Å; L340-A342 PolarHBondContact O-N 2.86Å; A342-A344 PolarHBondContact O-N 3.16Å; A342-I345 PolarHBondContact O-N 2.95Å; A342-I346 WeakPolarHBondContact O-CG1 3.33Å; A342-I346 PolarHBondContact O-N 3.02Å; A342-M496 HydrophobicContact CB-CE 4.25Å; A342-M496 HydrophobicContact CB-CG 4.39Å; A342-M496 HydrophobicContact CB-SD 4.11Å; A342-Y518 HydrophobicContact CB-CE1 4.13Å
343	F	94.1	Very high	90.1	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-64.5	-37.6	173.8	-58.8	-41.2	0	0	0	112.7	F335 E339 L340 I346 G347 Y518 I521 P552	F335-F343 HydrophobicContact CB-CE2 3.84Å; F335-F343 HydrophobicContact CB-CZ 4.13Å; F335-F343 HydrophobicContact CD2-CE2 4.33Å; F335-F343 HydrophobicContact CG-CE2 4.19Å; E339-F343 HydrophobicContact CB-CD2 4.37Å; E339-F343 HydrophobicContact CB-CE2 3.69Å; E339-F343 HydrophobicContact CB-CZ 3.87Å; E339-F343 WeakPolarHBondContact O-CD2 3.44Å; E339-F343 PolarHBondContact O-N 2.99Å; L340-F343 HydrophobicContact CD2-CD2 4.17Å; L340-F343 PolarHBondContact O-N 3.42Å; F343-I346 HydrophobicContact CD1-CD1 4.4Å; F343-I346 PolarHBondContact O-N 3.45Å; F343-G347 PolarHBondContact O-N 2.91Å; F343-Y518 HydrophobicContact CD1-CD1 4.11Å; F343-Y518 AromaticContact CD1-CE1 3.98Å; F343-Y518 HydrophobicContact CD1-CE1 3.98Å; F343-Y518 AromaticContact CE1-CD1 3.73Å; F343-Y518 HydrophobicContact CE1-CD1 3.73Å; F343-Y518 HydrophobicContact CE1-CD2 4.03Å; F343-Y518 AromaticContact CE1-CE1 3.51Å; F343-Y518 HydrophobicContact CE1-CE1 3.51Å; F343-Y518 AromaticContact CE1-CE2 3.8Å; F343-Y518 HydrophobicContact CE1-CE2 3.8Å; F343-Y518 AromaticContact CE1-CG 3.97Å; F343-Y518 HydrophobicContact CE1-CG 3.97Å; F343-Y518 AromaticContact CE1-CZ 3.53Å; F343-Y518 HydrophobicContact CZ-CE1 4.34Å; F343-Y518 HydrophobicContact CZ-CE2 4.11Å; F343-Y518 AromaticContact CZ-CZ 3.94Å; F343-I521 HydrophobicContact CD1-CD1 3.53Å; F343-I521 HydrophobicContact CD2-CD1 4.46Å; F343-I521 HydrophobicContact CE1-CD1 3.46Å; F343-I521 VanDerWaalsContact CE1-CD1 3.46Å; F343-I521 HydrophobicContact CE2-CD1 4.41Å; F343-I521 HydrophobicContact CG-CD1 4.07Å; F343-I521 HydrophobicContact CZ-CD1 3.94Å; F343-P552 HydrophobicContact CB-CB 4.3Å; F343-P552 HydrophobicContact CD2-CB 3.39Å; F343-P552 HydrophobicContact CD2-CG 4.17Å; F343-P552 HydrophobicContact CE2-CB 3.89Å; F343-P552 HydrophobicContact CE2-CG 4.16Å; F343-P552 HydrophobicContact CG-CB 4Å
344	A	94.9	Very high	91.3	Very high	28 Å²	28	41.3 Å²	41.3	23%	0.231	22%	0.221	C	C	.	.	H	α-helix	trans	-64.1	-42.7	174.5	0	0	0	0	0	111.8	L340 P341 A342 I346 G347 I348 L559	L340-A344 PolarHBondContact O-N 3.49Å; P341-A344 PolarHBondContact O-N 3.34Å; A342-A344 PolarHBondContact O-N 3.16Å; A344-I346 VanDerWaalsContact C-N 3.33Å; A344-I346 PolarHBondContact O-N 3.43Å; A344-G347 PolarHBondContact O-N 2.9Å; A344-I348 WeakPolarHBondContact O-CG1 3.41Å; A344-I348 PolarHBondContact O-N 3.39Å; A344-L559 HydrophobicContact CB-CD1 3.88Å
345	I	95.3	Very high	92.4	Very high	103 Å²	103	40.3 Å²	40.3	53%	0.528	22%	0.215	S	C	.	.	H	α-helix	trans	-61.9	-41.1	175	-68.9	163.9	0	0	0	110.9	P341 A342 I348 S349	P341-I345 VanDerWaalsContact O-CG1 3.27Å; P341-I345 WeakPolarHBondContact O-CG1 3.46Å; P341-I345 PolarHBondContact O-N 3.44Å; A342-I345 PolarHBondContact O-N 2.95Å; I345-I348 PolarHBondContact O-N 3.49Å; I345-S349 WeakPolarHBondContact O-CB 3.41Å; I345-S349 PolarHBondContact O-N 3.33Å; I345-S349 PolarHBondContact O-OG 2.73Å
346	I	96.6	Very high	93.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.7	-49	173.1	-71.8	164.5	0	0	0	110.1	A342 F343 A344 S349 C350 V492 Y518	A342-I346 WeakPolarHBondContact O-CG1 3.33Å; A342-I346 PolarHBondContact O-N 3.02Å; F343-I346 HydrophobicContact CD1-CD1 4.4Å; F343-I346 PolarHBondContact O-N 3.45Å; A344-I346 VanDerWaalsContact C-N 3.33Å; A344-I346 PolarHBondContact O-N 3.43Å; I346-S349 PolarHBondContact O-N 3.03Å; I346-C350 WeakPolarHBondContact O-CB 3.47Å; I346-C350 PolarHBondContact O-N 3.5Å; I346-C350 PolarHBondContact O-SG 3.44Å; I346-V492 HydrophobicContact CD1-CB 4.05Å; I346-V492 HydrophobicContact CD1-CG1 3.74Å; I346-V492 HydrophobicContact CG1-CB 4.08Å; I346-V492 HydrophobicContact CG1-CG1 3.81Å; I346-V492 HydrophobicContact CG1-CG2 4.15Å; I346-Y518 HydrophobicContact CD1-CD1 3.62Å; I346-Y518 HydrophobicContact CD1-CE1 4.39Å; I346-Y518 HydrophobicContact CD1-CG 4.48Å
347	G	97.5	Very high	94.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-55.9	-53.4	178.5	0	0	0	0	0	112.6	F343 A344 S349 C350 G351 A556 A560	F343-G347 PolarHBondContact O-N 2.91Å; A344-G347 PolarHBondContact O-N 2.9Å; G347-S349 PolarHBondContact O-N 3.24Å; G347-C350 PolarHBondContact O-N 2.91Å; G347-G351 PolarHBondContact O-N 3.39Å; G347-A556 VanDerWaalsContact CA-O 3.29Å; G347-A556 WeakPolarHBondContact CA-O 3.47Å; G347-A560 VanDerWaalsContact O-CA 3.23Å; G347-A560 WeakPolarHBondContact O-CA 3.25Å; G347-A560 WeakPolarHBondContact O-CB 3.38Å
348	I	98.1	Very high	94.9	Very high	70 Å²	70	37.6 Å²	37.6	36%	0.359	20%	0.198	S	C	.	.	H	α-helix	trans	-60.6	-46.9	-179.8	-66	167.8	0	0	0	111	A344 I345 G351 F352 L559 V563	A344-I348 WeakPolarHBondContact O-CG1 3.41Å; A344-I348 PolarHBondContact O-N 3.39Å; I345-I348 PolarHBondContact O-N 3.49Å; I348-G351 PolarHBondContact O-N 2.96Å; I348-F352 HydrophobicContact CG2-CD2 4Å; I348-F352 HydrophobicContact CG2-CE2 3.66Å; I348-F352 VanDerWaalsContact O-CD2 3.25Å; I348-F352 WeakPolarHBondContact O-CD2 3.37Å; I348-F352 PolarHBondContact O-N 3.18Å; I348-F352 VanDerWaalsContact O-N 3.14Å; I348-L559 HydrophobicContact CG1-CB 4.44Å; I348-V563 HydrophobicContact CG2-CG2 4.38Å
349	S	97.8	Very high	95.3	Very high	36 Å²	36	36.3 Å²	36.3	25%	0.252	19%	0.188	S	C	.	.	H	α-helix	trans	-65	-43.6	-179.6	-55.7	0	0	0	0	111.9	I345 I346 G347 G351 F352 L353	I345-S349 WeakPolarHBondContact O-CB 3.41Å; I345-S349 PolarHBondContact O-N 3.33Å; I345-S349 PolarHBondContact O-OG 2.73Å; I346-S349 PolarHBondContact O-N 3.03Å; G347-S349 PolarHBondContact O-N 3.24Å; S349-G351 VanDerWaalsContact C-N 3.26Å; S349-G351 PolarHBondContact O-N 3.41Å; S349-F352 PolarHBondContact O-N 2.57Å; S349-L353 WeakPolarHBondContact O-CB 3.49Å; S349-L353 VanDerWaalsContact O-CG 3.3Å; S349-L353 WeakPolarHBondContact O-CG 3.48Å; S349-L353 PolarHBondContact O-N 3.45Å
350	C	97.9	Very high	95.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.1	-33.9	173.5	-77.6	0	0	0	0	112.2	I346 G347 G354 F488 A525 M526 A560	I346-C350 WeakPolarHBondContact O-CB 3.47Å; I346-C350 PolarHBondContact O-N 3.5Å; I346-C350 PolarHBondContact O-SG 3.44Å; G347-C350 PolarHBondContact O-N 2.91Å; C350-G354 WeakPolarHBondContact O-CA 3.18Å; C350-G354 PolarHBondContact O-N 3.14Å; C350-F488 VanDerWaalsContact SG-CD1 3.58Å; C350-A525 HydrophobicContact CB-CB 3.94Å; C350-M526 HydrophobicContact CB-CB 4.12Å; C350-A560 HydrophobicContact CB-CB 4.45Å
351	G	97.9	Very high	95.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-49.5	172.8	0	0	0	0	0	112.6	G347 I348 S349 G354 A355 A560	G347-G351 PolarHBondContact O-N 3.39Å; I348-G351 PolarHBondContact O-N 2.96Å; S349-G351 VanDerWaalsContact C-N 3.26Å; S349-G351 PolarHBondContact O-N 3.41Å; G351-G354 PolarHBondContact O-N 3.17Å; G351-A355 WeakPolarHBondContact O-CB 3.34Å; G351-A355 PolarHBondContact O-N 2.79Å; G351-A560 WeakPolarHBondContact CA-O 3.33Å
352	F	98.1	Very high	95.9	Very high	116 Å²	116	34.1 Å²	34.1	51%	0.509	17%	0.169	S	C	.	.	H	α-helix	trans	-63	-45.7	175.2	-75.4	-70.1	0	0	0	112.4	I348 S349 G354 A355 F356 V563 L567	I348-F352 HydrophobicContact CG2-CD2 4Å; I348-F352 HydrophobicContact CG2-CE2 3.66Å; I348-F352 VanDerWaalsContact O-CD2 3.25Å; I348-F352 WeakPolarHBondContact O-CD2 3.37Å; I348-F352 PolarHBondContact O-N 3.18Å; I348-F352 VanDerWaalsContact O-N 3.14Å; S349-F352 PolarHBondContact O-N 2.57Å; F352-G354 VanDerWaalsContact C-N 3.34Å; F352-G354 PolarHBondContact O-N 2.81Å; F352-A355 PolarHBondContact O-N 3.26Å; F352-F356 WeakPolarHBondContact O-CB 3.1Å; F352-F356 PolarHBondContact O-N 3.38Å; F352-V563 HydrophobicContact CD1-CG1 3.99Å; F352-V563 HydrophobicContact CD2-CG1 3.94Å; F352-V563 HydrophobicContact CE1-CG1 4Å; F352-V563 HydrophobicContact CE2-CG1 3.95Å; F352-V563 HydrophobicContact CG-CG1 3.95Å; F352-V563 HydrophobicContact CZ-CG1 3.98Å; F352-L567 HydrophobicContact CD1-CD1 3.5Å; F352-L567 HydrophobicContact CE1-CD1 3.67Å
353	L	97.4	Very high	95.9	Very high	40 Å²	40	36.4 Å²	36.4	21%	0.209	18%	0.177	C	C	.	.	H	α-helix	trans	-64.5	-38.7	178.4	-70.3	168.9	0	0	0	111.9	S349 F356 F357 F458 F488 M526	S349-L353 WeakPolarHBondContact O-CB 3.49Å; S349-L353 VanDerWaalsContact O-CG 3.3Å; S349-L353 WeakPolarHBondContact O-CG 3.48Å; S349-L353 PolarHBondContact O-N 3.45Å; L353-F356 PolarHBondContact O-N 3.29Å; L353-F357 WeakPolarHBondContact O-CB 3.43Å; L353-F357 PolarHBondContact O-N 3.4Å; L353-F458 HydrophobicContact CD1-CZ 3.86Å; L353-F458 HydrophobicContact CD2-CE1 4.29Å; L353-F458 HydrophobicContact CD2-CZ 4.06Å; L353-F458 HydrophobicContact CG-CZ 4.44Å; L353-F488 HydrophobicContact CD1-CD1 4.32Å; L353-F488 HydrophobicContact CD1-CD2 3.91Å; L353-F488 HydrophobicContact CD1-CE1 4.29Å; L353-F488 HydrophobicContact CD1-CE2 3.88Å; L353-F488 HydrophobicContact CD1-CG 4.13Å; L353-F488 HydrophobicContact CD1-CZ 4.08Å; L353-M526 HydrophobicContact CB-CE 4.4Å
354	G	97.3	Very high	95.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.7	-46.1	174.8	0	0	0	0	0	112.2	C350 G351 F352 F356 F357 V358	C350-G354 WeakPolarHBondContact O-CA 3.18Å; C350-G354 PolarHBondContact O-N 3.14Å; G351-G354 PolarHBondContact O-N 3.17Å; F352-G354 VanDerWaalsContact C-N 3.34Å; F352-G354 PolarHBondContact O-N 2.81Å; G354-F356 VanDerWaalsContact C-N 3.34Å; G354-F356 PolarHBondContact O-N 3.15Å; G354-F357 WeakPolarHBondContact O-CB 3.26Å; G354-F357 PolarHBondContact O-N 3.44Å; G354-V358 WeakPolarHBondContact O-CG2 3.45Å; G354-V358 PolarHBondContact O-N 3Å
355	A	97.1	Very high	95.2	Very high	6 Å²	6	36.4 Å²	36.4	5%	0.05	18%	0.175	C	C	.	.	H	α-helix	trans	-60.3	-43.9	173.8	0	0	0	0	0	111.6	G351 F352 F357 V358 Y359 L567 Q568	G351-A355 WeakPolarHBondContact O-CB 3.34Å; G351-A355 PolarHBondContact O-N 2.79Å; F352-A355 PolarHBondContact O-N 3.26Å; A355-F357 VanDerWaalsContact C-N 3.32Å; A355-F357 PolarHBondContact O-N 2.93Å; A355-V358 PolarHBondContact O-N 3.37Å; A355-Y359 WeakPolarHBondContact O-CB 3.31Å; A355-Y359 PolarHBondContact O-N 3.05Å; A355-L567 HydrophobicContact CB-CB 3.89Å; A355-L567 HydrophobicContact CB-CD1 4.03Å; A355-Q568 HydrophobicContact CB-CB 4.31Å; A355-Q568 HydrophobicContact CB-CG 4.1Å; A355-Q568 WeakPolarHBondContact O-CG 3.4Å
356	F	97.1	Very high	94.8	Very high	106 Å²	106	34.7 Å²	34.7	47%	0.465	17%	0.166	S	C	.	.	H	α-helix	trans	-62.1	-39.1	175.3	-179.1	-118.9	0	0	0	112.2	F352 L353 G354 Y359 L360 F462	F352-F356 WeakPolarHBondContact O-CB 3.1Å; F352-F356 PolarHBondContact O-N 3.38Å; L353-F356 PolarHBondContact O-N 3.29Å; G354-F356 VanDerWaalsContact C-N 3.34Å; G354-F356 PolarHBondContact O-N 3.15Å; F356-Y359 HydrophobicContact CD2-CD1 4.47Å; F356-Y359 PolarHBondContact O-N 3.13Å; F356-L360 WeakPolarHBondContact O-CB 3.42Å; F356-L360 PolarHBondContact O-N 3.47Å; F356-F462 AromaticContact CD1-CE1 3.53Å; F356-F462 HydrophobicContact CD1-CE1 3.53Å; F356-F462 AromaticContact CD1-CZ 3.43Å; F356-F462 HydrophobicContact CD1-CZ 3.43Å; F356-F462 VanDerWaalsContact CD1-CZ 3.43Å; F356-F462 HydrophobicContact CE1-CD1 4.46Å; F356-F462 AromaticContact CE1-CE1 3.56Å; F356-F462 HydrophobicContact CE1-CE1 3.56Å; F356-F462 AromaticContact CE1-CZ 3.99Å; F356-F462 HydrophobicContact CE1-CZ 3.99Å; F356-F462 HydrophobicContact CG-CZ 4.35Å
357	F	96.9	Very high	94.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.6	-46.7	176	-178.7	-95.5	0	0	0	111.7	L353 G354 A355 Y359 L360 N361 F462 S465 A466 V481 L484 V530	L353-F357 WeakPolarHBondContact O-CB 3.43Å; L353-F357 PolarHBondContact O-N 3.4Å; G354-F357 WeakPolarHBondContact O-CB 3.26Å; G354-F357 PolarHBondContact O-N 3.44Å; A355-F357 VanDerWaalsContact C-N 3.32Å; A355-F357 PolarHBondContact O-N 2.93Å; F357-Y359 VanDerWaalsContact C-N 3.34Å; F357-Y359 PolarHBondContact O-N 3.11Å; F357-L360 PolarHBondContact O-N 3.34Å; F357-N361 WeakPolarHBondContact O-CB 3.39Å; F357-N361 PolarHBondContact O-N 2.96Å; F357-F462 HydrophobicContact CB-CE2 3.84Å; F357-F462 HydrophobicContact CB-CZ 3.59Å; F357-F462 HydrophobicContact CD2-CD2 4.32Å; F357-F462 HydrophobicContact CD2-CE1 4.27Å; F357-F462 AromaticContact CD2-CE2 3.96Å; F357-F462 HydrophobicContact CD2-CE2 3.96Å; F357-F462 AromaticContact CD2-CZ 3.93Å; F357-F462 HydrophobicContact CD2-CZ 3.93Å; F357-F462 HydrophobicContact CG-CE2 4.38Å; F357-F462 HydrophobicContact CG-CZ 4.28Å; F357-S465 WeakPolarHBondContact CE2-OG 3.44Å; F357-A466 HydrophobicContact CE2-CB 4.02Å; F357-V481 HydrophobicContact CD1-CG2 3.96Å; F357-V481 HydrophobicContact CE1-CG2 3.48Å; F357-V481 VanDerWaalsContact CE1-CG2 3.48Å; F357-V481 HydrophobicContact CE2-CG2 4.35Å; F357-V481 HydrophobicContact CZ-CG2 3.7Å; F357-L484 HydrophobicContact CD2-CD1 4.43Å; F357-L484 HydrophobicContact CE2-CD1 4.32Å; F357-V530 HydrophobicContact CB-CG2 4.41Å; F357-V530 HydrophobicContact CD1-CG1 4.09Å; F357-V530 HydrophobicContact CD1-CG2 4.04Å; F357-V530 HydrophobicContact CE1-CG1 4.4Å
358	V	95.4	Very high	93.5	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-64	-41.6	177.5	178.2	0	0	0	0	111.2	G354 A355 N361 R362 V530 P569 L571	G354-V358 WeakPolarHBondContact O-CG2 3.45Å; G354-V358 PolarHBondContact O-N 3Å; A355-V358 PolarHBondContact O-N 3.37Å; V358-N361 PolarHBondContact O-N 3.32Å; V358-R362 WeakPolarHBondContact O-CB 3.35Å; V358-R362 PolarHBondContact O-N 2.96Å; V358-V530 HydrophobicContact CG2-CB 4.44Å; V358-V530 HydrophobicContact CG2-CG1 3.95Å; V358-V530 HydrophobicContact CG2-CG2 4.42Å; V358-P569 WeakPolarHBondContact CG1-O 3.4Å; V358-L571 HydrophobicContact CG2-CB 4.16Å
359	Y	94.9	Very high	92.4	Very high	96 Å²	96	40.6 Å²	40.6	38%	0.376	19%	0.188	S	C	.	.	H	α-helix	trans	-58.7	-50.3	174.4	174.7	-95.8	0	0	0	111.3	A355 F356 F357 N361 R362 Q363	A355-Y359 WeakPolarHBondContact O-CB 3.31Å; A355-Y359 PolarHBondContact O-N 3.05Å; F356-Y359 HydrophobicContact CD2-CD1 4.47Å; F356-Y359 PolarHBondContact O-N 3.13Å; F357-Y359 VanDerWaalsContact C-N 3.34Å; F357-Y359 PolarHBondContact O-N 3.11Å; Y359-N361 PolarHBondContact O-N 3.32Å; Y359-R362 WeakPolarHBondContact O-CB 3.14Å; Y359-R362 PolarHBondContact O-N 3.49Å; Y359-Q363 HydrophobicContact CD1-CG 4.15Å; Y359-Q363 HydrophobicContact CE1-CG 3.69Å; Y359-Q363 HydrophobicContact CE2-CG 4.07Å; Y359-Q363 VanDerWaalsContact CE2-NE2 3.31Å; Y359-Q363 VanDerWaalsContact CZ-NE2 3.34Å; Y359-Q363 WeakPolarHBondContact O-CG 3.24Å; Y359-Q363 PolarHBondContact O-N 3.47Å; Y359-Q363 PolarHBondContact OH-NE2 2.95Å; Y359-Q363 VanDerWaalsContact OH-NE2 3.16Å
360	L	94.1	Very high	91.7	Very high	44 Å²	44	46 Å²	46	23%	0.23	20%	0.203	C	C	.	.	H	α-helix	trans	-60.8	-47.1	179.5	-179	62.8	0	0	0	111	F356 F357 R362 Q363 V364 F462 A466	F356-L360 WeakPolarHBondContact O-CB 3.42Å; F356-L360 PolarHBondContact O-N 3.47Å; F357-L360 PolarHBondContact O-N 3.34Å; L360-R362 VanDerWaalsContact C-N 3.31Å; L360-R362 PolarHBondContact O-N 3.27Å; L360-Q363 PolarHBondContact O-N 3.42Å; L360-Q363 VanDerWaalsContact O-N 3.09Å; L360-V364 HydrophobicContact CD1-CG2 4.36Å; L360-V364 HydrophobicContact CG-CG2 4.48Å; L360-V364 WeakPolarHBondContact O-CG2 3.42Å; L360-V364 PolarHBondContact O-N 2.88Å; L360-F462 HydrophobicContact CD2-CD1 4.03Å; L360-F462 HydrophobicContact CD2-CE1 3.72Å; L360-A466 HydrophobicContact CD2-CB 3.77Å; L360-A466 HydrophobicContact CG-CB 4.04Å
361	N	92.3	Very high	90.5	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-56.3	-46.5	177.5	-166.9	-93	0	0	0	111.3	F357 V358 Y359 Q363 V364 V365 A466 T469 L571	F357-N361 WeakPolarHBondContact O-CB 3.39Å; F357-N361 PolarHBondContact O-N 2.96Å; V358-N361 PolarHBondContact O-N 3.32Å; Y359-N361 PolarHBondContact O-N 3.32Å; N361-Q363 PolarHBondContact O-N 3.44Å; N361-V364 PolarHBondContact O-N 2.87Å; N361-V365 WeakPolarHBondContact O-CG2 3.19Å; N361-V365 PolarHBondContact O-N 3.02Å; N361-V365 VanDerWaalsContact O-N 3.14Å; N361-A466 PolarHBondContact ND2-O 2.94Å; N361-T469 PolarHBondContact ND2-OG1 3.18Å; N361-L571 HydrophobicContact CB-CD1 4.29Å
362	R	91	Very high	89.8	Confident	52 Å²	52	53.6 Å²	53.6	20%	0.196	25%	0.251	C	S	.	.	H	α-helix	trans	-59.8	-45.4	175	-174.2	176.6	65.3	-157.8	-9.6	111.7	V358 Y359 L360 V365 L366 V578	V358-R362 WeakPolarHBondContact O-CB 3.35Å; V358-R362 PolarHBondContact O-N 2.96Å; Y359-R362 WeakPolarHBondContact O-CB 3.14Å; Y359-R362 PolarHBondContact O-N 3.49Å; L360-R362 VanDerWaalsContact C-N 3.31Å; L360-R362 PolarHBondContact O-N 3.27Å; R362-V365 PolarHBondContact O-N 2.95Å; R362-L366 HydrophobicContact CG-CD1 3.95Å; R362-L366 HydrophobicContact CG-CG 4.32Å; R362-L366 WeakPolarHBondContact O-CB 3.41Å; R362-L366 VanDerWaalsContact O-CG 3.3Å; R362-L366 WeakPolarHBondContact O-CG 3.29Å; R362-L366 PolarHBondContact O-N 3.46Å; R362-V578 HydrophobicContact CG-CG2 3.94Å
363	Q	91.8	Very high	88.9	Confident	59 Å²	59	52 Å²	52	28%	0.276	26%	0.259	S	S	.	.	H	α-helix	trans	-64.4	-40.1	-179.8	-69	-58.8	-10.6	0	0	112.6	Y359 L360 N361 V365 L366 F367	Y359-Q363 HydrophobicContact CD1-CG 4.15Å; Y359-Q363 HydrophobicContact CE1-CG 3.69Å; Y359-Q363 HydrophobicContact CE2-CG 4.07Å; Y359-Q363 VanDerWaalsContact CE2-NE2 3.31Å; Y359-Q363 VanDerWaalsContact CZ-NE2 3.34Å; Y359-Q363 WeakPolarHBondContact O-CG 3.24Å; Y359-Q363 PolarHBondContact O-N 3.47Å; Y359-Q363 PolarHBondContact OH-NE2 2.95Å; Y359-Q363 VanDerWaalsContact OH-NE2 3.16Å; L360-Q363 PolarHBondContact O-N 3.42Å; L360-Q363 VanDerWaalsContact O-N 3.09Å; N361-Q363 PolarHBondContact O-N 3.44Å; Q363-V365 VanDerWaalsContact C-N 3.35Å; Q363-V365 PolarHBondContact O-N 3.38Å; Q363-L366 PolarHBondContact O-N 3.43Å; Q363-F367 WeakPolarHBondContact O-CB 3.22Å; Q363-F367 PolarHBondContact O-N 3.21Å
364	V	89.4	Confident	87.9	Confident	27 Å²	27	54.8 Å²	54.8	16%	0.164	27%	0.274	C	S	.	.	H	α-helix	trans	-60.7	-45.7	175.7	177.1	0	0	0	0	110.4	L360 N361 F367 M368 T470	L360-V364 HydrophobicContact CD1-CG2 4.36Å; L360-V364 HydrophobicContact CG-CG2 4.48Å; L360-V364 WeakPolarHBondContact O-CG2 3.42Å; L360-V364 PolarHBondContact O-N 2.88Å; N361-V364 PolarHBondContact O-N 2.87Å; V364-F367 PolarHBondContact O-N 3.01Å; V364-M368 WeakPolarHBondContact O-CB 3.17Å; V364-M368 WeakPolarHBondContact O-CG 3.41Å; V364-M368 PolarHBondContact O-N 3.07Å; V364-T470 HydrophobicContact CB-CG2 4.18Å; V364-T470 HydrophobicContact CG1-CG2 3.66Å
365	V	86	Confident	86.8	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.024	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-41.7	178.4	-178.7	0	0	0	0	111.6	L18 Y19 N361 R362 Q363 M368 R369 T470 V578	L18-V365 HydrophobicContact CD1-CG1 4.19Å; Y19-V365 HydrophobicContact CD2-CG1 4.24Å; Y19-V365 HydrophobicContact CE2-CG1 4.24Å; Y19-V365 HydrophobicContact CE2-CG2 4.32Å; N361-V365 WeakPolarHBondContact O-CG2 3.19Å; N361-V365 PolarHBondContact O-N 3.02Å; N361-V365 VanDerWaalsContact O-N 3.14Å; R362-V365 PolarHBondContact O-N 2.95Å; Q363-V365 VanDerWaalsContact C-N 3.35Å; Q363-V365 PolarHBondContact O-N 3.38Å; V365-M368 PolarHBondContact O-N 2.94Å; V365-R369 WeakPolarHBondContact O-CG 3.44Å; V365-R369 PolarHBondContact O-N 2.62Å; V365-T470 HydrophobicContact CG2-CG2 3.65Å; V365-V578 HydrophobicContact CB-CG1 4.38Å; V365-V578 HydrophobicContact CG1-CG1 3.5Å
366	L	87.3	Confident	85.9	Confident	67 Å²	67	63 Å²	63	35%	0.351	31%	0.305	S	S	.	.	H	α-helix	trans	-65.8	-41.1	176.8	-71.9	175.6	0	0	0	112	R362 Q363 R369 R370	R362-L366 HydrophobicContact CG-CD1 3.95Å; R362-L366 HydrophobicContact CG-CG 4.32Å; R362-L366 WeakPolarHBondContact O-CB 3.41Å; R362-L366 VanDerWaalsContact O-CG 3.3Å; R362-L366 WeakPolarHBondContact O-CG 3.29Å; R362-L366 PolarHBondContact O-N 3.46Å; Q363-L366 PolarHBondContact O-N 3.43Å; L366-R369 WeakPolarHBondContact O-CB 3.49Å; L366-R369 PolarHBondContact O-N 3.25Å; L366-R369 VanDerWaalsContact O-N 3.11Å; L366-R370 PolarHBondContact O-N 3.24Å
367	F	85.7	Confident	85.2	Confident	107 Å²	107	63 Å²	63	47%	0.469	31%	0.305	S	S	.	.	H	α-helix	trans	-60.6	-45.5	176.6	178.4	-101.3	0	0	0	111.3	Q363 V364 R369 R370	Q363-F367 WeakPolarHBondContact O-CB 3.22Å; Q363-F367 PolarHBondContact O-N 3.21Å; V364-F367 PolarHBondContact O-N 3.01Å; F367-R369 PolarHBondContact O-N 3.38Å; F367-R370 WeakPolarHBondContact O-CB 3.49Å; F367-R370 PolarHBondContact O-N 3.27Å
368	M	79.4	Confident	84.2	Confident	23 Å²	23	63.7 Å²	63.7	11%	0.113	31%	0.308	C	S	.	.	H	α-helix	trans	-64.3	-19.6	175.3	-74.4	-68.6	96.7	0	0	114.4	L18 V364 V365 T375 Y385	L18-M368 HydrophobicContact CD1-CB 3.35Å; L18-M368 HydrophobicContact CD1-CG 4.04Å; L18-M368 HydrophobicContact CG-CB 4.4Å; V364-M368 WeakPolarHBondContact O-CB 3.17Å; V364-M368 WeakPolarHBondContact O-CG 3.41Å; V364-M368 PolarHBondContact O-N 3.07Å; V365-M368 PolarHBondContact O-N 2.94Å; M368-T375 HydrophobicContact CE-CG2 4.25Å; M368-T375 WeakPolarHBondContact O-CG2 3.34Å; M368-Y385 HydrophobicContact CG-CE2 4.47Å; M368-Y385 HydrophobicContact SD-CD2 4.26Å; M368-Y385 HydrophobicContact SD-CE2 3.53Å; M368-Y385 VanDerWaalsContact SD-CE2 3.53Å
369	R	76.8	Confident	82.9	Confident	65 Å²	65	67.3 Å²	67.3	25%	0.245	33%	0.33	C	S	.	.	H	α-helix	trans	-88.2	-14.2	173.2	-73.2	-179.4	170.8	-159.1	3.3	113.9	V365 L366 F367 V578	V365-R369 WeakPolarHBondContact O-CG 3.44Å; V365-R369 PolarHBondContact O-N 2.62Å; L366-R369 WeakPolarHBondContact O-CB 3.49Å; L366-R369 PolarHBondContact O-N 3.25Å; L366-R369 VanDerWaalsContact O-N 3.11Å; F367-R369 PolarHBondContact O-N 3.38Å; R369-V578 VanDerWaalsContact CZ-O 3.31Å; R369-V578 PolarHBondContact NH1-O 3.07Å; R369-V578 PolarHBondContact NH2-O 2.97Å
370	R	81.6	Confident	82.1	Confident	149 Å²	149	70.6 Å²	70.6	56%	0.562	35%	0.347	S	S	*	.	S	Bend	trans	-66.1	134.5	177.4	-68.6	-174.4	179.6	-178.7	0.6	109.6	L366 F367 T372 T375	L366-R370 PolarHBondContact O-N 3.24Å; F367-R370 WeakPolarHBondContact O-CB 3.49Å; F367-R370 PolarHBondContact O-N 3.27Å; R370-T372 PolarHBondContact O-N 2.93Å; R370-T375 WeakPolarHBondContact O-CB 3.35Å; R370-T375 WeakPolarHBondContact O-CG2 3.09Å; R370-T375 PolarHBondContact O-OG1 2.92Å
371	P	73.8	Confident	81.5	Confident	102 Å²	102	72.4 Å²	72.4	66%	0.662	35%	0.354	S	S	*	.			trans	-79.6	65.5	-174.5	33.6	-37.1	0	0	0	112.3
372	T	83.1	Confident	81	Confident	57 Å²	57	73.7 Å²	73.7	35%	0.35	36%	0.358	S	S	.	.			trans	-83.5	163.9	171.7	60.9	0	0	0	0	110.9	R370 L374 T375 R376	R370-T372 PolarHBondContact O-N 2.93Å; T372-L374 PolarHBondContact O-N 2.96Å; T372-T375 PolarHBondContact N-OG1 3.35Å; T372-T375 PolarHBondContact O-N 3.49Å; T372-T375 PolarHBondContact O-OG1 2.93Å; T372-T375 WeakPolarHBondContact OG1-CG2 3.41Å; T372-T375 PolarHBondContact OG1-N 3.21Å; T372-T375 PolarHBondContact OG1-OG1 3.02Å; T372-R376 WeakPolarHBondContact O-CG 3.34Å; T372-R376 PolarHBondContact O-N 3.49Å
373	A	79.5	Confident	80.9	Confident	82 Å²	82	74.2 Å²	74.2	68%	0.678	37%	0.365	S	S	*	.	H	α-helix	trans	-56.5	-39.3	174.8	0	0	0	0	0	111.6	R376 F377	A373-R376 PolarHBondContact O-N 2.93Å; A373-F377 PolarHBondContact O-N 3.23Å
374	L	74.6	Confident	80.8	Confident	99 Å²	99	75 Å²	75	52%	0.518	37%	0.37	S	S	.	.	H	α-helix	trans	-62.2	-47.1	176.5	-178.5	64.2	0	0	0	112.2	T372 R376 F377 L378	T372-L374 PolarHBondContact O-N 2.96Å; L374-R376 VanDerWaalsContact C-N 3.34Å; L374-R376 PolarHBondContact O-N 2.9Å; L374-F377 PolarHBondContact O-N 3.04Å; L374-L378 HydrophobicContact CD1-CD1 4.23Å; L374-L378 HydrophobicContact CD1-CG 4.33Å; L374-L378 HydrophobicContact CG-CD1 3.97Å; L374-L378 HydrophobicContact CG-CG 4.46Å; L374-L378 WeakPolarHBondContact O-CB 3.29Å; L374-L378 VanDerWaalsContact O-CG 3.3Å; L374-L378 WeakPolarHBondContact O-CG 3.3Å; L374-L378 PolarHBondContact O-N 3.5Å
375	T	75.1	Confident	80.8	Confident	7 Å²	7	74.4 Å²	74.4	4%	0.043	37%	0.365	C	S	.	.	H	α-helix	trans	-70.2	-32.3	-179.2	57.7	0	0	0	0	112.1	M368 R370 T372 T379	M368-T375 HydrophobicContact CE-CG2 4.25Å; M368-T375 WeakPolarHBondContact O-CG2 3.34Å; R370-T375 WeakPolarHBondContact O-CB 3.35Å; R370-T375 WeakPolarHBondContact O-CG2 3.09Å; R370-T375 PolarHBondContact O-OG1 2.92Å; T372-T375 PolarHBondContact N-OG1 3.35Å; T372-T375 PolarHBondContact O-N 3.49Å; T372-T375 PolarHBondContact O-OG1 2.93Å; T372-T375 WeakPolarHBondContact OG1-CG2 3.41Å; T372-T375 PolarHBondContact OG1-N 3.21Å; T372-T375 PolarHBondContact OG1-OG1 3.02Å; T375-T379 VanDerWaalsContact O-CB 3.27Å; T375-T379 WeakPolarHBondContact O-CB 3.41Å; T375-T379 PolarHBondContact O-N 3.49Å; T375-T379 PolarHBondContact O-OG1 3.33Å
376	R	77.9	Confident	81.1	Confident	172 Å²	172	74.2 Å²	74.2	65%	0.649	36%	0.364	S	S	*	.	H	α-helix	trans	-62.8	-44	170.7	-69.2	-177.4	-149.8	162.1	7.5	111.7	T372 A373 L374 T379 K380	T372-R376 WeakPolarHBondContact O-CG 3.34Å; T372-R376 PolarHBondContact O-N 3.49Å; A373-R376 PolarHBondContact O-N 2.93Å; L374-R376 VanDerWaalsContact C-N 3.34Å; L374-R376 PolarHBondContact O-N 2.9Å; R376-T379 PolarHBondContact O-N 3.21Å; R376-K380 PolarHBondContact O-N 3.37Å
377	F	81.8	Confident	81.4	Confident	105 Å²	105	71.5 Å²	71.5	46%	0.461	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-49.1	176.1	177.9	-98.2	0	0	0	111.9	A373 L374 T379 K380 H381 I384	A373-F377 PolarHBondContact O-N 3.23Å; L374-F377 PolarHBondContact O-N 3.04Å; F377-T379 VanDerWaalsContact C-N 3.27Å; F377-T379 PolarHBondContact O-N 2.98Å; F377-K380 WeakPolarHBondContact O-CB 3.21Å; F377-K380 PolarHBondContact O-N 2.98Å; F377-K380 VanDerWaalsContact O-N 3.17Å; F377-H381 AromaticContact CE2-CD2 3.8Å; F377-H381 PolarHBondContact O-N 3.49Å; F377-I384 HydrophobicContact CE1-CD1 3.95Å; F377-I384 HydrophobicContact CZ-CD1 3.96Å
378	L	75.8	Confident	81.8	Confident	15 Å²	15	68.3 Å²	68.3	8%	0.079	35%	0.345	C	S	.	.	H	α-helix	trans	-60.9	-37.7	176.7	-68.1	171.4	0	0	0	111.4	L17 L374 H381 R382 I384 Y385	L17-L378 HydrophobicContact CD1-CB 4.09Å; L17-L378 WeakPolarHBondContact CD1-O 3.45Å; L17-L378 HydrophobicContact CD2-CB 4.09Å; L374-L378 HydrophobicContact CD1-CD1 4.23Å; L374-L378 HydrophobicContact CD1-CG 4.33Å; L374-L378 HydrophobicContact CG-CD1 3.97Å; L374-L378 HydrophobicContact CG-CG 4.46Å; L374-L378 WeakPolarHBondContact O-CB 3.29Å; L374-L378 VanDerWaalsContact O-CG 3.3Å; L374-L378 WeakPolarHBondContact O-CG 3.3Å; L374-L378 PolarHBondContact O-N 3.5Å; L378-H381 CarbonylContact O-C 3.03Å; L378-H381 PolarHBondContact O-N 3.15Å; L378-H381 VanDerWaalsContact O-O 3.11Å; L378-R382 WeakPolarHBondContact O-CA 3.48Å; L378-R382 PolarHBondContact O-N 3.46Å; L378-I384 HydrophobicContact CD2-CG2 4.18Å; L378-Y385 HydrophobicContact CD1-CD2 4.01Å; L378-Y385 HydrophobicContact CD2-CD2 4.49Å
379	T	68.9	Low	82.4	Confident	77 Å²	77	67.8 Å²	67.8	47%	0.472	34%	0.344	S	S	.	.	H	α-helix	trans	-67.7	-35.9	178	-54.7	0	0	0	0	111.9	T375 R376 F377	T375-T379 VanDerWaalsContact O-CB 3.27Å; T375-T379 WeakPolarHBondContact O-CB 3.41Å; T375-T379 PolarHBondContact O-N 3.49Å; T375-T379 PolarHBondContact O-OG1 3.33Å; R376-T379 PolarHBondContact O-N 3.21Å; F377-T379 VanDerWaalsContact C-N 3.27Å; F377-T379 PolarHBondContact O-N 2.98Å
380	K	78.4	Confident	83.4	Confident	166 Å²	166	64.7 Å²	64.7	72%	0.722	33%	0.332	S	S	*	.	H	α-helix	trans	-65.6	-39.5	173.2	-172.9	-179.7	178.5	-175.6	0	111.5	R376 F377	R376-K380 PolarHBondContact O-N 3.37Å; F377-K380 WeakPolarHBondContact O-CB 3.21Å; F377-K380 PolarHBondContact O-N 2.98Å; F377-K380 VanDerWaalsContact O-N 3.17Å
381	H	82.1	Confident	84	Confident	81 Å²	81	61.1 Å²	61.1	38%	0.375	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	73.4	-179.4	-62.8	-72.6	0	0	0	111.6	F377 L378 L383 I384	F377-H381 AromaticContact CE2-CD2 3.8Å; F377-H381 PolarHBondContact O-N 3.49Å; L378-H381 CarbonylContact O-C 3.03Å; L378-H381 PolarHBondContact O-N 3.15Å; L378-H381 VanDerWaalsContact O-O 3.11Å; H381-L383 PolarHBondContact O-N 3.42Å; H381-I384 HydrophobicContact CB-CB 4.33Å; H381-I384 HydrophobicContact CB-CD1 3.36Å; H381-I384 HydrophobicContact CB-CG1 3.72Å; H381-I384 WeakPolarHBondContact O-CB 3.36Å; H381-I384 PolarHBondContact O-N 2.94Å
382	R	80.8	Confident	85.1	Confident	31 Å²	31	60.3 Å²	60.3	12%	0.117	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-33.8	-173.3	-171.6	-174.6	-178	105.6	10.7	114.5	T16 L17 H172 L378 I384 P386	T16-R382 PolarHBondContact O-NH1 3.16Å; L17-R382 HydrophobicContact CD1-CG 4.46Å; L17-R382 PolarHBondContact O-NH2 3.01Å; H172-R382 VanDerWaalsContact CD2-CD 3.45Å; H172-R382 WeakPolarHBondContact CD2-CD 3.36Å; L378-R382 WeakPolarHBondContact O-CA 3.48Å; L378-R382 PolarHBondContact O-N 3.46Å; R382-I384 VanDerWaalsContact C-N 3.34Å; R382-P386 WeakPolarHBondContact O-CD 3.3Å
383	L	88.2	Confident	85.7	Confident	64 Å²	64	57.7 Å²	57.7	34%	0.335	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-21.6	-178.2	-59.3	176.6	0	0	0	113.4	L169 H381 Y385 P386 G387	L169-L383 HydrophobicContact CB-CD2 3.99Å; L169-L383 HydrophobicContact CD1-CD1 4.13Å; L169-L383 HydrophobicContact CD1-CD2 4.4Å; H381-L383 PolarHBondContact O-N 3.42Å; L383-Y385 VanDerWaalsContact C-N 3.34Å; L383-P386 WeakPolarHBondContact O-CD 3.42Å; L383-P386 WeakPolarHBondContact O-CG 3.38Å; L383-G387 PolarHBondContact O-N 2.9Å
384	I	89.8	Confident	86.4	Confident	75 Å²	75	53.8 Å²	53.8	39%	0.385	27%	0.265	S	S	.	.	H	α-helix	trans	-68.1	-38.2	-179.8	-64.1	-178.5	0	0	0	110.4	F377 L378 H381 R382 G387 A388	F377-I384 HydrophobicContact CE1-CD1 3.95Å; F377-I384 HydrophobicContact CZ-CD1 3.96Å; L378-I384 HydrophobicContact CD2-CG2 4.18Å; H381-I384 HydrophobicContact CB-CB 4.33Å; H381-I384 HydrophobicContact CB-CD1 3.36Å; H381-I384 HydrophobicContact CB-CG1 3.72Å; H381-I384 WeakPolarHBondContact O-CB 3.36Å; H381-I384 PolarHBondContact O-N 2.94Å; R382-I384 VanDerWaalsContact C-N 3.34Å; I384-G387 PolarHBondContact O-N 3.02Å; I384-A388 VanDerWaalsContact O-CB 3.25Å; I384-A388 WeakPolarHBondContact O-CB 3.36Å; I384-A388 PolarHBondContact O-N 3.28Å
385	Y	89.4	Confident	87.4	Confident	14 Å²	14	51.3 Å²	51.3	6%	0.055	25%	0.254	C	S	.	.	H	α-helix	trans	-57.9	-58.6	-178.8	178.3	-110.2	0	0	0	113.9	L17 L18 M368 L378 L383 G387 A388 V389 T470 P472	L17-Y385 HydrophobicContact CD2-CD1 4.06Å; L17-Y385 HydrophobicContact CD2-CD2 4.21Å; L17-Y385 HydrophobicContact CD2-CG 3.85Å; L18-Y385 HydrophobicContact CD2-CD1 4.11Å; L18-Y385 HydrophobicContact CD2-CE1 3.36Å; M368-Y385 HydrophobicContact CG-CE2 4.47Å; M368-Y385 HydrophobicContact SD-CD2 4.26Å; M368-Y385 HydrophobicContact SD-CE2 3.53Å; M368-Y385 VanDerWaalsContact SD-CE2 3.53Å; L378-Y385 HydrophobicContact CD1-CD2 4.01Å; L378-Y385 HydrophobicContact CD2-CD2 4.49Å; L383-Y385 VanDerWaalsContact C-N 3.34Å; Y385-G387 VanDerWaalsContact C-N 3.29Å; Y385-G387 PolarHBondContact O-N 3.4Å; Y385-A388 PolarHBondContact O-N 2.93Å; Y385-V389 HydrophobicContact CD2-CG2 4.25Å; Y385-V389 HydrophobicContact CE1-CG2 4.48Å; Y385-V389 HydrophobicContact CE2-CG2 3.83Å; Y385-V389 WeakPolarHBondContact O-CG2 3.26Å; Y385-V389 PolarHBondContact O-N 3.24Å; Y385-T470 PolarHBondContact OH-OG1 2.91Å; Y385-P472 HydrophobicContact CD1-CG 4.4Å
386	P	93	Very high	88.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64	-34.2	178.7	25.6	-33.8	0	0	0	112.4	V164 R382 L383 T390 M471 P472	V164-P386 HydrophobicContact CG1-CB 3.93Å; R382-P386 WeakPolarHBondContact O-CD 3.3Å; L383-P386 WeakPolarHBondContact O-CD 3.42Å; L383-P386 WeakPolarHBondContact O-CG 3.38Å; P386-T390 VanDerWaalsContact O-CB 3.29Å; P386-T390 WeakPolarHBondContact O-CB 3.42Å; P386-T390 PolarHBondContact O-N 3.36Å; P386-T390 PolarHBondContact O-OG1 3.41Å; P386-M471 HydrophobicContact CB-SD 4.31Å; P386-P472 HydrophobicContact CG-CG 4.3Å
387	G	94.4	Very high	89.1	Confident	10 Å²	10	47.4 Å²	47.4	10%	0.103	24%	0.242	C	C	.	.	H	α-helix	trans	-63.6	-44.8	174.7	0	0	0	0	0	113	L383 I384 Y385 T390 L391	L383-G387 PolarHBondContact O-N 2.9Å; I384-G387 PolarHBondContact O-N 3.02Å; Y385-G387 VanDerWaalsContact C-N 3.29Å; Y385-G387 PolarHBondContact O-N 3.4Å; G387-T390 PolarHBondContact O-N 2.92Å; G387-L391 WeakPolarHBondContact O-CB 3.43Å; G387-L391 PolarHBondContact O-N 3.48Å
388	A	92.9	Very high	89.7	Confident	40 Å²	40	43 Å²	43	33%	0.331	22%	0.223	S	C	.	.	H	α-helix	trans	-67.6	-42.4	179.1	0	0	0	0	0	112.5	I384 Y385 T390 L391 I392	I384-A388 VanDerWaalsContact O-CB 3.25Å; I384-A388 WeakPolarHBondContact O-CB 3.36Å; I384-A388 PolarHBondContact O-N 3.28Å; Y385-A388 PolarHBondContact O-N 2.93Å; A388-T390 VanDerWaalsContact C-N 3.32Å; A388-T390 PolarHBondContact O-N 3.48Å; A388-L391 WeakPolarHBondContact O-CB 3.47Å; A388-L391 PolarHBondContact O-N 2.9Å; A388-I392 VanDerWaalsContact O-CG1 3.31Å; A388-I392 WeakPolarHBondContact O-CG1 3.28Å; A388-I392 PolarHBondContact O-N 3.15Å
389	V	93.5	Very high	90.4	Very high	13 Å²	13	43.1 Å²	43.1	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-60.8	-45.1	174.4	170.9	0	0	0	0	110.5	Y385 I392 I393 V467 M471	Y385-V389 HydrophobicContact CD2-CG2 4.25Å; Y385-V389 HydrophobicContact CE1-CG2 4.48Å; Y385-V389 HydrophobicContact CE2-CG2 3.83Å; Y385-V389 WeakPolarHBondContact O-CG2 3.26Å; Y385-V389 PolarHBondContact O-N 3.24Å; V389-I392 PolarHBondContact O-N 3.27Å; V389-I393 HydrophobicContact CG1-CD1 3.79Å; V389-I393 HydrophobicContact CG1-CG1 4.48Å; V389-I393 WeakPolarHBondContact O-CG1 3.48Å; V389-I393 PolarHBondContact O-N 2.92Å; V389-V467 HydrophobicContact CG1-CG1 3.71Å; V389-V467 HydrophobicContact CG2-CG1 4.02Å; V389-M471 HydrophobicContact CB-CG 4.21Å; V389-M471 HydrophobicContact CB-SD 3.95Å; V389-M471 HydrophobicContact CG1-CG 3.93Å; V389-M471 HydrophobicContact CG1-SD 3.66Å
390	T	95.9	Very high	91.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.3	-42.5	178.2	-56.9	0	0	0	0	111.5	P160 I161 V164 M219 P386 G387 A388 I392 I393 A394	P160-T390 HydrophobicContact CB-CG2 3.67Å; I161-T390 HydrophobicContact CG1-CG2 3.91Å; V164-T390 HydrophobicContact CB-CG2 4.42Å; V164-T390 WeakPolarHBondContact CG1-OG1 3.3Å; V164-T390 HydrophobicContact CG2-CG2 4.14Å; M219-T390 HydrophobicContact CE-CG2 4.26Å; M219-T390 HydrophobicContact CG-CG2 4.34Å; M219-T390 HydrophobicContact SD-CG2 3.87Å; P386-T390 VanDerWaalsContact O-CB 3.29Å; P386-T390 WeakPolarHBondContact O-CB 3.42Å; P386-T390 PolarHBondContact O-N 3.36Å; P386-T390 PolarHBondContact O-OG1 3.41Å; G387-T390 PolarHBondContact O-N 2.92Å; A388-T390 VanDerWaalsContact C-N 3.32Å; A388-T390 PolarHBondContact O-N 3.48Å; T390-I392 PolarHBondContact O-N 3.32Å; T390-I393 PolarHBondContact O-N 2.87Å; T390-A394 WeakPolarHBondContact O-CB 3.38Å; T390-A394 PolarHBondContact O-N 3.23Å
391	L	96.1	Very high	92	Very high	73 Å²	73	35.9 Å²	35.9	38%	0.382	20%	0.201	S	C	.	.	H	α-helix	trans	-56.6	-49.2	175.2	176.7	65.3	0	0	0	111.5	I157 I161 G387 A388 A394 T395	I157-L391 HydrophobicContact CD1-CD1 4.08Å; I157-L391 HydrophobicContact CG2-CD1 3.36Å; I161-L391 HydrophobicContact CD1-CB 3.85Å; I161-L391 HydrophobicContact CD1-CD1 3.88Å; I161-L391 HydrophobicContact CD1-CG 4.44Å; G387-L391 WeakPolarHBondContact O-CB 3.43Å; G387-L391 PolarHBondContact O-N 3.48Å; A388-L391 WeakPolarHBondContact O-CB 3.47Å; A388-L391 PolarHBondContact O-N 2.9Å; L391-A394 PolarHBondContact O-N 3.13Å; L391-T395 WeakPolarHBondContact O-CB 3.49Å; L391-T395 PolarHBondContact O-N 3.5Å; L391-T395 PolarHBondContact O-OG1 3.22Å
392	I	95.1	Very high	92.4	Very high	85 Å²	85	35.4 Å²	35.4	44%	0.436	20%	0.198	S	C	.	.	H	α-helix	trans	-62.1	-48.9	-179.9	-67	166.2	0	0	0	110.5	A388 V389 T390 T395 F396 W463	A388-I392 VanDerWaalsContact O-CG1 3.31Å; A388-I392 WeakPolarHBondContact O-CG1 3.28Å; A388-I392 PolarHBondContact O-N 3.15Å; V389-I392 PolarHBondContact O-N 3.27Å; T390-I392 PolarHBondContact O-N 3.32Å; I392-T395 PolarHBondContact O-N 2.94Å; I392-F396 HydrophobicContact CG2-CD2 3.96Å; I392-F396 HydrophobicContact CG2-CE2 3.85Å; I392-F396 VanDerWaalsContact O-CD2 3.24Å; I392-F396 WeakPolarHBondContact O-CD2 3.2Å; I392-F396 PolarHBondContact O-N 3.43Å; I392-W463 HydrophobicContact CG2-CH2 4.11Å
393	I	95.4	Very high	92.8	Very high	2 Å²	2	34 Å²	34	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-63.7	-45.4	-179.6	-65.4	173	0	0	0	110.8	M219 V389 T390 T395 F396 T397 M464	M219-I393 HydrophobicContact CE-CG2 4.13Å; M219-I393 HydrophobicContact SD-CB 4.14Å; M219-I393 HydrophobicContact SD-CD1 4.43Å; M219-I393 HydrophobicContact SD-CG2 3.9Å; V389-I393 HydrophobicContact CG1-CD1 3.79Å; V389-I393 HydrophobicContact CG1-CG1 4.48Å; V389-I393 WeakPolarHBondContact O-CG1 3.48Å; V389-I393 PolarHBondContact O-N 2.92Å; T390-I393 PolarHBondContact O-N 2.87Å; I393-T395 VanDerWaalsContact C-N 3.33Å; I393-T395 PolarHBondContact O-N 2.97Å; I393-F396 PolarHBondContact O-N 3.44Å; I393-T397 WeakPolarHBondContact O-CB 3.48Å; I393-T397 PolarHBondContact O-N 3.3Å; I393-T397 PolarHBondContact O-OG1 3.45Å; I393-M464 HydrophobicContact CD1-CB 4.45Å; I393-M464 HydrophobicContact CG1-CB 4.4Å; I393-M464 HydrophobicContact CG1-CG 4.21Å; I393-M464 HydrophobicContact CG2-SD 4.25Å
394	A	95.1	Very high	92.9	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-63.6	-38.6	-179.9	0	0	0	0	0	111.9	W156 I157 T390 L391 T397 F398	W156-A394 VanDerWaalsContact CD1-O 3.28Å; W156-A394 PolarHBondContact NE1-O 2.82Å; W156-A394 VanDerWaalsContact NE1-O 3.1Å; I157-A394 HydrophobicContact CG1-CB 3.97Å; T390-A394 WeakPolarHBondContact O-CB 3.38Å; T390-A394 PolarHBondContact O-N 3.23Å; L391-A394 PolarHBondContact O-N 3.13Å; A394-T397 PolarHBondContact O-N 2.87Å; A394-F398 PolarHBondContact O-N 3.39Å; A394-F398 VanDerWaalsContact O-N 3.1Å
395	T	95.3	Very high	93	Very high	47 Å²	47	33.9 Å²	33.9	29%	0.288	19%	0.189	S	C	.	.	H	α-helix	trans	-59.9	-49.3	176.1	-58.1	0	0	0	0	111.4	Y153 L391 I392 I393 T397 F398	Y153-T395 HydrophobicContact CE2-CG2 4.25Å; Y153-T395 WeakPolarHBondContact OH-CG2 3.41Å; Y153-T395 PolarHBondContact OH-OG1 3.19Å; L391-T395 WeakPolarHBondContact O-CB 3.49Å; L391-T395 PolarHBondContact O-N 3.5Å; L391-T395 PolarHBondContact O-OG1 3.22Å; I392-T395 PolarHBondContact O-N 2.94Å; I393-T395 VanDerWaalsContact C-N 3.33Å; I393-T395 PolarHBondContact O-N 2.97Å; T395-T397 VanDerWaalsContact C-N 3.31Å; T395-T397 PolarHBondContact O-N 3.32Å; T395-F398 WeakPolarHBondContact O-CB 3.31Å; T395-F398 PolarHBondContact O-N 3.25Å
396	F	94.7	Very high	93	Very high	82 Å²	82	33.2 Å²	33.2	36%	0.36	19%	0.186	S	C	.	.	H	α-helix	trans	-71	-26.8	178.4	-76.2	-64.5	0	0	0	113.4	I392 I393 F398 F402 G403 M406 M460 W463 M464	I392-F396 HydrophobicContact CG2-CD2 3.96Å; I392-F396 HydrophobicContact CG2-CE2 3.85Å; I392-F396 VanDerWaalsContact O-CD2 3.24Å; I392-F396 WeakPolarHBondContact O-CD2 3.2Å; I392-F396 PolarHBondContact O-N 3.43Å; I393-F396 PolarHBondContact O-N 3.44Å; F396-F398 VanDerWaalsContact C-N 3.3Å; F396-F402 HydrophobicContact CB-CD1 4.46Å; F396-F402 HydrophobicContact CD1-CD1 4.05Å; F396-F402 HydrophobicContact CD1-CG 4.48Å; F396-G403 PolarHBondContact O-N 3.35Å; F396-M406 WeakPolarHBondContact O-CE 3.42Å; F396-M460 HydrophobicContact CB-CE 4.32Å; F396-M460 HydrophobicContact CD1-CE 4.13Å; F396-M460 HydrophobicContact CG-CE 4.12Å; F396-W463 HydrophobicContact CD2-CH2 4.1Å; F396-W463 HydrophobicContact CD2-CZ2 4.13Å; F396-W463 HydrophobicContact CE2-CH2 4.29Å; F396-W463 HydrophobicContact CE2-CZ2 4.37Å; F396-M464 HydrophobicContact CB-CE 3.37Å; F396-M464 HydrophobicContact CD2-CE 4.34Å; F396-M464 HydrophobicContact CG-CE 4.14Å
397	T	93.7	Very high	92.8	Very high	14 Å²	14	33.5 Å²	33.5	9%	0.086	19%	0.188	C	C	.	.	H	α-helix	trans	-84.4	-5.7	179.9	-46.7	0	0	0	0	112.2	W156 I393 A394 T395 P399 G408	W156-T397 HydrophobicContact CZ2-CG2 4.25Å; I393-T397 WeakPolarHBondContact O-CB 3.48Å; I393-T397 PolarHBondContact O-N 3.3Å; I393-T397 PolarHBondContact O-OG1 3.45Å; A394-T397 PolarHBondContact O-N 2.87Å; T395-T397 VanDerWaalsContact C-N 3.31Å; T395-T397 PolarHBondContact O-N 3.32Å; T397-P399 WeakPolarHBondContact O-CD 3.34Å; T397-G408 WeakPolarHBondContact CG2-O 3.49Å
398	F	94.5	Very high	92.4	Very high	13 Å²	13	33.1 Å²	33.1	6%	0.057	19%	0.185	C	C	.	.			trans	-58	117.7	-177.9	-179.8	-121.7	0	0	0	111.9	V149 Q152 Y153 W156 A394 T395 F396 P400 G401 G403	V149-F398 HydrophobicContact CG1-CE1 4.32Å; V149-F398 HydrophobicContact CG1-CZ 4.31Å; Q152-F398 HydrophobicContact CB-CE2 4.24Å; Q152-F398 HydrophobicContact CB-CZ 4.32Å; Y153-F398 HydrophobicContact CD2-CB 4.41Å; Y153-F398 AromaticContact CD2-CD1 3.87Å; Y153-F398 HydrophobicContact CD2-CD1 3.87Å; Y153-F398 HydrophobicContact CD2-CD2 4.15Å; Y153-F398 HydrophobicContact CD2-CE1 4.12Å; Y153-F398 HydrophobicContact CD2-CE2 4.39Å; Y153-F398 AromaticContact CD2-CG 3.89Å; Y153-F398 HydrophobicContact CD2-CG 3.89Å; Y153-F398 HydrophobicContact CD2-CZ 4.36Å; W156-F398 HydrophobicContact CB-CD2 3.88Å; W156-F398 HydrophobicContact CB-CE2 4.21Å; W156-F398 AromaticContact CD1-CD2 3.87Å; W156-F398 HydrophobicContact CD2-CD2 4.25Å; W156-F398 AromaticContact CG-CD2 3.72Å; W156-F398 HydrophobicContact CG-CD2 3.72Å; W156-F398 HydrophobicContact CG-CE2 4.46Å; A394-F398 PolarHBondContact O-N 3.39Å; A394-F398 VanDerWaalsContact O-N 3.1Å; T395-F398 WeakPolarHBondContact O-CB 3.31Å; T395-F398 PolarHBondContact O-N 3.25Å; F396-F398 VanDerWaalsContact C-N 3.3Å; F398-P400 HydrophobicContact CD1-CB 4.47Å; F398-P400 HydrophobicContact CE1-CB 3.81Å; F398-P400 HydrophobicContact CE1-CG 3.84Å; F398-P400 HydrophobicContact CE2-CG 4.06Å; F398-P400 HydrophobicContact CZ-CB 4.06Å; F398-P400 HydrophobicContact CZ-CG 3.58Å; F398-G401 PolarHBondContact O-N 2.9Å; F398-G403 VanDerWaalsContact O-CA 3.23Å; F398-G403 WeakPolarHBondContact O-CA 3.35Å; F398-G403 PolarHBondContact O-N 3.47Å
399	P	91.2	Very high	92.2	Very high	17 Å²	17	35.8 Å²	35.8	11%	0.11	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-47	-167.2	-21.1	29.7	0	0	0	115	W156 T397 G401 G403 Q404 E409	W156-P399 HydrophobicContact CE3-CG 4.35Å; W156-P399 HydrophobicContact CH2-CG 3.63Å; W156-P399 HydrophobicContact CZ2-CG 3.95Å; W156-P399 HydrophobicContact CZ3-CG 3.85Å; T397-P399 WeakPolarHBondContact O-CD 3.34Å; P399-G401 PolarHBondContact O-N 3.46Å; P399-G403 CarbonylContact O-C 3.53Å; P399-Q404 PolarHBondContact O-N 3.13Å; P399-E409 HydrophobicContact CB-CB 4.28Å; P399-E409 HydrophobicContact CG-CB 4.1Å
400	P	90	Very high	92	Very high	62 Å²	62	36 Å²	36	40%	0.403	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-17.2	176.7	-19.8	33.1	0	0	0	114.4	F398	F398-P400 HydrophobicContact CD1-CB 4.47Å; F398-P400 HydrophobicContact CE1-CB 3.81Å; F398-P400 HydrophobicContact CE1-CG 3.84Å; F398-P400 HydrophobicContact CE2-CG 4.06Å; F398-P400 HydrophobicContact CZ-CB 4.06Å; F398-P400 HydrophobicContact CZ-CG 3.58Å
401	G	90.6	Very high	91.7	Very high	30 Å²	30	36.6 Å²	36.6	31%	0.309	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-124.5	178.4	0	0	0	0	0	111.3	F398 P399 G403 Q404	F398-G401 PolarHBondContact O-N 2.9Å; P399-G401 PolarHBondContact O-N 3.46Å; G401-G403 PolarHBondContact O-N 2.88Å; G401-Q404 VanDerWaalsContact O-CG 3.29Å; G401-Q404 WeakPolarHBondContact O-CG 3.29Å; G401-Q404 PolarHBondContact O-NE2 3.26Å
402	F	91.1	Very high	91.4	Very high	70 Å²	70	34.8 Å²	34.8	31%	0.307	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-71	-18.2	178.1	-170.4	-107.8	0	0	0	112.9	F396 Q404 F405 M406 L456 M460	F396-F402 HydrophobicContact CB-CD1 4.46Å; F396-F402 HydrophobicContact CD1-CD1 4.05Å; F396-F402 HydrophobicContact CD1-CG 4.48Å; F402-Q404 PolarHBondContact O-N 3.46Å; F402-F405 HydrophobicContact CD2-CD2 4.18Å; F402-F405 HydrophobicContact CE2-CD2 4.5Å; F402-F405 PolarHBondContact O-N 3.4Å; F402-M406 HydrophobicContact CD1-CE 3.17Å; F402-M406 HydrophobicContact CE1-CE 3.36Å; F402-M406 HydrophobicContact CG-CE 4.35Å; F402-L456 HydrophobicContact CE1-CD2 3.7Å; F402-L456 HydrophobicContact CE1-CG 4.47Å; F402-L456 HydrophobicContact CE2-CD1 4.03Å; F402-L456 HydrophobicContact CE2-CD2 4.38Å; F402-L456 HydrophobicContact CZ-CD1 3.72Å; F402-L456 HydrophobicContact CZ-CD2 3.55Å; F402-L456 HydrophobicContact CZ-CG 3.89Å; F402-M460 HydrophobicContact CD1-CE 4.29Å; F402-M460 HydrophobicContact CE1-CE 3.62Å; F402-M460 HydrophobicContact CE1-CG 3.77Å; F402-M460 HydrophobicContact CE1-SD 3.86Å; F402-M460 HydrophobicContact CZ-CE 4.39Å; F402-M460 HydrophobicContact CZ-CG 4.21Å; F402-M460 HydrophobicContact CZ-SD 4.16Å
403	G	89.9	Confident	91	Very high	1 Å²	1	37 Å²	37	1%	0.01	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-59	-26	177.7	0	0	0	0	0	114.5	F396 F398 P399 G401 F405 M406 A407 G408	F396-G403 PolarHBondContact O-N 3.35Å; F398-G403 VanDerWaalsContact O-CA 3.23Å; F398-G403 WeakPolarHBondContact O-CA 3.35Å; F398-G403 PolarHBondContact O-N 3.47Å; P399-G403 CarbonylContact O-C 3.53Å; G401-G403 PolarHBondContact O-N 2.88Å; G403-F405 PolarHBondContact O-N 3.45Å; G403-M406 CarbonylContact O-C 3.59Å; G403-M406 PolarHBondContact O-N 2.89Å; G403-M406 VanDerWaalsContact O-N 3.11Å; G403-A407 PolarHBondContact O-N 3.03Å; G403-A407 VanDerWaalsContact O-N 3.12Å; G403-G408 PolarHBondContact O-N 3.28Å
404	Q	89.8	Confident	90.6	Very high	82 Å²	82	38.3 Å²	38.3	38%	0.383	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-60.9	-28.5	177.8	72.2	-170.5	-23.9	0	0	113	P399 G401 F402	P399-Q404 PolarHBondContact O-N 3.13Å; G401-Q404 VanDerWaalsContact O-CG 3.29Å; G401-Q404 WeakPolarHBondContact O-CG 3.29Å; G401-Q404 PolarHBondContact O-NE2 3.26Å; F402-Q404 PolarHBondContact O-N 3.46Å
405	F	90.8	Very high	90.5	Very high	55 Å²	55	38.5 Å²	38.5	24%	0.241	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-92.5	-3.7	-180	-54.5	-63.3	0	0	0	113.4	F402 G403 V448 I453 L456	F402-F405 HydrophobicContact CD2-CD2 4.18Å; F402-F405 HydrophobicContact CE2-CD2 4.5Å; F402-F405 PolarHBondContact O-N 3.4Å; G403-F405 PolarHBondContact O-N 3.45Å; F405-V448 HydrophobicContact CD1-CG2 4.19Å; F405-V448 HydrophobicContact CE1-CG2 3.89Å; F405-I453 WeakPolarHBondContact O-CA 3.14Å; F405-I453 WeakPolarHBondContact O-CG2 3.36Å; F405-L456 HydrophobicContact CB-CD1 4.07Å; F405-L456 HydrophobicContact CB-CD2 3.97Å
406	M	89.5	Confident	90.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.7	16	-179.8	74.8	168.9	80.2	0	0	113.2	F396 F402 G403 G408 L456 F457 M460 M464	F396-M406 WeakPolarHBondContact O-CE 3.42Å; F402-M406 HydrophobicContact CD1-CE 3.17Å; F402-M406 HydrophobicContact CE1-CE 3.36Å; F402-M406 HydrophobicContact CG-CE 4.35Å; G403-M406 CarbonylContact O-C 3.59Å; G403-M406 PolarHBondContact O-N 2.89Å; G403-M406 VanDerWaalsContact O-N 3.11Å; M406-G408 PolarHBondContact O-N 3.07Å; M406-L456 HydrophobicContact CB-CD2 3.9Å; M406-F457 HydrophobicContact CB-CB 4.35Å; M406-F457 HydrophobicContact CB-CD2 4.25Å; M406-F457 WeakPolarHBondContact O-CD2 3.23Å; M406-M460 HydrophobicContact CE-CB 4.25Å; M406-M460 HydrophobicContact CE-CG 4.38Å; M406-M464 HydrophobicContact CE-CE 4.47Å
407	A	88.8	Confident	90.1	Very high	6 Å²	6	35.8 Å²	35.8	5%	0.05	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	45.6	-172.3	0	0	0	0	0	112.5	G403 E409 L410 A442 W443	G403-A407 PolarHBondContact O-N 3.03Å; G403-A407 VanDerWaalsContact O-N 3.12Å; A407-E409 PolarHBondContact O-N 2.94Å; A407-E409 VanDerWaalsContact O-N 3.07Å; A407-L410 HydrophobicContact CB-CD1 3.82Å; A407-L410 HydrophobicContact CB-CG 4.22Å; A407-L410 WeakPolarHBondContact O-CB 3.32Å; A407-L410 PolarHBondContact O-N 3.44Å; A407-A442 HydrophobicContact CB-CB 4.09Å; A407-A442 WeakPolarHBondContact CB-O 3.41Å; A407-W443 HydrophobicContact CB-CD2 3.96Å; A407-W443 HydrophobicContact CB-CE3 4.05Å; A407-W443 HydrophobicContact CB-CG 4.48Å; A407-W443 HydrophobicContact CB-CH2 4.43Å; A407-W443 HydrophobicContact CB-CZ2 4.36Å; A407-W443 HydrophobicContact CB-CZ3 4.27Å
408	G	87.1	Confident	90	Very high	3 Å²	3	35.3 Å²	35.3	3%	0.031	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.4	-170.4	0	0	0	0	0	115.4	T397 G403 M406 L410	T397-G408 WeakPolarHBondContact CG2-O 3.49Å; G403-G408 PolarHBondContact O-N 3.28Å; M406-G408 PolarHBondContact O-N 3.07Å; G408-L410 VanDerWaalsContact C-N 3.29Å; G408-L410 PolarHBondContact O-N 2.88Å
409	E	88.1	Confident	89.9	Confident	95 Å²	95	34.7 Å²	34.7	44%	0.444	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-23	174.3	-170.9	176.1	178.1	0	0	113	P399 A407 M411	P399-E409 HydrophobicContact CB-CB 4.28Å; P399-E409 HydrophobicContact CG-CB 4.1Å; A407-E409 PolarHBondContact O-N 2.94Å; A407-E409 VanDerWaalsContact O-N 3.07Å; E409-M411 PolarHBondContact O-N 3.35Å
410	L	89.6	Confident	90	Very high	19 Å²	19	34.2 Å²	34.2	10%	0.099	18%	0.175	C	C	.	.			trans	-75.3	122.5	-177.8	-65.6	179.9	0	0	0	111.4	A407 G408 C415 R439 A442 W443	A407-L410 HydrophobicContact CB-CD1 3.82Å; A407-L410 HydrophobicContact CB-CG 4.22Å; A407-L410 WeakPolarHBondContact O-CB 3.32Å; A407-L410 PolarHBondContact O-N 3.44Å; G408-L410 VanDerWaalsContact C-N 3.29Å; G408-L410 PolarHBondContact O-N 2.88Å; L410-C415 HydrophobicContact CB-CB 4.16Å; L410-R439 HydrophobicContact CD2-CB 4.29Å; L410-A442 HydrophobicContact CD1-CB 3.99Å; L410-A442 HydrophobicContact CD2-CB 4.11Å; L410-A442 HydrophobicContact CG-CB 3.88Å; L410-W443 HydrophobicContact CD1-CZ2 4.12Å
411	M	90.2	Very high	90	Very high	11 Å²	11	32.6 Å²	32.6	5%	0.054	16%	0.163	C	C	.	.			trans	-78.5	155.4	174.1	-63.2	-60.2	153.8	0	0	110.7	L135 Y138 K139 W156 E409 R413 E414 C415	L135-M411 HydrophobicContact CD1-CE 4.43Å; L135-M411 HydrophobicContact CD1-CG 4.26Å; L135-M411 HydrophobicContact CD1-SD 3.62Å; L135-M411 HydrophobicContact CD2-CB 3.51Å; L135-M411 HydrophobicContact CD2-CG 3.35Å; L135-M411 HydrophobicContact CD2-SD 3.76Å; L135-M411 HydrophobicContact CG-CB 4.44Å; L135-M411 HydrophobicContact CG-CG 3.74Å; L135-M411 HydrophobicContact CG-SD 3.79Å; Y138-M411 HydrophobicContact CD1-CE 3.92Å; Y138-M411 HydrophobicContact CE1-CE 3.84Å; K139-M411 HydrophobicContact CG-CE 4.3Å; W156-M411 HydrophobicContact CH2-CE 4.13Å; E409-M411 PolarHBondContact O-N 3.35Å; M411-R413 VanDerWaalsContact C-N 3.34Å; M411-R413 PolarHBondContact O-N 3.43Å; M411-R413 VanDerWaalsContact O-N 3.11Å; M411-E414 HydrophobicContact CB-CG 4.39Å; M411-E414 PolarHBondContact O-N 3.28Å; M411-C415 WeakPolarHBondContact O-CB 3.24Å; M411-C415 PolarHBondContact O-N 3.36Å
412	P	88.4	Confident	89.7	Confident	36 Å²	36	33.6 Å²	33.6	23%	0.234	16%	0.161	C	C	.	.	H	α-helix	trans	-49.1	-46.5	-171.1	-31.8	36.5	0	0	0	115.3	E414 C415 I416 I483	P412-E414 PolarHBondContact O-N 2.92Å; P412-C415 WeakPolarHBondContact O-CB 3.42Å; P412-C415 PolarHBondContact O-N 2.93Å; P412-I416 WeakPolarHBondContact O-CG1 3.46Å; P412-I416 PolarHBondContact O-N 2.89Å; P412-I416 VanDerWaalsContact O-N 3.16Å; P412-I483 HydrophobicContact CB-CD1 3.73Å
413	R	86.3	Confident	89.4	Confident	130 Å²	130	34.6 Å²	34.6	49%	0.491	17%	0.165	S	C	.	.	H	α-helix	trans	-65.6	-37.6	179.4	-168.1	179.4	176.5	166.9	-6.8	112.8	F325 M411 N417	F325-R413 HydrophobicContact CE1-CG 3.67Å; F325-R413 HydrophobicContact CZ-CG 4.19Å; M411-R413 VanDerWaalsContact C-N 3.34Å; M411-R413 PolarHBondContact O-N 3.43Å; M411-R413 VanDerWaalsContact O-N 3.11Å; R413-N417 PolarHBondContact O-N 3.21Å
414	E	88.9	Confident	89.3	Confident	31 Å²	31	35.9 Å²	35.9	15%	0.145	17%	0.173	C	C	.	.	H	α-helix	trans	-76.9	-35.9	179.9	-52.7	179	164.2	0	0	111.4	K139 M411 P412 I416 N417 S418 R439	K139-E414 IonicContact NZ-OE1 2.92Å; K139-E414 PolarHBondContact NZ-OE1 3.37Å; K139-E414 IonicContact NZ-OE2 2.57Å; K139-E414 PolarHBondContact NZ-OE2 3.06Å; M411-E414 HydrophobicContact CB-CG 4.39Å; M411-E414 PolarHBondContact O-N 3.28Å; P412-E414 PolarHBondContact O-N 2.92Å; E414-I416 VanDerWaalsContact C-N 3.34Å; E414-I416 PolarHBondContact O-N 2.99Å; E414-N417 PolarHBondContact O-N 3.03Å; E414-S418 PolarHBondContact O-N 3.26Å; E414-S418 PolarHBondContact O-OG 2.8Å; E414-R439 IonicContact OE1-CZ 3.9Å; E414-R439 VanDerWaalsContact OE1-CZ 3.25Å; E414-R439 IonicContact OE1-NH1 3.71Å; E414-R439 PolarHBondContact OE1-NH1 2.98Å; E414-R439 IonicContact OE1-NH2 3.51Å; E414-R439 IonicContact OE2-NH1 2.72Å
415	C	91.9	Very high	89.2	Confident	4 Å²	4	32 Å²	32	3%	0.027	16%	0.155	C	C	.	.	H	α-helix	trans	-57.3	-47.4	174.1	-177.8	0	0	0	0	110.5	L410 M411 P412 N417 S418 L419 F457	L410-C415 HydrophobicContact CB-CB 4.16Å; M411-C415 WeakPolarHBondContact O-CB 3.24Å; M411-C415 PolarHBondContact O-N 3.36Å; P412-C415 WeakPolarHBondContact O-CB 3.42Å; P412-C415 PolarHBondContact O-N 2.93Å; C415-N417 PolarHBondContact O-N 2.61Å; C415-S418 WeakPolarHBondContact CA-OG 3.4Å; C415-S418 PolarHBondContact O-N 3.21Å; C415-S418 PolarHBondContact O-OG 3.48Å; C415-L419 WeakPolarHBondContact O-CG 2.82Å; C415-L419 PolarHBondContact O-N 3.01Å; C415-F457 WeakPolarHBondContact SG-CZ 3.15Å
416	I	91.9	Very high	88.8	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.2	-48.8	176	-65.4	167	0	0	0	111.3	F325 P412 E414 S418 L419 F420 M479 F482 I483	F325-I416 HydrophobicContact CD1-CB 4.43Å; F325-I416 HydrophobicContact CD1-CG2 3.92Å; F325-I416 HydrophobicContact CD2-CG2 4.34Å; F325-I416 HydrophobicContact CE1-CB 4.13Å; F325-I416 HydrophobicContact CE1-CD1 4.34Å; F325-I416 HydrophobicContact CE1-CG2 4Å; F325-I416 HydrophobicContact CE2-CD1 4.42Å; F325-I416 HydrophobicContact CE2-CG2 4.44Å; F325-I416 HydrophobicContact CG-CG2 4.08Å; F325-I416 HydrophobicContact CZ-CB 4.49Å; F325-I416 HydrophobicContact CZ-CD1 3.91Å; F325-I416 HydrophobicContact CZ-CG2 4.28Å; P412-I416 WeakPolarHBondContact O-CG1 3.46Å; P412-I416 PolarHBondContact O-N 2.89Å; P412-I416 VanDerWaalsContact O-N 3.16Å; E414-I416 VanDerWaalsContact C-N 3.34Å; E414-I416 PolarHBondContact O-N 2.99Å; I416-S418 VanDerWaalsContact C-N 3.27Å; I416-S418 PolarHBondContact O-N 2.86Å; I416-L419 PolarHBondContact O-N 3.39Å; I416-L419 VanDerWaalsContact O-N 3.13Å; I416-F420 HydrophobicContact CG2-CD2 3.68Å; I416-F420 HydrophobicContact CG2-CE1 4.48Å; I416-F420 HydrophobicContact CG2-CE2 3.36Å; I416-F420 HydrophobicContact CG2-CG 4.37Å; I416-F420 HydrophobicContact CG2-CZ 3.83Å; I416-F420 WeakPolarHBondContact O-CG 3.37Å; I416-F420 PolarHBondContact O-N 2.9Å; I416-M479 HydrophobicContact CD1-CE 4.49Å; I416-M479 HydrophobicContact CD1-CG 4.47Å; I416-M479 HydrophobicContact CD1-SD 3.29Å; I416-M479 WeakPolarHBondContact CD1-SD 3.41Å; I416-F482 HydrophobicContact CD1-CD1 4.13Å; I416-F482 HydrophobicContact CD1-CE1 4.46Å; I416-F482 HydrophobicContact CG2-CE1 4.22Å; I416-I483 HydrophobicContact CD1-CD1 4.2Å; I416-I483 HydrophobicContact CD1-CG1 3.79Å; I416-I483 HydrophobicContact CG1-CD1 4.2Å; I416-I483 HydrophobicContact CG1-CG1 3.56Å
417	N	89.8	Confident	88.3	Confident	73 Å²	73	36 Å²	36	39%	0.39	18%	0.175	S	C	.	.	H	α-helix	trans	-58.2	-40.2	177.7	-80.4	-25.9	0	0	0	112.3	F325 R413 E414 C415 D421	F325-N417 VanDerWaalsContact CD1-OD1 3.31Å; F325-N417 WeakPolarHBondContact CD1-OD1 3.18Å; R413-N417 PolarHBondContact O-N 3.21Å; E414-N417 PolarHBondContact O-N 3.03Å; C415-N417 PolarHBondContact O-N 2.61Å; N417-D421 PolarHBondContact O-N 2.87Å
418	S	91.7	Very high	87.6	Confident	4 Å²	4	37.6 Å²	37.6	3%	0.028	18%	0.183	C	C	.	.	H	α-helix	trans	-69.3	-37.9	176.2	67.6	0	0	0	0	112.6	E414 C415 I416 F420 D421 W425 W443	E414-S418 PolarHBondContact O-N 3.26Å; E414-S418 PolarHBondContact O-OG 2.8Å; C415-S418 WeakPolarHBondContact CA-OG 3.4Å; C415-S418 PolarHBondContact O-N 3.21Å; C415-S418 PolarHBondContact O-OG 3.48Å; I416-S418 VanDerWaalsContact C-N 3.27Å; I416-S418 PolarHBondContact O-N 2.86Å; S418-F420 VanDerWaalsContact C-N 3.3Å; S418-F420 PolarHBondContact O-N 3.37Å; S418-D421 WeakPolarHBondContact O-CB 3.26Å; S418-D421 PolarHBondContact O-N 3.47Å; S418-W425 WeakPolarHBondContact O-CZ2 3.33Å; S418-W443 PolarHBondContact OG-NE1 3.28Å
419	L	93.3	Very high	86	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.6	-32.4	178.2	-71.6	168.1	0	0	0	112.1	C415 I416 D421 W425 W443 L454 I483 A486 A487 R490 A519	C415-L419 WeakPolarHBondContact O-CG 2.82Å; C415-L419 PolarHBondContact O-N 3.01Å; I416-L419 PolarHBondContact O-N 3.39Å; I416-L419 VanDerWaalsContact O-N 3.13Å; L419-D421 PolarHBondContact O-N 3.22Å; L419-W425 HydrophobicContact CD2-CH2 4.25Å; L419-W443 HydrophobicContact CD2-CH2 3.99Å; L419-W443 HydrophobicContact CD2-CZ2 3.74Å; L419-W443 HydrophobicContact CG-CZ2 3.99Å; L419-L454 HydrophobicContact CD2-CD2 4.05Å; L419-I483 HydrophobicContact CD1-CG2 4.38Å; L419-A486 HydrophobicContact CB-CB 4.28Å; L419-A486 HydrophobicContact CD1-CB 3.79Å; L419-A487 HydrophobicContact CD1-CB 4.35Å; L419-A487 HydrophobicContact CD2-CB 4.42Å; L419-R490 HydrophobicContact CD2-CB 4.04Å; L419-R490 HydrophobicContact CD2-CG 4.06Å; L419-R490 WeakPolarHBondContact O-CD 3.49Å; L419-R490 PolarHBondContact O-NH1 3.31Å; L419-A519 WeakPolarHBondContact O-CB 3.19Å
420	F	92.5	Very high	84.4	Confident	7 Å²	7	43.8 Å²	43.8	3%	0.031	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	6.3	177.9	-64.8	-11	0	0	0	114	F325 T327 I416 S418 F482 A486 A519 V520 A523 T544	F325-F420 HydrophobicContact CB-CD2 4.34Å; F325-F420 HydrophobicContact CB-CE2 4.47Å; T327-F420 HydrophobicContact CG2-CB 3.82Å; T327-F420 HydrophobicContact CG2-CD2 4.26Å; T327-F420 HydrophobicContact CG2-CG 4.39Å; I416-F420 HydrophobicContact CG2-CD2 3.68Å; I416-F420 HydrophobicContact CG2-CE1 4.48Å; I416-F420 HydrophobicContact CG2-CE2 3.36Å; I416-F420 HydrophobicContact CG2-CG 4.37Å; I416-F420 HydrophobicContact CG2-CZ 3.83Å; I416-F420 WeakPolarHBondContact O-CG 3.37Å; I416-F420 PolarHBondContact O-N 2.9Å; S418-F420 VanDerWaalsContact C-N 3.3Å; S418-F420 PolarHBondContact O-N 3.37Å; F420-F482 HydrophobicContact CE2-CE1 4.08Å; F420-F482 HydrophobicContact CE2-CZ 4.33Å; F420-F482 AromaticContact CZ-CE1 3.61Å; F420-F482 HydrophobicContact CZ-CE1 3.61Å; F420-F482 AromaticContact CZ-CZ 3.85Å; F420-F482 HydrophobicContact CZ-CZ 3.85Å; F420-A486 HydrophobicContact CE1-CB 3.84Å; F420-A519 HydrophobicContact CD1-CB 3.93Å; F420-A519 HydrophobicContact CE1-CB 4.21Å; F420-V520 HydrophobicContact CD1-CG2 3.6Å; F420-V520 HydrophobicContact CD2-CG2 4.1Å; F420-V520 HydrophobicContact CE1-CB 4.31Å; F420-V520 HydrophobicContact CE1-CG2 3.65Å; F420-V520 HydrophobicContact CE2-CG2 4.13Å; F420-V520 HydrophobicContact CG-CG2 3.84Å; F420-V520 HydrophobicContact CZ-CG2 3.91Å; F420-A523 HydrophobicContact CE1-CB 4.31Å; F420-A523 HydrophobicContact CZ-CB 4.18Å; F420-T544 HydrophobicContact CD2-CG2 4.43Å; F420-T544 HydrophobicContact CE2-CG2 4.19Å
421	D	88.9	Confident	82.6	Confident	28 Å²	28	48.2 Å²	48.2	15%	0.15	26%	0.257	C	S	.	.			trans	-62.9	150.1	-179.6	-163.4	-2.5	0	0	0	112.1	N417 S418 L419 F423 S440 R490	N417-D421 PolarHBondContact O-N 2.87Å; S418-D421 WeakPolarHBondContact O-CB 3.26Å; S418-D421 PolarHBondContact O-N 3.47Å; L419-D421 PolarHBondContact O-N 3.22Å; D421-F423 WeakPolarHBondContact OD1-CD2 3.36Å; D421-F423 WeakPolarHBondContact OD2-CD2 3.47Å; D421-S440 WeakPolarHBondContact OD2-CB 3.31Å; D421-S440 PolarHBondContact OD2-OG 3.04Å; D421-R490 PolarHBondContact O-NH1 3.02Å
422	N	84.6	Confident	80.6	Confident	51 Å²	51	53.6 Å²	53.6	27%	0.273	29%	0.29	S	S	.	.	S	Bend	trans	-84.5	-16.2	-174.6	-68.7	-13	0	0	0	113.2	N328 F329 L514	N328-N422 PolarHBondContact O-ND2 3.46Å; F329-N422 WeakPolarHBondContact CD1-OD1 3.22Å; F329-N422 WeakPolarHBondContact CE1-OD1 3Å; N422-L514 HydrophobicContact CB-CD2 4.38Å
423	F	85.3	Confident	78.9	Confident	90 Å²	90	55.4 Å²	55.4	40%	0.395	31%	0.308	S	S	.	.	S	Bend	trans	-72.3	146.2	-177.7	-60.8	-66.8	0	0	0	111.9	D421 I428 L437 R490	D421-F423 WeakPolarHBondContact OD1-CD2 3.36Å; D421-F423 WeakPolarHBondContact OD2-CD2 3.47Å; F423-I428 HydrophobicContact CB-CD1 4.26Å; F423-L437 HydrophobicContact CB-CD1 4.4Å; F423-L437 HydrophobicContact CD2-CD1 4.01Å; F423-L437 HydrophobicContact CG-CD1 4.32Å; F423-R490 PolarHBondContact O-NH2 3.14Å
424	T	87.9	Confident	77.2	Confident	28 Å²	28	51.4 Å²	51.4	17%	0.172	30%	0.303	C	S	.	.			trans	-88.5	109	169.5	-51.4	0	0	0	0	108.7	T426 K427 A497 P515	T424-T426 VanDerWaalsContact C-N 3.29Å; T424-T426 WeakPolarHBondContact CG2-OG1 3.47Å; T424-T426 PolarHBondContact O-N 3.28Å; T424-K427 HydrophobicContact CG2-CD 4.43Å; T424-K427 HydrophobicContact CG2-CG 4.18Å; T424-K427 PolarHBondContact O-N 3.33Å; T424-A497 HydrophobicContact CG2-CB 3.66Å; T424-P515 HydrophobicContact CG2-CG 4.41Å
425	W	87.4	Confident	75.3	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.008	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-68.6	-29.9	-171.2	-64.9	-22.6	0	0	0	113.1	S418 L419 K427 I428 W443 L444 V450 L454 R490 E494	S418-W425 WeakPolarHBondContact O-CZ2 3.33Å; L419-W425 HydrophobicContact CD2-CH2 4.25Å; W425-K427 PolarHBondContact O-N 3.3Å; W425-I428 PolarHBondContact O-N 2.58Å; W425-W443 HydrophobicContact CE3-CB 4.16Å; W425-W443 HydrophobicContact CE3-CG 4.37Å; W425-W443 HydrophobicContact CH2-CB 4.09Å; W425-W443 AromaticContact CH2-CD1 3.32Å; W425-W443 AromaticContact CH2-CD2 3.76Å; W425-W443 HydrophobicContact CH2-CD2 3.76Å; W425-W443 AromaticContact CH2-CE2 3.81Å; W425-W443 AromaticContact CH2-CG 3.47Å; W425-W443 HydrophobicContact CH2-CG 3.47Å; W425-W443 VanDerWaalsContact CH2-CG 3.47Å; W425-W443 AromaticContact CH2-NE1 3.53Å; W425-W443 HydrophobicContact CZ2-CB 4.46Å; W425-W443 AromaticContact CZ2-CD1 3.59Å; W425-W443 HydrophobicContact CZ2-CG 4.03Å; W425-W443 HydrophobicContact CZ3-CB 3.92Å; W425-W443 AromaticContact CZ3-CD2 3.85Å; W425-W443 HydrophobicContact CZ3-CD2 3.85Å; W425-W443 HydrophobicContact CZ3-CE3 4.32Å; W425-W443 AromaticContact CZ3-CG 3.66Å; W425-W443 HydrophobicContact CZ3-CG 3.66Å; W425-L444 HydrophobicContact CB-CD2 4.48Å; W425-V450 HydrophobicContact CB-CG1 4Å; W425-V450 HydrophobicContact CB-CG2 4.31Å; W425-V450 HydrophobicContact CD2-CG1 4.39Å; W425-V450 HydrophobicContact CE3-CG1 3.61Å; W425-V450 HydrophobicContact CZ3-CG1 4.44Å; W425-L454 HydrophobicContact CE3-CD1 4.3Å; W425-L454 HydrophobicContact CZ3-CD1 4.15Å; W425-L454 HydrophobicContact CZ3-CD2 4.09Å; W425-L454 HydrophobicContact CZ3-CG 4.33Å; W425-R490 HydrophobicContact CH2-CG 4.39Å; W425-R490 HydrophobicContact CZ3-CG 4.02Å; W425-E494 PolarHBondContact N-OE1 2.98Å; W425-E494 PolarHBondContact N-OE2 2.78Å
426	T	83.6	Confident	73.7	Confident	39 Å²	39	59.2 Å²	59.2	24%	0.239	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-66.5	-21.4	178.9	49.1	0	0	0	0	114.5	T424 F451 E494 T498	T424-T426 VanDerWaalsContact C-N 3.29Å; T424-T426 WeakPolarHBondContact CG2-OG1 3.47Å; T424-T426 PolarHBondContact O-N 3.28Å; T426-F451 HydrophobicContact CG2-CE1 4.27Å; T426-F451 HydrophobicContact CG2-CE2 3.66Å; T426-F451 HydrophobicContact CG2-CZ 3.52Å; T426-E494 HydrophobicContact CG2-CB 4.34Å; T426-E494 WeakPolarHBondContact CG2-OE2 3.41Å; T426-E494 PolarHBondContact N-OE2 2.9Å; T426-E494 PolarHBondContact OG1-OE2 2.87Å; T426-T498 HydrophobicContact CG2-CG2 3.86Å
427	K	78.1	Confident	72.5	Confident	98 Å²	98	59.8 Å²	59.8	43%	0.426	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-91.3	-10	179.2	-69	-173.1	176.5	178.6	0	113.7	T424 W425 S429 P501	T424-K427 HydrophobicContact CG2-CD 4.43Å; T424-K427 HydrophobicContact CG2-CG 4.18Å; T424-K427 PolarHBondContact O-N 3.33Å; W425-K427 PolarHBondContact O-N 3.3Å; K427-S429 PolarHBondContact O-N 2.85Å; K427-S429 VanDerWaalsContact O-N 3.16Å; K427-P501 PolarHBondContact NZ-O 3.43Å
428	I	73.1	Confident	71.8	Confident	41 Å²	41	59.4 Å²	59.4	21%	0.21	38%	0.383	C	S	.	.			trans	-85.8	89.7	179.8	-56.6	171.5	0	0	0	107	F423 W425 L437 L444	F423-I428 HydrophobicContact CB-CD1 4.26Å; W425-I428 PolarHBondContact O-N 2.58Å; I428-L437 HydrophobicContact CD1-CD1 3.48Å; I428-L437 VanDerWaalsContact CD1-CD1 3.48Å; I428-L437 HydrophobicContact CD1-CD2 4.32Å; I428-L444 HydrophobicContact CG2-CD1 4.27Å
429	S	54.1	Low	71.3	Confident	108 Å²	108	66.6 Å²	66.6	76%	0.755	41%	0.41	S	S	*	.			trans	-87.6	-17.8	-173.8	-58.8	0	0	0	0	114	K427	K427-S429 PolarHBondContact O-N 2.85Å; K427-S429 VanDerWaalsContact O-N 3.16Å
430	D	54.7	Low	70.8	Confident	120 Å²	120	66.8 Å²	66.8	64%	0.642	41%	0.411	S	S	*	.			trans	-109.7	129	178	-84.6	-45.2	0	0	0	112.4	V432	D430-V432 PolarHBondContact O-N 3.49Å
431	P	51.5	Low	70.4	Confident	111 Å²	111	68.9 Å²	68.9	72%	0.721	43%	0.43	S	S	*	.			trans	-74.1	-1.8	175.7	29.9	-33.5	0	0	0	113.5	A433	P431-A433 PolarHBondContact O-N 3.47Å
432	V	49.3	Very low	70.3	Confident	124 Å²	124	69.2 Å²	69.2	75%	0.752	44%	0.437	S	S	*	.	S	Bend	trans	-69.5	87	166.5	-176.1	0	0	0	0	106.6	D430 A434	D430-V432 PolarHBondContact O-N 3.49Å; V432-A434 PolarHBondContact O-N 3.46Å
433	A	51.5	Low	70.5	Confident	74 Å²	74	66.8 Å²	66.8	61%	0.612	42%	0.424	S	S	*	.			trans	-27.1	102.7	-175.1	0	0	0	0	0	112.2	P431 P435	P431-A433 PolarHBondContact O-N 3.47Å; A433-P435 VanDerWaalsContact O-N 3.09Å
434	A	51.2	Low	70.6	Confident	47 Å²	47	65 Å²	65	39%	0.388	42%	0.417	S	S	.	.			trans	-48.7	123.7	166	0	0	0	0	0	106.9	V432 G436 L437	V432-A434 PolarHBondContact O-N 3.46Å; A434-G436 PolarHBondContact O-N 3.37Å; A434-L437 PolarHBondContact O-N 3.21Å; A434-L437 VanDerWaalsContact O-N 3.17Å
435	P	48.7	Very low	70.5	Confident	139 Å²	139	65.8 Å²	65.8	90%	0.903	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	112	-174	18.8	-29.8	0	0	0	108.8	A433	A433-P435 VanDerWaalsContact O-N 3.09Å
436	G	57.7	Low	70.4	Confident	59 Å²	59	70.9 Å²	70.9	61%	0.608	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	120.9	-7.6	-179.2	0	0	0	0	0	117.2	A434 G438	A434-G436 PolarHBondContact O-N 3.37Å; G436-G438 PolarHBondContact O-N 3.21Å
437	L	68.2	Low	70.5	Confident	13 Å²	13	77.3 Å²	77.3	7%	0.068	48%	0.48	C	S	.	.			trans	-66.1	-20.3	-178.7	-159.3	64.6	0	0	0	114.1	F423 I428 A434 R439 S440 A441 L444	F423-L437 HydrophobicContact CB-CD1 4.4Å; F423-L437 HydrophobicContact CD2-CD1 4.01Å; F423-L437 HydrophobicContact CG-CD1 4.32Å; I428-L437 HydrophobicContact CD1-CD1 3.48Å; I428-L437 VanDerWaalsContact CD1-CD1 3.48Å; I428-L437 HydrophobicContact CD1-CD2 4.32Å; A434-L437 PolarHBondContact O-N 3.21Å; A434-L437 VanDerWaalsContact O-N 3.17Å; L437-R439 PolarHBondContact O-N 3.04Å; L437-S440 WeakPolarHBondContact O-CB 3.42Å; L437-S440 PolarHBondContact O-N 3.32Å; L437-A441 HydrophobicContact CD2-CB 4.37Å; L437-L444 HydrophobicContact CD2-CD1 3.55Å
438	G	75.6	Confident	71.1	Confident	65 Å²	65	74.2 Å²	74.2	67%	0.67	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	53.8	-123.9	171	0	0	0	0	0	113.4	G436	G436-G438 PolarHBondContact O-N 3.21Å
439	R	79.6	Confident	71.9	Confident	154 Å²	154	75.5 Å²	75.5	58%	0.581	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-83.6	-9.1	-179.4	-67.2	-175.7	176.8	170.1	-8.7	113.8	L410 E414 L437 A441 A442	L410-R439 HydrophobicContact CD2-CB 4.29Å; E414-R439 IonicContact OE1-CZ 3.9Å; E414-R439 VanDerWaalsContact OE1-CZ 3.25Å; E414-R439 IonicContact OE1-NH1 3.71Å; E414-R439 PolarHBondContact OE1-NH1 2.98Å; E414-R439 IonicContact OE1-NH2 3.51Å; E414-R439 IonicContact OE2-NH1 2.72Å; L437-R439 PolarHBondContact O-N 3.04Å; R439-A441 PolarHBondContact O-N 3.07Å; R439-A442 PolarHBondContact O-N 2.99Å
440	S	83.6	Confident	73.6	Confident	5 Å²	5	71.1 Å²	71.1	4%	0.035	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-71.2	-12.9	178.4	-55.1	0	0	0	0	112.5	D421 L437 A442 W443	D421-S440 WeakPolarHBondContact OD2-CB 3.31Å; D421-S440 PolarHBondContact OD2-OG 3.04Å; L437-S440 WeakPolarHBondContact O-CB 3.42Å; L437-S440 PolarHBondContact O-N 3.32Å; S440-A442 PolarHBondContact O-N 3.41Å; S440-W443 PolarHBondContact O-N 2.71Å; S440-W443 VanDerWaalsContact O-N 3.16Å
441	A	83.4	Confident	75.5	Confident	50 Å²	50	68.2 Å²	68.2	41%	0.413	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-58.3	-25.7	172.3	0	0	0	0	0	113.5	L437 R439 W443 L444	L437-A441 HydrophobicContact CD2-CB 4.37Å; R439-A441 PolarHBondContact O-N 3.07Å; A441-W443 PolarHBondContact O-N 3.39Å; A441-W443 VanDerWaalsContact O-N 3.14Å; A441-L444 PolarHBondContact O-N 2.89Å
442	A	86.4	Confident	77.5	Confident	36 Å²	36	67.3 Å²	67.3	30%	0.298	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-65.2	-14.5	178.2	0	0	0	0	0	113.9	A407 L410 R439 S440	A407-A442 HydrophobicContact CB-CB 4.09Å; A407-A442 WeakPolarHBondContact CB-O 3.41Å; L410-A442 HydrophobicContact CD1-CB 3.99Å; L410-A442 HydrophobicContact CD2-CB 4.11Å; L410-A442 HydrophobicContact CG-CB 3.88Å; R439-A442 PolarHBondContact O-N 2.99Å; S440-A442 PolarHBondContact O-N 3.41Å
443	W	89.1	Confident	79.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-89.6	-8	175.9	-63.1	99.9	0	0	0	113.5	A407 L410 S418 L419 W425 S440 A441 I453 L454 F457	A407-W443 HydrophobicContact CB-CD2 3.96Å; A407-W443 HydrophobicContact CB-CE3 4.05Å; A407-W443 HydrophobicContact CB-CG 4.48Å; A407-W443 HydrophobicContact CB-CH2 4.43Å; A407-W443 HydrophobicContact CB-CZ2 4.36Å; A407-W443 HydrophobicContact CB-CZ3 4.27Å; L410-W443 HydrophobicContact CD1-CZ2 4.12Å; S418-W443 PolarHBondContact OG-NE1 3.28Å; L419-W443 HydrophobicContact CD2-CH2 3.99Å; L419-W443 HydrophobicContact CD2-CZ2 3.74Å; L419-W443 HydrophobicContact CG-CZ2 3.99Å; W425-W443 HydrophobicContact CE3-CB 4.16Å; W425-W443 HydrophobicContact CE3-CG 4.37Å; W425-W443 HydrophobicContact CH2-CB 4.09Å; W425-W443 AromaticContact CH2-CD1 3.32Å; W425-W443 AromaticContact CH2-CD2 3.76Å; W425-W443 HydrophobicContact CH2-CD2 3.76Å; W425-W443 AromaticContact CH2-CE2 3.81Å; W425-W443 AromaticContact CH2-CG 3.47Å; W425-W443 HydrophobicContact CH2-CG 3.47Å; W425-W443 VanDerWaalsContact CH2-CG 3.47Å; W425-W443 AromaticContact CH2-NE1 3.53Å; W425-W443 HydrophobicContact CZ2-CB 4.46Å; W425-W443 AromaticContact CZ2-CD1 3.59Å; W425-W443 HydrophobicContact CZ2-CG 4.03Å; W425-W443 HydrophobicContact CZ3-CB 3.92Å; W425-W443 AromaticContact CZ3-CD2 3.85Å; W425-W443 HydrophobicContact CZ3-CD2 3.85Å; W425-W443 HydrophobicContact CZ3-CE3 4.32Å; W425-W443 AromaticContact CZ3-CG 3.66Å; W425-W443 HydrophobicContact CZ3-CG 3.66Å; S440-W443 PolarHBondContact O-N 2.71Å; S440-W443 VanDerWaalsContact O-N 3.16Å; A441-W443 PolarHBondContact O-N 3.39Å; A441-W443 VanDerWaalsContact O-N 3.14Å; W443-I453 HydrophobicContact CE3-CG2 3.91Å; W443-I453 HydrophobicContact CZ3-CG2 4.44Å; W443-I453 VanDerWaalsContact O-CD1 3.23Å; W443-I453 WeakPolarHBondContact O-CD1 3.32Å; W443-L454 HydrophobicContact CE3-CD2 3.96Å; W443-L454 HydrophobicContact CE3-CG 4.4Å; W443-L454 HydrophobicContact CH2-CD2 4.23Å; W443-L454 HydrophobicContact CZ3-CD2 3.69Å; W443-L454 HydrophobicContact CZ3-CG 4.45Å; W443-F457 HydrophobicContact CH2-CB 4.29Å; W443-F457 AromaticContact CH2-CD1 3.77Å; W443-F457 HydrophobicContact CH2-CD1 3.77Å; W443-F457 AromaticContact CH2-CD2 3.72Å; W443-F457 HydrophobicContact CH2-CD2 3.72Å; W443-F457 AromaticContact CH2-CE1 3.95Å; W443-F457 HydrophobicContact CH2-CE1 3.95Å; W443-F457 AromaticContact CH2-CE2 3.84Å; W443-F457 HydrophobicContact CH2-CE2 3.84Å; W443-F457 AromaticContact CH2-CG 3.65Å; W443-F457 HydrophobicContact CH2-CG 3.65Å; W443-F457 AromaticContact CH2-CZ 3.96Å; W443-F457 HydrophobicContact CH2-CZ 3.96Å; W443-F457 HydrophobicContact CZ3-CB 3.87Å; W443-F457 HydrophobicContact CZ3-CD1 4.17Å; W443-F457 HydrophobicContact CZ3-CD2 4.04Å; W443-F457 AromaticContact CZ3-CG 3.76Å; W443-F457 HydrophobicContact CZ3-CG 3.76Å
444	L	87.4	Confident	81.6	Confident	51 Å²	51	58 Å²	58	27%	0.267	36%	0.356	S	S	.	.			trans	-98.5	127	-179.2	-59.9	-178.8	0	0	0	109.8	W425 I428 L437 A441 V450	W425-L444 HydrophobicContact CB-CD2 4.48Å; I428-L444 HydrophobicContact CG2-CD1 4.27Å; L437-L444 HydrophobicContact CD2-CD1 3.55Å; A441-L444 PolarHBondContact O-N 2.89Å; L444-V450 HydrophobicContact CD2-CG2 3.65Å
445	H	86.9	Confident	83.7	Confident	45 Å²	45	59.7 Å²	59.7	21%	0.208	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-123.8	135.8	173	-172.2	-88.3	0	0	0	109.6	H447 V448 I453	H445-H447 PolarHBondContact ND1-N 3.43Å; H445-H447 PolarHBondContact O-N 3.25Å; H445-H447 VanDerWaalsContact O-N 3.13Å; H445-V448 HydrophobicContact CB-CB 4.11Å; H445-V448 PolarHBondContact ND1-N 3.39Å; H445-V448 PolarHBondContact O-N 3.25Å; H445-I453 HydrophobicContact CB-CD1 3.59Å
446	P	84.4	Confident	85.9	Confident	110 Å²	110	55 Å²	55	71%	0.714	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-32.4	-173.9	-26.5	34.3	0	0	0	114.8
447	H	86.3	Confident	87.7	Confident	174 Å²	174	52.3 Å²	52.3	81%	0.806	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	-4.3	-174.3	-59.9	-62.5	0	0	0	114.6	H445	H445-H447 PolarHBondContact ND1-N 3.43Å; H445-H447 PolarHBondContact O-N 3.25Å; H445-H447 VanDerWaalsContact O-N 3.13Å
448	V	89.6	Confident	89.1	Confident	33 Å²	33	52.6 Å²	52.6	20%	0.2	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-128.3	133.5	-171.4	-179.6	0	0	0	0	110.1	F405 H445 L452 I453	F405-V448 HydrophobicContact CD1-CG2 4.19Å; F405-V448 HydrophobicContact CE1-CG2 3.89Å; H445-V448 HydrophobicContact CB-CB 4.11Å; H445-V448 PolarHBondContact ND1-N 3.39Å; H445-V448 PolarHBondContact O-N 3.25Å; V448-L452 HydrophobicContact CG1-CB 3.9Å; V448-L452 HydrophobicContact CG1-CD2 3.76Å; V448-L452 HydrophobicContact CG1-CG 4.18Å; V448-I453 HydrophobicContact CB-CD1 4.47Å; V448-I453 HydrophobicContact CB-CG1 4.49Å; V448-I453 HydrophobicContact CG1-CD1 4.38Å; V448-I453 HydrophobicContact CG1-CG1 3.92Å
449	S	90.8	Very high	90	Very high	68 Å²	68	53.2 Å²	53.2	48%	0.476	29%	0.288	S	S	.	.			trans	-64.2	145.3	177.7	68.1	0	0	0	0	111.7	F451 L452 I453	S449-F451 PolarHBondContact O-N 3.39Å; S449-L452 PolarHBondContact O-N 3.1Å; S449-L452 VanDerWaalsContact O-N 3.08Å; S449-L452 PolarHBondContact OG-N 3.15Å; S449-I453 PolarHBondContact O-N 2.88Å
450	V	90.6	Very high	90.8	Very high	15 Å²	15	47 Å²	47	9%	0.091	27%	0.266	C	S	.	.	H	α-helix	trans	-57.8	-33.5	176.5	-179.6	0	0	0	0	111.7	W425 L444 L452 I453 L454	W425-V450 HydrophobicContact CB-CG1 4Å; W425-V450 HydrophobicContact CB-CG2 4.31Å; W425-V450 HydrophobicContact CD2-CG1 4.39Å; W425-V450 HydrophobicContact CE3-CG1 3.61Å; W425-V450 HydrophobicContact CZ3-CG1 4.44Å; L444-V450 HydrophobicContact CD2-CG2 3.65Å; V450-L452 PolarHBondContact O-N 2.58Å; V450-I453 PolarHBondContact O-N 2.99Å; V450-L454 HydrophobicContact CG1-CD1 4.06Å; V450-L454 HydrophobicContact CG1-CG 4.44Å; V450-L454 WeakPolarHBondContact O-CB 3.47Å; V450-L454 PolarHBondContact O-N 3.26Å
451	F	93.3	Very high	91.3	Very high	59 Å²	59	48.4 Å²	48.4	26%	0.259	27%	0.272	S	S	.	.	H	α-helix	trans	-59	-45.5	175.1	-63.9	-66.3	0	0	0	112.7	T426 S449 L454 L455 L491 E494 I495 T498	T426-F451 HydrophobicContact CG2-CE1 4.27Å; T426-F451 HydrophobicContact CG2-CE2 3.66Å; T426-F451 HydrophobicContact CG2-CZ 3.52Å; S449-F451 PolarHBondContact O-N 3.39Å; F451-L454 PolarHBondContact O-N 3.02Å; F451-L455 VanDerWaalsContact O-CB 3.31Å; F451-L455 WeakPolarHBondContact O-CB 3.21Å; F451-L455 PolarHBondContact O-N 3.26Å; F451-L491 HydrophobicContact CD1-CD1 4Å; F451-E494 HydrophobicContact CD1-CB 4.45Å; F451-E494 HydrophobicContact CE1-CB 3.69Å; F451-E494 HydrophobicContact CZ-CB 4.32Å; F451-I495 HydrophobicContact CD1-CG1 4.07Å; F451-I495 HydrophobicContact CE1-CB 4.46Å; F451-I495 HydrophobicContact CE1-CG1 3.69Å; F451-T498 HydrophobicContact CE2-CG2 4.07Å; F451-T498 HydrophobicContact CZ-CG2 3.6Å
452	L	93.3	Very high	91.9	Very high	93 Å²	93	46.7 Å²	46.7	49%	0.487	26%	0.255	S	S	.	.	H	α-helix	trans	-68.7	-38.8	-179.9	-172.7	63.5	0	0	0	111.1	V448 S449 V450 L455 L456	V448-L452 HydrophobicContact CG1-CB 3.9Å; V448-L452 HydrophobicContact CG1-CD2 3.76Å; V448-L452 HydrophobicContact CG1-CG 4.18Å; S449-L452 PolarHBondContact O-N 3.1Å; S449-L452 VanDerWaalsContact O-N 3.08Å; S449-L452 PolarHBondContact OG-N 3.15Å; V450-L452 PolarHBondContact O-N 2.58Å; L452-L455 PolarHBondContact O-N 2.9Å; L452-L456 WeakPolarHBondContact O-CB 3.19Å; L452-L456 PolarHBondContact O-N 3.07Å
453	I	93.4	Very high	92.3	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-62.5	-46.8	176.1	-64.8	168.2	0	0	0	110.5	F405 W443 H445 V448 S449 V450 L456 F457	F405-I453 WeakPolarHBondContact O-CA 3.14Å; F405-I453 WeakPolarHBondContact O-CG2 3.36Å; W443-I453 HydrophobicContact CE3-CG2 3.91Å; W443-I453 HydrophobicContact CZ3-CG2 4.44Å; W443-I453 VanDerWaalsContact O-CD1 3.23Å; W443-I453 WeakPolarHBondContact O-CD1 3.32Å; H445-I453 HydrophobicContact CB-CD1 3.59Å; V448-I453 HydrophobicContact CB-CD1 4.47Å; V448-I453 HydrophobicContact CB-CG1 4.49Å; V448-I453 HydrophobicContact CG1-CD1 4.38Å; V448-I453 HydrophobicContact CG1-CG1 3.92Å; S449-I453 PolarHBondContact O-N 2.88Å; V450-I453 PolarHBondContact O-N 2.99Å; I453-L456 PolarHBondContact O-N 3.5Å; I453-F457 WeakPolarHBondContact O-CB 3.44Å; I453-F457 PolarHBondContact O-N 3.11Å
454	L	94.8	Very high	92.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-42.5	176.9	-82.7	171.1	0	0	0	112.4	L419 W425 W443 V450 F451 F457 F458 R490 L491 E494	L419-L454 HydrophobicContact CD2-CD2 4.05Å; W425-L454 HydrophobicContact CE3-CD1 4.3Å; W425-L454 HydrophobicContact CZ3-CD1 4.15Å; W425-L454 HydrophobicContact CZ3-CD2 4.09Å; W425-L454 HydrophobicContact CZ3-CG 4.33Å; W443-L454 HydrophobicContact CE3-CD2 3.96Å; W443-L454 HydrophobicContact CE3-CG 4.4Å; W443-L454 HydrophobicContact CH2-CD2 4.23Å; W443-L454 HydrophobicContact CZ3-CD2 3.69Å; W443-L454 HydrophobicContact CZ3-CG 4.45Å; V450-L454 HydrophobicContact CG1-CD1 4.06Å; V450-L454 HydrophobicContact CG1-CG 4.44Å; V450-L454 WeakPolarHBondContact O-CB 3.47Å; V450-L454 PolarHBondContact O-N 3.26Å; F451-L454 PolarHBondContact O-N 3.02Å; L454-F457 PolarHBondContact O-N 3.46Å; L454-F458 WeakPolarHBondContact O-CB 3.24Å; L454-F458 PolarHBondContact O-N 3.36Å; L454-R490 HydrophobicContact CD1-CG 4.11Å; L454-R490 HydrophobicContact CD2-CG 4.29Å; L454-L491 HydrophobicContact CB-CB 4.49Å; L454-L491 HydrophobicContact CB-CD1 4.08Å; L454-E494 HydrophobicContact CD1-CG 4.42Å
455	L	95.4	Very high	92.9	Very high	84 Å²	84	46.2 Å²	46.2	44%	0.44	24%	0.242	S	C	.	.	H	α-helix	trans	-63.8	-46.5	176.8	-179.7	65	0	0	0	111.2	F451 L452 F458 V459 L491	F451-L455 VanDerWaalsContact O-CB 3.31Å; F451-L455 WeakPolarHBondContact O-CB 3.21Å; F451-L455 PolarHBondContact O-N 3.26Å; L452-L455 PolarHBondContact O-N 2.9Å; L455-F458 PolarHBondContact O-N 3.49Å; L455-V459 HydrophobicContact CD1-CG2 4.44Å; L455-V459 WeakPolarHBondContact O-CG2 3.05Å; L455-V459 PolarHBondContact O-N 3.4Å; L455-L491 HydrophobicContact CD1-CD2 4.49Å
456	L	94.8	Very high	93.2	Very high	39 Å²	39	44.1 Å²	44.1	20%	0.204	23%	0.232	C	C	.	.	H	α-helix	trans	-65.8	-42	178.6	-172.3	149.8	0	0	0	110.8	F402 F405 M406 L452 I453 F458 V459 M460	F402-L456 HydrophobicContact CE1-CD2 3.7Å; F402-L456 HydrophobicContact CE1-CG 4.47Å; F402-L456 HydrophobicContact CE2-CD1 4.03Å; F402-L456 HydrophobicContact CE2-CD2 4.38Å; F402-L456 HydrophobicContact CZ-CD1 3.72Å; F402-L456 HydrophobicContact CZ-CD2 3.55Å; F402-L456 HydrophobicContact CZ-CG 3.89Å; F405-L456 HydrophobicContact CB-CD1 4.07Å; F405-L456 HydrophobicContact CB-CD2 3.97Å; M406-L456 HydrophobicContact CB-CD2 3.9Å; L452-L456 WeakPolarHBondContact O-CB 3.19Å; L452-L456 PolarHBondContact O-N 3.07Å; I453-L456 PolarHBondContact O-N 3.5Å; L456-F458 PolarHBondContact O-N 3.37Å; L456-V459 PolarHBondContact O-N 3.14Å; L456-M460 HydrophobicContact CD2-CG 3.97Å; L456-M460 HydrophobicContact CG-CG 4.27Å; L456-M460 VanDerWaalsContact O-CB 3.23Å; L456-M460 WeakPolarHBondContact O-CB 3.26Å; L456-M460 WeakPolarHBondContact O-CG 3.4Å; L456-M460 PolarHBondContact O-N 2.9Å
457	F	95.6	Very high	93.6	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.018	21%	0.208	C	C	.	.	H	α-helix	trans	-55.5	-50.4	171.2	175.2	-94.8	0	0	0	111.5	M406 C415 W443 I453 L454 M460 K461 I483 A487	M406-F457 HydrophobicContact CB-CB 4.35Å; M406-F457 HydrophobicContact CB-CD2 4.25Å; M406-F457 WeakPolarHBondContact O-CD2 3.23Å; C415-F457 WeakPolarHBondContact SG-CZ 3.15Å; W443-F457 HydrophobicContact CH2-CB 4.29Å; W443-F457 AromaticContact CH2-CD1 3.77Å; W443-F457 HydrophobicContact CH2-CD1 3.77Å; W443-F457 AromaticContact CH2-CD2 3.72Å; W443-F457 HydrophobicContact CH2-CD2 3.72Å; W443-F457 AromaticContact CH2-CE1 3.95Å; W443-F457 HydrophobicContact CH2-CE1 3.95Å; W443-F457 AromaticContact CH2-CE2 3.84Å; W443-F457 HydrophobicContact CH2-CE2 3.84Å; W443-F457 AromaticContact CH2-CG 3.65Å; W443-F457 HydrophobicContact CH2-CG 3.65Å; W443-F457 AromaticContact CH2-CZ 3.96Å; W443-F457 HydrophobicContact CH2-CZ 3.96Å; W443-F457 HydrophobicContact CZ3-CB 3.87Å; W443-F457 HydrophobicContact CZ3-CD1 4.17Å; W443-F457 HydrophobicContact CZ3-CD2 4.04Å; W443-F457 AromaticContact CZ3-CG 3.76Å; W443-F457 HydrophobicContact CZ3-CG 3.76Å; I453-F457 WeakPolarHBondContact O-CB 3.44Å; I453-F457 PolarHBondContact O-N 3.11Å; L454-F457 PolarHBondContact O-N 3.46Å; F457-M460 PolarHBondContact O-N 3.39Å; F457-K461 HydrophobicContact CD1-CG 4.39Å; F457-K461 HydrophobicContact CD2-CG 3.87Å; F457-K461 HydrophobicContact CE1-CG 4.12Å; F457-K461 HydrophobicContact CE2-CD 4.22Å; F457-K461 HydrophobicContact CE2-CG 3.63Å; F457-K461 HydrophobicContact CG-CG 4.29Å; F457-K461 HydrophobicContact CZ-CG 3.75Å; F457-K461 VanDerWaalsContact O-CB 3.26Å; F457-K461 WeakPolarHBondContact O-CB 3.31Å; F457-K461 VanDerWaalsContact O-CG 3.31Å; F457-K461 WeakPolarHBondContact O-CG 3.05Å; F457-K461 PolarHBondContact O-N 3.29Å; F457-I483 HydrophobicContact CE1-CG2 3.91Å; F457-I483 HydrophobicContact CZ-CG2 3.73Å; F457-A487 HydrophobicContact CD1-CB 3.62Å; F457-A487 HydrophobicContact CE1-CB 3.65Å
458	F	96.3	Very high	93.9	Very high	19 Å²	19	32.2 Å²	32.2	8%	0.083	17%	0.17	C	C	.	.	H	α-helix	trans	-58.7	-54.5	-179.9	175.9	-96.7	0	0	0	111.2	L353 L454 L455 L456 M460 K461 F462 L484 F488 M526	L353-F458 HydrophobicContact CD1-CZ 3.86Å; L353-F458 HydrophobicContact CD2-CE1 4.29Å; L353-F458 HydrophobicContact CD2-CZ 4.06Å; L353-F458 HydrophobicContact CG-CZ 4.44Å; L454-F458 WeakPolarHBondContact O-CB 3.24Å; L454-F458 PolarHBondContact O-N 3.36Å; L455-F458 PolarHBondContact O-N 3.49Å; L456-F458 PolarHBondContact O-N 3.37Å; F458-M460 VanDerWaalsContact C-N 3.35Å; F458-M460 PolarHBondContact O-N 2.92Å; F458-K461 PolarHBondContact O-N 3.29Å; F458-F462 HydrophobicContact CE1-CD2 4.44Å; F458-F462 HydrophobicContact CE2-CD2 4.49Å; F458-F462 AromaticContact CZ-CD2 3.99Å; F458-F462 HydrophobicContact CZ-CD2 3.99Å; F458-F462 WeakPolarHBondContact O-CB 3.13Å; F458-F462 PolarHBondContact O-N 3.08Å; F458-L484 HydrophobicContact CD2-CB 4.48Å; F458-L484 HydrophobicContact CD2-CD2 4.25Å; F458-L484 HydrophobicContact CE2-CB 4.22Å; F458-L484 HydrophobicContact CE2-CD2 4.5Å; F458-F488 HydrophobicContact CD2-CB 4.08Å; F458-F488 HydrophobicContact CE2-CB 3.92Å; F458-M526 HydrophobicContact CE2-CE 4.49Å; F458-M526 HydrophobicContact CE2-SD 4.38Å
459	V	95.8	Very high	93.9	Very high	78 Å²	78	31.1 Å²	31.1	47%	0.473	16%	0.164	S	C	.	.	H	α-helix	trans	-59.9	-45.6	-178.4	172.7	0	0	0	0	111.1	L455 L456 F462 W463	L455-V459 HydrophobicContact CD1-CG2 4.44Å; L455-V459 WeakPolarHBondContact O-CG2 3.05Å; L455-V459 PolarHBondContact O-N 3.4Å; L456-V459 PolarHBondContact O-N 3.14Å; V459-F462 WeakPolarHBondContact O-CB 3.43Å; V459-F462 PolarHBondContact O-N 2.85Å; V459-W463 PolarHBondContact O-N 3.34Å
460	M	95.1	Very high	93.8	Very high	24 Å²	24	27.9 Å²	27.9	12%	0.118	14%	0.141	C	C	.	.	H	α-helix	trans	-69	-47.1	-176.9	-66.2	-65.3	-57.6	0	0	111.9	F396 F402 M406 L456 F457 F458 F462 W463 M464	F396-M460 HydrophobicContact CB-CE 4.32Å; F396-M460 HydrophobicContact CD1-CE 4.13Å; F396-M460 HydrophobicContact CG-CE 4.12Å; F402-M460 HydrophobicContact CD1-CE 4.29Å; F402-M460 HydrophobicContact CE1-CE 3.62Å; F402-M460 HydrophobicContact CE1-CG 3.77Å; F402-M460 HydrophobicContact CE1-SD 3.86Å; F402-M460 HydrophobicContact CZ-CE 4.39Å; F402-M460 HydrophobicContact CZ-CG 4.21Å; F402-M460 HydrophobicContact CZ-SD 4.16Å; M406-M460 HydrophobicContact CE-CB 4.25Å; M406-M460 HydrophobicContact CE-CG 4.38Å; L456-M460 HydrophobicContact CD2-CG 3.97Å; L456-M460 HydrophobicContact CG-CG 4.27Å; L456-M460 VanDerWaalsContact O-CB 3.23Å; L456-M460 WeakPolarHBondContact O-CB 3.26Å; L456-M460 WeakPolarHBondContact O-CG 3.4Å; L456-M460 PolarHBondContact O-N 2.9Å; F457-M460 PolarHBondContact O-N 3.39Å; F458-M460 VanDerWaalsContact C-N 3.35Å; F458-M460 PolarHBondContact O-N 2.92Å; M460-F462 PolarHBondContact O-N 2.91Å; M460-W463 HydrophobicContact CE-CZ2 3.59Å; M460-W463 VanDerWaalsContact O-CD1 3.29Å; M460-W463 PolarHBondContact O-NE1 3.32Å; M460-W463 PolarHBondContact SD-NE1 3.36Å; M460-M464 HydrophobicContact CE-CE 3.77Å; M460-M464 WeakPolarHBondContact O-CB 3.49Å; M460-M464 WeakPolarHBondContact O-CG 2.94Å; M460-M464 PolarHBondContact O-N 3.03Å; M460-M464 VanDerWaalsContact O-N 3.11Å
461	K	95	Very high	93.7	Very high	34 Å²	34	27.2 Å²	27.2	15%	0.148	14%	0.137	C	C	.	.	H	α-helix	trans	-66.2	-28.3	176.7	-68.5	-66	-171.8	-175.6	0	112.1	F457 F458 M464 S465 L484	F457-K461 HydrophobicContact CD1-CG 4.39Å; F457-K461 HydrophobicContact CD2-CG 3.87Å; F457-K461 HydrophobicContact CE1-CG 4.12Å; F457-K461 HydrophobicContact CE2-CD 4.22Å; F457-K461 HydrophobicContact CE2-CG 3.63Å; F457-K461 HydrophobicContact CG-CG 4.29Å; F457-K461 HydrophobicContact CZ-CG 3.75Å; F457-K461 VanDerWaalsContact O-CB 3.26Å; F457-K461 WeakPolarHBondContact O-CB 3.31Å; F457-K461 VanDerWaalsContact O-CG 3.31Å; F457-K461 WeakPolarHBondContact O-CG 3.05Å; F457-K461 PolarHBondContact O-N 3.29Å; F458-K461 PolarHBondContact O-N 3.29Å; K461-M464 HydrophobicContact CD-SD 4.42Å; K461-S465 VanDerWaalsContact O-CB 3.25Å; K461-S465 WeakPolarHBondContact O-CB 3.36Å; K461-S465 PolarHBondContact O-N 2.84Å; K461-S465 PolarHBondContact O-OG 3.46Å; K461-L484 HydrophobicContact CB-CD2 3.62Å
462	F	95.8	Very high	93.6	Very high	14 Å²	14	24.4 Å²	24.4	6%	0.061	12%	0.124	C	C	.	.	H	α-helix	trans	-61.6	-54.4	180	-171.6	-84.5	0	0	0	111.5	F356 F357 L360 F458 V459 M460 S465 A466 L484 M526	F356-F462 AromaticContact CD1-CE1 3.53Å; F356-F462 HydrophobicContact CD1-CE1 3.53Å; F356-F462 AromaticContact CD1-CZ 3.43Å; F356-F462 HydrophobicContact CD1-CZ 3.43Å; F356-F462 VanDerWaalsContact CD1-CZ 3.43Å; F356-F462 HydrophobicContact CE1-CD1 4.46Å; F356-F462 AromaticContact CE1-CE1 3.56Å; F356-F462 HydrophobicContact CE1-CE1 3.56Å; F356-F462 AromaticContact CE1-CZ 3.99Å; F356-F462 HydrophobicContact CE1-CZ 3.99Å; F356-F462 HydrophobicContact CG-CZ 4.35Å; F357-F462 HydrophobicContact CB-CE2 3.84Å; F357-F462 HydrophobicContact CB-CZ 3.59Å; F357-F462 HydrophobicContact CD2-CD2 4.32Å; F357-F462 HydrophobicContact CD2-CE1 4.27Å; F357-F462 AromaticContact CD2-CE2 3.96Å; F357-F462 HydrophobicContact CD2-CE2 3.96Å; F357-F462 AromaticContact CD2-CZ 3.93Å; F357-F462 HydrophobicContact CD2-CZ 3.93Å; F357-F462 HydrophobicContact CG-CE2 4.38Å; F357-F462 HydrophobicContact CG-CZ 4.28Å; L360-F462 HydrophobicContact CD2-CD1 4.03Å; L360-F462 HydrophobicContact CD2-CE1 3.72Å; F458-F462 HydrophobicContact CE1-CD2 4.44Å; F458-F462 HydrophobicContact CE2-CD2 4.49Å; F458-F462 AromaticContact CZ-CD2 3.99Å; F458-F462 HydrophobicContact CZ-CD2 3.99Å; F458-F462 WeakPolarHBondContact O-CB 3.13Å; F458-F462 PolarHBondContact O-N 3.08Å; V459-F462 WeakPolarHBondContact O-CB 3.43Å; V459-F462 PolarHBondContact O-N 2.85Å; M460-F462 PolarHBondContact O-N 2.91Å; F462-S465 PolarHBondContact O-OG 3.41Å; F462-A466 PolarHBondContact O-N 3.17Å; F462-L484 HydrophobicContact CB-CD1 4.4Å; F462-L484 HydrophobicContact CB-CD2 4.16Å; F462-L484 HydrophobicContact CD2-CD1 4Å; F462-L484 HydrophobicContact CG-CD1 4.49Å; F462-M526 HydrophobicContact CD2-CE 4.05Å; F462-M526 HydrophobicContact CE2-CE 3.76Å
463	W	94.6	Very high	93.6	Very high	75 Å²	75	20 Å²	20	28%	0.284	10%	0.101	S	C	.	.	H	α-helix	trans	-72.4	-37.1	178.3	73.6	-100.4	0	0	0	112	I392 F396 V459 M460 S465 A466 V467	I392-W463 HydrophobicContact CG2-CH2 4.11Å; F396-W463 HydrophobicContact CD2-CH2 4.1Å; F396-W463 HydrophobicContact CD2-CZ2 4.13Å; F396-W463 HydrophobicContact CE2-CH2 4.29Å; F396-W463 HydrophobicContact CE2-CZ2 4.37Å; V459-W463 PolarHBondContact O-N 3.34Å; M460-W463 HydrophobicContact CE-CZ2 3.59Å; M460-W463 VanDerWaalsContact O-CD1 3.29Å; M460-W463 PolarHBondContact O-NE1 3.32Å; M460-W463 PolarHBondContact SD-NE1 3.36Å; W463-S465 VanDerWaalsContact C-N 3.34Å; W463-S465 PolarHBondContact O-N 3.26Å; W463-A466 PolarHBondContact O-N 3.48Å; W463-V467 HydrophobicContact CE3-CG2 4.24Å; W463-V467 WeakPolarHBondContact O-CG2 3.15Å; W463-V467 PolarHBondContact O-N 2.87Å
464	M	94.9	Very high	93.6	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.9	-42.2	178.8	-73.3	172.1	172.5	0	0	112	I393 F396 M406 M460 K461 V467 S468	I393-M464 HydrophobicContact CD1-CB 4.45Å; I393-M464 HydrophobicContact CG1-CB 4.4Å; I393-M464 HydrophobicContact CG1-CG 4.21Å; I393-M464 HydrophobicContact CG2-SD 4.25Å; F396-M464 HydrophobicContact CB-CE 3.37Å; F396-M464 HydrophobicContact CD2-CE 4.34Å; F396-M464 HydrophobicContact CG-CE 4.14Å; M406-M464 HydrophobicContact CE-CE 4.47Å; M460-M464 HydrophobicContact CE-CE 3.77Å; M460-M464 WeakPolarHBondContact O-CB 3.49Å; M460-M464 WeakPolarHBondContact O-CG 2.94Å; M460-M464 PolarHBondContact O-N 3.03Å; M460-M464 VanDerWaalsContact O-N 3.11Å; K461-M464 HydrophobicContact CD-SD 4.42Å; M464-V467 PolarHBondContact O-N 3.43Å; M464-S468 VanDerWaalsContact O-CB 3.27Å; M464-S468 WeakPolarHBondContact O-CB 2.98Å; M464-S468 PolarHBondContact O-N 2.82Å; M464-S468 PolarHBondContact O-OG 3.47Å
465	S	94.1	Very high	93.4	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.014	10%	0.103	C	C	.	.	H	α-helix	trans	-70.4	-36	177.2	60	0	0	0	0	112.5	F357 K461 F462 W463 V467 S468 T469	F357-S465 WeakPolarHBondContact CE2-OG 3.44Å; K461-S465 VanDerWaalsContact O-CB 3.25Å; K461-S465 WeakPolarHBondContact O-CB 3.36Å; K461-S465 PolarHBondContact O-N 2.84Å; K461-S465 PolarHBondContact O-OG 3.46Å; F462-S465 PolarHBondContact O-OG 3.41Å; W463-S465 VanDerWaalsContact C-N 3.34Å; W463-S465 PolarHBondContact O-N 3.26Å; S465-V467 VanDerWaalsContact C-N 3.29Å; S465-V467 PolarHBondContact O-N 3.12Å; S465-S468 WeakPolarHBondContact CA-OG 3.36Å; S465-S468 PolarHBondContact O-OG 3.36Å; S465-S468 VanDerWaalsContact O-OG 3.12Å; S465-T469 WeakPolarHBondContact O-CB 3.37Å; S465-T469 VanDerWaalsContact O-CG2 3.24Å; S465-T469 WeakPolarHBondContact O-CG2 3.41Å; S465-T469 PolarHBondContact O-N 2.89Å; S465-T469 PolarHBondContact O-OG1 3.38Å
466	A	92.8	Very high	93.3	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.7	-38.4	173	0	0	0	0	0	111.6	F357 L360 N361 F462 W463 T469 T470	F357-A466 HydrophobicContact CE2-CB 4.02Å; L360-A466 HydrophobicContact CD2-CB 3.77Å; L360-A466 HydrophobicContact CG-CB 4.04Å; N361-A466 PolarHBondContact ND2-O 2.94Å; F462-A466 PolarHBondContact O-N 3.17Å; W463-A466 PolarHBondContact O-N 3.48Å; A466-T469 PolarHBondContact O-OG1 3.3Å; A466-T469 VanDerWaalsContact O-OG1 3.12Å; A466-T470 WeakPolarHBondContact O-CG2 3.4Å
467	V	92.8	Very high	93.2	Very high	35 Å²	35	15 Å²	15	21%	0.212	8%	0.078	C	C	.	.	H	α-helix	trans	-78.4	-43.2	177	179.1	0	0	0	0	111.9	V389 W463 M464 S465 T469 T470	V389-V467 HydrophobicContact CG1-CG1 3.71Å; V389-V467 HydrophobicContact CG2-CG1 4.02Å; W463-V467 HydrophobicContact CE3-CG2 4.24Å; W463-V467 WeakPolarHBondContact O-CG2 3.15Å; W463-V467 PolarHBondContact O-N 2.87Å; M464-V467 PolarHBondContact O-N 3.43Å; S465-V467 VanDerWaalsContact C-N 3.29Å; S465-V467 PolarHBondContact O-N 3.12Å; V467-T469 VanDerWaalsContact C-N 3.31Å; V467-T469 PolarHBondContact O-N 3.03Å; V467-T470 WeakPolarHBondContact O-CB 3.33Å; V467-T470 PolarHBondContact O-N 3.27Å; V467-T470 PolarHBondContact O-OG1 3.36Å
468	S	92.6	Very high	93	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-60.9	-38.7	-176.4	70.3	0	0	0	0	112.7	P220 M464 S465 T470 M471	P220-S468 PolarHBondContact O-OG 3.41Å; M464-S468 VanDerWaalsContact O-CB 3.27Å; M464-S468 WeakPolarHBondContact O-CB 2.98Å; M464-S468 PolarHBondContact O-N 2.82Å; M464-S468 PolarHBondContact O-OG 3.47Å; S465-S468 WeakPolarHBondContact CA-OG 3.36Å; S465-S468 PolarHBondContact O-OG 3.36Å; S465-S468 VanDerWaalsContact O-OG 3.12Å; S468-T470 PolarHBondContact O-N 3.11Å; S468-M471 WeakPolarHBondContact O-CB 3.35Å; S468-M471 WeakPolarHBondContact O-CE 3.36Å; S468-M471 WeakPolarHBondContact O-CG 3.32Å; S468-M471 PolarHBondContact O-N 3.29Å; S468-M471 VanDerWaalsContact O-N 3.12Å
469	T	90.4	Very high	92.9	Very high	10 Å²	10	15.6 Å²	15.6	6%	0.061	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-17.9	179.1	50.9	0	0	0	0	113.2	Y19 N361 S465 A466 V467 A477	Y19-T469 PolarHBondContact OH-O 3.23Å; N361-T469 PolarHBondContact ND2-OG1 3.18Å; S465-T469 WeakPolarHBondContact O-CB 3.37Å; S465-T469 VanDerWaalsContact O-CG2 3.24Å; S465-T469 WeakPolarHBondContact O-CG2 3.41Å; S465-T469 PolarHBondContact O-N 2.89Å; S465-T469 PolarHBondContact O-OG1 3.38Å; A466-T469 PolarHBondContact O-OG1 3.3Å; A466-T469 VanDerWaalsContact O-OG1 3.12Å; V467-T469 VanDerWaalsContact C-N 3.31Å; V467-T469 PolarHBondContact O-N 3.03Å; T469-A477 HydrophobicContact CG2-CB 3.78Å
470	T	87.8	Confident	92.8	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-19	175.1	72.6	0	0	0	0	113.1	L18 V364 V365 Y385 A466 V467 S468	L18-T470 WeakPolarHBondContact CD2-O 3.49Å; V364-T470 HydrophobicContact CB-CG2 4.18Å; V364-T470 HydrophobicContact CG1-CG2 3.66Å; V365-T470 HydrophobicContact CG2-CG2 3.65Å; Y385-T470 PolarHBondContact OH-OG1 2.91Å; A466-T470 WeakPolarHBondContact O-CG2 3.4Å; V467-T470 WeakPolarHBondContact O-CB 3.33Å; V467-T470 PolarHBondContact O-N 3.27Å; V467-T470 PolarHBondContact O-OG1 3.36Å; S468-T470 PolarHBondContact O-N 3.11Å
471	M	89.8	Confident	92.9	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.005	6%	0.055	C	C	.	.	S	Bend	trans	-55	142.3	-178.4	-66.7	-170.5	-69.2	0	0	111.7	V164 V221 P386 V389 S468 I473	V164-M471 HydrophobicContact CG1-SD 4.23Å; V221-M471 HydrophobicContact CG1-CE 4.45Å; P386-M471 HydrophobicContact CB-SD 4.31Å; V389-M471 HydrophobicContact CB-CG 4.21Å; V389-M471 HydrophobicContact CB-SD 3.95Å; V389-M471 HydrophobicContact CG1-CG 3.93Å; V389-M471 HydrophobicContact CG1-SD 3.66Å; S468-M471 WeakPolarHBondContact O-CB 3.35Å; S468-M471 WeakPolarHBondContact O-CE 3.36Å; S468-M471 WeakPolarHBondContact O-CG 3.32Å; S468-M471 PolarHBondContact O-N 3.29Å; S468-M471 VanDerWaalsContact O-N 3.12Å; M471-I473 HydrophobicContact CB-CD1 4.21Å; M471-I473 HydrophobicContact CB-CG1 3.95Å; M471-I473 HydrophobicContact CE-CD1 3.73Å; M471-I473 PolarHBondContact O-N 3.44Å
472	P	90	Very high	93	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.049	C	C	.	.	S	Bend	trans	-76.6	51.5	-178.7	33.1	-37.5	0	0	0	112.8	L17 I179 Y385 P386	L17-P472 VanDerWaalsContact O-CB 3.27Å; L17-P472 WeakPolarHBondContact O-CB 3.28Å; I179-P472 HydrophobicContact CD1-CB 4.36Å; I179-P472 HydrophobicContact CG2-CB 4.12Å; Y385-P472 HydrophobicContact CD1-CG 4.4Å; P386-P472 HydrophobicContact CG-CG 4.3Å
473	I	93.1	Very high	93	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.05	C	C	.	.	S	Bend	trans	-122.5	160.2	176	62.8	177.2	0	0	0	108.8	V164 A167 G180 A214 V221 M471 S475	V164-I473 HydrophobicContact CG1-CD1 4.35Å; V164-I473 HydrophobicContact CG1-CG2 4.32Å; A167-I473 HydrophobicContact CB-CG2 4.3Å; G180-I473 PolarHBondContact N-O 2.88Å; A214-I473 HydrophobicContact CB-CD1 4.03Å; V221-I473 HydrophobicContact CG1-CD1 4.46Å; M471-I473 HydrophobicContact CB-CD1 4.21Å; M471-I473 HydrophobicContact CB-CG1 3.95Å; M471-I473 HydrophobicContact CE-CD1 3.73Å; M471-I473 PolarHBondContact O-N 3.44Å; I473-S475 PolarHBondContact O-N 3.09Å; I473-S475 VanDerWaalsContact O-N 3.11Å
474	P	94.1	Very high	93.1	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	4%	0.036	C	C	.	.			trans	-64.8	111.1	168.1	26.7	-34.1	0	0	0	109.2	C171 K207 G210 L211 P226	C171-P474 VanDerWaalsContact SG-CD 3.52Å; K207-P474 HydrophobicContact CG-CB 3.94Å; G210-P474 VanDerWaalsContact C-CG 3.41Å; L211-P474 HydrophobicContact CB-CB 4.27Å; L211-P474 HydrophobicContact CB-CG 4.1Å; L211-P474 HydrophobicContact CD1-CB 4.43Å; L211-P474 VanDerWaalsContact CD1-O 3.32Å; L211-P474 WeakPolarHBondContact CD1-O 3.35Å; P226-P474 HydrophobicContact CB-CB 4.38Å; P226-P474 HydrophobicContact CG-CB 4.35Å
475	S	91.6	Very high	93.2	Very high	6 Å²	6	6.2 Å²	6.2	4%	0.042	4%	0.036	C	C	.	.			trans	-143.1	142.8	-179.3	64.1	0	0	0	0	111.4	G180 S181 P226 I473	G180-S475 CarbonylContact C-O 3.46Å; S181-S475 VanDerWaalsContact CA-O 3.3Å; S181-S475 WeakPolarHBondContact CA-O 3.47Å; S181-S475 PolarHBondContact N-O 3.21Å; P226-S475 VanDerWaalsContact CG-C 3.5Å; I473-S475 PolarHBondContact O-N 3.09Å; I473-S475 VanDerWaalsContact O-N 3.11Å
476	G	91.9	Very high	93.3	Very high	1 Å²	1	6.1 Å²	6.1	1%	0.01	4%	0.036	C	C	.	.	B	Isolated β-bridge	trans	-109.2	146.8	169.6	0	0	0	0	0	111	G222	G222-G476 WeakPolarHBondContact CA-O 3.28Å; G222-G476 PolarHBondContact N-O 2.92Å; G222-G476 WeakPolarHBondContact O-CA 3.27Å; G222-G476 PolarHBondContact O-N 2.97Å
477	A	92.3	Very high	93.5	Very high	12 Å²	12	6.1 Å²	6.1	10%	0.099	4%	0.036	C	C	.	.	S	Bend	trans	-95.1	-11.4	179.6	0	0	0	0	0	114	T469 P480 V481 L571	T469-A477 HydrophobicContact CG2-CB 3.78Å; A477-P480 WeakPolarHBondContact O-CD 3.41Å; A477-V481 VanDerWaalsContact O-CG2 3.26Å; A477-V481 WeakPolarHBondContact O-CG2 3.3Å; A477-V481 PolarHBondContact O-N 3.34Å; A477-L571 HydrophobicContact CB-CD2 3.45Å; A477-L571 VanDerWaalsContact CB-CD2 3.45Å
478	F	93.4	Very high	93.7	Very high	6 Å²	6	6 Å²	6	3%	0.026	3%	0.032	C	C	.	.	H	α-helix	trans	-58.3	-54.7	-174.8	-170.6	-75.5	0	0	0	112.2	E224 F271 F280 V481 F482 T527 T531 T536 I539	E224-F478 HydrophobicContact CB-CB 4.02Å; E224-F478 HydrophobicContact CG-CB 3.98Å; E224-F478 HydrophobicContact CG-CD1 4.28Å; E224-F478 HydrophobicContact CG-CG 4.29Å; F271-F478 AromaticContact CE1-CD1 3.86Å; F271-F478 HydrophobicContact CE1-CD1 3.86Å; F271-F478 AromaticContact CE1-CE1 3.67Å; F271-F478 HydrophobicContact CE1-CE1 3.67Å; F271-F478 HydrophobicContact CE1-CZ 4.43Å; F271-F478 HydrophobicContact CE2-CE1 4.18Å; F271-F478 HydrophobicContact CE2-CZ 4.2Å; F271-F478 AromaticContact CZ-CD1 3.41Å; F271-F478 HydrophobicContact CZ-CD1 3.41Å; F271-F478 VanDerWaalsContact CZ-CD1 3.41Å; F271-F478 HydrophobicContact CZ-CD2 4.36Å; F271-F478 AromaticContact CZ-CE1 3.25Å; F271-F478 HydrophobicContact CZ-CE1 3.25Å; F271-F478 HydrophobicContact CZ-CE2 4.23Å; F271-F478 AromaticContact CZ-CG 3.98Å; F271-F478 HydrophobicContact CZ-CG 3.98Å; F271-F478 AromaticContact CZ-CZ 3.69Å; F271-F478 HydrophobicContact CZ-CZ 3.69Å; F280-F478 HydrophobicContact CE2-CD2 4.35Å; F280-F478 AromaticContact CE2-CE2 3.99Å; F280-F478 HydrophobicContact CE2-CE2 3.99Å; F280-F478 HydrophobicContact CZ-CD2 4.43Å; F280-F478 HydrophobicContact CZ-CE2 4.47Å; F478-V481 PolarHBondContact O-N 3.39Å; F478-F482 HydrophobicContact CE1-CD2 4.18Å; F478-F482 WeakPolarHBondContact O-CB 3.37Å; F478-F482 PolarHBondContact O-N 3.43Å; F478-T527 HydrophobicContact CD1-CG2 4.05Å; F478-T527 HydrophobicContact CD2-CG2 3.61Å; F478-T527 HydrophobicContact CE1-CG2 3.89Å; F478-T527 HydrophobicContact CE2-CG2 3.45Å; F478-T527 VanDerWaalsContact CE2-CG2 3.45Å; F478-T527 HydrophobicContact CG-CG2 3.93Å; F478-T527 HydrophobicContact CZ-CG2 3.6Å; F478-T531 HydrophobicContact CD2-CG2 4.38Å; F478-T536 HydrophobicContact CE2-CG2 4.01Å; F478-T536 HydrophobicContact CZ-CG2 4.3Å; F478-I539 HydrophobicContact CZ-CD1 4.28Å; F478-I539 HydrophobicContact CZ-CG2 4.46Å
479	M	92.9	Very high	93.9	Very high	29 Å²	29	6 Å²	6	14%	0.143	3%	0.032	C	C	.	.	H	α-helix	trans	-63.8	-44.8	-175.9	-172.3	65.6	72.9	0	0	113.6	F271 I416 V481 F482 I483	F271-M479 HydrophobicContact CE1-CE 4.37Å; I416-M479 HydrophobicContact CD1-CE 4.49Å; I416-M479 HydrophobicContact CD1-CG 4.47Å; I416-M479 HydrophobicContact CD1-SD 3.29Å; I416-M479 WeakPolarHBondContact CD1-SD 3.41Å; M479-V481 PolarHBondContact O-N 3.26Å; M479-F482 WeakPolarHBondContact O-CB 3.5Å; M479-F482 PolarHBondContact O-N 2.9Å; M479-I483 HydrophobicContact CG-CD1 4.36Å; M479-I483 WeakPolarHBondContact O-CG1 3.49Å; M479-I483 PolarHBondContact O-N 3.1Å
480	P	94.9	Very high	94.2	Very high	7 Å²	7	5.5 Å²	5.5	5%	0.045	3%	0.029	C	C	.	.	H	α-helix	trans	-58.6	-43	173.8	-26.7	34.9	0	0	0	113.7	P220 A477 F482 I483 L484	P220-P480 VanDerWaalsContact O-CG 3.25Å; P220-P480 WeakPolarHBondContact O-CG 3.35Å; A477-P480 WeakPolarHBondContact O-CD 3.41Å; P480-F482 VanDerWaalsContact C-N 3.33Å; P480-I483 PolarHBondContact O-N 2.9Å; P480-L484 WeakPolarHBondContact O-CG 3.41Å; P480-L484 PolarHBondContact O-N 2.88Å
481	V	96.3	Very high	94.5	Very high	1 Å²	1	6.5 Å²	6.5	1%	0.006	4%	0.035	C	C	.	.	H	α-helix	trans	-66.8	-37.5	177.6	175.4	0	0	0	0	111.2	F357 A477 F478 M479 I483 L484 G485 M526 V530	F357-V481 HydrophobicContact CD1-CG2 3.96Å; F357-V481 HydrophobicContact CE1-CG2 3.48Å; F357-V481 VanDerWaalsContact CE1-CG2 3.48Å; F357-V481 HydrophobicContact CE2-CG2 4.35Å; F357-V481 HydrophobicContact CZ-CG2 3.7Å; A477-V481 VanDerWaalsContact O-CG2 3.26Å; A477-V481 WeakPolarHBondContact O-CG2 3.3Å; A477-V481 PolarHBondContact O-N 3.34Å; F478-V481 PolarHBondContact O-N 3.39Å; M479-V481 PolarHBondContact O-N 3.26Å; V481-I483 VanDerWaalsContact C-N 3.33Å; V481-I483 PolarHBondContact O-N 3.03Å; V481-L484 PolarHBondContact O-N 3.07Å; V481-G485 PolarHBondContact O-N 3.47Å; V481-M526 HydrophobicContact CG1-CG 4.01Å; V481-V530 HydrophobicContact CG1-CB 4.05Å; V481-V530 HydrophobicContact CG1-CG2 3.7Å; V481-V530 HydrophobicContact CG2-CG1 4.34Å; V481-V530 HydrophobicContact CG2-CG2 4.47Å
482	F	96.4	Very high	94.8	Very high	3 Å²	3	7.7 Å²	7.7	1%	0.013	4%	0.042	C	C	.	.	H	α-helix	trans	-59.9	-42.4	174.3	-169.8	-91.8	0	0	0	112	I416 F420 F478 M479 P480 G485 A486 A523 T527 C540	I416-F482 HydrophobicContact CD1-CD1 4.13Å; I416-F482 HydrophobicContact CD1-CE1 4.46Å; I416-F482 HydrophobicContact CG2-CE1 4.22Å; F420-F482 HydrophobicContact CE2-CE1 4.08Å; F420-F482 HydrophobicContact CE2-CZ 4.33Å; F420-F482 AromaticContact CZ-CE1 3.61Å; F420-F482 HydrophobicContact CZ-CE1 3.61Å; F420-F482 AromaticContact CZ-CZ 3.85Å; F420-F482 HydrophobicContact CZ-CZ 3.85Å; F478-F482 HydrophobicContact CE1-CD2 4.18Å; F478-F482 WeakPolarHBondContact O-CB 3.37Å; F478-F482 PolarHBondContact O-N 3.43Å; M479-F482 WeakPolarHBondContact O-CB 3.5Å; M479-F482 PolarHBondContact O-N 2.9Å; P480-F482 VanDerWaalsContact C-N 3.33Å; F482-G485 PolarHBondContact O-N 2.96Å; F482-A486 WeakPolarHBondContact O-CB 2.9Å; F482-A486 PolarHBondContact O-N 3.17Å; F482-A523 HydrophobicContact CD1-CB 4.1Å; F482-A523 HydrophobicContact CD2-CB 3.92Å; F482-A523 HydrophobicContact CE1-CB 3.87Å; F482-A523 HydrophobicContact CE2-CB 3.68Å; F482-A523 HydrophobicContact CG-CB 4.12Å; F482-A523 HydrophobicContact CZ-CB 3.66Å; F482-A523 WeakPolarHBondContact O-CB 3.27Å; F482-T527 WeakPolarHBondContact CA-OG1 3.18Å; F482-T527 PolarHBondContact N-OG1 3.4Å; F482-C540 HydrophobicContact CE2-CB 4.36Å
483	I	96.2	Very high	95	Very high	16 Å²	16	7.7 Å²	7.7	8%	0.082	4%	0.042	C	C	.	.	H	α-helix	trans	-65.2	-40.9	174.9	-67.7	167.4	0	0	0	111.7	P412 I416 L419 F457 M479 P480 V481 A486 A487	P412-I483 HydrophobicContact CB-CD1 3.73Å; I416-I483 HydrophobicContact CD1-CD1 4.2Å; I416-I483 HydrophobicContact CD1-CG1 3.79Å; I416-I483 HydrophobicContact CG1-CD1 4.2Å; I416-I483 HydrophobicContact CG1-CG1 3.56Å; L419-I483 HydrophobicContact CD1-CG2 4.38Å; F457-I483 HydrophobicContact CE1-CG2 3.91Å; F457-I483 HydrophobicContact CZ-CG2 3.73Å; M479-I483 HydrophobicContact CG-CD1 4.36Å; M479-I483 WeakPolarHBondContact O-CG1 3.49Å; M479-I483 PolarHBondContact O-N 3.1Å; P480-I483 PolarHBondContact O-N 2.9Å; V481-I483 VanDerWaalsContact C-N 3.33Å; V481-I483 PolarHBondContact O-N 3.03Å; I483-A486 PolarHBondContact O-N 3.27Å; I483-A487 WeakPolarHBondContact O-CB 2.97Å; I483-A487 PolarHBondContact O-N 3Å
484	L	96.8	Very high	95	Very high	1 Å²	1	7.7 Å²	7.7	1%	0.005	4%	0.042	C	C	.	.	H	α-helix	trans	-62.4	-43.8	176.7	-68.7	172	0	0	0	111.7	F357 F458 K461 F462 P480 V481 A486 A487 F488 M526	F357-L484 HydrophobicContact CD2-CD1 4.43Å; F357-L484 HydrophobicContact CE2-CD1 4.32Å; F458-L484 HydrophobicContact CD2-CB 4.48Å; F458-L484 HydrophobicContact CD2-CD2 4.25Å; F458-L484 HydrophobicContact CE2-CB 4.22Å; F458-L484 HydrophobicContact CE2-CD2 4.5Å; K461-L484 HydrophobicContact CB-CD2 3.62Å; F462-L484 HydrophobicContact CB-CD1 4.4Å; F462-L484 HydrophobicContact CB-CD2 4.16Å; F462-L484 HydrophobicContact CD2-CD1 4Å; F462-L484 HydrophobicContact CG-CD1 4.49Å; P480-L484 WeakPolarHBondContact O-CG 3.41Å; P480-L484 PolarHBondContact O-N 2.88Å; V481-L484 PolarHBondContact O-N 3.07Å; L484-A486 VanDerWaalsContact C-N 3.34Å; L484-A487 PolarHBondContact O-N 2.88Å; L484-F488 PolarHBondContact O-N 3.49Å; L484-M526 HydrophobicContact CB-CE 3.83Å; L484-M526 HydrophobicContact CB-SD 3.62Å; L484-M526 HydrophobicContact CD1-CE 4.1Å
485	G	97.3	Very high	94.9	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.5	-41.3	175	0	0	0	0	0	112	V481 F482 A487 F488 G489 G522 A523 M526	V481-G485 PolarHBondContact O-N 3.47Å; F482-G485 PolarHBondContact O-N 2.96Å; G485-A487 PolarHBondContact O-N 3.3Å; G485-F488 PolarHBondContact O-N 2.86Å; G485-G489 PolarHBondContact O-N 3.38Å; G485-G522 CarbonylContact C-O 3.51Å; G485-G522 VanDerWaalsContact CA-O 3.31Å; G485-G522 WeakPolarHBondContact CA-O 3.47Å; G485-G522 CarbonylContact O-C 2.93Å; G485-G522 WeakPolarHBondContact O-CA 3.48Å; G485-A523 VanDerWaalsContact C-N 3.31Å; G485-A523 PolarHBondContact O-N 3.41Å; G485-M526 PolarHBondContact N-SD 3.5Å; G485-M526 VanDerWaalsContact N-SD 3.37Å
486	A	96.8	Very high	94.9	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.9	-43.9	175.5	0	0	0	0	0	112	L419 F420 F482 I483 L484 R490 A519 A523	L419-A486 HydrophobicContact CB-CB 4.28Å; L419-A486 HydrophobicContact CD1-CB 3.79Å; F420-A486 HydrophobicContact CE1-CB 3.84Å; F482-A486 WeakPolarHBondContact O-CB 2.9Å; F482-A486 PolarHBondContact O-N 3.17Å; I483-A486 PolarHBondContact O-N 3.27Å; L484-A486 VanDerWaalsContact C-N 3.34Å; A486-R490 WeakPolarHBondContact O-CB 3.27Å; A486-R490 PolarHBondContact O-N 3.47Å; A486-A519 WeakPolarHBondContact CA-O 3.49Å; A486-A519 WeakPolarHBondContact O-CB 3.45Å; A486-A523 HydrophobicContact CB-CB 3.89Å
487	A	96.8	Very high	94.9	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-66.5	-42.2	177.8	0	0	0	0	0	112.6	L419 F457 I483 L484 G485 R490 L491	L419-A487 HydrophobicContact CD1-CB 4.35Å; L419-A487 HydrophobicContact CD2-CB 4.42Å; F457-A487 HydrophobicContact CD1-CB 3.62Å; F457-A487 HydrophobicContact CE1-CB 3.65Å; I483-A487 WeakPolarHBondContact O-CB 2.97Å; I483-A487 PolarHBondContact O-N 3Å; L484-A487 PolarHBondContact O-N 2.88Å; G485-A487 PolarHBondContact O-N 3.3Å; A487-R490 PolarHBondContact O-N 2.95Å; A487-L491 WeakPolarHBondContact O-CB 3.24Å; A487-L491 PolarHBondContact O-N 3.43Å
488	F	97.1	Very high	94.7	Very high	32 Å²	32	14.5 Å²	14.5	14%	0.14	8%	0.078	C	C	.	.	H	α-helix	trans	-65.6	-45.1	176	-178.6	-103.3	0	0	0	111.9	C350 L353 F458 L484 G485 R490 L491 V492	C350-F488 VanDerWaalsContact SG-CD1 3.58Å; L353-F488 HydrophobicContact CD1-CD1 4.32Å; L353-F488 HydrophobicContact CD1-CD2 3.91Å; L353-F488 HydrophobicContact CD1-CE1 4.29Å; L353-F488 HydrophobicContact CD1-CE2 3.88Å; L353-F488 HydrophobicContact CD1-CG 4.13Å; L353-F488 HydrophobicContact CD1-CZ 4.08Å; F458-F488 HydrophobicContact CD2-CB 4.08Å; F458-F488 HydrophobicContact CE2-CB 3.92Å; L484-F488 PolarHBondContact O-N 3.49Å; G485-F488 PolarHBondContact O-N 2.86Å; F488-R490 VanDerWaalsContact C-N 3.32Å; F488-R490 PolarHBondContact O-N 2.88Å; F488-L491 WeakPolarHBondContact O-CB 3.49Å; F488-L491 PolarHBondContact O-N 3.24Å; F488-V492 HydrophobicContact CE1-CG2 4.19Å; F488-V492 HydrophobicContact CE2-CG2 4.48Å; F488-V492 HydrophobicContact CZ-CG2 4.12Å; F488-V492 WeakPolarHBondContact O-CG2 3.37Å; F488-V492 PolarHBondContact O-N 2.88Å
489	G	96.5	Very high	94.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.6	-42.1	174.4	0	0	0	0	0	112.1	G485 L491 V492 G493 Y518	G485-G489 PolarHBondContact O-N 3.38Å; G489-L491 PolarHBondContact O-N 3.03Å; G489-V492 PolarHBondContact O-N 3.25Å; G489-G493 PolarHBondContact O-N 3.34Å; G489-Y518 WeakPolarHBondContact CA-O 3.38Å; G489-Y518 VanDerWaalsContact O-CB 3.28Å; G489-Y518 WeakPolarHBondContact O-CB 3.19Å
490	R	95.8	Very high	94.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.9	-43.7	176	-174.8	61.6	178.5	-154.4	14.4	112.1	L419 D421 F423 W425 L454 A486 A487 F488 G493 E494 A519	L419-R490 HydrophobicContact CD2-CB 4.04Å; L419-R490 HydrophobicContact CD2-CG 4.06Å; L419-R490 WeakPolarHBondContact O-CD 3.49Å; L419-R490 PolarHBondContact O-NH1 3.31Å; D421-R490 PolarHBondContact O-NH1 3.02Å; F423-R490 PolarHBondContact O-NH2 3.14Å; W425-R490 HydrophobicContact CH2-CG 4.39Å; W425-R490 HydrophobicContact CZ3-CG 4.02Å; L454-R490 HydrophobicContact CD1-CG 4.11Å; L454-R490 HydrophobicContact CD2-CG 4.29Å; A486-R490 WeakPolarHBondContact O-CB 3.27Å; A486-R490 PolarHBondContact O-N 3.47Å; A487-R490 PolarHBondContact O-N 2.95Å; F488-R490 VanDerWaalsContact C-N 3.32Å; F488-R490 PolarHBondContact O-N 2.88Å; R490-G493 PolarHBondContact O-N 3Å; R490-E494 IonicContact CZ-OE1 3.76Å; R490-E494 IonicContact NE-OE1 2.73Å; R490-E494 PolarHBondContact NE-OE1 3.24Å; R490-E494 IonicContact NH2-OE1 3.25Å; R490-E494 PolarHBondContact NH2-OE1 3.41Å; R490-E494 WeakPolarHBondContact O-CG 3.4Å; R490-E494 PolarHBondContact O-N 2.85Å; R490-A519 HydrophobicContact CB-CB 3.87Å
491	L	95.6	Very high	93.8	Very high	21 Å²	21	25.2 Å²	25.2	11%	0.11	13%	0.134	C	C	.	.	H	α-helix	trans	-57.1	-49.4	176	176.6	65.9	0	0	0	111	F451 L454 L455 A487 F488 G489 G493 E494 I495	F451-L491 HydrophobicContact CD1-CD1 4Å; L454-L491 HydrophobicContact CB-CB 4.49Å; L454-L491 HydrophobicContact CB-CD1 4.08Å; L455-L491 HydrophobicContact CD1-CD2 4.49Å; A487-L491 WeakPolarHBondContact O-CB 3.24Å; A487-L491 PolarHBondContact O-N 3.43Å; F488-L491 WeakPolarHBondContact O-CB 3.49Å; F488-L491 PolarHBondContact O-N 3.24Å; G489-L491 PolarHBondContact O-N 3.03Å; L491-G493 VanDerWaalsContact C-N 3.34Å; L491-G493 PolarHBondContact O-N 2.64Å; L491-E494 PolarHBondContact O-N 3.05Å; L491-I495 HydrophobicContact CD1-CD1 4.45Å; L491-I495 HydrophobicContact CG-CD1 4.24Å; L491-I495 VanDerWaalsContact O-CG1 3.3Å; L491-I495 WeakPolarHBondContact O-CG1 3.3Å; L491-I495 PolarHBondContact O-N 3.28Å
492	V	95.2	Very high	93	Very high	26 Å²	26	31.4 Å²	31.4	16%	0.158	17%	0.168	C	C	.	.	H	α-helix	trans	-63.9	-40.1	177.2	177.5	0	0	0	0	111.5	I346 F488 G489 I495 M496 Y518	I346-V492 HydrophobicContact CD1-CB 4.05Å; I346-V492 HydrophobicContact CD1-CG1 3.74Å; I346-V492 HydrophobicContact CG1-CB 4.08Å; I346-V492 HydrophobicContact CG1-CG1 3.81Å; I346-V492 HydrophobicContact CG1-CG2 4.15Å; F488-V492 HydrophobicContact CE1-CG2 4.19Å; F488-V492 HydrophobicContact CE2-CG2 4.48Å; F488-V492 HydrophobicContact CZ-CG2 4.12Å; F488-V492 WeakPolarHBondContact O-CG2 3.37Å; F488-V492 PolarHBondContact O-N 2.88Å; G489-V492 PolarHBondContact O-N 3.25Å; V492-I495 WeakPolarHBondContact O-CB 3.36Å; V492-I495 PolarHBondContact O-N 3.46Å; V492-M496 WeakPolarHBondContact O-CG 3.44Å; V492-M496 PolarHBondContact O-N 3.26Å; V492-Y518 HydrophobicContact CG1-CD1 4.41Å
493	G	93.6	Very high	92.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.4	-41.3	177	0	0	0	0	0	113.5	G489 R490 L491 M496 A497	G489-G493 PolarHBondContact O-N 3.34Å; R490-G493 PolarHBondContact O-N 3Å; L491-G493 VanDerWaalsContact C-N 3.34Å; L491-G493 PolarHBondContact O-N 2.64Å; G493-M496 PolarHBondContact O-N 3.39Å; G493-A497 WeakPolarHBondContact O-CB 3.36Å; G493-A497 PolarHBondContact O-N 3.49Å
494	E	93.4	Very high	91.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-67.8	-36	174.5	-68	-70.2	167.7	0	0	111.3	W425 T426 F451 L454 R490 L491 A497 T498 P515	W425-E494 PolarHBondContact N-OE1 2.98Å; W425-E494 PolarHBondContact N-OE2 2.78Å; T426-E494 HydrophobicContact CG2-CB 4.34Å; T426-E494 WeakPolarHBondContact CG2-OE2 3.41Å; T426-E494 PolarHBondContact N-OE2 2.9Å; T426-E494 PolarHBondContact OG1-OE2 2.87Å; F451-E494 HydrophobicContact CD1-CB 4.45Å; F451-E494 HydrophobicContact CE1-CB 3.69Å; F451-E494 HydrophobicContact CZ-CB 4.32Å; L454-E494 HydrophobicContact CD1-CG 4.42Å; R490-E494 IonicContact CZ-OE1 3.76Å; R490-E494 IonicContact NE-OE1 2.73Å; R490-E494 PolarHBondContact NE-OE1 3.24Å; R490-E494 IonicContact NH2-OE1 3.25Å; R490-E494 PolarHBondContact NH2-OE1 3.41Å; R490-E494 WeakPolarHBondContact O-CG 3.4Å; R490-E494 PolarHBondContact O-N 2.85Å; L491-E494 PolarHBondContact O-N 3.05Å; E494-A497 PolarHBondContact O-N 3.17Å; E494-T498 PolarHBondContact O-N 2.89Å; E494-T498 PolarHBondContact O-OG1 2.77Å; E494-P515 HydrophobicContact CG-CB 4.2Å; E494-P515 HydrophobicContact CG-CG 4.34Å
495	I	93	Very high	90.6	Very high	71 Å²	71	36.6 Å²	36.6	36%	0.364	20%	0.198	S	C	.	.	H	α-helix	trans	-61.4	-48	173.7	-68.4	165.7	0	0	0	109.5	F451 L491 V492 A497 T498 L499	F451-I495 HydrophobicContact CD1-CG1 4.07Å; F451-I495 HydrophobicContact CE1-CB 4.46Å; F451-I495 HydrophobicContact CE1-CG1 3.69Å; L491-I495 HydrophobicContact CD1-CD1 4.45Å; L491-I495 HydrophobicContact CG-CD1 4.24Å; L491-I495 VanDerWaalsContact O-CG1 3.3Å; L491-I495 WeakPolarHBondContact O-CG1 3.3Å; L491-I495 PolarHBondContact O-N 3.28Å; V492-I495 WeakPolarHBondContact O-CB 3.36Å; V492-I495 PolarHBondContact O-N 3.46Å; I495-A497 VanDerWaalsContact C-N 3.32Å; I495-A497 PolarHBondContact O-N 2.67Å; I495-T498 PolarHBondContact O-N 3.28Å; I495-T498 VanDerWaalsContact O-N 3.08Å; I495-T498 PolarHBondContact O-OG1 3.5Å; I495-L499 HydrophobicContact CG2-CD1 3.88Å; I495-L499 HydrophobicContact CG2-CG 4.29Å; I495-L499 WeakPolarHBondContact O-CG 3.37Å; I495-L499 PolarHBondContact O-N 3.46Å
496	M	91.4	Very high	89.1	Confident	23 Å²	23	40.9 Å²	40.9	11%	0.113	22%	0.217	C	C	.	.	H	α-helix	trans	-59.2	-42	176.6	-73.4	-60.1	-64	0	0	112.3	A342 V492 G493 T498 L499 F500 I513 Y518	A342-M496 HydrophobicContact CB-CE 4.25Å; A342-M496 HydrophobicContact CB-CG 4.39Å; A342-M496 HydrophobicContact CB-SD 4.11Å; V492-M496 WeakPolarHBondContact O-CG 3.44Å; V492-M496 PolarHBondContact O-N 3.26Å; G493-M496 PolarHBondContact O-N 3.39Å; M496-T498 VanDerWaalsContact C-N 3.25Å; M496-T498 PolarHBondContact O-N 2.97Å; M496-L499 PolarHBondContact O-N 3.2Å; M496-L499 HydrophobicContact SD-CD1 4.36Å; M496-F500 HydrophobicContact CE-CD2 3.81Å; M496-F500 HydrophobicContact CE-CE2 3.69Å; M496-F500 PolarHBondContact O-N 3.34Å; M496-F500 HydrophobicContact SD-CE2 4.48Å; M496-I513 HydrophobicContact CB-CD1 4.13Å; M496-I513 HydrophobicContact CB-CG2 4.27Å; M496-I513 HydrophobicContact CE-CD1 4.39Å; M496-Y518 HydrophobicContact CB-CE1 4.41Å; M496-Y518 HydrophobicContact CG-CE1 3.9Å
497	A	90.3	Very high	87.6	Confident	5 Å²	5	48.1 Å²	48.1	4%	0.041	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-28	176.4	0	0	0	0	0	113.4	T424 G493 E494 I495 P501 P515	T424-A497 HydrophobicContact CG2-CB 3.66Å; G493-A497 WeakPolarHBondContact O-CB 3.36Å; G493-A497 PolarHBondContact O-N 3.49Å; E494-A497 PolarHBondContact O-N 3.17Å; I495-A497 VanDerWaalsContact C-N 3.32Å; I495-A497 PolarHBondContact O-N 2.67Å; A497-P501 WeakPolarHBondContact O-CA 3.25Å; A497-P515 HydrophobicContact CB-CG 4.2Å
498	T	89.9	Confident	86.3	Confident	63 Å²	63	51.4 Å²	51.4	39%	0.387	29%	0.289	S	S	.	.	H	α-helix	trans	-82.2	-33.5	172.8	56	0	0	0	0	114.1	T426 F451 E494 I495 M496	T426-T498 HydrophobicContact CG2-CG2 3.86Å; F451-T498 HydrophobicContact CE2-CG2 4.07Å; F451-T498 HydrophobicContact CZ-CG2 3.6Å; E494-T498 PolarHBondContact O-N 2.89Å; E494-T498 PolarHBondContact O-OG1 2.77Å; I495-T498 PolarHBondContact O-N 3.28Å; I495-T498 VanDerWaalsContact O-N 3.08Å; I495-T498 PolarHBondContact O-OG1 3.5Å; M496-T498 VanDerWaalsContact C-N 3.25Å; M496-T498 PolarHBondContact O-N 2.97Å
499	L	89.9	Confident	85.2	Confident	110 Å²	110	54.3 Å²	54.3	58%	0.576	31%	0.306	S	S	*	.	H	α-helix	trans	-69.3	-36.7	176.1	-71.8	172.7	0	0	0	111.8	I495 M496 P501	I495-L499 HydrophobicContact CG2-CD1 3.88Å; I495-L499 HydrophobicContact CG2-CG 4.29Å; I495-L499 WeakPolarHBondContact O-CG 3.37Å; I495-L499 PolarHBondContact O-N 3.46Å; M496-L499 PolarHBondContact O-N 3.2Å; M496-L499 HydrophobicContact SD-CD1 4.36Å; L499-P501 VanDerWaalsContact C-CD 3.42Å; L499-P501 VanDerWaalsContact O-CD 3.26Å; L499-P501 WeakPolarHBondContact O-CD 3.39Å
500	F	88.3	Confident	84.3	Confident	91 Å²	91	58 Å²	58	40%	0.399	33%	0.328	S	S	.	.	S	Bend	trans	-118.9	71.4	178.2	-59.9	-82	0	0	0	110.5	M496 N502 G503 I513	M496-F500 HydrophobicContact CE-CD2 3.81Å; M496-F500 HydrophobicContact CE-CE2 3.69Å; M496-F500 PolarHBondContact O-N 3.34Å; M496-F500 HydrophobicContact SD-CE2 4.48Å; F500-N502 VanDerWaalsContact C-N 3.29Å; F500-N502 PolarHBondContact O-N 3.38Å; F500-G503 PolarHBondContact O-N 3.38Å; F500-I513 HydrophobicContact CB-CD1 3.81Å; F500-I513 HydrophobicContact CD2-CD1 4.18Å; F500-I513 HydrophobicContact CG-CD1 4.38Å
501	P	82.6	Confident	83.5	Confident	66 Å²	66	60.7 Å²	60.7	43%	0.429	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-32	-171.7	25.3	-34	0	0	0	112.8	K427 A497 L499 G503	K427-P501 PolarHBondContact NZ-O 3.43Å; A497-P501 WeakPolarHBondContact O-CA 3.25Å; L499-P501 VanDerWaalsContact C-CD 3.42Å; L499-P501 VanDerWaalsContact O-CD 3.26Å; L499-P501 WeakPolarHBondContact O-CD 3.39Å; P501-G503 VanDerWaalsContact C-N 3.3Å
502	N	80.1	Confident	82.8	Confident	131 Å²	131	67.9 Å²	67.9	70%	0.701	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-21.4	176.8	-66.6	-26.1	0	0	0	111.8	F500 V510	F500-N502 VanDerWaalsContact C-N 3.29Å; F500-N502 PolarHBondContact O-N 3.38Å; N502-V510 WeakPolarHBondContact O-CG1 3.46Å
503	G	81.3	Confident	82.5	Confident	14 Å²	14	67 Å²	67	14%	0.144	36%	0.358	C	S	.	.			trans	103.8	-177.7	-167.2	0	0	0	0	0	111.4	F500 P501 Y511	F500-G503 PolarHBondContact O-N 3.38Å; P501-G503 VanDerWaalsContact C-N 3.3Å; G503-Y511 CarbonylContact C-O 3.6Å; G503-Y511 WeakPolarHBondContact CA-O 3.16Å
504	I	80.3	Confident	82.2	Confident	5 Å²	5	68.7 Å²	68.7	3%	0.026	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	133.9	176.2	-61.1	167.4	0	0	0	107.7	D336 Q338 E339 Y511 I513	D336-I504 HydrophobicContact CB-CD1 4.07Å; D336-I504 HydrophobicContact CB-CG2 4.1Å; D336-I504 WeakPolarHBondContact OD2-CB 3.32Å; Q338-I504 HydrophobicContact CB-CD1 4.47Å; Q338-I504 HydrophobicContact CB-CG2 4.37Å; Q338-I504 HydrophobicContact CG-CG2 4.47Å; E339-I504 HydrophobicContact CG-CD1 3.45Å; E339-I504 VanDerWaalsContact CG-CD1 3.45Å; I504-Y511 PolarHBondContact N-O 3.23Å; I504-Y511 PolarHBondContact O-N 2.91Å; I504-I513 HydrophobicContact CD1-CD1 4.14Å; I504-I513 HydrophobicContact CD1-CG1 4.27Å; I504-I513 HydrophobicContact CG1-CD1 4.3Å; I504-I513 HydrophobicContact CG1-CG1 4.44Å
505	L	76.8	Confident	82.1	Confident	110 Å²	110	68.7 Å²	68.7	58%	0.576	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	118.9	179.6	-176.9	74.3	0	0	0	109.1	V510	L505-V510 HydrophobicContact CD1-CG2 3.65Å
506	F	66.9	Low	82	Confident	90 Å²	90	65.3 Å²	65.3	40%	0.395	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	124.2	173.2	-167.6	-93.7	0	0	0	109.6	F333 G508 I509 Y511	F333-F506 HydrophobicContact CE2-CD1 4.09Å; F333-F506 HydrophobicContact CE2-CE1 4.25Å; F333-F506 HydrophobicContact CZ-CD1 4.1Å; F333-F506 HydrophobicContact CZ-CG 4.16Å; F506-G508 VanDerWaalsContact C-N 3.25Å; F506-G508 PolarHBondContact O-N 3.19Å; F506-G508 VanDerWaalsContact O-N 3.17Å; F506-I509 PolarHBondContact N-O 3.12Å; F506-I509 PolarHBondContact O-N 3.12Å; F506-I509 VanDerWaalsContact O-O 3.07Å; F506-Y511 HydrophobicContact CB-CD2 4.22Å; F506-Y511 HydrophobicContact CB-CE2 4.25Å
507	D	64.7	Low	82	Confident	153 Å²	153	64.2 Å²	64.2	82%	0.818	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	39.7	178.6	-154.2	23.7	0	0	0	114.6	I509	D507-I509 VanDerWaalsContact C-N 3.25Å; D507-I509 PolarHBondContact O-N 2.87Å
508	G	69.4	Low	82.2	Confident	68 Å²	68	64 Å²	64	70%	0.701	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	-3.9	-179.9	0	0	0	0	0	115.7	F506	F506-G508 VanDerWaalsContact C-N 3.25Å; F506-G508 PolarHBondContact O-N 3.19Å; F506-G508 VanDerWaalsContact O-N 3.17Å
509	I	74.9	Confident	82.5	Confident	94 Å²	94	61 Å²	61	48%	0.482	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	134.3	175.6	-55	175	0	0	0	109.2	F506 D507 Y511	F506-I509 PolarHBondContact N-O 3.12Å; F506-I509 PolarHBondContact O-N 3.12Å; F506-I509 VanDerWaalsContact O-O 3.07Å; D507-I509 VanDerWaalsContact C-N 3.25Å; D507-I509 PolarHBondContact O-N 2.87Å; I509-Y511 HydrophobicContact CB-CE2 3.95Å; I509-Y511 HydrophobicContact CG2-CD2 4.5Å; I509-Y511 HydrophobicContact CG2-CE1 4.08Å; I509-Y511 HydrophobicContact CG2-CE2 3.97Å
510	V	77.8	Confident	82.7	Confident	77 Å²	77	56 Å²	56	47%	0.467	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	113.5	179.8	-176.4	0	0	0	0	110	N502 L505	N502-V510 WeakPolarHBondContact O-CG1 3.46Å; L505-V510 HydrophobicContact CD1-CG2 3.65Å
511	Y	77.9	Confident	83.1	Confident	56 Å²	56	51.7 Å²	51.7	22%	0.22	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.3	179.1	-67	-75.8	0	0	0	111.2	F333 G503 I504 F506 I509	F333-Y511 HydrophobicContact CB-CD1 4.35Å; F333-Y511 HydrophobicContact CB-CE1 3.93Å; F333-Y511 HydrophobicContact CD1-CD1 4.22Å; F333-Y511 AromaticContact CD1-CD2 3.95Å; F333-Y511 HydrophobicContact CD1-CD2 3.95Å; F333-Y511 HydrophobicContact CD1-CE1 4.38Å; F333-Y511 HydrophobicContact CD1-CE2 4.13Å; F333-Y511 HydrophobicContact CD1-CG 4Å; F333-Y511 HydrophobicContact CE1-CD2 4.16Å; F333-Y511 HydrophobicContact CE1-CE2 4.44Å; F333-Y511 HydrophobicContact CG-CE1 4.29Å; F333-Y511 HydrophobicContact CG-CE2 4.27Å; G503-Y511 CarbonylContact C-O 3.6Å; G503-Y511 WeakPolarHBondContact CA-O 3.16Å; I504-Y511 PolarHBondContact N-O 3.23Å; I504-Y511 PolarHBondContact O-N 2.91Å; F506-Y511 HydrophobicContact CB-CD2 4.22Å; F506-Y511 HydrophobicContact CB-CE2 4.25Å; I509-Y511 HydrophobicContact CB-CE2 3.95Å; I509-Y511 HydrophobicContact CG2-CD2 4.5Å; I509-Y511 HydrophobicContact CG2-CE1 4.08Å; I509-Y511 HydrophobicContact CG2-CE2 3.97Å
512	R	81.8	Confident	83.8	Confident	173 Å²	173	48.5 Å²	48.5	65%	0.653	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-70.2	142.1	175.7	-66.3	-179.7	-179.9	-176.1	1.1	110.9	R330 L514	R330-R512 PolarHBondContact NH1-O 3.07Å; R330-R512 PolarHBondContact NH2-O 3.32Å; R512-L514 WeakPolarHBondContact O-CD1 3.33Å
513	I	87.5	Confident	84.5	Confident	6 Å²	6	42.3 Å²	42.3	3%	0.031	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-75.2	134.9	176.5	-61.2	175.1	0	0	0	109.5	M496 F500 I504 P515 Y518	M496-I513 HydrophobicContact CB-CD1 4.13Å; M496-I513 HydrophobicContact CB-CG2 4.27Å; M496-I513 HydrophobicContact CE-CD1 4.39Å; F500-I513 HydrophobicContact CB-CD1 3.81Å; F500-I513 HydrophobicContact CD2-CD1 4.18Å; F500-I513 HydrophobicContact CG-CD1 4.38Å; I504-I513 HydrophobicContact CD1-CD1 4.14Å; I504-I513 HydrophobicContact CD1-CG1 4.27Å; I504-I513 HydrophobicContact CG1-CD1 4.3Å; I504-I513 HydrophobicContact CG1-CG1 4.44Å; I513-P515 WeakPolarHBondContact O-CD 3.43Å; I513-Y518 HydrophobicContact CG2-CD2 4.41Å; I513-Y518 HydrophobicContact CG2-CE2 3.65Å
514	L	87.9	Confident	85.3	Confident	36 Å²	36	41.6 Å²	41.6	19%	0.188	22%	0.218	C	C	.	.			trans	-105.3	105.9	175.6	-78.6	88	0	0	0	110.5	F329 R330 N422 R512 G516 G517	F329-L514 HydrophobicContact CD1-CD2 4.26Å; R330-L514 HydrophobicContact CG-CD1 4.35Å; N422-L514 HydrophobicContact CB-CD2 4.38Å; R512-L514 WeakPolarHBondContact O-CD1 3.33Å; L514-G516 PolarHBondContact O-N 2.78Å; L514-G516 VanDerWaalsContact O-N 3.11Å; L514-G517 PolarHBondContact O-N 3.12Å
515	P	91.4	Very high	86.1	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-23	-179.4	-25.4	35.4	0	0	0	114.4	T424 E494 A497 I513 G517 Y518 A519	T424-P515 HydrophobicContact CG2-CG 4.41Å; E494-P515 HydrophobicContact CG-CB 4.2Å; E494-P515 HydrophobicContact CG-CG 4.34Å; A497-P515 HydrophobicContact CB-CG 4.2Å; I513-P515 WeakPolarHBondContact O-CD 3.43Å; P515-G517 VanDerWaalsContact C-N 3.33Å; P515-G517 PolarHBondContact O-N 2.81Å; P515-Y518 WeakPolarHBondContact O-CB 3.42Å; P515-Y518 PolarHBondContact O-N 3.35Å; P515-A519 PolarHBondContact O-N 3.31Å
516	G	90.6	Very high	87.1	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-37.3	176.4	0	0	0	0	0	113.3	L514 Y518 A519 V520	L514-G516 PolarHBondContact O-N 2.78Å; L514-G516 VanDerWaalsContact O-N 3.11Å; G516-Y518 PolarHBondContact O-N 2.96Å; G516-A519 WeakPolarHBondContact O-CB 3.44Å; G516-A519 PolarHBondContact O-N 3.05Å; G516-V520 WeakPolarHBondContact O-CG2 3.26Å; G516-V520 PolarHBondContact O-N 2.81Å; G516-V520 VanDerWaalsContact O-N 3.11Å
517	G	91.8	Very high	88.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.4	-40.6	176.2	0	0	0	0	0	112.4	L514 P515 A519 V520 I521	L514-G517 PolarHBondContact O-N 3.12Å; P515-G517 VanDerWaalsContact C-N 3.33Å; P515-G517 PolarHBondContact O-N 2.81Å; G517-A519 VanDerWaalsContact C-N 3.34Å; G517-A519 PolarHBondContact O-N 3.31Å; G517-V520 PolarHBondContact O-N 3.11Å; G517-I521 WeakPolarHBondContact O-CG1 3.37Å; G517-I521 PolarHBondContact O-N 3.14Å
518	Y	94.5	Very high	90	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.008	13%	0.132	C	C	.	.	H	α-helix	trans	-64.2	-39.4	175.6	-70.3	-109.8	0	0	0	111.7	E339 A342 F343 I346 G489 V492 M496 I513 P515 G516 I521 G522	E339-Y518 WeakPolarHBondContact CB-OH 3.28Å; E339-Y518 VanDerWaalsContact CG-OH 3.24Å; E339-Y518 WeakPolarHBondContact CG-OH 3.33Å; E339-Y518 WeakPolarHBondContact OE2-CE2 3.47Å; E339-Y518 VanDerWaalsContact OE2-CZ 3.23Å; E339-Y518 PolarHBondContact OE2-OH 3.44Å; A342-Y518 HydrophobicContact CB-CE1 4.13Å; F343-Y518 HydrophobicContact CD1-CD1 4.11Å; F343-Y518 AromaticContact CD1-CE1 3.98Å; F343-Y518 HydrophobicContact CD1-CE1 3.98Å; F343-Y518 AromaticContact CE1-CD1 3.73Å; F343-Y518 HydrophobicContact CE1-CD1 3.73Å; F343-Y518 HydrophobicContact CE1-CD2 4.03Å; F343-Y518 AromaticContact CE1-CE1 3.51Å; F343-Y518 HydrophobicContact CE1-CE1 3.51Å; F343-Y518 AromaticContact CE1-CE2 3.8Å; F343-Y518 HydrophobicContact CE1-CE2 3.8Å; F343-Y518 AromaticContact CE1-CG 3.97Å; F343-Y518 HydrophobicContact CE1-CG 3.97Å; F343-Y518 AromaticContact CE1-CZ 3.53Å; F343-Y518 HydrophobicContact CZ-CE1 4.34Å; F343-Y518 HydrophobicContact CZ-CE2 4.11Å; F343-Y518 AromaticContact CZ-CZ 3.94Å; I346-Y518 HydrophobicContact CD1-CD1 3.62Å; I346-Y518 HydrophobicContact CD1-CE1 4.39Å; I346-Y518 HydrophobicContact CD1-CG 4.48Å; G489-Y518 WeakPolarHBondContact CA-O 3.38Å; G489-Y518 VanDerWaalsContact O-CB 3.28Å; G489-Y518 WeakPolarHBondContact O-CB 3.19Å; V492-Y518 HydrophobicContact CG1-CD1 4.41Å; M496-Y518 HydrophobicContact CB-CE1 4.41Å; M496-Y518 HydrophobicContact CG-CE1 3.9Å; I513-Y518 HydrophobicContact CG2-CD2 4.41Å; I513-Y518 HydrophobicContact CG2-CE2 3.65Å; P515-Y518 WeakPolarHBondContact O-CB 3.42Å; P515-Y518 PolarHBondContact O-N 3.35Å; G516-Y518 PolarHBondContact O-N 2.96Å; Y518-I521 PolarHBondContact O-N 3.28Å; Y518-G522 PolarHBondContact O-N 3.39Å
519	A	95.6	Very high	91.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.6	-45.8	175.1	0	0	0	0	0	111.6	L419 F420 A486 R490 P515 G516 G517 I521 G522 A523	L419-A519 WeakPolarHBondContact O-CB 3.19Å; F420-A519 HydrophobicContact CD1-CB 3.93Å; F420-A519 HydrophobicContact CE1-CB 4.21Å; A486-A519 WeakPolarHBondContact CA-O 3.49Å; A486-A519 WeakPolarHBondContact O-CB 3.45Å; R490-A519 HydrophobicContact CB-CB 3.87Å; P515-A519 PolarHBondContact O-N 3.31Å; G516-A519 WeakPolarHBondContact O-CB 3.44Å; G516-A519 PolarHBondContact O-N 3.05Å; G517-A519 VanDerWaalsContact C-N 3.34Å; G517-A519 PolarHBondContact O-N 3.31Å; A519-I521 PolarHBondContact O-N 2.91Å; A519-G522 PolarHBondContact O-N 2.91Å; A519-A523 WeakPolarHBondContact O-CB 3.42Å; A519-A523 PolarHBondContact O-N 3.39Å
520	V	95	Very high	92.4	Very high	4 Å²	4	17 Å²	17	2%	0.024	8%	0.077	C	C	.	.	H	α-helix	trans	-62.2	-45.3	177.8	177	0	0	0	0	111.2	F329 F420 G516 G517 G522 A523 A524 C540 T544 M553	F329-V520 HydrophobicContact CE2-CG2 3.91Å; F329-V520 HydrophobicContact CZ-CG2 3.88Å; F420-V520 HydrophobicContact CD1-CG2 3.6Å; F420-V520 HydrophobicContact CD2-CG2 4.1Å; F420-V520 HydrophobicContact CE1-CB 4.31Å; F420-V520 HydrophobicContact CE1-CG2 3.65Å; F420-V520 HydrophobicContact CE2-CG2 4.13Å; F420-V520 HydrophobicContact CG-CG2 3.84Å; F420-V520 HydrophobicContact CZ-CG2 3.91Å; G516-V520 WeakPolarHBondContact O-CG2 3.26Å; G516-V520 PolarHBondContact O-N 2.81Å; G516-V520 VanDerWaalsContact O-N 3.11Å; G517-V520 PolarHBondContact O-N 3.11Å; V520-G522 PolarHBondContact O-N 2.73Å; V520-A523 WeakPolarHBondContact O-CB 3.41Å; V520-A523 PolarHBondContact O-N 3.48Å; V520-A524 PolarHBondContact O-N 2.89Å; V520-A524 VanDerWaalsContact O-N 3.11Å; V520-C540 WeakPolarHBondContact CG1-SG 3.26Å; V520-T544 HydrophobicContact CG1-CG2 3.8Å; V520-T544 HydrophobicContact CG2-CG2 3.96Å; V520-M553 HydrophobicContact CG1-CE 3.58Å
521	I	95.6	Very high	93.2	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-61.7	-45.3	177.6	-66.8	166.3	0	0	0	111	F343 G517 Y518 A519 A523 A524 A525 H549 P552 M553 A556	F343-I521 HydrophobicContact CD1-CD1 3.53Å; F343-I521 HydrophobicContact CD2-CD1 4.46Å; F343-I521 HydrophobicContact CE1-CD1 3.46Å; F343-I521 VanDerWaalsContact CE1-CD1 3.46Å; F343-I521 HydrophobicContact CE2-CD1 4.41Å; F343-I521 HydrophobicContact CG-CD1 4.07Å; F343-I521 HydrophobicContact CZ-CD1 3.94Å; G517-I521 WeakPolarHBondContact O-CG1 3.37Å; G517-I521 PolarHBondContact O-N 3.14Å; Y518-I521 PolarHBondContact O-N 3.28Å; A519-I521 PolarHBondContact O-N 2.91Å; I521-A523 VanDerWaalsContact C-N 3.34Å; I521-A523 PolarHBondContact O-N 3.24Å; I521-A524 PolarHBondContact O-N 3.22Å; I521-A525 VanDerWaalsContact O-CB 3.3Å; I521-A525 WeakPolarHBondContact O-CB 3.41Å; I521-A525 PolarHBondContact O-N 3.34Å; I521-H549 HydrophobicContact CD1-CB 4.45Å; I521-P552 HydrophobicContact CD1-CB 4.4Å; I521-P552 HydrophobicContact CD1-CG 4.46Å; I521-M553 HydrophobicContact CG1-CB 4.11Å; I521-M553 HydrophobicContact CG1-CG 4.5Å; I521-A556 HydrophobicContact CG2-CB 3.7Å
522	G	97.1	Very high	94	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-61.1	-40.7	176.5	0	0	0	0	0	112.9	G485 Y518 A519 V520 A525 M526	G485-G522 CarbonylContact C-O 3.51Å; G485-G522 VanDerWaalsContact CA-O 3.31Å; G485-G522 WeakPolarHBondContact CA-O 3.47Å; G485-G522 CarbonylContact O-C 2.93Å; G485-G522 WeakPolarHBondContact O-CA 3.48Å; Y518-G522 PolarHBondContact O-N 3.39Å; A519-G522 PolarHBondContact O-N 2.91Å; V520-G522 PolarHBondContact O-N 2.73Å; G522-A525 PolarHBondContact O-N 3.08Å; G522-M526 WeakPolarHBondContact O-CB 3.33Å; G522-M526 PolarHBondContact O-N 3.06Å
523	A	96.8	Very high	94.6	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-60.2	-47.1	177.2	0	0	0	0	0	111.9	F420 F482 G485 A486 A519 V520 I521 T527	F420-A523 HydrophobicContact CE1-CB 4.31Å; F420-A523 HydrophobicContact CZ-CB 4.18Å; F482-A523 HydrophobicContact CD1-CB 4.1Å; F482-A523 HydrophobicContact CD2-CB 3.92Å; F482-A523 HydrophobicContact CE1-CB 3.87Å; F482-A523 HydrophobicContact CE2-CB 3.68Å; F482-A523 HydrophobicContact CG-CB 4.12Å; F482-A523 HydrophobicContact CZ-CB 3.66Å; F482-A523 WeakPolarHBondContact O-CB 3.27Å; G485-A523 VanDerWaalsContact C-N 3.31Å; G485-A523 PolarHBondContact O-N 3.41Å; A486-A523 HydrophobicContact CB-CB 3.89Å; A519-A523 WeakPolarHBondContact O-CB 3.42Å; A519-A523 PolarHBondContact O-N 3.39Å; V520-A523 WeakPolarHBondContact O-CB 3.41Å; V520-A523 PolarHBondContact O-N 3.48Å; I521-A523 VanDerWaalsContact C-N 3.34Å; I521-A523 PolarHBondContact O-N 3.24Å; A523-T527 WeakPolarHBondContact O-CB 3.02Å; A523-T527 PolarHBondContact O-N 3.28Å; A523-T527 PolarHBondContact O-OG1 2.85Å
524	A	96.9	Very high	94.9	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-65.5	-46.4	176.9	0	0	0	0	0	112.1	V520 I521 G528 T536 C540 M553 V557	V520-A524 PolarHBondContact O-N 2.89Å; V520-A524 VanDerWaalsContact O-N 3.11Å; I521-A524 PolarHBondContact O-N 3.22Å; A524-G528 PolarHBondContact O-N 2.86Å; A524-T536 PolarHBondContact O-OG1 3.22Å; A524-C540 HydrophobicContact CB-CB 3.88Å; A524-M553 HydrophobicContact CB-CG 3.77Å; A524-M553 HydrophobicContact CB-SD 3.82Å; A524-V557 HydrophobicContact CB-CG2 3.83Å
525	A	97.9	Very high	95.3	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-64	-49	-176	0	0	0	0	0	112.8	C350 I521 G522 G528 A529 A556 V557 A560	C350-A525 HydrophobicContact CB-CB 3.94Å; I521-A525 VanDerWaalsContact O-CB 3.3Å; I521-A525 WeakPolarHBondContact O-CB 3.41Å; I521-A525 PolarHBondContact O-N 3.34Å; G522-A525 PolarHBondContact O-N 3.08Å; A525-G528 PolarHBondContact O-N 3.07Å; A525-A529 WeakPolarHBondContact O-CB 3.49Å; A525-A529 PolarHBondContact O-N 3.4Å; A525-A556 HydrophobicContact CB-CB 4.4Å; A525-V557 HydrophobicContact CB-CG2 4.33Å; A525-A560 HydrophobicContact CB-CB 4.21Å
526	M	97.4	Very high	95.4	Very high	0 Å²	0	5.8 Å²	5.8	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-67.7	-39.7	-180	-170	175.8	179.3	0	0	111.8	C350 L353 F458 F462 V481 L484 G485 G522 A529 V530	C350-M526 HydrophobicContact CB-CB 4.12Å; L353-M526 HydrophobicContact CB-CE 4.4Å; F458-M526 HydrophobicContact CE2-CE 4.49Å; F458-M526 HydrophobicContact CE2-SD 4.38Å; F462-M526 HydrophobicContact CD2-CE 4.05Å; F462-M526 HydrophobicContact CE2-CE 3.76Å; V481-M526 HydrophobicContact CG1-CG 4.01Å; L484-M526 HydrophobicContact CB-CE 3.83Å; L484-M526 HydrophobicContact CB-SD 3.62Å; L484-M526 HydrophobicContact CD1-CE 4.1Å; G485-M526 PolarHBondContact N-SD 3.5Å; G485-M526 VanDerWaalsContact N-SD 3.37Å; G522-M526 WeakPolarHBondContact O-CB 3.33Å; G522-M526 PolarHBondContact O-N 3.06Å; M526-A529 PolarHBondContact O-N 2.9Å; M526-V530 WeakPolarHBondContact O-CG2 3.48Å; M526-V530 PolarHBondContact O-N 2.91Å; M526-V530 VanDerWaalsContact O-N 3.13Å
527	T	96.6	Very high	95.7	Very high	1 Å²	1	5.8 Å²	5.8	1%	0.006	3%	0.032	C	C	.	.	H	α-helix	trans	-65.7	-46.2	177.6	-51	0	0	0	0	110.8	F478 F482 A523 A529 V530 T531 T536	F478-T527 HydrophobicContact CD1-CG2 4.05Å; F478-T527 HydrophobicContact CD2-CG2 3.61Å; F478-T527 HydrophobicContact CE1-CG2 3.89Å; F478-T527 HydrophobicContact CE2-CG2 3.45Å; F478-T527 VanDerWaalsContact CE2-CG2 3.45Å; F478-T527 HydrophobicContact CG-CG2 3.93Å; F478-T527 HydrophobicContact CZ-CG2 3.6Å; F482-T527 WeakPolarHBondContact CA-OG1 3.18Å; F482-T527 PolarHBondContact N-OG1 3.4Å; A523-T527 WeakPolarHBondContact O-CB 3.02Å; A523-T527 PolarHBondContact O-N 3.28Å; A523-T527 PolarHBondContact O-OG1 2.85Å; T527-A529 VanDerWaalsContact C-N 3.32Å; T527-A529 PolarHBondContact O-N 3.29Å; T527-V530 PolarHBondContact O-N 3.41Å; T527-V530 VanDerWaalsContact O-N 3.15Å; T527-T531 PolarHBondContact O-N 2.91Å; T527-T531 PolarHBondContact O-OG1 3.45Å; T527-T536 HydrophobicContact CG2-CG2 4.04Å
528	G	96.6	Very high	95.8	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-55.3	-48	175.2	0	0	0	0	0	111.6	A524 A525 V530 T531 H532 T533 T536 N561	A524-G528 PolarHBondContact O-N 2.86Å; A525-G528 PolarHBondContact O-N 3.07Å; G528-V530 VanDerWaalsContact C-N 3.29Å; G528-V530 PolarHBondContact O-N 3.42Å; G528-T531 CarbonylContact O-C 3.19Å; G528-T531 PolarHBondContact O-N 3.39Å; G528-T531 PolarHBondContact O-OG1 3.49Å; G528-H532 VanDerWaalsContact O-CA 3.31Å; G528-H532 WeakPolarHBondContact O-CA 3.42Å; G528-H532 PolarHBondContact O-N 3.21Å; G528-T533 WeakPolarHBondContact CA-O 3.34Å; G528-T533 PolarHBondContact O-N 3.26Å; G528-T536 VanDerWaalsContact CA-OG1 3.28Å; G528-T536 WeakPolarHBondContact CA-OG1 3.21Å; G528-N561 PolarHBondContact O-OD1 3.27Å
529	A	97.3	Very high	95.8	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-59.2	-35.3	177.9	0	0	0	0	0	113.7	A525 M526 T527 H532 A560 N561 A564	A525-A529 WeakPolarHBondContact O-CB 3.49Å; A525-A529 PolarHBondContact O-N 3.4Å; M526-A529 PolarHBondContact O-N 2.9Å; T527-A529 VanDerWaalsContact C-N 3.32Å; T527-A529 PolarHBondContact O-N 3.29Å; A529-H532 PolarHBondContact O-CD2 3.45Å; A529-A560 HydrophobicContact CB-CB 3.96Å; A529-N561 WeakPolarHBondContact CA-OD1 3.47Å; A529-N561 PolarHBondContact N-OD1 3.32Å; A529-A564 HydrophobicContact CB-CB 3.94Å; A529-A564 VanDerWaalsContact O-CB 3.28Å; A529-A564 WeakPolarHBondContact O-CB 3.37Å
530	V	96.8	Very high	95.7	Very high	3 Å²	3	6.5 Å²	6.5	2%	0.018	4%	0.036	C	C	.	.	H	α-helix	trans	-78.2	-35.4	178.7	171.1	0	0	0	0	111.9	F357 V358 V481 M526 T527 G528 L571	F357-V530 HydrophobicContact CB-CG2 4.41Å; F357-V530 HydrophobicContact CD1-CG1 4.09Å; F357-V530 HydrophobicContact CD1-CG2 4.04Å; F357-V530 HydrophobicContact CE1-CG1 4.4Å; V358-V530 HydrophobicContact CG2-CB 4.44Å; V358-V530 HydrophobicContact CG2-CG1 3.95Å; V358-V530 HydrophobicContact CG2-CG2 4.42Å; V481-V530 HydrophobicContact CG1-CB 4.05Å; V481-V530 HydrophobicContact CG1-CG2 3.7Å; V481-V530 HydrophobicContact CG2-CG1 4.34Å; V481-V530 HydrophobicContact CG2-CG2 4.47Å; M526-V530 WeakPolarHBondContact O-CG2 3.48Å; M526-V530 PolarHBondContact O-N 2.91Å; M526-V530 VanDerWaalsContact O-N 3.13Å; T527-V530 PolarHBondContact O-N 3.41Å; T527-V530 VanDerWaalsContact O-N 3.15Å; G528-V530 VanDerWaalsContact C-N 3.29Å; G528-V530 PolarHBondContact O-N 3.42Å; V530-L571 HydrophobicContact CG1-CB 3.74Å; V530-L571 HydrophobicContact CG1-CD2 3.94Å; V530-L571 HydrophobicContact CG1-CG 4.34Å; V530-L571 WeakPolarHBondContact O-CB 3.47Å; V530-L571 PolarHBondContact O-N 3.38Å
531	T	94.6	Very high	95.4	Very high	8 Å²	8	7.9 Å²	7.9	5%	0.049	4%	0.042	C	C	.	.	H	α-helix	trans	-90.4	-14	-178.1	52.2	0	0	0	0	114	F280 F478 T527 G528 T533 Y572	F280-T531 HydrophobicContact CE2-CG2 4.34Å; F478-T531 HydrophobicContact CD2-CG2 4.38Å; T527-T531 PolarHBondContact O-N 2.91Å; T527-T531 PolarHBondContact O-OG1 3.45Å; G528-T531 CarbonylContact O-C 3.19Å; G528-T531 PolarHBondContact O-N 3.39Å; G528-T531 PolarHBondContact O-OG1 3.49Å; T531-T533 WeakPolarHBondContact CB-OG1 3.44Å; T531-T533 PolarHBondContact OG1-OG1 2.93Å; T531-Y572 HydrophobicContact CG2-CE2 3.84Å
532	H	94.3	Very high	95.2	Very high	44 Å²	44	9.6 Å²	9.6	20%	0.204	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	43.4	-170.4	-66.2	-167.9	0	0	0	113.1	G528 A529 Q565 Q568 P569 S570	G528-H532 VanDerWaalsContact O-CA 3.31Å; G528-H532 WeakPolarHBondContact O-CA 3.42Å; G528-H532 PolarHBondContact O-N 3.21Å; A529-H532 PolarHBondContact O-CD2 3.45Å; H532-Q565 HydrophobicContact CB-CG 4.43Å; H532-Q568 PolarHBondContact CE1-O 3.49Å; H532-Q568 PolarHBondContact NE2-O 3.47Å; H532-P569 VanDerWaalsContact CE1-C 3.49Å; H532-S570 PolarHBondContact CE1-N 3.02Å
533	T	94	Very high	94.8	Very high	2 Å²	2	9.7 Å²	9.7	1%	0.012	5%	0.051	C	C	.	.			trans	-131.8	143.4	-174	53.6	0	0	0	0	111.6	F280 E283 V284 G528 T531 T536 N561	F280-T533 HydrophobicContact CD2-CG2 4.29Å; F280-T533 HydrophobicContact CE2-CG2 4.22Å; E283-T533 HydrophobicContact CB-CG2 3.84Å; E283-T533 WeakPolarHBondContact OE2-CA 3.4Å; E283-T533 WeakPolarHBondContact OE2-CB 3.29Å; E283-T533 WeakPolarHBondContact OE2-CG2 3.36Å; V284-T533 HydrophobicContact CG2-CG2 3.46Å; V284-T533 VanDerWaalsContact CG2-CG2 3.46Å; G528-T533 WeakPolarHBondContact CA-O 3.34Å; G528-T533 PolarHBondContact O-N 3.26Å; T531-T533 WeakPolarHBondContact CB-OG1 3.44Å; T531-T533 PolarHBondContact OG1-OG1 2.93Å; T533-T536 PolarHBondContact O-OG1 2.76Å; T533-T536 WeakPolarHBondContact OG1-CG2 3.39Å; T533-N561 VanDerWaalsContact C-ND2 3.3Å; T533-N561 PolarHBondContact O-ND2 3.05Å
534	V	95.1	Very high	94.5	Very high	54 Å²	54	9.8 Å²	9.8	33%	0.327	5%	0.051	S	C	.	.	S	Bend	trans	-93.4	-27.6	175.9	-179.4	0	0	0	0	110	E283 T536 A537 V557 I558	E283-V534 PolarHBondContact OE2-N 2.98Å; V534-T536 PolarHBondContact O-N 3.45Å; V534-A537 WeakPolarHBondContact O-CB 3.32Å; V534-A537 PolarHBondContact O-N 2.92Å; V534-V557 HydrophobicContact CG1-CG1 4.46Å; V534-I558 HydrophobicContact CG1-CG1 4.41Å; V534-I558 HydrophobicContact CG2-CG1 4.35Å
535	S	94.8	Very high	93.9	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.007	8%	0.077	C	C	.	.	H	α-helix	trans	-51	-18.4	170.8	56.3	0	0	0	0	115.5	F280 E283 A537 V538 I539	F280-S535 VanDerWaalsContact CA-OG 3.23Å; F280-S535 WeakPolarHBondContact CA-OG 3.26Å; F280-S535 WeakPolarHBondContact CB-OG 3.27Å; F280-S535 WeakPolarHBondContact CD2-OG 3.19Å; E283-S535 PolarHBondContact OE1-N 2.93Å; E283-S535 VanDerWaalsContact OE1-N 3.13Å; E283-S535 VanDerWaalsContact OE2-CB 3.27Å; E283-S535 WeakPolarHBondContact OE2-CB 3.36Å; E283-S535 PolarHBondContact OE2-N 3.36Å; E283-S535 PolarHBondContact OE2-OG 3.21Å; S535-A537 VanDerWaalsContact C-N 3.27Å; S535-A537 PolarHBondContact O-N 3.49Å; S535-V538 WeakPolarHBondContact O-CA 3.06Å; S535-V538 WeakPolarHBondContact O-CB 3.46Å; S535-V538 PolarHBondContact O-N 3.31Å; S535-I539 WeakPolarHBondContact O-CG1 3.48Å; S535-I539 PolarHBondContact O-N 3.07Å
536	T	95	Very high	93.3	Very high	2 Å²	2	13.7 Å²	13.7	1%	0.012	8%	0.084	C	C	.	.	H	α-helix	trans	-63	-33.9	173.3	55.3	0	0	0	0	112.4	F478 A524 T527 G528 T533 V534 V538 C540	F478-T536 HydrophobicContact CE2-CG2 4.01Å; F478-T536 HydrophobicContact CZ-CG2 4.3Å; A524-T536 PolarHBondContact O-OG1 3.22Å; T527-T536 HydrophobicContact CG2-CG2 4.04Å; G528-T536 VanDerWaalsContact CA-OG1 3.28Å; G528-T536 WeakPolarHBondContact CA-OG1 3.21Å; T533-T536 PolarHBondContact O-OG1 2.76Å; T533-T536 WeakPolarHBondContact OG1-CG2 3.39Å; V534-T536 PolarHBondContact O-N 3.45Å; T536-V538 PolarHBondContact O-N 3.11Å; T536-C540 VanDerWaalsContact O-CB 3.26Å; T536-C540 WeakPolarHBondContact O-CB 3.27Å; T536-C540 PolarHBondContact O-N 3.11Å
537	A	95.3	Very high	92.7	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.008	11%	0.109	C	C	.	.	H	α-helix	trans	-61	-40.4	171.3	0	0	0	0	0	110.4	V534 S535 C540 F541 M553 M554 V557	V534-A537 WeakPolarHBondContact O-CB 3.32Å; V534-A537 PolarHBondContact O-N 2.92Å; S535-A537 VanDerWaalsContact C-N 3.27Å; S535-A537 PolarHBondContact O-N 3.49Å; A537-C540 PolarHBondContact O-N 2.99Å; A537-F541 WeakPolarHBondContact O-CD1 3.35Å; A537-F541 PolarHBondContact O-N 2.95Å; A537-M553 HydrophobicContact CB-CG 4.19Å; A537-M553 HydrophobicContact CB-SD 4.12Å; A537-M554 HydrophobicContact CB-CG 4.27Å; A537-V557 HydrophobicContact CB-CG2 4.1Å
538	V	95	Very high	92.1	Very high	16 Å²	16	19.3 Å²	19.3	10%	0.097	11%	0.114	C	C	.	.	H	α-helix	trans	-65.6	-49	-179.4	-177.5	0	0	0	0	111.3	L275 G276 L279 S535 T536 C540 F541 E542	L275-V538 HydrophobicContact CB-CG1 4.21Å; G276-V538 VanDerWaalsContact CA-CG1 3.5Å; L279-V538 HydrophobicContact CD1-CB 4.39Å; L279-V538 HydrophobicContact CD1-CG1 4.08Å; L279-V538 HydrophobicContact CD1-CG2 3.98Å; S535-V538 WeakPolarHBondContact O-CA 3.06Å; S535-V538 WeakPolarHBondContact O-CB 3.46Å; S535-V538 PolarHBondContact O-N 3.31Å; T536-V538 PolarHBondContact O-N 3.11Å; V538-C540 VanDerWaalsContact C-N 3.26Å; V538-C540 PolarHBondContact O-N 3.28Å; V538-F541 HydrophobicContact CB-CD1 4.2Å; V538-F541 HydrophobicContact CB-CE1 3.61Å; V538-F541 HydrophobicContact CB-CZ 4.34Å; V538-F541 HydrophobicContact CG1-CD1 4.22Å; V538-F541 HydrophobicContact CG1-CE1 3.25Å; V538-F541 HydrophobicContact CG1-CZ 3.48Å; V538-F541 VanDerWaalsContact CG1-CZ 3.48Å; V538-F541 HydrophobicContact CG2-CE1 3.94Å; V538-F541 WeakPolarHBondContact O-CD1 3.4Å; V538-F541 WeakPolarHBondContact O-CE1 3.37Å; V538-F541 WeakPolarHBondContact O-CG 3.12Å; V538-F541 PolarHBondContact O-N 3.15Å; V538-E542 PolarHBondContact O-N 3.49Å; V538-E542 VanDerWaalsContact O-N 3.11Å
539	I	94.3	Very high	91.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-57.5	-43.3	174.2	-65.1	167.3	0	0	0	110.2	V267 F271 T273 F280 F478 S535 E542 L543	V267-I539 HydrophobicContact CG1-CD1 4.29Å; F271-I539 HydrophobicContact CB-CG2 4.27Å; F271-I539 HydrophobicContact CD1-CG2 4.26Å; F271-I539 HydrophobicContact CD2-CD1 4.35Å; F271-I539 HydrophobicContact CD2-CG2 3.79Å; F271-I539 HydrophobicContact CE2-CD1 4.15Å; F271-I539 HydrophobicContact CE2-CG2 4.09Å; F271-I539 HydrophobicContact CG-CG2 3.87Å; F271-I539 HydrophobicContact CZ-CG2 4.44Å; T273-I539 HydrophobicContact CG2-CG2 4.45Å; F280-I539 HydrophobicContact CB-CD1 3.93Å; F280-I539 HydrophobicContact CD2-CD1 4.04Å; F280-I539 HydrophobicContact CG-CD1 4.13Å; F478-I539 HydrophobicContact CZ-CD1 4.28Å; F478-I539 HydrophobicContact CZ-CG2 4.46Å; S535-I539 WeakPolarHBondContact O-CG1 3.48Å; S535-I539 PolarHBondContact O-N 3.07Å; I539-E542 PolarHBondContact O-N 3.48Å; I539-L543 HydrophobicContact CG2-CD1 3.7Å; I539-L543 HydrophobicContact CG2-CG 4.09Å; I539-L543 VanDerWaalsContact O-CB 3.24Å; I539-L543 WeakPolarHBondContact O-CB 3.42Å; I539-L543 WeakPolarHBondContact O-CG 3.32Å; I539-L543 PolarHBondContact O-N 3.28Å
540	C	93.4	Very high	91.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64.7	-41.5	-177.7	-160.7	0	0	0	0	112.7	F482 V520 A524 T536 A537 V538 L543 T544 M553	F482-C540 HydrophobicContact CE2-CB 4.36Å; V520-C540 WeakPolarHBondContact CG1-SG 3.26Å; A524-C540 HydrophobicContact CB-CB 3.88Å; T536-C540 VanDerWaalsContact O-CB 3.26Å; T536-C540 WeakPolarHBondContact O-CB 3.27Å; T536-C540 PolarHBondContact O-N 3.11Å; A537-C540 PolarHBondContact O-N 2.99Å; V538-C540 VanDerWaalsContact C-N 3.26Å; V538-C540 PolarHBondContact O-N 3.28Å; C540-L543 PolarHBondContact O-N 3.49Å; C540-T544 WeakPolarHBondContact O-CB 3.2Å; C540-T544 WeakPolarHBondContact O-CG2 3.47Å; C540-T544 PolarHBondContact O-N 3.43Å; C540-T544 PolarHBondContact O-OG1 3.47Å; C540-M553 HydrophobicContact CB-SD 3.92Å
541	F	89.4	Confident	90.9	Very high	34 Å²	34	28.1 Å²	28.1	15%	0.149	16%	0.159	C	C	.	.	H	α-helix	trans	-68	-41	175.9	82.3	-114.3	0	0	0	112	A537 V538 L543 T544 G545 I547 I550	A537-F541 WeakPolarHBondContact O-CD1 3.35Å; A537-F541 PolarHBondContact O-N 2.95Å; V538-F541 HydrophobicContact CB-CD1 4.2Å; V538-F541 HydrophobicContact CB-CE1 3.61Å; V538-F541 HydrophobicContact CB-CZ 4.34Å; V538-F541 HydrophobicContact CG1-CD1 4.22Å; V538-F541 HydrophobicContact CG1-CE1 3.25Å; V538-F541 HydrophobicContact CG1-CZ 3.48Å; V538-F541 VanDerWaalsContact CG1-CZ 3.48Å; V538-F541 HydrophobicContact CG2-CE1 3.94Å; V538-F541 WeakPolarHBondContact O-CD1 3.4Å; V538-F541 WeakPolarHBondContact O-CE1 3.37Å; V538-F541 WeakPolarHBondContact O-CG 3.12Å; V538-F541 PolarHBondContact O-N 3.15Å; F541-L543 VanDerWaalsContact C-N 3.29Å; F541-L543 PolarHBondContact O-N 2.9Å; F541-T544 WeakPolarHBondContact CA-OG1 3.41Å; F541-T544 PolarHBondContact O-N 3Å; F541-T544 PolarHBondContact O-OG1 2.7Å; F541-T544 VanDerWaalsContact O-OG1 3.09Å; F541-G545 PolarHBondContact O-N 3.19Å; F541-I547 HydrophobicContact CD2-CG2 4.11Å; F541-I550 HydrophobicContact CD1-CD1 4.37Å
542	E	91.6	Very high	90.8	Very high	36 Å²	36	27.9 Å²	27.9	17%	0.168	16%	0.158	C	C	.	.	H	α-helix	trans	-67.2	-35.3	179	-71.7	-163.7	143.5	0	0	110.9	T273 L275 G276 V538 I539	T273-E542 WeakPolarHBondContact CA-OE2 3.36Å; T273-E542 WeakPolarHBondContact CB-OE2 3.37Å; T273-E542 HydrophobicContact CG2-CB 3.36Å; L275-E542 WeakPolarHBondContact CB-OE1 3.34Å; L275-E542 WeakPolarHBondContact CD1-OE1 3.39Å; L275-E542 WeakPolarHBondContact CG-OE1 3.38Å; L275-E542 PolarHBondContact N-OE1 3.26Å; L275-E542 PolarHBondContact N-OE2 3.24Å; G276-E542 PolarHBondContact N-OE2 3.17Å; V538-E542 PolarHBondContact O-N 3.49Å; V538-E542 VanDerWaalsContact O-N 3.11Å; I539-E542 PolarHBondContact O-N 3.48Å
543	L	88.9	Confident	90.8	Very high	2 Å²	2	26 Å²	26	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-66.3	-39.6	175.7	-81.7	178.8	0	0	0	113.3	F271 T273 A323 L324 F325 I539 C540 F541	F271-L543 HydrophobicContact CB-CD2 3.85Å; F271-L543 HydrophobicContact CB-CG 4.32Å; F271-L543 HydrophobicContact CD1-CD1 3.95Å; F271-L543 HydrophobicContact CD1-CD2 4.28Å; F271-L543 HydrophobicContact CG-CD1 4.47Å; F271-L543 WeakPolarHBondContact O-CD2 3.23Å; T273-L543 HydrophobicContact CG2-CD2 3.92Å; T273-L543 HydrophobicContact CG2-CG 3.77Å; A323-L543 WeakPolarHBondContact CB-O 3.48Å; L324-L543 HydrophobicContact CB-CD2 3.99Å; L324-L543 HydrophobicContact CD2-CD2 4.18Å; L324-L543 PolarHBondContact N-O 2.98Å; F325-L543 CarbonylContact C-O 3.13Å; F325-L543 HydrophobicContact CD2-CB 4.25Å; F325-L543 HydrophobicContact CD2-CD1 4.36Å; F325-L543 HydrophobicContact CD2-CD2 4.1Å; F325-L543 HydrophobicContact CD2-CG 4.49Å; F325-L543 HydrophobicContact CE2-CD1 4.45Å; F325-L543 HydrophobicContact CE2-CD2 4.29Å; F325-L543 PolarHBondContact N-O 3.48Å; I539-L543 HydrophobicContact CG2-CD1 3.7Å; I539-L543 HydrophobicContact CG2-CG 4.09Å; I539-L543 VanDerWaalsContact O-CB 3.24Å; I539-L543 WeakPolarHBondContact O-CB 3.42Å; I539-L543 WeakPolarHBondContact O-CG 3.32Å; I539-L543 PolarHBondContact O-N 3.28Å; C540-L543 PolarHBondContact O-N 3.49Å; F541-L543 VanDerWaalsContact C-N 3.29Å; F541-L543 PolarHBondContact O-N 2.9Å
544	T	88.7	Confident	90.8	Very high	2 Å²	2	29 Å²	29	1%	0.012	16%	0.164	C	C	.	.	H	α-helix	trans	-81.8	-25.4	-178.5	51.5	0	0	0	0	112.9	F325 T327 F420 V520 C540 F541 Q546	F325-T544 WeakPolarHBondContact O-CA 3.35Å; T327-T544 HydrophobicContact CG2-CG2 4.33Å; T327-T544 PolarHBondContact N-O 2.79Å; T327-T544 VanDerWaalsContact N-O 3.17Å; T327-T544 PolarHBondContact OG1-O 3.24Å; F420-T544 HydrophobicContact CD2-CG2 4.43Å; F420-T544 HydrophobicContact CE2-CG2 4.19Å; V520-T544 HydrophobicContact CG1-CG2 3.8Å; V520-T544 HydrophobicContact CG2-CG2 3.96Å; C540-T544 WeakPolarHBondContact O-CB 3.2Å; C540-T544 WeakPolarHBondContact O-CG2 3.47Å; C540-T544 PolarHBondContact O-N 3.43Å; C540-T544 PolarHBondContact O-OG1 3.47Å; F541-T544 WeakPolarHBondContact CA-OG1 3.41Å; F541-T544 PolarHBondContact O-N 3Å; F541-T544 PolarHBondContact O-OG1 2.7Å; F541-T544 VanDerWaalsContact O-OG1 3.09Å; T544-Q546 VanDerWaalsContact C-N 3.25Å; T544-Q546 PolarHBondContact O-N 3Å
545	G	85.9	Confident	90.8	Very high	52 Å²	52	30 Å²	30	54%	0.536	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	10.1	179	0	0	0	0	0	114.2	F541	F541-G545 PolarHBondContact O-N 3.19Å
546	Q	84.7	Confident	90.8	Very high	30 Å²	30	29.9 Å²	29.9	14%	0.14	17%	0.169	C	C	.	.			trans	-131.2	131	178.8	-65.8	-169.2	-43.9	0	0	110.6	T327 F329 M331 T544	T327-Q546 WeakPolarHBondContact O-CG 3.4Å; T327-Q546 PolarHBondContact O-NE2 3.35Å; T327-Q546 PolarHBondContact O-OE1 3.36Å; T327-Q546 PolarHBondContact OG1-OE1 3.42Å; F329-Q546 PolarHBondContact O-NE2 2.89Å; M331-Q546 HydrophobicContact SD-CB 4.5Å; T544-Q546 VanDerWaalsContact C-N 3.25Å; T544-Q546 PolarHBondContact O-N 3Å
547	I	84.6	Confident	91	Very high	103 Å²	103	29.8 Å²	29.8	53%	0.528	17%	0.168	S	C	.	.			trans	-98.1	6.8	-176.4	59.1	172	0	0	0	113.5	F541 H549 I550	F541-I547 HydrophobicContact CD2-CG2 4.11Å; I547-H549 VanDerWaalsContact C-N 3.3Å; I547-H549 PolarHBondContact O-N 2.92Å; I547-I550 WeakPolarHBondContact O-CB 3.45Å; I547-I550 VanDerWaalsContact O-CG2 3.31Å; I547-I550 WeakPolarHBondContact O-CG2 3.5Å; I547-I550 PolarHBondContact O-N 3.25Å
548	S	82.9	Confident	91.1	Very high	16 Å²	16	33.6 Å²	33.6	11%	0.112	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-26.6	-168.4	63.9	0	0	0	0	114.4	P334	P334-S548 WeakPolarHBondContact CB-O 3.48Å; P334-S548 VanDerWaalsContact CG-O 3.26Å; P334-S548 WeakPolarHBondContact CG-O 3.37Å
549	H	87.6	Confident	91.2	Very high	16 Å²	16	35.1 Å²	35.1	7%	0.074	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	19.9	179.2	-63.9	75.7	0	0	0	113.3	P334 I521 I547 L551 P552 M553	P334-H549 PolarHBondContact O-NE2 3.33Å; I521-H549 HydrophobicContact CD1-CB 4.45Å; I547-H549 VanDerWaalsContact C-N 3.3Å; I547-H549 PolarHBondContact O-N 2.92Å; H549-L551 PolarHBondContact O-N 2.81Å; H549-P552 WeakPolarHBondContact O-CD 3.42Å; H549-M553 WeakPolarHBondContact O-CB 3.37Å; H549-M553 PolarHBondContact O-N 3.45Å; H549-M553 VanDerWaalsContact O-N 3.15Å
550	I	89.6	Confident	91.4	Very high	63 Å²	63	35.1 Å²	35.1	32%	0.323	20%	0.195	S	C	.	.	H	α-helix	trans	-60.8	-45.1	-171.8	-168.7	168.8	0	0	0	113.3	F541 I547 M553 M554	F541-I550 HydrophobicContact CD1-CD1 4.37Å; I547-I550 WeakPolarHBondContact O-CB 3.45Å; I547-I550 VanDerWaalsContact O-CG2 3.31Å; I547-I550 WeakPolarHBondContact O-CG2 3.5Å; I547-I550 PolarHBondContact O-N 3.25Å; I550-M553 PolarHBondContact O-N 3.38Å; I550-M554 HydrophobicContact CD1-CE 3.83Å; I550-M554 HydrophobicContact CG1-CE 3.74Å; I550-M554 HydrophobicContact CG1-CG 4.49Å; I550-M554 HydrophobicContact CG1-SD 4.23Å; I550-M554 WeakPolarHBondContact O-CG 3.42Å; I550-M554 PolarHBondContact O-N 3.45Å
551	L	90.1	Very high	91.5	Very high	109 Å²	109	35.4 Å²	35.4	57%	0.571	20%	0.197	S	C	*	.	H	α-helix	trans	-64	-57.4	-176.7	-177.6	75.5	0	0	0	112.3	H549 M553 M554 V555	H549-L551 PolarHBondContact O-N 2.81Å; L551-M553 VanDerWaalsContact C-N 3.26Å; L551-M553 PolarHBondContact O-N 3.33Å; L551-M554 PolarHBondContact O-N 3.17Å; L551-V555 WeakPolarHBondContact O-CG2 3.4Å; L551-V555 PolarHBondContact O-N 3.34Å; L551-V555 VanDerWaalsContact O-N 3.09Å
552	P	91.5	Very high	91.8	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.019	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-31.9	179.1	19.9	-30	0	0	0	112.7	F335 L340 F343 I521 H549 V555 A556	F335-P552 HydrophobicContact CD1-CG 3.73Å; F335-P552 HydrophobicContact CD2-CG 4.22Å; F335-P552 VanDerWaalsContact CE1-CD 3.47Å; F335-P552 HydrophobicContact CE1-CG 3.63Å; F335-P552 HydrophobicContact CE2-CG 4.12Å; F335-P552 HydrophobicContact CG-CG 4.05Å; F335-P552 VanDerWaalsContact CZ-CD 3.47Å; F335-P552 HydrophobicContact CZ-CG 3.84Å; L340-P552 HydrophobicContact CD2-CB 4.17Å; F343-P552 HydrophobicContact CB-CB 4.3Å; F343-P552 HydrophobicContact CD2-CB 3.39Å; F343-P552 HydrophobicContact CD2-CG 4.17Å; F343-P552 HydrophobicContact CE2-CB 3.89Å; F343-P552 HydrophobicContact CE2-CG 4.16Å; F343-P552 HydrophobicContact CG-CB 4Å; I521-P552 HydrophobicContact CD1-CB 4.4Å; I521-P552 HydrophobicContact CD1-CG 4.46Å; H549-P552 WeakPolarHBondContact O-CD 3.42Å; P552-V555 PolarHBondContact O-N 3.05Å; P552-A556 WeakPolarHBondContact O-CB 3.12Å; P552-A556 PolarHBondContact O-N 3.02Å
553	M	93.6	Very high	92.1	Very high	5 Å²	5	39.6 Å²	39.6	3%	0.025	22%	0.22	C	C	.	.	H	α-helix	trans	-62.6	-47.6	173.9	-173.2	-173.8	-52.3	0	0	112.1	V520 I521 A524 A537 C540 H549 I550 L551 V555 A556 V557	V520-M553 HydrophobicContact CG1-CE 3.58Å; I521-M553 HydrophobicContact CG1-CB 4.11Å; I521-M553 HydrophobicContact CG1-CG 4.5Å; A524-M553 HydrophobicContact CB-CG 3.77Å; A524-M553 HydrophobicContact CB-SD 3.82Å; A537-M553 HydrophobicContact CB-CG 4.19Å; A537-M553 HydrophobicContact CB-SD 4.12Å; C540-M553 HydrophobicContact CB-SD 3.92Å; H549-M553 WeakPolarHBondContact O-CB 3.37Å; H549-M553 PolarHBondContact O-N 3.45Å; H549-M553 VanDerWaalsContact O-N 3.15Å; I550-M553 PolarHBondContact O-N 3.38Å; L551-M553 VanDerWaalsContact C-N 3.26Å; L551-M553 PolarHBondContact O-N 3.33Å; M553-V555 PolarHBondContact O-N 3.38Å; M553-A556 PolarHBondContact O-N 3.44Å; M553-V557 HydrophobicContact CG-CG2 4.48Å; M553-V557 WeakPolarHBondContact O-CB 3.23Å; M553-V557 VanDerWaalsContact O-CG2 3.23Å; M553-V557 WeakPolarHBondContact O-CG2 3.31Å; M553-V557 PolarHBondContact O-N 3.38Å
554	M	94.1	Very high	92.4	Very high	65 Å²	65	39.5 Å²	39.5	32%	0.32	22%	0.22	S	C	.	.	H	α-helix	trans	-61.8	-43.9	178	-75.8	-176.8	175.4	0	0	111.6	A537 I550 L551 V557 I558	A537-M554 HydrophobicContact CB-CG 4.27Å; I550-M554 HydrophobicContact CD1-CE 3.83Å; I550-M554 HydrophobicContact CG1-CE 3.74Å; I550-M554 HydrophobicContact CG1-CG 4.49Å; I550-M554 HydrophobicContact CG1-SD 4.23Å; I550-M554 WeakPolarHBondContact O-CG 3.42Å; I550-M554 PolarHBondContact O-N 3.45Å; L551-M554 PolarHBondContact O-N 3.17Å; M554-V557 PolarHBondContact O-N 3.08Å; M554-I558 WeakPolarHBondContact O-CB 3.26Å; M554-I558 VanDerWaalsContact O-CG1 3.25Å; M554-I558 WeakPolarHBondContact O-CG1 3.11Å; M554-I558 PolarHBondContact O-N 3.49Å
555	V	94.9	Very high	92.6	Very high	73 Å²	73	44.9 Å²	44.9	44%	0.442	25%	0.245	S	C	.	.	H	α-helix	trans	-60.5	-48.2	176.6	174.8	0	0	0	0	110.9	L551 P552 M553 V557 I558 L559	L551-V555 WeakPolarHBondContact O-CG2 3.4Å; L551-V555 PolarHBondContact O-N 3.34Å; L551-V555 VanDerWaalsContact O-N 3.09Å; P552-V555 PolarHBondContact O-N 3.05Å; M553-V555 PolarHBondContact O-N 3.38Å; V555-V557 VanDerWaalsContact C-N 3.34Å; V555-V557 PolarHBondContact O-N 3.01Å; V555-I558 PolarHBondContact O-N 3.45Å; V555-L559 HydrophobicContact CG1-CD1 4Å; V555-L559 HydrophobicContact CG1-CG 4.43Å; V555-L559 WeakPolarHBondContact O-CG 3.09Å; V555-L559 PolarHBondContact O-N 3.39Å
556	A	96.9	Very high	92.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.2	-41.2	178.4	0	0	0	0	0	112.3	G347 I521 A525 P552 M553 L559 A560	G347-A556 VanDerWaalsContact CA-O 3.29Å; G347-A556 WeakPolarHBondContact CA-O 3.47Å; I521-A556 HydrophobicContact CG2-CB 3.7Å; A525-A556 HydrophobicContact CB-CB 4.4Å; P552-A556 WeakPolarHBondContact O-CB 3.12Å; P552-A556 PolarHBondContact O-N 3.02Å; M553-A556 PolarHBondContact O-N 3.44Å; A556-L559 PolarHBondContact O-N 2.95Å; A556-A560 VanDerWaalsContact O-CB 3.27Å; A556-A560 WeakPolarHBondContact O-CB 3.31Å; A556-A560 PolarHBondContact O-N 2.96Å
557	V	97.6	Very high	93.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-65.8	-42.6	177.2	169.8	0	0	0	0	111.7	A524 A525 V534 A537 M553 M554 V555 A560 N561	A524-V557 HydrophobicContact CB-CG2 3.83Å; A525-V557 HydrophobicContact CB-CG2 4.33Å; V534-V557 HydrophobicContact CG1-CG1 4.46Å; A537-V557 HydrophobicContact CB-CG2 4.1Å; M553-V557 HydrophobicContact CG-CG2 4.48Å; M553-V557 WeakPolarHBondContact O-CB 3.23Å; M553-V557 VanDerWaalsContact O-CG2 3.23Å; M553-V557 WeakPolarHBondContact O-CG2 3.31Å; M553-V557 PolarHBondContact O-N 3.38Å; M554-V557 PolarHBondContact O-N 3.08Å; V555-V557 VanDerWaalsContact C-N 3.34Å; V555-V557 PolarHBondContact O-N 3.01Å; V557-A560 PolarHBondContact O-N 3.2Å; V557-N561 WeakPolarHBondContact O-CB 3.48Å; V557-N561 VanDerWaalsContact O-CG 3.26Å; V557-N561 PolarHBondContact O-N 3.03Å; V557-N561 PolarHBondContact O-ND2 3.1Å
558	I	97	Very high	93.7	Very high	80 Å²	80	45.5 Å²	45.5	41%	0.41	25%	0.252	S	S	.	.	H	α-helix	trans	-63.3	-46.9	176.8	-69.3	165.6	0	0	0	110.4	V534 M554 V555 A560 N561 M562	V534-I558 HydrophobicContact CG1-CG1 4.41Å; V534-I558 HydrophobicContact CG2-CG1 4.35Å; M554-I558 WeakPolarHBondContact O-CB 3.26Å; M554-I558 VanDerWaalsContact O-CG1 3.25Å; M554-I558 WeakPolarHBondContact O-CG1 3.11Å; M554-I558 PolarHBondContact O-N 3.49Å; V555-I558 PolarHBondContact O-N 3.45Å; I558-A560 VanDerWaalsContact C-N 3.33Å; I558-A560 PolarHBondContact O-N 3.35Å; I558-N561 PolarHBondContact O-N 3.25Å; I558-M562 HydrophobicContact CG2-CG 4.46Å; I558-M562 HydrophobicContact CG2-SD 4.2Å; I558-M562 WeakPolarHBondContact O-CG 3.27Å; I558-M562 PolarHBondContact O-N 3.45Å
559	L	97.6	Very high	94.1	Very high	49 Å²	49	46.3 Å²	46.3	26%	0.257	26%	0.257	S	S	.	.	H	α-helix	trans	-59.7	-44.2	176.2	-70.6	173.6	0	0	0	111.6	A344 I348 V555 A556 N561 M562 V563	A344-L559 HydrophobicContact CB-CD1 3.88Å; I348-L559 HydrophobicContact CG1-CB 4.44Å; V555-L559 HydrophobicContact CG1-CD1 4Å; V555-L559 HydrophobicContact CG1-CG 4.43Å; V555-L559 WeakPolarHBondContact O-CG 3.09Å; V555-L559 PolarHBondContact O-N 3.39Å; A556-L559 PolarHBondContact O-N 2.95Å; L559-N561 VanDerWaalsContact C-N 3.34Å; L559-N561 PolarHBondContact O-N 3.38Å; L559-M562 PolarHBondContact O-N 2.99Å; L559-V563 WeakPolarHBondContact O-CG2 3.36Å; L559-V563 PolarHBondContact O-N 3.31Å; L559-V563 VanDerWaalsContact O-N 3.1Å
560	A	98	Very high	94.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-42.3	177.6	0	0	0	0	0	111.8	G347 C350 G351 A525 A529 A556 V557 I558 V563 A564	G347-A560 VanDerWaalsContact O-CA 3.23Å; G347-A560 WeakPolarHBondContact O-CA 3.25Å; G347-A560 WeakPolarHBondContact O-CB 3.38Å; C350-A560 HydrophobicContact CB-CB 4.45Å; G351-A560 WeakPolarHBondContact CA-O 3.33Å; A525-A560 HydrophobicContact CB-CB 4.21Å; A529-A560 HydrophobicContact CB-CB 3.96Å; A556-A560 VanDerWaalsContact O-CB 3.27Å; A556-A560 WeakPolarHBondContact O-CB 3.31Å; A556-A560 PolarHBondContact O-N 2.96Å; V557-A560 PolarHBondContact O-N 3.2Å; I558-A560 VanDerWaalsContact C-N 3.33Å; I558-A560 PolarHBondContact O-N 3.35Å; A560-V563 PolarHBondContact O-N 3.38Å; A560-A564 WeakPolarHBondContact O-CB 3.27Å; A560-A564 PolarHBondContact O-N 2.85Å
561	N	96.1	Very high	94.5	Very high	6 Å²	6	42.9 Å²	42.9	3%	0.032	24%	0.24	C	C	.	.	H	α-helix	trans	-65.1	-43.8	176.4	-76.1	-15.6	0	0	0	112.4	G528 A529 T533 V557 I558 L559 V563 A564 Q565	G528-N561 PolarHBondContact O-OD1 3.27Å; A529-N561 WeakPolarHBondContact CA-OD1 3.47Å; A529-N561 PolarHBondContact N-OD1 3.32Å; T533-N561 VanDerWaalsContact C-ND2 3.3Å; T533-N561 PolarHBondContact O-ND2 3.05Å; V557-N561 WeakPolarHBondContact O-CB 3.48Å; V557-N561 VanDerWaalsContact O-CG 3.26Å; V557-N561 PolarHBondContact O-N 3.03Å; V557-N561 PolarHBondContact O-ND2 3.1Å; I558-N561 PolarHBondContact O-N 3.25Å; L559-N561 VanDerWaalsContact C-N 3.34Å; L559-N561 PolarHBondContact O-N 3.38Å; N561-V563 VanDerWaalsContact C-N 3.32Å; N561-V563 PolarHBondContact O-N 3.04Å; N561-A564 PolarHBondContact O-N 3.44Å; N561-Q565 VanDerWaalsContact O-CB 3.25Å; N561-Q565 WeakPolarHBondContact O-CB 3.43Å; N561-Q565 WeakPolarHBondContact O-CG 3.48Å; N561-Q565 PolarHBondContact O-N 2.97Å
562	M	95.9	Very high	94.6	Very high	127 Å²	127	38 Å²	38	63%	0.626	21%	0.214	S	C	*	.	H	α-helix	trans	-58.5	-45	177.1	-74.6	179.2	67.6	0	0	111.5	I558 L559 G566	I558-M562 HydrophobicContact CG2-CG 4.46Å; I558-M562 HydrophobicContact CG2-SD 4.2Å; I558-M562 WeakPolarHBondContact O-CG 3.27Å; I558-M562 PolarHBondContact O-N 3.45Å; L559-M562 PolarHBondContact O-N 2.99Å; M562-G566 PolarHBondContact O-N 3.29Å
563	V	97.3	Very high	94.6	Very high	31 Å²	31	39.3 Å²	39.3	19%	0.188	22%	0.221	C	C	.	.	H	α-helix	trans	-66.5	-47.3	177.5	174.5	0	0	0	0	111.1	I348 F352 L559 A560 N561 G566 L567	I348-V563 HydrophobicContact CG2-CG2 4.38Å; F352-V563 HydrophobicContact CD1-CG1 3.99Å; F352-V563 HydrophobicContact CD2-CG1 3.94Å; F352-V563 HydrophobicContact CE1-CG1 4Å; F352-V563 HydrophobicContact CE2-CG1 3.95Å; F352-V563 HydrophobicContact CG-CG1 3.95Å; F352-V563 HydrophobicContact CZ-CG1 3.98Å; L559-V563 WeakPolarHBondContact O-CG2 3.36Å; L559-V563 PolarHBondContact O-N 3.31Å; L559-V563 VanDerWaalsContact O-N 3.1Å; A560-V563 PolarHBondContact O-N 3.38Å; N561-V563 VanDerWaalsContact C-N 3.32Å; N561-V563 PolarHBondContact O-N 3.04Å; V563-G566 PolarHBondContact O-N 2.94Å; V563-L567 HydrophobicContact CG1-CD1 3.98Å; V563-L567 WeakPolarHBondContact O-CG 3.35Å; V563-L567 PolarHBondContact O-N 2.92Å
564	A	96.2	Very high	94.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65	-45.2	-177.2	0	0	0	0	0	112.7	A529 A560 N561 G566 L567 Q568	A529-A564 HydrophobicContact CB-CB 3.94Å; A529-A564 VanDerWaalsContact O-CB 3.28Å; A529-A564 WeakPolarHBondContact O-CB 3.37Å; A560-A564 WeakPolarHBondContact O-CB 3.27Å; A560-A564 PolarHBondContact O-N 2.85Å; N561-A564 PolarHBondContact O-N 3.44Å; A564-G566 PolarHBondContact O-N 3.47Å; A564-L567 PolarHBondContact O-N 3.49Å; A564-Q568 PolarHBondContact O-N 2.8Å; A564-Q568 VanDerWaalsContact O-O 3.11Å
565	Q	92.4	Very high	94.3	Very high	115 Å²	115	36.9 Å²	36.9	54%	0.537	21%	0.209	S	C	.	.	H	α-helix	trans	-61.5	-32.2	177.5	-73.2	177.1	10.5	0	0	112.7	H532 N561 L567	H532-Q565 HydrophobicContact CB-CG 4.43Å; N561-Q565 VanDerWaalsContact O-CB 3.25Å; N561-Q565 WeakPolarHBondContact O-CB 3.43Å; N561-Q565 WeakPolarHBondContact O-CG 3.48Å; N561-Q565 PolarHBondContact O-N 2.97Å; Q565-L567 VanDerWaalsContact C-N 3.3Å; Q565-L567 PolarHBondContact O-N 2.88Å
566	G	91.4	Very high	94	Very high	68 Å²	68	33.5 Å²	33.5	70%	0.701	19%	0.189	S	C	*	.	H	α-helix	trans	-70.1	-22.9	174.4	0	0	0	0	0	114.1	M562 V563 A564	M562-G566 PolarHBondContact O-N 3.29Å; V563-G566 PolarHBondContact O-N 2.94Å; A564-G566 PolarHBondContact O-N 3.47Å
567	L	93.6	Very high	93.5	Very high	85 Å²	85	38.5 Å²	38.5	45%	0.445	21%	0.212	S	C	.	.	H	α-helix	trans	-108.8	-42.7	-170.7	-65.9	173.7	0	0	0	114.5	F352 A355 V563 A564 Q565	F352-L567 HydrophobicContact CD1-CD1 3.5Å; F352-L567 HydrophobicContact CE1-CD1 3.67Å; A355-L567 HydrophobicContact CB-CB 3.89Å; A355-L567 HydrophobicContact CB-CD1 4.03Å; V563-L567 HydrophobicContact CG1-CD1 3.98Å; V563-L567 WeakPolarHBondContact O-CG 3.35Å; V563-L567 PolarHBondContact O-N 2.92Å; A564-L567 PolarHBondContact O-N 3.49Å; Q565-L567 VanDerWaalsContact C-N 3.3Å; Q565-L567 PolarHBondContact O-N 2.88Å
568	Q	93.4	Very high	93	Very high	44 Å²	44	39.2 Å²	39.2	21%	0.206	22%	0.216	C	C	.	.	S	Bend	trans	-141	157.1	-174.9	-71	-58.7	-60.2	0	0	111.3	A355 H532 A564	A355-Q568 HydrophobicContact CB-CB 4.31Å; A355-Q568 HydrophobicContact CB-CG 4.1Å; A355-Q568 WeakPolarHBondContact O-CG 3.4Å; H532-Q568 PolarHBondContact CE1-O 3.49Å; H532-Q568 PolarHBondContact NE2-O 3.47Å; A564-Q568 PolarHBondContact O-N 2.8Å; A564-Q568 VanDerWaalsContact O-O 3.11Å
569	P	91.9	Very high	92.4	Very high	34 Å²	34	35.8 Å²	35.8	22%	0.221	20%	0.198	C	C	.	.			trans	-68.1	163.9	167.1	30.7	-35.5	0	0	0	110.9	V358 H532 D573	V358-P569 WeakPolarHBondContact CG1-O 3.4Å; H532-P569 VanDerWaalsContact CE1-C 3.49Å; P569-D573 HydrophobicContact CB-CB 4.33Å
570	S	92.6	Very high	91.8	Very high	3 Å²	3	39 Å²	39	2%	0.021	21%	0.21	C	C	.	.			trans	-59.2	156.6	173.9	76	0	0	0	0	111.1	H532 Y572 D573 S574	H532-S570 PolarHBondContact CE1-N 3.02Å; S570-Y572 PolarHBondContact O-N 3.11Å; S570-D573 PolarHBondContact O-N 3.35Å; S570-D573 WeakPolarHBondContact OG-CB 3.41Å; S570-D573 PolarHBondContact OG-N 2.78Å; S570-D573 PolarHBondContact OG-OD2 3.38Å; S570-S574 WeakPolarHBondContact O-CB 3.29Å; S570-S574 PolarHBondContact O-N 2.83Å
571	L	92.9	Very high	91	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-53.5	-44	175.2	-179.7	67.7	0	0	0	111.9	V358 N361 A477 V530 S574 I575	V358-L571 HydrophobicContact CG2-CB 4.16Å; N361-L571 HydrophobicContact CB-CD1 4.29Å; A477-L571 HydrophobicContact CB-CD2 3.45Å; A477-L571 VanDerWaalsContact CB-CD2 3.45Å; V530-L571 HydrophobicContact CG1-CB 3.74Å; V530-L571 HydrophobicContact CG1-CD2 3.94Å; V530-L571 HydrophobicContact CG1-CG 4.34Å; V530-L571 WeakPolarHBondContact O-CB 3.47Å; V530-L571 PolarHBondContact O-N 3.38Å; L571-S574 PolarHBondContact O-N 2.91Å; L571-I575 HydrophobicContact CD1-CD1 4.35Å; L571-I575 HydrophobicContact CG-CD1 4.09Å; L571-I575 VanDerWaalsContact O-CG1 3.27Å; L571-I575 WeakPolarHBondContact O-CG1 3.22Å; L571-I575 PolarHBondContact O-N 3.47Å
572	Y	91.9	Very high	90.1	Very high	7 Å²	7	40.8 Å²	40.8	3%	0.027	22%	0.221	C	C	.	.	H	α-helix	trans	-68.3	-43.7	-178.6	-57.7	-61.3	0	0	0	111.7	I183 P184 F280 V284 T531 S570 S574 I575 I576	I183-Y572 HydrophobicContact CB-CD1 3.88Å; I183-Y572 HydrophobicContact CB-CE1 3.81Å; I183-Y572 HydrophobicContact CD1-CE1 3.66Å; I183-Y572 HydrophobicContact CD1-CE2 4.43Å; I183-Y572 WeakPolarHBondContact CD1-OH 3.46Å; I183-Y572 HydrophobicContact CG1-CE1 4.29Å; I183-Y572 HydrophobicContact CG2-CD1 3.66Å; I183-Y572 HydrophobicContact CG2-CD2 4.17Å; I183-Y572 HydrophobicContact CG2-CE1 3.83Å; I183-Y572 HydrophobicContact CG2-CE2 4.32Å; I183-Y572 HydrophobicContact CG2-CG 3.84Å; P184-Y572 HydrophobicContact CG-CD1 4.21Å; F280-Y572 HydrophobicContact CZ-CE2 4.26Å; V284-Y572 HydrophobicContact CG1-CD2 3.97Å; V284-Y572 HydrophobicContact CG1-CE2 4.21Å; T531-Y572 HydrophobicContact CG2-CE2 3.84Å; S570-Y572 PolarHBondContact O-N 3.11Å; Y572-S574 VanDerWaalsContact C-N 3.33Å; Y572-S574 PolarHBondContact O-N 3.24Å; Y572-I575 PolarHBondContact O-N 2.92Å; Y572-I576 VanDerWaalsContact O-CG1 3.3Å; Y572-I576 WeakPolarHBondContact O-CG1 3.31Å; Y572-I576 PolarHBondContact O-N 2.9Å
573	D	90.8	Very high	88.9	Confident	30 Å²	30	36.3 Å²	36.3	16%	0.16	20%	0.198	C	C	.	.	H	α-helix	trans	-65.9	-36.7	177	-66.1	-47.1	0	0	0	111.9	K187 P569 S570 I576 Q577 Y583	K187-D573 IonicContact NZ-OD1 3.31Å; K187-D573 PolarHBondContact NZ-OD1 3.18Å; K187-D573 IonicContact NZ-OD2 3.48Å; K187-D573 PolarHBondContact NZ-OD2 3.09Å; P569-D573 HydrophobicContact CB-CB 4.33Å; S570-D573 PolarHBondContact O-N 3.35Å; S570-D573 WeakPolarHBondContact OG-CB 3.41Å; S570-D573 PolarHBondContact OG-N 2.78Å; S570-D573 PolarHBondContact OG-OD2 3.38Å; D573-I576 WeakPolarHBondContact O-CB 3.34Å; D573-I576 PolarHBondContact O-N 2.94Å; D573-Q577 WeakPolarHBondContact O-CG 3.48Å; D573-Q577 PolarHBondContact O-N 3.41Å; D573-Y583 PolarHBondContact OD1-OH 3.3Å
574	S	91.2	Very high	87.5	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.014	21%	0.208	C	C	.	.	H	α-helix	trans	-59.6	-45.5	172.5	-173.7	0	0	0	0	111.3	S570 L571 Y572 I576 Q577 V578	S570-S574 WeakPolarHBondContact O-CB 3.29Å; S570-S574 PolarHBondContact O-N 2.83Å; L571-S574 PolarHBondContact O-N 2.91Å; Y572-S574 VanDerWaalsContact C-N 3.33Å; Y572-S574 PolarHBondContact O-N 3.24Å; S574-I576 PolarHBondContact O-N 2.85Å; S574-Q577 PolarHBondContact O-N 3.33Å; S574-V578 VanDerWaalsContact O-CG2 3.3Å; S574-V578 WeakPolarHBondContact O-CG2 3.45Å; S574-V578 PolarHBondContact O-N 3Å
575	I	90.1	Very high	86	Confident	17 Å²	17	41.1 Å²	41.1	9%	0.087	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-40.5	176.1	-65.5	162.9	0	0	0	111.2	P184 L571 Y572 V578 K579	P184-I575 HydrophobicContact CB-CG2 4.09Å; P184-I575 HydrophobicContact CG-CB 3.97Å; P184-I575 HydrophobicContact CG-CD1 4.37Å; P184-I575 HydrophobicContact CG-CG2 3.7Å; L571-I575 HydrophobicContact CD1-CD1 4.35Å; L571-I575 HydrophobicContact CG-CD1 4.09Å; L571-I575 VanDerWaalsContact O-CG1 3.27Å; L571-I575 WeakPolarHBondContact O-CG1 3.22Å; L571-I575 PolarHBondContact O-N 3.47Å; Y572-I575 PolarHBondContact O-N 2.92Å; I575-V578 PolarHBondContact O-N 3.32Å; I575-K579 HydrophobicContact CG2-CD 3.79Å; I575-K579 HydrophobicContact CG2-CG 4.13Å; I575-K579 VanDerWaalsContact O-CB 3.29Å; I575-K579 WeakPolarHBondContact O-CB 3.45Å; I575-K579 WeakPolarHBondContact O-CG 3.41Å; I575-K579 PolarHBondContact O-N 3.35Å
576	I	89.1	Confident	84.4	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-58.1	-49.1	175.6	-70	173.3	0	0	0	110.6	P184 K187 Y572 D573 S574 K579 K580 L581 Y583	P184-I576 HydrophobicContact CB-CD1 4.46Å; P184-I576 HydrophobicContact CB-CG1 3.68Å; K187-I576 HydrophobicContact CB-CD1 4.37Å; K187-I576 HydrophobicContact CD-CD1 3.93Å; K187-I576 HydrophobicContact CG-CD1 4.41Å; Y572-I576 VanDerWaalsContact O-CG1 3.3Å; Y572-I576 WeakPolarHBondContact O-CG1 3.31Å; Y572-I576 PolarHBondContact O-N 2.9Å; D573-I576 WeakPolarHBondContact O-CB 3.34Å; D573-I576 PolarHBondContact O-N 2.94Å; S574-I576 PolarHBondContact O-N 2.85Å; I576-K579 PolarHBondContact O-N 3.03Å; I576-K580 PolarHBondContact O-N 2.87Å; I576-L581 HydrophobicContact CG1-CD1 4.39Å; I576-L581 HydrophobicContact CG2-CB 4.16Å; I576-L581 PolarHBondContact O-N 2.74Å; I576-Y583 HydrophobicContact CD1-CD2 4.07Å; I576-Y583 HydrophobicContact CD1-CE1 4.48Å; I576-Y583 HydrophobicContact CD1-CE2 4.03Å; I576-Y583 HydrophobicContact CD1-CG 4.32Å; I576-Y583 HydrophobicContact CG2-CD1 3.67Å; I576-Y583 HydrophobicContact CG2-CD2 4.3Å; I576-Y583 HydrophobicContact CG2-CE1 4.39Å; I576-Y583 HydrophobicContact CG2-CG 3.57Å
577	Q	87.6	Confident	82.8	Confident	105 Å²	105	39.7 Å²	39.7	49%	0.491	20%	0.201	S	C	.	.	H	α-helix	trans	-61.5	-46.1	179.1	-71.6	176.5	4.8	0	0	111.5	D573 S574 K580	D573-Q577 WeakPolarHBondContact O-CG 3.48Å; D573-Q577 PolarHBondContact O-N 3.41Å; S574-Q577 PolarHBondContact O-N 3.33Å; Q577-K580 PolarHBondContact O-N 3.49Å; Q577-K580 VanDerWaalsContact O-N 3.11Å
578	V	86.4	Confident	80.9	Confident	15 Å²	15	38.9 Å²	38.9	9%	0.091	21%	0.207	C	C	.	.	H	α-helix	trans	-65.1	-42.4	178.5	175	0	0	0	0	110.7	R362 V365 R369 S574 I575 K580	R362-V578 HydrophobicContact CG-CG2 3.94Å; V365-V578 HydrophobicContact CB-CG1 4.38Å; V365-V578 HydrophobicContact CG1-CG1 3.5Å; R369-V578 VanDerWaalsContact CZ-O 3.31Å; R369-V578 PolarHBondContact NH1-O 3.07Å; R369-V578 PolarHBondContact NH2-O 2.97Å; S574-V578 VanDerWaalsContact O-CG2 3.3Å; S574-V578 WeakPolarHBondContact O-CG2 3.45Å; S574-V578 PolarHBondContact O-N 3Å; I575-V578 PolarHBondContact O-N 3.32Å; V578-K580 PolarHBondContact O-N 3.18Å
579	K	83.8	Confident	78.8	Confident	7 Å²	7	44.4 Å²	44.4	3%	0.03	24%	0.237	C	C	.	.	H	α-helix	trans	-68.5	-12.7	175.3	-74	-177.1	177.7	-178.3	0	113.7	Y19 E185 I575 I576 L581	Y19-K579 HydrophobicContact CD1-CD 4.45Å; Y19-K579 HydrophobicContact CD2-CG 4.4Å; Y19-K579 HydrophobicContact CG-CD 4.3Å; Y19-K579 HydrophobicContact CG-CG 4.14Å; E185-K579 IonicContact OE1-NZ 3.56Å; E185-K579 PolarHBondContact OE1-NZ 3.31Å; E185-K579 IonicContact OE2-NZ 3.87Å; E185-K579 PolarHBondContact OE2-NZ 2.92Å; I575-K579 HydrophobicContact CG2-CD 3.79Å; I575-K579 HydrophobicContact CG2-CG 4.13Å; I575-K579 VanDerWaalsContact O-CB 3.29Å; I575-K579 WeakPolarHBondContact O-CB 3.45Å; I575-K579 WeakPolarHBondContact O-CG 3.41Å; I575-K579 PolarHBondContact O-N 3.35Å; I576-K579 PolarHBondContact O-N 3.03Å; K579-L581 HydrophobicContact CB-CD1 4.29Å; K579-L581 HydrophobicContact CB-CD2 4.33Å; K579-L581 HydrophobicContact CB-CG 3.78Å; K579-L581 HydrophobicContact CD-CD1 4.25Å; K579-L581 PolarHBondContact O-N 3.34Å
580	K	84.8	Confident	76.9	Confident	117 Å²	117	45.9 Å²	45.9	51%	0.509	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	39.6	-173.4	-58.2	177.1	-178.9	166.8	0	111.7	E21 I576 Q577 V578	E21-K580 WeakPolarHBondContact OE1-CE 3.39Å; E21-K580 IonicContact OE1-NZ 2.97Å; E21-K580 PolarHBondContact OE1-NZ 3.4Å; I576-K580 PolarHBondContact O-N 2.87Å; Q577-K580 PolarHBondContact O-N 3.49Å; Q577-K580 VanDerWaalsContact O-N 3.11Å; V578-K580 PolarHBondContact O-N 3.18Å
581	L	82.4	Confident	75.2	Confident	15 Å²	15	50.2 Å²	50.2	8%	0.079	28%	0.278	C	S	.	.			trans	-66.1	145.4	175.9	-66	176.3	0	0	0	109.4	Y22 P184 E185 T188 I576 K579 Y583	Y22-L581 HydrophobicContact CD2-CD2 3.94Å; Y22-L581 HydrophobicContact CE2-CD2 3.75Å; P184-L581 HydrophobicContact CB-CD1 4.41Å; E185-L581 HydrophobicContact CG-CD1 4.13Å; T188-L581 HydrophobicContact CG2-CB 4.46Å; I576-L581 HydrophobicContact CG1-CD1 4.39Å; I576-L581 HydrophobicContact CG2-CB 4.16Å; I576-L581 PolarHBondContact O-N 2.74Å; K579-L581 HydrophobicContact CB-CD1 4.29Å; K579-L581 HydrophobicContact CB-CD2 4.33Å; K579-L581 HydrophobicContact CB-CG 3.78Å; K579-L581 HydrophobicContact CD-CD1 4.25Å; K579-L581 PolarHBondContact O-N 3.34Å; L581-Y583 PolarHBondContact O-N 3.38Å
582	P	75.6	Confident	73.4	Confident	28 Å²	28	56.2 Å²	56.2	18%	0.182	31%	0.308	C	S	.	.	S	Bend	trans	-67.2	80.2	174.8	29.6	-36.8	0	0	0	109.9	L26 T188 V193	L26-P582 HydrophobicContact CD1-CB 4.43Å; T188-P582 HydrophobicContact CG2-CG 4.34Å; T188-P582 WeakPolarHBondContact CG2-O 3.42Å; V193-P582 HydrophobicContact CB-CG 4.44Å; V193-P582 HydrophobicContact CG1-CB 4.25Å; V193-P582 HydrophobicContact CG1-CG 3.59Å; V193-P582 HydrophobicContact CG2-CB 4.49Å; V193-P582 WeakPolarHBondContact CG2-O 3.31Å
583	Y	71.2	Confident	71.9	Confident	33 Å²	33	59.9 Å²	59.9	13%	0.129	34%	0.335	C	S	.	.			trans	-123.4	130.6	-177.2	173.2	-103.1	0	0	0	108.5	K187 R191 D573 I576 L581 P585	K187-Y583 HydrophobicContact CD-CE2 4.21Å; K187-Y583 VanDerWaalsContact CE-OH 3.24Å; K187-Y583 WeakPolarHBondContact CE-OH 2.87Å; K187-Y583 HydrophobicContact CG-CE2 4.16Å; K187-Y583 PolarHBondContact NZ-OH 2.93Å; R191-Y583 VanDerWaalsContact CZ-CZ 3.47Å; R191-Y583 VanDerWaalsContact NH1-CE2 3.26Å; R191-Y583 PolarHBondContact NH1-OH 3.19Å; R191-Y583 PolarHBondContact NH2-OH 3.41Å; D573-Y583 PolarHBondContact OD1-OH 3.3Å; I576-Y583 HydrophobicContact CD1-CD2 4.07Å; I576-Y583 HydrophobicContact CD1-CE1 4.48Å; I576-Y583 HydrophobicContact CD1-CE2 4.03Å; I576-Y583 HydrophobicContact CD1-CG 4.32Å; I576-Y583 HydrophobicContact CG2-CD1 3.67Å; I576-Y583 HydrophobicContact CG2-CD2 4.3Å; I576-Y583 HydrophobicContact CG2-CE1 4.39Å; I576-Y583 HydrophobicContact CG2-CG 3.57Å; L581-Y583 PolarHBondContact O-N 3.38Å; Y583-P585 HydrophobicContact CD1-CB 4.22Å; Y583-P585 VanDerWaalsContact CE1-CA 3.49Å; Y583-P585 HydrophobicContact CE1-CB 4.11Å; Y583-P585 WeakPolarHBondContact O-CD 3.17Å
584	L	67.4	Low	70.3	Confident	76 Å²	76	60.1 Å²	60.1	40%	0.398	34%	0.335	S	S	.	.			trans	-82.8	104.6	171.1	-132.6	88.5	0	0	0	108	R191 R805 L827	R191-L584 PolarHBondContact NH1-O 3.5Å; L584-R805 HydrophobicContact CD2-CB 4.4Å; L584-R805 HydrophobicContact CD2-CG 3.68Å; L584-R805 PolarHBondContact O-NH2 3.48Å; L584-L827 HydrophobicContact CD1-CD2 3.65Å
585	P	64.8	Low	69	Low	57 Å²	57	63.7 Å²	63.7	37%	0.37	35%	0.348	S	S	.	.			trans	-70.4	140.9	-178.7	30.9	-35.2	0	0	0	110	Y583 L587 R805	Y583-P585 HydrophobicContact CD1-CB 4.22Å; Y583-P585 VanDerWaalsContact CE1-CA 3.49Å; Y583-P585 HydrophobicContact CE1-CB 4.11Å; Y583-P585 WeakPolarHBondContact O-CD 3.17Å; P585-L587 PolarHBondContact O-N 2.9Å; P585-R805 VanDerWaalsContact O-CZ 3.22Å; P585-R805 PolarHBondContact O-NH1 2.65Å; P585-R805 PolarHBondContact O-NH2 3.08Å
586	E	60.5	Low	68.2	Low	119 Å²	119	68.6 Å²	68.6	56%	0.556	38%	0.375	S	S	*	.			trans	-52.3	128.5	175	-83.6	159.6	-140.7	0	0	111	R191 T287 A588 R805	R191-E586 IonicContact CZ-OE1 2.87Å; R191-E586 IonicContact NH1-OE1 2.91Å; R191-E586 IonicContact NH2-OE1 3.24Å; R191-E586 PolarHBondContact NH2-OE1 3.07Å; T287-E586 WeakPolarHBondContact CG2-OE1 3.31Å; E586-A588 VanDerWaalsContact C-N 3.28Å; E586-A588 PolarHBondContact O-N 3.19Å; E586-R805 VanDerWaalsContact CA-NH2 3.33Å
587	L	57.5	Low	67.5	Low	34 Å²	34	71 Å²	71	18%	0.178	39%	0.387	C	S	.	.			trans	-75.5	90.2	177.8	-70.8	150.9	0	0	0	105.8	P585 K594 H802	P585-L587 PolarHBondContact O-N 2.9Å; L587-K594 HydrophobicContact CD2-CB 4.01Å; L587-K594 HydrophobicContact CD2-CD 3.21Å; L587-K594 HydrophobicContact CD2-CG 4.23Å; L587-H802 HydrophobicContact CD1-CB 4.27Å
588	A	53.4	Low	67.3	Low	68 Å²	68	69.4 Å²	69.4	56%	0.562	38%	0.379	S	S	*	.			trans	-56.5	144.9	168.1	0	0	0	0	0	109	E586 G590 H591	E586-A588 VanDerWaalsContact C-N 3.28Å; E586-A588 PolarHBondContact O-N 3.19Å; A588-G590 PolarHBondContact O-N 3.29Å; A588-H591 PolarHBondContact O-N 3Å
589	L	49.8	Very low	67.1	Low	160 Å²	160	69.6 Å²	69.6	84%	0.838	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-6.8	-175.1	-81.5	147.2	0	0	0	115.3
590	G	51.8	Low	67	Low	64 Å²	64	72.1 Å²	72.1	66%	0.66	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-9.3	-179.5	0	0	0	0	0	117	A588 I592	A588-G590 PolarHBondContact O-N 3.29Å; G590-I592 PolarHBondContact O-N 3.29Å
591	H	55.8	Low	66.9	Low	95 Å²	95	70.3 Å²	70.3	44%	0.44	39%	0.388	S	S	.	.			trans	-94.2	70.4	-177.7	-75	-68.5	0	0	0	113.4	A588 S593 K594	A588-H591 PolarHBondContact O-N 3Å; H591-S593 PolarHBondContact O-N 3.31Å; H591-K594 HydrophobicContact CB-CD 3.82Å; H591-K594 HydrophobicContact CB-CG 4.2Å; H591-K594 PolarHBondContact O-N 3.11Å; H591-K594 VanDerWaalsContact O-N 3.17Å
592	I	56.6	Low	66.7	Low	130 Å²	130	71.7 Å²	71.7	67%	0.667	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-57.9	-31.9	-178.3	-65	163.8	0	0	0	112.9	G590 K594 Y595	G590-I592 PolarHBondContact O-N 3.29Å; I592-K594 PolarHBondContact O-N 3.03Å; I592-Y595 WeakPolarHBondContact O-CD2 3.41Å; I592-Y595 PolarHBondContact O-N 2.87Å
593	S	59.4	Low	66.9	Low	84 Å²	84	73 Å²	73	59%	0.587	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-65.4	-20.8	-179.9	60.7	0	0	0	0	114.4	H591 Y595	H591-S593 PolarHBondContact O-N 3.31Å; S593-Y595 VanDerWaalsContact C-N 3.33Å
594	K	56.9	Low	67.4	Low	35 Å²	35	74.1 Å²	74.1	15%	0.152	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-84	-7.8	-178.3	-61.6	178.2	-174.7	167.4	0	113.2	L587 H591 I592 N596	L587-K594 HydrophobicContact CD2-CB 4.01Å; L587-K594 HydrophobicContact CD2-CD 3.21Å; L587-K594 HydrophobicContact CD2-CG 4.23Å; H591-K594 HydrophobicContact CB-CD 3.82Å; H591-K594 HydrophobicContact CB-CG 4.2Å; H591-K594 PolarHBondContact O-N 3.11Å; H591-K594 VanDerWaalsContact O-N 3.17Å; I592-K594 PolarHBondContact O-N 3.03Å; K594-N596 VanDerWaalsContact C-N 3.33Å
595	Y	63.5	Low	68	Low	77 Å²	77	79.3 Å²	79.3	30%	0.302	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-79.4	-17.8	173.2	-66.2	-91.1	0	0	0	112.7	I592 S593 S800 H802	I592-Y595 WeakPolarHBondContact O-CD2 3.41Å; I592-Y595 PolarHBondContact O-N 2.87Å; S593-Y595 VanDerWaalsContact C-N 3.33Å; Y595-S800 WeakPolarHBondContact O-CB 3.5Å; Y595-H802 HydrophobicContact CD1-CB 4.08Å; Y595-H802 HydrophobicContact CE1-CB 3.9Å; Y595-H802 AromaticContact CE1-CD2 3.86Å; Y595-H802 AromaticContact CE1-CG 3.77Å; Y595-H802 AromaticContact CZ-CD2 3.88Å
596	N	73.6	Confident	68.9	Low	119 Å²	119	85.7 Å²	85.7	64%	0.636	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-92.4	7.1	-178.2	-66.7	-3.1	0	0	0	113.8	K594	K594-N596 VanDerWaalsContact C-N 3.33Å
597	I	75.8	Confident	69.9	Low	54 Å²	54	82.8 Å²	82.8	28%	0.277	44%	0.436	S	S	.	.			trans	-101	122.6	172	-54.6	175.3	0	0	0	107.3	D601 I602 L801	I597-D601 HydrophobicContact CG2-CB 4.34Å; I597-I602 HydrophobicContact CG2-CD1 3.74Å; I597-I602 HydrophobicContact CG2-CG1 4.03Å; I597-L801 HydrophobicContact CB-CB 4.35Å; I597-L801 HydrophobicContact CB-CD2 4.48Å; I597-L801 HydrophobicContact CD1-CD2 4.5Å; I597-L801 HydrophobicContact CG2-CD2 4.49Å; I597-L801 WeakPolarHBondContact O-CB 3.31Å; I597-L801 PolarHBondContact O-N 2.98Å
598	F	81.5	Confident	71.4	Confident	70 Å²	70	85 Å²	85	31%	0.307	44%	0.444	S	S	.	.	B	Isolated β-bridge	trans	-101.8	162	-178.9	-61.1	-74.2	0	0	0	111.1	E600 D601 R798	F598-E600 HydrophobicContact CB-CG 3.82Å; F598-E600 PolarHBondContact O-N 3.43Å; F598-D601 PolarHBondContact N-OD2 3.13Å; F598-D601 WeakPolarHBondContact O-CB 3.45Å; F598-D601 PolarHBondContact O-N 2.99Å; F598-R798 WeakPolarHBondContact CD1-O 3.31Å
599	V	82.8	Confident	73	Confident	20 Å²	20	84.8 Å²	84.8	12%	0.121	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-59.7	-36.9	177.6	167.5	0	0	0	0	111	D601 I602 M603 L795 E797 T799 A804	V599-D601 PolarHBondContact O-N 3.42Å; V599-D601 VanDerWaalsContact O-N 3.16Å; V599-I602 PolarHBondContact O-N 2.9Å; V599-M603 HydrophobicContact CG1-CB 4.42Å; V599-M603 WeakPolarHBondContact O-CB 3.27Å; V599-M603 PolarHBondContact O-N 2.69Å; V599-L795 HydrophobicContact CB-CD2 4.24Å; V599-L795 HydrophobicContact CG1-CD2 3.61Å; V599-L795 HydrophobicContact CG1-CG 4.15Å; V599-L795 HydrophobicContact CG2-CD2 3.57Å; V599-L795 HydrophobicContact CG2-CG 3.99Å; V599-E797 WeakPolarHBondContact CB-O 3.23Å; V599-E797 PolarHBondContact N-O 3.44Å; V599-T799 WeakPolarHBondContact CG2-O 3.27Å; V599-T799 PolarHBondContact N-O 3.24Å; V599-T799 VanDerWaalsContact N-O 3.1Å; V599-A804 HydrophobicContact CG2-CB 3.67Å
600	E	83	Confident	75	Confident	59 Å²	59	77.3 Å²	77.3	28%	0.276	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-57.3	-27.6	177	62.2	-180	159.5	0	0	114.5	F598 I602 M603 E797	F598-E600 HydrophobicContact CB-CG 3.82Å; F598-E600 PolarHBondContact O-N 3.43Å; E600-I602 VanDerWaalsContact C-N 3.29Å; E600-M603 HydrophobicContact CB-CE 4.21Å; E600-E797 HydrophobicContact CB-CB 4.24Å; E600-E797 PolarHBondContact N-O 2.99Å; E600-E797 VanDerWaalsContact N-O 3.16Å
601	D	81.5	Confident	76.9	Confident	79 Å²	79	74.4 Å²	74.4	42%	0.422	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-76.1	-19	179.1	-65.7	-50.4	0	0	0	113.1	I597 F598 V599	I597-D601 HydrophobicContact CG2-CB 4.34Å; F598-D601 PolarHBondContact N-OD2 3.13Å; F598-D601 WeakPolarHBondContact O-CB 3.45Å; F598-D601 PolarHBondContact O-N 2.99Å; V599-D601 PolarHBondContact O-N 3.42Å; V599-D601 VanDerWaalsContact O-N 3.16Å
602	I	78.6	Confident	78.3	Confident	44 Å²	44	71.6 Å²	71.6	23%	0.226	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	-29.1	-169.1	-48	175.6	0	0	0	111.1	I597 V599 E600 L801 L826	I597-I602 HydrophobicContact CG2-CD1 3.74Å; I597-I602 HydrophobicContact CG2-CG1 4.03Å; V599-I602 PolarHBondContact O-N 2.9Å; E600-I602 VanDerWaalsContact C-N 3.29Å; I602-L801 HydrophobicContact CD1-CD1 3.73Å; I602-L801 HydrophobicContact CD1-CD2 4.35Å; I602-L826 HydrophobicContact CG2-CD2 3.95Å
603	M	79.4	Confident	79.8	Confident	57 Å²	57	72.5 Å²	72.5	28%	0.281	35%	0.353	S	S	.	.			trans	-61.8	141.2	-174	70.5	-179.7	-176.9	0	0	112.9	V599 E600 R605 E797	V599-M603 HydrophobicContact CG1-CB 4.42Å; V599-M603 WeakPolarHBondContact O-CB 3.27Å; V599-M603 PolarHBondContact O-N 2.69Å; E600-M603 HydrophobicContact CB-CE 4.21Å; M603-R605 HydrophobicContact CE-CG 4.25Å; M603-R605 HydrophobicContact CG-CG 4.42Å; M603-E797 HydrophobicContact CE-CG 4.34Å; M603-E797 HydrophobicContact SD-CG 4.42Å
604	V	81.8	Confident	81.2	Confident	55 Å²	55	68.7 Å²	68.7	33%	0.333	33%	0.326	S	S	.	.			trans	-86.9	114.8	174.2	-175	0	0	0	0	108.6	F822	V604-F822 HydrophobicContact CB-CD1 3.59Å; V604-F822 HydrophobicContact CB-CE1 3.73Å; V604-F822 HydrophobicContact CG1-CD1 3.81Å; V604-F822 HydrophobicContact CG1-CE1 3.43Å; V604-F822 VanDerWaalsContact CG1-CE1 3.43Å; V604-F822 HydrophobicContact CG2-CD1 3.9Å; V604-F822 HydrophobicContact CG2-CE1 4.4Å
605	R	80.6	Confident	82.8	Confident	186 Å²	186	68.7 Å²	68.7	70%	0.702	33%	0.329	S	S	*	.			trans	-81.1	-18.3	-174.6	-58.9	-175.1	-176.2	-159.5	-3.5	114.4	M603 V607	M603-R605 HydrophobicContact CE-CG 4.25Å; M603-R605 HydrophobicContact CG-CG 4.42Å; R605-V607 PolarHBondContact O-N 3.32Å
606	K	82.4	Confident	84.1	Confident	191 Å²	191	65.1 Å²	65.1	83%	0.83	32%	0.316	S	S	*	.			trans	-97.8	93.5	-177.7	-66.8	-171.9	179.4	-174.7	0	109.7	F822	K606-F822 WeakPolarHBondContact O-CZ 3.5Å
607	V	83.1	Confident	84.9	Confident	58 Å²	58	64 Å²	64	35%	0.352	30%	0.302	S	S	.	.			trans	-107.8	138.4	177.5	-177.7	0	0	0	0	109	R605 P632 F822	R605-V607 PolarHBondContact O-N 3.32Å; V607-P632 HydrophobicContact CG1-CG 3.87Å; V607-F822 HydrophobicContact CB-CE2 4.25Å; V607-F822 HydrophobicContact CB-CZ 4.18Å; V607-F822 HydrophobicContact CG1-CE2 3.88Å; V607-F822 HydrophobicContact CG1-CZ 4.27Å; V607-F822 HydrophobicContact CG2-CE1 4.45Å; V607-F822 HydrophobicContact CG2-CE2 3.86Å; V607-F822 HydrophobicContact CG2-CZ 3.77Å
608	K	87.2	Confident	85.6	Confident	81 Å²	81	64.9 Å²	64.9	35%	0.352	31%	0.305	S	S	.	.			trans	-90.1	134.9	168.6	-69.8	-178.7	167.4	-159.5	0	107.9	L622 S625 T626 P632	K608-L622 HydrophobicContact CB-CD1 3.98Å; K608-L622 HydrophobicContact CD-CD1 4.38Å; K608-S625 VanDerWaalsContact NZ-C 3.3Å; K608-S625 VanDerWaalsContact NZ-CB 3.26Å; K608-S625 PolarHBondContact NZ-O 3.28Å; K608-S625 PolarHBondContact NZ-OG 2.92Å; K608-T626 HydrophobicContact CB-CG2 4.19Å; K608-T626 HydrophobicContact CD-CG2 3.18Å; K608-T626 HydrophobicContact CG-CG2 4.35Å; K608-P632 WeakPolarHBondContact O-CD 3.45Å; K608-P632 VanDerWaalsContact O-CG 3.28Å; K608-P632 WeakPolarHBondContact O-CG 3.31Å
609	F	89	Confident	86	Confident	63 Å²	63	61.6 Å²	61.6	28%	0.276	29%	0.291	S	S	.	.			trans	-139.7	161.3	-171.3	58.3	-93.8	0	0	0	110.1	P632 V634 K637 M640	F609-P632 WeakPolarHBondContact CA-O 3.31Å; F609-P632 HydrophobicContact CB-CG 4.26Å; F609-V634 HydrophobicContact CB-CG1 4.1Å; F609-V634 HydrophobicContact CB-CG2 4.31Å; F609-V634 HydrophobicContact CD2-CG2 3.39Å; F609-V634 HydrophobicContact CE2-CG2 3.93Å; F609-V634 HydrophobicContact CG-CG1 4.44Å; F609-V634 HydrophobicContact CG-CG2 4.09Å; F609-K637 HydrophobicContact CE2-CG 4.09Å; F609-M640 HydrophobicContact CD1-CE 3.83Å; F609-M640 HydrophobicContact CD1-SD 4.25Å; F609-M640 HydrophobicContact CE1-CE 3.58Å; F609-M640 HydrophobicContact CE1-SD 3.7Å; F609-M640 HydrophobicContact CE2-SD 4.01Å; F609-M640 HydrophobicContact CZ-CE 4.1Å; F609-M640 HydrophobicContact CZ-SD 3.55Å; F609-M640 VanDerWaalsContact CZ-SD 3.55Å
610	L	91.3	Very high	86.4	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.016	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	138.5	168.2	-172.9	67.1	0	0	0	107.7	L619 L622 I631 P632 L633 V634 L651 M783	L610-L619 HydrophobicContact CD1-CB 4.42Å; L610-L619 HydrophobicContact CD1-CD1 4.22Å; L610-L619 HydrophobicContact CD2-CD1 4.18Å; L610-L622 HydrophobicContact CB-CD2 4.11Å; L610-L622 HydrophobicContact CD1-CD2 4.24Å; L610-I631 HydrophobicContact CB-CG2 3.99Å; L610-P632 PolarHBondContact N-O 3.04Å; L610-L633 HydrophobicContact CB-CD1 4.36Å; L610-L633 HydrophobicContact CD2-CD1 4.37Å; L610-L633 HydrophobicContact CG-CD1 4.32Å; L610-L633 CarbonylContact O-C 3.54Å; L610-L633 WeakPolarHBondContact O-CA 3.25Å; L610-V634 WeakPolarHBondContact O-CG2 3.29Å; L610-V634 PolarHBondContact O-N 3.35Å; L610-L651 HydrophobicContact CD2-CD1 4.4Å; L610-L651 HydrophobicContact CD2-CD2 4.18Å; L610-M783 HydrophobicContact CD2-CE 3.66Å; L610-M783 HydrophobicContact CD2-SD 4.45Å; L610-M783 HydrophobicContact CG-CE 3.97Å
611	S	90.9	Very high	86.8	Confident	2 Å²	2	66 Å²	66	1%	0.014	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	151.6	173.3	173.9	0	0	0	0	110	Q613 S614 V634 D635 S636	S611-Q613 PolarHBondContact O-N 3.39Å; S611-Q613 PolarHBondContact OG-N 3.47Å; S611-S614 PolarHBondContact N-OG 3.49Å; S611-S614 VanDerWaalsContact O-CB 3.29Å; S611-S614 WeakPolarHBondContact O-CB 3.24Å; S611-S614 PolarHBondContact O-N 3.16Å; S611-V634 CarbonylContact C-O 3.54Å; S611-V634 VanDerWaalsContact CA-O 3.27Å; S611-V634 WeakPolarHBondContact CA-O 3.17Å; S611-D635 PolarHBondContact OG-O 3.39Å; S611-S636 WeakPolarHBondContact OG-CA 3.43Å
612	S	86.3	Confident	87.2	Confident	37 Å²	37	63 Å²	63	26%	0.259	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-20.2	172.2	-56.1	0	0	0	0	113.5	V634 D635	S612-V634 PolarHBondContact N-O 2.87Å; S612-V634 PolarHBondContact OG-O 3.48Å; S612-D635 PolarHBondContact N-O 3.01Å
613	Q	86.4	Confident	87.7	Confident	148 Å²	148	61.4 Å²	61.4	69%	0.692	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	9.8	178.4	-57.6	179.3	9.7	0	0	113.2	S611	S611-Q613 PolarHBondContact O-N 3.39Å; S611-Q613 PolarHBondContact OG-N 3.47Å
614	S	89.4	Confident	88.1	Confident	4 Å²	4	65.3 Å²	65.3	3%	0.028	31%	0.305	C	S	.	.			trans	-70.9	146.5	179.8	-80.3	0	0	0	0	111.8	S611 E618 V781	S611-S614 PolarHBondContact N-OG 3.49Å; S611-S614 VanDerWaalsContact O-CB 3.29Å; S611-S614 WeakPolarHBondContact O-CB 3.24Å; S611-S614 PolarHBondContact O-N 3.16Å; S614-E618 WeakPolarHBondContact CB-OE2 3.41Å; S614-E618 PolarHBondContact OG-OE2 3.42Å; S614-V781 PolarHBondContact O-N 3.02Å
615	T	91.8	Very high	88.5	Confident	35 Å²	35	65.5 Å²	65.5	22%	0.215	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-86.7	162.4	175.5	62.2	0	0	0	0	111.9	R617 E618 L619 D778 K779	T615-R617 PolarHBondContact O-N 3.43Å; T615-E618 WeakPolarHBondContact O-CB 3.19Å; T615-E618 PolarHBondContact O-N 3.06Å; T615-L619 PolarHBondContact O-N 3Å; T615-D778 WeakPolarHBondContact CG2-O 3.37Å; T615-K779 VanDerWaalsContact CA-O 3.29Å; T615-K779 WeakPolarHBondContact CA-O 3.36Å; T615-K779 WeakPolarHBondContact CB-O 3.48Å
616	F	89.3	Confident	88.7	Confident	3 Å²	3	57 Å²	57	1%	0.013	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-29	175	-78.5	-79.5	0	0	0	112.7	L619 N620 V654 L655 W658 L777 K779 P780 V781	F616-L619 HydrophobicContact CD1-CD2 4.29Å; F616-L619 PolarHBondContact O-N 2.77Å; F616-N620 WeakPolarHBondContact O-CB 3.29Å; F616-N620 PolarHBondContact O-N 3.45Å; F616-V654 HydrophobicContact CE1-CG1 4.2Å; F616-L655 HydrophobicContact CB-CD1 4.41Å; F616-L655 HydrophobicContact CD1-CD1 3.88Å; F616-W658 HydrophobicContact CD1-CB 4.47Å; F616-W658 HydrophobicContact CD1-CG 4.15Å; F616-W658 HydrophobicContact CD2-CD2 4.29Å; F616-W658 AromaticContact CD2-CE2 3.8Å; F616-W658 HydrophobicContact CD2-CG 4.41Å; F616-W658 HydrophobicContact CD2-CZ2 4.27Å; F616-W658 AromaticContact CD2-NE1 3.59Å; F616-W658 HydrophobicContact CE1-CB 4.03Å; F616-W658 AromaticContact CE1-CD2 3.96Å; F616-W658 HydrophobicContact CE1-CD2 3.96Å; F616-W658 HydrophobicContact CE1-CE3 4.42Å; F616-W658 AromaticContact CE1-CG 3.78Å; F616-W658 HydrophobicContact CE1-CG 3.78Å; F616-W658 AromaticContact CE2-CD2 3.59Å; F616-W658 HydrophobicContact CE2-CD2 3.59Å; F616-W658 AromaticContact CE2-CE2 3.3Å; F616-W658 HydrophobicContact CE2-CE3 4.09Å; F616-W658 HydrophobicContact CE2-CG 4.07Å; F616-W658 HydrophobicContact CE2-CH2 4.09Å; F616-W658 AromaticContact CE2-CZ2 3.58Å; F616-W658 HydrophobicContact CE2-CZ2 3.58Å; F616-W658 HydrophobicContact CE2-CZ3 4.32Å; F616-W658 AromaticContact CE2-NE1 3.6Å; F616-W658 HydrophobicContact CG-CG 4.45Å; F616-W658 HydrophobicContact CZ-CB 4.37Å; F616-W658 AromaticContact CZ-CD2 3.39Å; F616-W658 HydrophobicContact CZ-CD2 3.39Å; F616-W658 AromaticContact CZ-CE2 3.67Å; F616-W658 AromaticContact CZ-CE3 3.66Å; F616-W658 HydrophobicContact CZ-CE3 3.66Å; F616-W658 AromaticContact CZ-CG 3.74Å; F616-W658 HydrophobicContact CZ-CG 3.74Å; F616-W658 HydrophobicContact CZ-CH2 4.4Å; F616-W658 HydrophobicContact CZ-CZ2 4.17Å; F616-W658 HydrophobicContact CZ-CZ3 4.16Å; F616-L777 CarbonylContact C-O 3.59Å; F616-L777 HydrophobicContact CB-CD2 4.02Å; F616-L777 PolarHBondContact N-O 3.47Å; F616-K779 WeakPolarHBondContact CD2-O 3.36Å; F616-K779 PolarHBondContact N-O 2.67Å; F616-K779 VanDerWaalsContact N-O 3.11Å; F616-P780 WeakPolarHBondContact CE2-O 3.48Å; F616-V781 HydrophobicContact CB-CG2 4.48Å; F616-V781 HydrophobicContact CD1-CG2 3.82Å; F616-V781 HydrophobicContact CD2-CG2 3.94Å; F616-V781 HydrophobicContact CE1-CG1 4.26Å; F616-V781 HydrophobicContact CE1-CG2 3.95Å; F616-V781 HydrophobicContact CE2-CB 4.33Å; F616-V781 HydrophobicContact CE2-CG2 4.05Å; F616-V781 HydrophobicContact CG-CG2 3.82Å; F616-V781 HydrophobicContact CZ-CB 4.26Å; F616-V781 HydrophobicContact CZ-CG1 4.14Å; F616-V781 HydrophobicContact CZ-CG2 4.05Å
617	R	91.1	Very high	88.7	Confident	95 Å²	95	54.5 Å²	54.5	36%	0.358	28%	0.278	S	S	.	.	H	α-helix	trans	-62.3	-47.4	172.6	-170.9	-178.5	-63.4	-87.9	2.6	111.4	T615 L619 N620 H621 E774 L777 D778	T615-R617 PolarHBondContact O-N 3.43Å; R617-L619 VanDerWaalsContact C-N 3.32Å; R617-N620 PolarHBondContact O-N 2.92Å; R617-H621 WeakPolarHBondContact O-CB 3.22Å; R617-H621 PolarHBondContact O-N 3.35Å; R617-E774 PolarHBondContact NH2-O 3.39Å; R617-L777 HydrophobicContact CB-CB 4.14Å; R617-L777 WeakPolarHBondContact CB-O 3.48Å; R617-L777 PolarHBondContact N-O 2.95Å; R617-D778 IonicContact CZ-OD1 3.34Å; R617-D778 IonicContact CZ-OD2 3.81Å; R617-D778 IonicContact NE-OD1 2.71Å; R617-D778 PolarHBondContact NE-OD1 2.91Å; R617-D778 IonicContact NE-OD2 3.92Å; R617-D778 VanDerWaalsContact NH2-CG 3.29Å; R617-D778 IonicContact NH2-OD1 3.11Å; R617-D778 PolarHBondContact NH2-OD1 3.11Å; R617-D778 VanDerWaalsContact NH2-OD1 3.11Å; R617-D778 IonicContact NH2-OD2 2.86Å; R617-D778 PolarHBondContact NH2-OD2 3.44Å
618	E	90	Very high	88.6	Confident	73 Å²	73	53.7 Å²	53.7	34%	0.341	27%	0.272	S	S	.	.	H	α-helix	trans	-64.3	-40.3	177.1	-67.4	-171.3	165.3	0	0	111.3	S614 T615 H621 L622 K637	S614-E618 WeakPolarHBondContact CB-OE2 3.41Å; S614-E618 PolarHBondContact OG-OE2 3.42Å; T615-E618 WeakPolarHBondContact O-CB 3.19Å; T615-E618 PolarHBondContact O-N 3.06Å; E618-H621 PolarHBondContact O-N 2.78Å; E618-L622 VanDerWaalsContact O-CB 3.24Å; E618-L622 WeakPolarHBondContact O-CB 3.34Å; E618-L622 PolarHBondContact O-N 2.97Å; E618-K637 IonicContact OE1-NZ 2.62Å; E618-K637 PolarHBondContact OE1-NZ 3.4Å; E618-K637 WeakPolarHBondContact OE2-CE 3.32Å; E618-K637 IonicContact OE2-NZ 3.03Å; E618-K637 PolarHBondContact OE2-NZ 2.69Å
619	L	90.8	Very high	88.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60.6	-48.7	174.8	177.4	60.4	0	0	0	111.5	L610 T615 F616 R617 H621 L622 L623 L651 V781	L610-L619 HydrophobicContact CD1-CB 4.42Å; L610-L619 HydrophobicContact CD1-CD1 4.22Å; L610-L619 HydrophobicContact CD2-CD1 4.18Å; T615-L619 PolarHBondContact O-N 3Å; F616-L619 HydrophobicContact CD1-CD2 4.29Å; F616-L619 PolarHBondContact O-N 2.77Å; R617-L619 VanDerWaalsContact C-N 3.32Å; L619-H621 PolarHBondContact O-N 3.12Å; L619-L622 CarbonylContact O-C 3.54Å; L619-L622 WeakPolarHBondContact O-CB 3.18Å; L619-L622 PolarHBondContact O-N 2.65Å; L619-L622 VanDerWaalsContact O-N 3.12Å; L619-L623 HydrophobicContact CD1-CD1 4.25Å; L619-L623 HydrophobicContact CD1-CG 4.18Å; L619-L623 HydrophobicContact CG-CD1 4.15Å; L619-L623 HydrophobicContact CG-CG 4.48Å; L619-L623 WeakPolarHBondContact O-CG 3.15Å; L619-L623 PolarHBondContact O-N 3.13Å; L619-L651 HydrophobicContact CD1-CB 4.22Å; L619-L651 HydrophobicContact CD1-CD1 4.13Å; L619-L651 HydrophobicContact CD1-CD2 4.16Å; L619-L651 HydrophobicContact CD1-CG 4.41Å; L619-L651 HydrophobicContact CD2-CD2 4.4Å; L619-V781 HydrophobicContact CD2-CG2 4.29Å
620	N	90.8	Very high	88.1	Confident	48 Å²	48	55.3 Å²	55.3	26%	0.257	28%	0.28	S	S	.	.	H	α-helix	trans	-60.5	-46.3	178.4	-170.8	23.1	0	0	0	111	F616 R617 L622 L623 E624 L655 L777	F616-N620 WeakPolarHBondContact O-CB 3.29Å; F616-N620 PolarHBondContact O-N 3.45Å; R617-N620 PolarHBondContact O-N 2.92Å; N620-L622 VanDerWaalsContact C-N 3.27Å; N620-L622 PolarHBondContact O-N 2.86Å; N620-L623 PolarHBondContact O-N 3.25Å; N620-E624 WeakPolarHBondContact O-CG 3.35Å; N620-E624 PolarHBondContact O-N 3.36Å; N620-L655 HydrophobicContact CB-CD2 3.92Å; N620-L777 HydrophobicContact CB-CD2 4.37Å
621	H	90.8	Very high	88	Confident	123 Å²	123	55.3 Å²	55.3	57%	0.569	28%	0.28	S	S	*	.	H	α-helix	trans	-61.5	-36.2	175.3	-120.3	-39.3	0	0	0	112.7	R617 E618 L619 S625	R617-H621 WeakPolarHBondContact O-CB 3.22Å; R617-H621 PolarHBondContact O-N 3.35Å; E618-H621 PolarHBondContact O-N 2.78Å; L619-H621 PolarHBondContact O-N 3.12Å; H621-S625 WeakPolarHBondContact O-CB 3.29Å; H621-S625 PolarHBondContact O-N 3.4Å; H621-S625 PolarHBondContact O-OG 2.83Å
622	L	90	Very high	88	Confident	18 Å²	18	56.1 Å²	56.1	9%	0.094	29%	0.285	C	S	.	.	H	α-helix	trans	-66.9	-45.5	175.7	-174.6	66.6	0	0	0	110.7	K608 L610 E618 L619 N620 S625 T626 I631	K608-L622 HydrophobicContact CB-CD1 3.98Å; K608-L622 HydrophobicContact CD-CD1 4.38Å; L610-L622 HydrophobicContact CB-CD2 4.11Å; L610-L622 HydrophobicContact CD1-CD2 4.24Å; E618-L622 VanDerWaalsContact O-CB 3.24Å; E618-L622 WeakPolarHBondContact O-CB 3.34Å; E618-L622 PolarHBondContact O-N 2.97Å; L619-L622 CarbonylContact O-C 3.54Å; L619-L622 WeakPolarHBondContact O-CB 3.18Å; L619-L622 PolarHBondContact O-N 2.65Å; L619-L622 VanDerWaalsContact O-N 3.12Å; N620-L622 VanDerWaalsContact C-N 3.27Å; N620-L622 PolarHBondContact O-N 2.86Å; L622-S625 PolarHBondContact O-N 3.2Å; L622-S625 PolarHBondContact O-OG 3.39Å; L622-T626 HydrophobicContact CD1-CG2 3.8Å; L622-T626 HydrophobicContact CG-CG2 4.36Å; L622-T626 VanDerWaalsContact O-CB 3.28Å; L622-T626 WeakPolarHBondContact O-CB 3.4Å; L622-T626 WeakPolarHBondContact O-CG2 3.42Å; L622-T626 PolarHBondContact O-N 2.8Å; L622-T626 PolarHBondContact O-OG1 3.28Å; L622-I631 HydrophobicContact CD2-CD1 4.07Å; L622-I631 HydrophobicContact CD2-CG2 3.69Å; L622-I631 HydrophobicContact CG-CD1 4.35Å
623	L	89.4	Confident	88.2	Confident	9 Å²	9	54.4 Å²	54.4	5%	0.047	27%	0.273	C	S	.	.	H	α-helix	trans	-62.6	-43.4	177.5	-70.9	174.7	0	0	0	111.4	L619 N620 I631 R648 L655	L619-L623 HydrophobicContact CD1-CD1 4.25Å; L619-L623 HydrophobicContact CD1-CG 4.18Å; L619-L623 HydrophobicContact CG-CD1 4.15Å; L619-L623 HydrophobicContact CG-CG 4.48Å; L619-L623 WeakPolarHBondContact O-CG 3.15Å; L619-L623 PolarHBondContact O-N 3.13Å; N620-L623 PolarHBondContact O-N 3.25Å; L623-I631 HydrophobicContact CD2-CD1 4.1Å; L623-R648 HydrophobicContact CD2-CG 3.6Å; L623-R648 VanDerWaalsContact O-CZ 3.26Å; L623-R648 PolarHBondContact O-NH1 3.36Å; L623-R648 PolarHBondContact O-NH2 3.23Å; L623-L655 HydrophobicContact CD1-CD2 3.8Å
624	E	88.9	Confident	88.4	Confident	139 Å²	139	47.7 Å²	47.7	65%	0.65	24%	0.242	S	C	*	.	H	α-helix	trans	-65.3	-39.3	175	-71	-177.2	167.1	0	0	112.6	N620	N620-E624 WeakPolarHBondContact O-CG 3.35Å; N620-E624 PolarHBondContact O-N 3.36Å
625	S	88.5	Confident	88.4	Confident	60 Å²	60	50.6 Å²	50.6	42%	0.42	26%	0.257	S	S	.	.	H	α-helix	trans	-84.6	-13.4	-174.3	76.4	0	0	0	0	113.9	K608 H621 L622	K608-S625 VanDerWaalsContact NZ-C 3.3Å; K608-S625 VanDerWaalsContact NZ-CB 3.26Å; K608-S625 PolarHBondContact NZ-O 3.28Å; K608-S625 PolarHBondContact NZ-OG 2.92Å; H621-S625 WeakPolarHBondContact O-CB 3.29Å; H621-S625 PolarHBondContact O-N 3.4Å; H621-S625 PolarHBondContact O-OG 2.83Å; L622-S625 PolarHBondContact O-N 3.2Å; L622-S625 PolarHBondContact O-OG 3.39Å
626	T	84.6	Confident	88.3	Confident	7 Å²	7	50 Å²	50	4%	0.043	25%	0.254	C	S	.	.			trans	-117.2	157.1	-177.5	60.6	0	0	0	0	112.9	K608 L622 R648	K608-T626 HydrophobicContact CB-CG2 4.19Å; K608-T626 HydrophobicContact CD-CG2 3.18Å; K608-T626 HydrophobicContact CG-CG2 4.35Å; L622-T626 HydrophobicContact CD1-CG2 3.8Å; L622-T626 HydrophobicContact CG-CG2 4.36Å; L622-T626 VanDerWaalsContact O-CB 3.28Å; L622-T626 WeakPolarHBondContact O-CB 3.4Å; L622-T626 WeakPolarHBondContact O-CG2 3.42Å; L622-T626 PolarHBondContact O-N 2.8Å; L622-T626 PolarHBondContact O-OG1 3.28Å; T626-R648 PolarHBondContact O-NH1 3.39Å; T626-R648 PolarHBondContact OG1-NH1 3.01Å
627	T	84.3	Confident	88.2	Confident	139 Å²	139	55.2 Å²	55.2	85%	0.853	28%	0.277	S	S	*	.			trans	-128.9	16.1	172.5	50.3	0	0	0	0	111
628	L	79.3	Confident	88.1	Confident	40 Å²	40	59.7 Å²	59.7	21%	0.209	30%	0.302	C	S	.	.			trans	-71.7	139.3	179.2	-50	178.7	0	0	0	108.5	T630 R648 A821	L628-T630 WeakPolarHBondContact CB-O 3.25Å; L628-T630 PolarHBondContact O-N 3.2Å; L628-R648 VanDerWaalsContact O-CD 3.32Å; L628-R648 WeakPolarHBondContact O-CD 3.27Å; L628-A821 HydrophobicContact CB-CB 4.01Å; L628-A821 HydrophobicContact CD2-CB 3.46Å; L628-A821 VanDerWaalsContact CD2-CB 3.46Å; L628-A821 HydrophobicContact CG-CB 4.18Å
629	K	82.2	Confident	87.9	Confident	167 Å²	167	58.4 Å²	58.4	73%	0.726	30%	0.301	S	S	*	.	S	Bend	trans	-66.3	-30.3	177.2	-75.5	-171.3	164.4	-151.9	0	112.6	R648	K629-R648 WeakPolarHBondContact O-CB 3.28Å; K629-R648 PolarHBondContact O-N 3.28Å
630	T	85	Confident	87.8	Confident	11 Å²	11	63.1 Å²	63.1	7%	0.067	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	144.4	-174	51.3	0	0	0	0	108.5	L628 I646 E647 E818	L628-T630 WeakPolarHBondContact CB-O 3.25Å; L628-T630 PolarHBondContact O-N 3.2Å; T630-I646 WeakPolarHBondContact CA-O 3.22Å; T630-E647 HydrophobicContact CG2-CG 4.38Å; T630-E818 WeakPolarHBondContact CB-O 3.48Å; T630-E818 WeakPolarHBondContact CG2-O 3.12Å; T630-E818 PolarHBondContact OG1-O 3.4Å
631	I	88.9	Confident	87.6	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.015	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.5	-172.5	-65.4	176.4	0	0	0	107.6	L610 L622 L623 S645 I646 L651	L610-I631 HydrophobicContact CB-CG2 3.99Å; L622-I631 HydrophobicContact CD2-CD1 4.07Å; L622-I631 HydrophobicContact CD2-CG2 3.69Å; L622-I631 HydrophobicContact CG-CD1 4.35Å; L623-I631 HydrophobicContact CD2-CD1 4.1Å; I631-S645 WeakPolarHBondContact O-CA 3.12Å; I631-I646 PolarHBondContact N-O 3.34Å; I631-I646 PolarHBondContact O-N 2.91Å; I631-L651 HydrophobicContact CB-CD1 4.12Å; I631-L651 HydrophobicContact CD1-CD1 3.84Å; I631-L651 HydrophobicContact CG1-CD1 4.41Å
632	P	90.6	Very high	87.5	Confident	20 Å²	20	63.5 Å²	63.5	13%	0.13	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	133.2	176.5	28.6	-31.2	0	0	0	110.3	V607 K608 F609 L610 L642	V607-P632 HydrophobicContact CG1-CG 3.87Å; K608-P632 WeakPolarHBondContact O-CD 3.45Å; K608-P632 VanDerWaalsContact O-CG 3.28Å; K608-P632 WeakPolarHBondContact O-CG 3.31Å; F609-P632 WeakPolarHBondContact CA-O 3.31Å; F609-P632 HydrophobicContact CB-CG 4.26Å; L610-P632 PolarHBondContact N-O 3.04Å; P632-L642 HydrophobicContact CB-CD1 3.66Å
633	L	90.1	Very high	87.3	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	125.8	172.8	-177.4	71.4	0	0	0	109.2	L610 L643 G644 I646 M783 I788	L610-L633 HydrophobicContact CB-CD1 4.36Å; L610-L633 HydrophobicContact CD2-CD1 4.37Å; L610-L633 HydrophobicContact CG-CD1 4.32Å; L610-L633 CarbonylContact O-C 3.54Å; L610-L633 WeakPolarHBondContact O-CA 3.25Å; L633-L643 HydrophobicContact CD2-CB 4.46Å; L633-L643 HydrophobicContact CD2-CD1 4.44Å; L633-L643 PolarHBondContact O-N 3.37Å; L633-G644 PolarHBondContact N-O 3.47Å; L633-G644 PolarHBondContact O-N 3.48Å; L633-I646 HydrophobicContact CB-CD1 4.45Å; L633-I646 HydrophobicContact CD2-CD1 4.33Å; L633-M783 HydrophobicContact CD1-CE 4.28Å; L633-M783 HydrophobicContact CD1-SD 4.38Å; L633-I788 HydrophobicContact CD2-CD1 3.5Å; L633-I788 VanDerWaalsContact CD2-CD1 3.5Å; L633-I788 HydrophobicContact CD2-CG1 3.93Å; L633-I788 HydrophobicContact CD2-CG2 4.16Å
634	V	91.1	Very high	87.3	Confident	7 Å²	7	66 Å²	66	4%	0.042	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	154.2	173.2	-58	0	0	0	0	110.5	F609 L610 S611 S612 I641	F609-V634 HydrophobicContact CB-CG1 4.1Å; F609-V634 HydrophobicContact CB-CG2 4.31Å; F609-V634 HydrophobicContact CD2-CG2 3.39Å; F609-V634 HydrophobicContact CE2-CG2 3.93Å; F609-V634 HydrophobicContact CG-CG1 4.44Å; F609-V634 HydrophobicContact CG-CG2 4.09Å; L610-V634 WeakPolarHBondContact O-CG2 3.29Å; L610-V634 PolarHBondContact O-N 3.35Å; S611-V634 CarbonylContact C-O 3.54Å; S611-V634 VanDerWaalsContact CA-O 3.27Å; S611-V634 WeakPolarHBondContact CA-O 3.17Å; S612-V634 PolarHBondContact N-O 2.87Å; S612-V634 PolarHBondContact OG-O 3.48Å; V634-I641 CarbonylContact C-O 3.57Å; V634-I641 WeakPolarHBondContact CA-O 3.39Å; V634-I641 WeakPolarHBondContact CB-O 3.46Å
635	D	88.9	Confident	87.3	Confident	64 Å²	64	59.8 Å²	59.8	34%	0.342	31%	0.314	S	S	.	.	S	Bend	trans	-59.4	-64.7	177.2	168.9	48.5	0	0	0	111.5	S611 S612 S639 I641 L643	S611-D635 PolarHBondContact OG-O 3.39Å; S612-D635 PolarHBondContact N-O 3.01Å; D635-S639 PolarHBondContact OD2-OG 2.83Å; D635-I641 HydrophobicContact CB-CB 4.4Å; D635-I641 PolarHBondContact N-O 3.45Å; D635-L643 HydrophobicContact CB-CD1 4Å; D635-L643 HydrophobicContact CB-CD2 4.2Å; D635-L643 HydrophobicContact CB-CG 4.1Å
636	S	88.9	Confident	87.3	Confident	23 Å²	23	57 Å²	57	16%	0.161	30%	0.295	C	S	.	.			trans	-137.6	162.5	175.6	72.9	0	0	0	0	112.4	S611 E638 S639 M640	S611-S636 WeakPolarHBondContact OG-CA 3.43Å; S636-E638 PolarHBondContact O-N 3.44Å; S636-E638 PolarHBondContact OG-N 3.42Å; S636-S639 PolarHBondContact N-OG 2.97Å; S636-S639 VanDerWaalsContact N-OG 3.16Å; S636-S639 VanDerWaalsContact OG-CB 3.28Å; S636-S639 WeakPolarHBondContact OG-CB 3.47Å; S636-S639 PolarHBondContact OG-N 2.68Å; S636-S639 PolarHBondContact OG-OG 3.39Å; S636-M640 PolarHBondContact O-N 2.93Å
637	K	88	Confident	87.4	Confident	112 Å²	112	60.9 Å²	60.9	49%	0.487	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22	174	-66.8	175.1	-177.4	167.6	0	112.7	F609 E618	F609-K637 HydrophobicContact CE2-CG 4.09Å; E618-K637 IonicContact OE1-NZ 2.62Å; E618-K637 PolarHBondContact OE1-NZ 3.4Å; E618-K637 WeakPolarHBondContact OE2-CE 3.32Å; E618-K637 IonicContact OE2-NZ 3.03Å; E618-K637 PolarHBondContact OE2-NZ 2.69Å
638	E	88.3	Confident	87.6	Confident	190 Å²	190	56.9 Å²	56.9	89%	0.888	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-46.1	-179.7	-61.8	-178.6	-179.4	0	0	111.7	S636	S636-E638 PolarHBondContact O-N 3.44Å; S636-E638 PolarHBondContact OG-N 3.42Å
639	S	87.5	Confident	87.9	Confident	46 Å²	46	59.4 Å²	59.4	32%	0.322	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-34.3	-178.3	67.1	0	0	0	0	112.3	D635 S636 I641	D635-S639 PolarHBondContact OD2-OG 2.83Å; S636-S639 PolarHBondContact N-OG 2.97Å; S636-S639 VanDerWaalsContact N-OG 3.16Å; S636-S639 VanDerWaalsContact OG-CB 3.28Å; S636-S639 WeakPolarHBondContact OG-CB 3.47Å; S636-S639 PolarHBondContact OG-N 2.68Å; S636-S639 PolarHBondContact OG-OG 3.39Å; S639-I641 PolarHBondContact O-N 2.88Å
640	M	87.2	Confident	88.2	Confident	99 Å²	99	54.8 Å²	54.8	49%	0.488	28%	0.28	S	S	.	.			trans	52	24.4	-178.6	-68.2	-67.2	-67.6	0	0	113.6	F609 S636	F609-M640 HydrophobicContact CD1-CE 3.83Å; F609-M640 HydrophobicContact CD1-SD 4.25Å; F609-M640 HydrophobicContact CE1-CE 3.58Å; F609-M640 HydrophobicContact CE1-SD 3.7Å; F609-M640 HydrophobicContact CE2-SD 4.01Å; F609-M640 HydrophobicContact CZ-CE 4.1Å; F609-M640 HydrophobicContact CZ-SD 3.55Å; F609-M640 VanDerWaalsContact CZ-SD 3.55Å; S636-M640 PolarHBondContact O-N 2.93Å
641	I	87.6	Confident	88.4	Confident	99 Å²	99	54.2 Å²	54.2	51%	0.508	28%	0.277	S	S	.	.			trans	-79	124.6	177	-62.4	174.3	0	0	0	108	V634 D635 S639 L643	V634-I641 CarbonylContact C-O 3.57Å; V634-I641 WeakPolarHBondContact CA-O 3.39Å; V634-I641 WeakPolarHBondContact CB-O 3.46Å; D635-I641 HydrophobicContact CB-CB 4.4Å; D635-I641 PolarHBondContact N-O 3.45Å; S639-I641 PolarHBondContact O-N 2.88Å; I641-L643 PolarHBondContact O-N 2.89Å
642	L	87.7	Confident	88.5	Confident	80 Å²	80	58 Å²	58	42%	0.419	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	121.1	175.9	-176.8	69.9	0	0	0	109.7	P632 G644	P632-L642 HydrophobicContact CB-CD1 3.66Å; L642-G644 WeakPolarHBondContact CD1-O 3.5Å
643	L	86.9	Confident	88.3	Confident	77 Å²	77	59.8 Å²	59.8	40%	0.403	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-41.3	173.9	-62.9	179.2	0	0	0	110.9	L633 D635 I641	L633-L643 HydrophobicContact CD2-CB 4.46Å; L633-L643 HydrophobicContact CD2-CD1 4.44Å; L633-L643 PolarHBondContact O-N 3.37Å; D635-L643 HydrophobicContact CB-CD1 4Å; D635-L643 HydrophobicContact CB-CD2 4.2Å; D635-L643 HydrophobicContact CB-CG 4.1Å; I641-L643 PolarHBondContact O-N 2.89Å
644	G	88.3	Confident	88.2	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.01	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.4	-159.1	-176.7	0	0	0	0	0	113.3	L633 L642 D789	L633-G644 PolarHBondContact N-O 3.47Å; L633-G644 PolarHBondContact O-N 3.48Å; L642-G644 WeakPolarHBondContact CD1-O 3.5Å; G644-D789 CarbonylContact C-O 3.59Å; G644-D789 WeakPolarHBondContact CA-O 3.19Å
645	S	88.5	Confident	88.1	Confident	9 Å²	9	61.6 Å²	61.6	6%	0.063	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	149.7	173.3	48.6	0	0	0	0	111.4	I631 D789 S819	I631-S645 WeakPolarHBondContact O-CA 3.12Å; S645-D789 PolarHBondContact N-O 3.08Å; S645-D789 PolarHBondContact O-N 3.21Å; S645-D789 VanDerWaalsContact O-N 3.14Å; S645-S819 PolarHBondContact OG-OG 3.04Å; S645-S819 VanDerWaalsContact OG-OG 3.05Å
646	I	89.3	Confident	88	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.015	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	143.3	178.4	-51.6	170.6	0	0	0	108.6	T630 I631 L633 L651 I786 I788	T630-I646 WeakPolarHBondContact CA-O 3.22Å; I631-I646 PolarHBondContact N-O 3.34Å; I631-I646 PolarHBondContact O-N 2.91Å; L633-I646 HydrophobicContact CB-CD1 4.45Å; L633-I646 HydrophobicContact CD2-CD1 4.33Å; I646-L651 HydrophobicContact CB-CD1 4.19Å; I646-L651 HydrophobicContact CB-CG 4.26Å; I646-L651 HydrophobicContact CD1-CD2 4.27Å; I646-L651 HydrophobicContact CG2-CD1 4.18Å; I646-L651 HydrophobicContact CG2-CD2 3.98Å; I646-L651 HydrophobicContact CG2-CG 3.71Å; I646-I786 HydrophobicContact CD1-CG2 4.12Å; I646-I786 HydrophobicContact CG2-CG2 3.81Å; I646-I788 HydrophobicContact CD1-CG1 4.26Å; I646-I788 HydrophobicContact CG1-CG1 4.3Å
647	E	87.4	Confident	87.9	Confident	88 Å²	88	67.2 Å²	67.2	41%	0.411	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	139.4	173.4	-68.8	-155.2	154	0	0	111.9	T630 T649 E650 L651	T630-E647 HydrophobicContact CG2-CG 4.38Å; E647-T649 VanDerWaalsContact C-N 3.28Å; E647-T649 PolarHBondContact O-N 3.35Å; E647-T649 PolarHBondContact OE2-OG1 3.47Å; E647-E650 HydrophobicContact CB-CB 4.25Å; E647-E650 PolarHBondContact O-N 3.23Å; E647-L651 PolarHBondContact O-N 3.22Å; E647-L651 VanDerWaalsContact O-N 3.1Å
648	R	87.6	Confident	87.7	Confident	55 Å²	55	63.9 Å²	63.9	21%	0.208	33%	0.326	C	S	.	.	H	α-helix	trans	-62.9	-38.2	177.6	-177.7	-167.2	169.1	95.9	-1.6	111.7	L623 T626 L628 K629 E650 L651 Q652	L623-R648 HydrophobicContact CD2-CG 3.6Å; L623-R648 VanDerWaalsContact O-CZ 3.26Å; L623-R648 PolarHBondContact O-NH1 3.36Å; L623-R648 PolarHBondContact O-NH2 3.23Å; T626-R648 PolarHBondContact O-NH1 3.39Å; T626-R648 PolarHBondContact OG1-NH1 3.01Å; L628-R648 VanDerWaalsContact O-CD 3.32Å; L628-R648 WeakPolarHBondContact O-CD 3.27Å; K629-R648 WeakPolarHBondContact O-CB 3.28Å; K629-R648 PolarHBondContact O-N 3.28Å; R648-E650 VanDerWaalsContact C-N 3.3Å; R648-L651 PolarHBondContact O-N 2.61Å; R648-Q652 VanDerWaalsContact O-CB 3.28Å; R648-Q652 WeakPolarHBondContact O-CB 3.29Å; R648-Q652 PolarHBondContact O-N 3.43Å
649	T	86.6	Confident	87.6	Confident	93 Å²	93	56.5 Å²	56.5	57%	0.571	29%	0.293	S	S	*	.	H	α-helix	trans	-62.5	-39.5	179.9	28.3	0	0	0	0	111.7	E647 Q652 A653	E647-T649 VanDerWaalsContact C-N 3.28Å; E647-T649 PolarHBondContact O-N 3.35Å; E647-T649 PolarHBondContact OE2-OG1 3.47Å; T649-Q652 PolarHBondContact O-N 3.11Å; T649-A653 WeakPolarHBondContact O-CB 3.35Å; T649-A653 PolarHBondContact O-N 3.27Å
650	E	88.4	Confident	87.5	Confident	69 Å²	69	55.1 Å²	55.1	32%	0.322	28%	0.283	S	S	.	.	H	α-helix	trans	-67.5	-48	175.2	-167.8	170.9	-170.9	0	0	110.9	E647 R648 Q652 A653 V654	E647-E650 HydrophobicContact CB-CB 4.25Å; E647-E650 PolarHBondContact O-N 3.23Å; R648-E650 VanDerWaalsContact C-N 3.3Å; E650-Q652 VanDerWaalsContact C-N 3.26Å; E650-Q652 PolarHBondContact O-N 3.42Å; E650-A653 PolarHBondContact O-N 3.35Å; E650-A653 VanDerWaalsContact O-N 3.13Å; E650-V654 WeakPolarHBondContact O-CG2 3.3Å; E650-V654 PolarHBondContact O-N 3.2Å
651	L	89.5	Confident	86.9	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.7	-36	174.6	-72	172.8	0	0	0	113.3	L610 L619 I631 I646 E647 R648 L655 I786	L610-L651 HydrophobicContact CD2-CD1 4.4Å; L610-L651 HydrophobicContact CD2-CD2 4.18Å; L619-L651 HydrophobicContact CD1-CB 4.22Å; L619-L651 HydrophobicContact CD1-CD1 4.13Å; L619-L651 HydrophobicContact CD1-CD2 4.16Å; L619-L651 HydrophobicContact CD1-CG 4.41Å; L619-L651 HydrophobicContact CD2-CD2 4.4Å; I631-L651 HydrophobicContact CB-CD1 4.12Å; I631-L651 HydrophobicContact CD1-CD1 3.84Å; I631-L651 HydrophobicContact CG1-CD1 4.41Å; I646-L651 HydrophobicContact CB-CD1 4.19Å; I646-L651 HydrophobicContact CB-CG 4.26Å; I646-L651 HydrophobicContact CD1-CD2 4.27Å; I646-L651 HydrophobicContact CG2-CD1 4.18Å; I646-L651 HydrophobicContact CG2-CD2 3.98Å; I646-L651 HydrophobicContact CG2-CG 3.71Å; E647-L651 PolarHBondContact O-N 3.22Å; E647-L651 VanDerWaalsContact O-N 3.1Å; R648-L651 PolarHBondContact O-N 2.61Å; L651-L655 WeakPolarHBondContact O-CB 3.45Å; L651-L655 PolarHBondContact O-N 2.93Å; L651-I786 HydrophobicContact CD2-CD1 4.43Å
652	Q	89.8	Confident	86.3	Confident	82 Å²	82	56.4 Å²	56.4	38%	0.383	29%	0.292	S	S	.	.	H	α-helix	trans	-70.7	-41.8	176.3	-172.5	172.2	-12.2	0	0	111.1	R648 T649 E650 V654 L655 D656	R648-Q652 VanDerWaalsContact O-CB 3.28Å; R648-Q652 WeakPolarHBondContact O-CB 3.29Å; R648-Q652 PolarHBondContact O-N 3.43Å; T649-Q652 PolarHBondContact O-N 3.11Å; E650-Q652 VanDerWaalsContact C-N 3.26Å; E650-Q652 PolarHBondContact O-N 3.42Å; Q652-V654 VanDerWaalsContact C-N 3.33Å; Q652-V654 PolarHBondContact O-N 2.87Å; Q652-L655 PolarHBondContact O-N 3.11Å; Q652-D656 WeakPolarHBondContact O-CB 3.15Å; Q652-D656 PolarHBondContact O-N 3.18Å
653	A	87.6	Confident	85.9	Confident	58 Å²	58	53.6 Å²	53.6	48%	0.479	28%	0.275	S	S	.	.	H	α-helix	trans	-62.6	-40.6	175.1	0	0	0	0	0	111.9	T649 E650 D656 W657	T649-A653 WeakPolarHBondContact O-CB 3.35Å; T649-A653 PolarHBondContact O-N 3.27Å; E650-A653 PolarHBondContact O-N 3.35Å; E650-A653 VanDerWaalsContact O-N 3.13Å; A653-D656 PolarHBondContact O-N 2.9Å; A653-W657 VanDerWaalsContact O-CB 3.24Å; A653-W657 WeakPolarHBondContact O-CB 3.25Å; A653-W657 PolarHBondContact O-N 3.37Å
654	V	87.8	Confident	85.5	Confident	38 Å²	38	51.1 Å²	51.1	23%	0.23	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-45.5	175	173	0	0	0	0	110.7	F616 E650 Q652 W657 W658 I786	F616-V654 HydrophobicContact CE1-CG1 4.2Å; E650-V654 WeakPolarHBondContact O-CG2 3.3Å; E650-V654 PolarHBondContact O-N 3.2Å; Q652-V654 VanDerWaalsContact C-N 3.33Å; Q652-V654 PolarHBondContact O-N 2.87Å; V654-W657 PolarHBondContact O-N 2.9Å; V654-W658 VanDerWaalsContact O-CB 3.27Å; V654-W658 WeakPolarHBondContact O-CB 3.24Å; V654-W658 PolarHBondContact O-N 2.81Å; V654-I786 HydrophobicContact CG1-CD1 4.43Å; V654-I786 HydrophobicContact CG2-CD1 4.48Å; V654-I786 HydrophobicContact CG2-CG1 4.49Å
655	L	87.9	Confident	84.7	Confident	8 Å²	8	52.8 Å²	52.8	4%	0.042	27%	0.27	C	S	.	.	H	α-helix	trans	-64.6	-44.8	177.4	-176.6	68.3	0	0	0	112.2	F616 N620 L623 L651 Q652 W657 W658 L659 L777	F616-L655 HydrophobicContact CB-CD1 4.41Å; F616-L655 HydrophobicContact CD1-CD1 3.88Å; N620-L655 HydrophobicContact CB-CD2 3.92Å; L623-L655 HydrophobicContact CD1-CD2 3.8Å; L651-L655 WeakPolarHBondContact O-CB 3.45Å; L651-L655 PolarHBondContact O-N 2.93Å; Q652-L655 PolarHBondContact O-N 3.11Å; L655-W657 VanDerWaalsContact C-N 3.31Å; L655-W657 PolarHBondContact O-N 3.4Å; L655-W658 PolarHBondContact O-N 3.22Å; L655-L659 HydrophobicContact CD1-CD1 3.94Å; L655-L659 HydrophobicContact CD1-CG 4.47Å; L655-L659 HydrophobicContact CG-CD1 4.06Å; L655-L659 WeakPolarHBondContact O-CG 3.36Å; L655-L659 PolarHBondContact O-N 2.7Å; L655-L777 HydrophobicContact CD1-CD2 4.22Å
656	D	88.3	Confident	83.8	Confident	96 Å²	96	59.5 Å²	59.5	51%	0.513	30%	0.299	S	S	.	.	H	α-helix	trans	-64.3	-37.2	179.3	-71.3	-17.5	0	0	0	111.1	Q652 A653 S660	Q652-D656 WeakPolarHBondContact O-CB 3.15Å; Q652-D656 PolarHBondContact O-N 3.18Å; A653-D656 PolarHBondContact O-N 2.9Å; D656-S660 PolarHBondContact O-N 3.28Å
657	W	85.9	Confident	82.7	Confident	109 Å²	109	62.5 Å²	62.5	41%	0.413	31%	0.313	S	S	.	.	H	α-helix	trans	-70.3	-42.3	173.3	-178.8	84.6	0	0	0	112.3	A653 V654 L655 L659 S660 W681	A653-W657 VanDerWaalsContact O-CB 3.24Å; A653-W657 WeakPolarHBondContact O-CB 3.25Å; A653-W657 PolarHBondContact O-N 3.37Å; V654-W657 PolarHBondContact O-N 2.9Å; L655-W657 VanDerWaalsContact C-N 3.31Å; L655-W657 PolarHBondContact O-N 3.4Å; W657-L659 PolarHBondContact O-N 3.44Å; W657-S660 WeakPolarHBondContact O-CB 3.48Å; W657-S660 PolarHBondContact O-N 3.32Å; W657-S660 PolarHBondContact O-OG 2.64Å; W657-W681 HydrophobicContact CE3-CZ2 4.45Å; W657-W681 HydrophobicContact CH2-CH2 4.12Å; W657-W681 AromaticContact CH2-CZ2 3.61Å; W657-W681 HydrophobicContact CH2-CZ2 3.61Å; W657-W681 AromaticContact CZ2-CH2 3.92Å; W657-W681 HydrophobicContact CZ2-CH2 3.92Å; W657-W681 AromaticContact CZ2-CZ2 3.89Å; W657-W681 HydrophobicContact CZ2-CZ2 3.89Å; W657-W681 AromaticContact CZ3-CZ2 3.93Å; W657-W681 HydrophobicContact CZ3-CZ2 3.93Å
658	W	84.4	Confident	81.4	Confident	42 Å²	42	64 Å²	64	16%	0.159	32%	0.315	C	S	.	.	H	α-helix	trans	-60.2	-37.8	179.4	-167.2	-97.8	0	0	0	111.8	F616 V654 L655 S660 R663 E776 K779	F616-W658 HydrophobicContact CD1-CB 4.47Å; F616-W658 HydrophobicContact CD1-CG 4.15Å; F616-W658 HydrophobicContact CD2-CD2 4.29Å; F616-W658 AromaticContact CD2-CE2 3.8Å; F616-W658 HydrophobicContact CD2-CG 4.41Å; F616-W658 HydrophobicContact CD2-CZ2 4.27Å; F616-W658 AromaticContact CD2-NE1 3.59Å; F616-W658 HydrophobicContact CE1-CB 4.03Å; F616-W658 AromaticContact CE1-CD2 3.96Å; F616-W658 HydrophobicContact CE1-CD2 3.96Å; F616-W658 HydrophobicContact CE1-CE3 4.42Å; F616-W658 AromaticContact CE1-CG 3.78Å; F616-W658 HydrophobicContact CE1-CG 3.78Å; F616-W658 AromaticContact CE2-CD2 3.59Å; F616-W658 HydrophobicContact CE2-CD2 3.59Å; F616-W658 AromaticContact CE2-CE2 3.3Å; F616-W658 HydrophobicContact CE2-CE3 4.09Å; F616-W658 HydrophobicContact CE2-CG 4.07Å; F616-W658 HydrophobicContact CE2-CH2 4.09Å; F616-W658 AromaticContact CE2-CZ2 3.58Å; F616-W658 HydrophobicContact CE2-CZ2 3.58Å; F616-W658 HydrophobicContact CE2-CZ3 4.32Å; F616-W658 AromaticContact CE2-NE1 3.6Å; F616-W658 HydrophobicContact CG-CG 4.45Å; F616-W658 HydrophobicContact CZ-CB 4.37Å; F616-W658 AromaticContact CZ-CD2 3.39Å; F616-W658 HydrophobicContact CZ-CD2 3.39Å; F616-W658 AromaticContact CZ-CE2 3.67Å; F616-W658 AromaticContact CZ-CE3 3.66Å; F616-W658 HydrophobicContact CZ-CE3 3.66Å; F616-W658 AromaticContact CZ-CG 3.74Å; F616-W658 HydrophobicContact CZ-CG 3.74Å; F616-W658 HydrophobicContact CZ-CH2 4.4Å; F616-W658 HydrophobicContact CZ-CZ2 4.17Å; F616-W658 HydrophobicContact CZ-CZ3 4.16Å; V654-W658 VanDerWaalsContact O-CB 3.27Å; V654-W658 WeakPolarHBondContact O-CB 3.24Å; V654-W658 PolarHBondContact O-N 2.81Å; L655-W658 PolarHBondContact O-N 3.22Å; W658-S660 VanDerWaalsContact C-N 3.33Å; W658-R663 VanDerWaalsContact CD1-NH1 3.34Å; W658-R663 VanDerWaalsContact CE2-CZ 3.44Å; W658-R663 VanDerWaalsContact CG-NH1 3.3Å; W658-R663 VanDerWaalsContact NE1-NH1 3.15Å; W658-R663 PolarHBondContact O-NH1 2.97Å; W658-E776 PolarHBondContact NE1-OE2 2.61Å; W658-K779 HydrophobicContact CZ2-CD 4.27Å
659	L	85.8	Confident	79.7	Confident	35 Å²	35	64.2 Å²	64.2	18%	0.183	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	8.9	177	-61	170	0	0	0	113.1	L655 W657 R664 E773 L777	L655-L659 HydrophobicContact CD1-CD1 3.94Å; L655-L659 HydrophobicContact CD1-CG 4.47Å; L655-L659 HydrophobicContact CG-CD1 4.06Å; L655-L659 WeakPolarHBondContact O-CG 3.36Å; L655-L659 PolarHBondContact O-N 2.7Å; W657-L659 PolarHBondContact O-N 3.44Å; L659-R664 PolarHBondContact O-NH1 3.25Å; L659-E773 HydrophobicContact CD2-CB 4.22Å; L659-E773 HydrophobicContact CD2-CG 4.06Å; L659-L777 HydrophobicContact CD1-CD2 4.39Å; L659-L777 HydrophobicContact CD2-CD2 4.41Å; L659-L777 HydrophobicContact CD2-CG 4.37Å
660	S	84.4	Confident	77.9	Confident	16 Å²	16	63.7 Å²	63.7	11%	0.112	33%	0.334	C	S	.	.			trans	-70.9	149.7	-174.2	70.9	0	0	0	0	112.9	D656 W657 W658 E662 R663 R664	D656-S660 PolarHBondContact O-N 3.28Å; W657-S660 WeakPolarHBondContact O-CB 3.48Å; W657-S660 PolarHBondContact O-N 3.32Å; W657-S660 PolarHBondContact O-OG 2.64Å; W658-S660 VanDerWaalsContact C-N 3.33Å; S660-E662 PolarHBondContact O-N 3.2Å; S660-R663 PolarHBondContact O-N 2.91Å; S660-R663 PolarHBondContact OG-N 3.49Å; S660-R664 PolarHBondContact O-N 2.85Å
661	P	75.3	Confident	75.6	Confident	73 Å²	73	65 Å²	65	47%	0.474	35%	0.351	S	S	.	.	H	α-helix	trans	-60	-31.7	172.7	-18.5	28.9	0	0	0	113.2	R664 V665	P661-R664 WeakPolarHBondContact O-CB 3.34Å; P661-R664 PolarHBondContact O-N 2.79Å; P661-V665 WeakPolarHBondContact O-CG2 3.42Å; P661-V665 PolarHBondContact O-N 3.28Å
662	E	75.4	Confident	72.9	Confident	152 Å²	152	69.3 Å²	69.3	71%	0.71	38%	0.381	S	S	*	.	H	α-helix	trans	-65.2	-42	-178.7	-63.7	-180	179	0	0	111.3	S660 V665 F666	S660-E662 PolarHBondContact O-N 3.2Å; E662-V665 PolarHBondContact O-N 2.89Å; E662-F666 PolarHBondContact O-N 2.9Å; E662-F666 VanDerWaalsContact O-N 3.07Å
663	R	79.3	Confident	70.3	Confident	21 Å²	21	71.8 Å²	71.8	8%	0.079	40%	0.404	C	S	.	.	H	α-helix	trans	-68.3	-40.2	175.9	-174.8	170.2	170.5	-104.7	-11.1	112.4	W658 S660 V665 F666 E667 E776	W658-R663 VanDerWaalsContact CD1-NH1 3.34Å; W658-R663 VanDerWaalsContact CE2-CZ 3.44Å; W658-R663 VanDerWaalsContact CG-NH1 3.3Å; W658-R663 VanDerWaalsContact NE1-NH1 3.15Å; W658-R663 PolarHBondContact O-NH1 2.97Å; S660-R663 PolarHBondContact O-N 2.91Å; S660-R663 PolarHBondContact OG-N 3.49Å; R663-V665 PolarHBondContact O-N 3.48Å; R663-F666 PolarHBondContact O-N 3.45Å; R663-F666 VanDerWaalsContact O-N 3.13Å; R663-E667 IonicContact CZ-OE1 2.64Å; R663-E667 IonicContact NE-OE1 2.76Å; R663-E667 IonicContact NH2-OE1 3.33Å; R663-E667 PolarHBondContact NH2-OE1 3Å; R663-E667 PolarHBondContact O-N 3.17Å; R663-E776 IonicContact CZ-OE2 2.92Å; R663-E776 IonicContact NH1-OE2 3.45Å; R663-E776 PolarHBondContact NH1-OE2 2.98Å; R663-E776 IonicContact NH2-OE2 3.2Å; R663-E776 PolarHBondContact NH2-OE2 3.49Å
664	R	79.3	Confident	67.9	Low	26 Å²	26	72 Å²	72	10%	0.098	41%	0.412	C	S	.	.	H	α-helix	trans	-54.2	-42	174.5	-75.9	-163.6	-66.8	-92.1	6.9	112.4	L659 S660 P661 R668 D762 W772 E773	L659-R664 PolarHBondContact O-NH1 3.25Å; S660-R664 PolarHBondContact O-N 2.85Å; P661-R664 WeakPolarHBondContact O-CB 3.34Å; P661-R664 PolarHBondContact O-N 2.79Å; R664-R668 PolarHBondContact O-N 3.22Å; R664-D762 IonicContact CZ-OD2 2.6Å; R664-D762 IonicContact NE-OD2 2.64Å; R664-D762 PolarHBondContact NE-OD2 3.1Å; R664-D762 IonicContact NH2-OD2 3.4Å; R664-D762 PolarHBondContact NH2-OD2 3.02Å; R664-W772 HydrophobicContact CB-CH2 4.48Å; R664-W772 HydrophobicContact CB-CZ2 4.45Å; R664-W772 VanDerWaalsContact CD-CE3 3.49Å; R664-W772 HydrophobicContact CG-CD2 3.81Å; R664-W772 HydrophobicContact CG-CE3 3.57Å; R664-W772 HydrophobicContact CG-CH2 3.3Å; R664-W772 HydrophobicContact CG-CZ2 3.54Å; R664-W772 HydrophobicContact CG-CZ3 3.32Å; R664-E773 IonicContact NH1-OE1 3.92Å
665	V	70.9	Confident	65.1	Low	35 Å²	35	79.1 Å²	79.1	21%	0.212	44%	0.443	C	S	.	.	H	α-helix	trans	-73.5	-37.7	180	174.5	0	0	0	0	111.6	P661 E662 R663 R668 G669 L760	P661-V665 WeakPolarHBondContact O-CG2 3.42Å; P661-V665 PolarHBondContact O-N 3.28Å; E662-V665 PolarHBondContact O-N 2.89Å; R663-V665 PolarHBondContact O-N 3.48Å; V665-R668 PolarHBondContact O-N 3.32Å; V665-G669 PolarHBondContact O-N 3.45Å; V665-L760 HydrophobicContact CG1-CB 3.98Å; V665-L760 HydrophobicContact CG1-CD1 3.82Å; V665-L760 HydrophobicContact CG1-CD2 3.6Å; V665-L760 HydrophobicContact CG1-CG 3.95Å; V665-L760 HydrophobicContact CG2-CB 4.32Å
666	F	69.7	Low	62.7	Low	151 Å²	151	83 Å²	83	66%	0.662	49%	0.485	S	S	*	.	H	α-helix	trans	-64.8	-42.6	178.7	-173.4	-95.9	0	0	0	113.3	E662 R663 R668 G669 S670	E662-F666 PolarHBondContact O-N 2.9Å; E662-F666 VanDerWaalsContact O-N 3.07Å; R663-F666 PolarHBondContact O-N 3.45Å; R663-F666 VanDerWaalsContact O-N 3.13Å; F666-R668 VanDerWaalsContact C-N 3.28Å; F666-R668 PolarHBondContact O-N 2.94Å; F666-G669 PolarHBondContact O-N 3.4Å; F666-S670 PolarHBondContact O-N 3.45Å; F666-S670 PolarHBondContact O-OG 2.66Å; F666-S670 VanDerWaalsContact O-OG 3.1Å
667	E	64.8	Low	59.9	Low	65 Å²	65	82.5 Å²	82.5	30%	0.304	49%	0.489	S	S	.	.	H	α-helix	trans	-66.1	-30.9	175.5	-75	-168.1	170.9	0	0	112.4	R663 S670	R663-E667 IonicContact CZ-OE1 2.64Å; R663-E667 IonicContact NE-OE1 2.76Å; R663-E667 IonicContact NH2-OE1 3.33Å; R663-E667 PolarHBondContact NH2-OE1 3Å; R663-E667 PolarHBondContact O-N 3.17Å; E667-S670 WeakPolarHBondContact CA-OG 3.28Å; E667-S670 PolarHBondContact O-OG 3.39Å
668	R	60	Low	57.4	Low	120 Å²	120	87.9 Å²	87.9	45%	0.453	52%	0.515	S	S	.	.	H	α-helix	trans	-70.3	-38.7	172.8	-116.1	-179.9	-161.8	-176.2	6.6	112.3	R664 V665 F666 S670 S671 T763	R664-R668 PolarHBondContact O-N 3.22Å; V665-R668 PolarHBondContact O-N 3.32Å; F666-R668 VanDerWaalsContact C-N 3.28Å; F666-R668 PolarHBondContact O-N 2.94Å; R668-S670 VanDerWaalsContact C-N 3.28Å; R668-S670 PolarHBondContact O-N 3.38Å; R668-S671 PolarHBondContact O-N 2.99Å; R668-S671 PolarHBondContact O-OG 2.94Å; R668-T763 PolarHBondContact NH1-OG1 3.38Å
669	G	53.4	Low	54.9	Low	60 Å²	60	92.6 Å²	92.6	62%	0.619	54%	0.543	S	S	*	.	H	α-helix	trans	-64.8	-29.3	178	0	0	0	0	0	114.2	V665 F666	V665-G669 PolarHBondContact O-N 3.45Å; F666-G669 PolarHBondContact O-N 3.4Å
670	S	47.4	Very low	52.1	Low	81 Å²	81	94.7 Å²	94.7	57%	0.566	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-5.4	179.1	46.8	0	0	0	0	114.2	F666 E667 R668 S672	F666-S670 PolarHBondContact O-N 3.45Å; F666-S670 PolarHBondContact O-OG 2.66Å; F666-S670 VanDerWaalsContact O-OG 3.1Å; E667-S670 WeakPolarHBondContact CA-OG 3.28Å; E667-S670 PolarHBondContact O-OG 3.39Å; R668-S670 VanDerWaalsContact C-N 3.28Å; R668-S670 PolarHBondContact O-N 3.38Å; S670-S672 VanDerWaalsContact C-N 3.25Å; S670-S672 PolarHBondContact O-N 3.37Å
671	S	40.3	Very low	49.7	Very low	96 Å²	96	100.3 Å²	100.3	67%	0.671	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	1.4	175.7	68.4	0	0	0	0	114.8	R668	R668-S671 PolarHBondContact O-N 2.99Å; R668-S671 PolarHBondContact O-OG 2.94Å
672	S	34	Very low	47.3	Very low	92 Å²	92	104.6 Å²	104.6	64%	0.643	59%	0.593	S	S	*	*	S	Bend	trans	-90.8	126	170.2	-151.3	0	0	0	0	110	S670 G674	S670-S672 VanDerWaalsContact C-N 3.25Å; S670-S672 PolarHBondContact O-N 3.37Å; S672-G674 PolarHBondContact O-N 3.44Å
673	P	35.2	Very low	44.9	Very low	133 Å²	133	101.9 Å²	101.9	86%	0.864	59%	0.591	S	S	*	*	S	Bend	trans	-74.7	104.3	-168.5	29.2	-32	0	0	0	110.4
674	G	36.4	Very low	42.5	Very low	63 Å²	63	109.6 Å²	109.6	65%	0.649	63%	0.625	S	S	*	*	S	Bend	trans	150.2	50.1	163.9	0	0	0	0	0	118	S672	S672-G674 PolarHBondContact O-N 3.44Å
675	Q	29.4	Very low	39.9	Very low	188 Å²	188	112.8 Å²	112.8	88%	0.879	65%	0.652	S	S	*	*			trans	-164.9	103.7	145.5	-130	145.4	-7.5	0	0	110.9	S677	Q675-S677 PolarHBondContact O-N 3.47Å
676	G	38	Very low	37.8	Very low	89 Å²	89	120.8 Å²	120.8	92%	0.918	68%	0.684	S	S	*	*			trans	-74.5	107.4	167.8	0	0	0	0	0	109.4
677	S	29.2	Very low	35.6	Very low	86 Å²	86	119.5 Å²	119.5	60%	0.601	69%	0.688	S	S	*	*			trans	-132.1	102.5	160.6	57.3	0	0	0	0	108.9	Q675 L679	Q675-S677 PolarHBondContact O-N 3.47Å; S677-L679 PolarHBondContact O-N 3.45Å; S677-L679 VanDerWaalsContact O-N 3.08Å
678	K	32	Very low	33.7	Very low	222 Å²	222	123.1 Å²	123.1	97%	0.965	71%	0.709	S	S	*	*			trans	-57.7	106.2	160.1	-100.3	179.7	168.4	-175	0	107
679	L	33.2	Very low	32.4	Very low	140 Å²	140	124.8 Å²	124.8	73%	0.733	72%	0.723	S	S	*	*			trans	-91	108.6	162.6	-93.5	115.2	0	0	0	107.6	S677	S677-L679 PolarHBondContact O-N 3.45Å; S677-L679 VanDerWaalsContact O-N 3.08Å
680	S	26.7	Very low	31.2	Very low	79 Å²	79	130 Å²	130	55%	0.552	73%	0.731	S	S	*	*			trans	-65.5	143.4	165.1	158	0	0	0	0	109.6	E682	S680-E682 PolarHBondContact O-N 3.11Å; S680-E682 WeakPolarHBondContact OG-CG 3.23Å
681	W	32.9	Very low	30.4	Very low	134 Å²	134	129.9 Å²	129.9	51%	0.508	74%	0.743	S	S	.	*	S	Bend	trans	-61.6	8.6	179.5	-93.7	103.8	0	0	0	116.8	W657 S683 E785	W657-W681 HydrophobicContact CE3-CZ2 4.45Å; W657-W681 HydrophobicContact CH2-CH2 4.12Å; W657-W681 AromaticContact CH2-CZ2 3.61Å; W657-W681 HydrophobicContact CH2-CZ2 3.61Å; W657-W681 AromaticContact CZ2-CH2 3.92Å; W657-W681 HydrophobicContact CZ2-CH2 3.92Å; W657-W681 AromaticContact CZ2-CZ2 3.89Å; W657-W681 HydrophobicContact CZ2-CZ2 3.89Å; W657-W681 AromaticContact CZ3-CZ2 3.93Å; W657-W681 HydrophobicContact CZ3-CZ2 3.93Å; W681-S683 PolarHBondContact O-N 3.37Å; W681-E785 VanDerWaalsContact NE1-CD 3.26Å; W681-E785 PolarHBondContact NE1-OE1 2.86Å; W681-E785 PolarHBondContact NE1-OE2 3.36Å
682	E	25.5	Very low	29.7	Very low	164 Å²	164	134.7 Å²	134.7	77%	0.766	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-1.6	-172.9	-76.7	178.8	165.6	0	0	115.8	S680	S680-E682 PolarHBondContact O-N 3.11Å; S680-E682 WeakPolarHBondContact OG-CG 3.23Å
683	S	24.8	Very low	29.4	Very low	95 Å²	95	139.7 Å²	139.7	66%	0.664	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-0.2	-174.9	-163	0	0	0	0	116.3	W681	W681-S683 PolarHBondContact O-N 3.37Å
684	F	30	Very low	28.9	Very low	182 Å²	182	139.2 Å²	139.2	80%	0.798	77%	0.767	S	S	*	*			trans	-137.7	28.7	179.3	-79.2	-77.4	0	0	0	115.2	F686	F684-F686 PolarHBondContact O-N 3.19Å
685	S	23.5	Very low	28.3	Very low	94 Å²	94	141.4 Å²	141.4	66%	0.657	77%	0.773	S	S	*	*			trans	-69.4	115.4	160.6	59.5	0	0	0	0	109.4	V687	S685-V687 PolarHBondContact O-N 3.2Å
686	F	26.4	Very low	28.1	Very low	202 Å²	202	139.2 Å²	139.2	89%	0.886	77%	0.767	S	S	*	*			trans	-52.1	128.1	157.5	-106	-100.9	0	0	0	108.2	F684 D688	F684-F686 PolarHBondContact O-N 3.19Å; F686-D688 PolarHBondContact O-N 3.24Å
687	V	24.7	Very low	27.5	Very low	124 Å²	124	144.2 Å²	144.2	75%	0.752	76%	0.764	S	S	*	*			trans	-68.2	98.1	174.7	179.2	0	0	0	0	108.2	S685 E689	S685-V687 PolarHBondContact O-N 3.2Å; V687-E689 HydrophobicContact CG1-CG 4.29Å
688	D	25.7	Very low	27.3	Very low	141 Å²	141	144.2 Å²	144.2	75%	0.754	77%	0.769	S	S	*	*			trans	-96.6	107.4	152.5	-91.5	-25.4	0	0	0	107.4	F686 E690	F686-D688 PolarHBondContact O-N 3.24Å; D688-E690 PolarHBondContact O-N 2.93Å
689	E	31.9	Very low	26.9	Very low	156 Å²	156	140.4 Å²	140.4	73%	0.729	76%	0.764	S	S	*	*			trans	-73.2	100.3	166.5	-82.5	-164.8	155.8	0	0	109	V687	V687-E689 HydrophobicContact CG1-CG 4.29Å
690	E	28.8	Very low	26.3	Very low	168 Å²	168	138.6 Å²	138.6	79%	0.785	76%	0.763	S	S	*	*			trans	-141.5	128.3	146	-70	-161.2	164.6	0	0	109.5	K105 D688	K105-E690 IonicContact NZ-OE1 2.73Å; D688-E690 PolarHBondContact O-N 2.93Å
691	G	29.3	Very low	26.5	Very low	80 Å²	80	140.1 Å²	140.1	83%	0.825	77%	0.771	S	S	*	*			trans	-88.6	159.9	-166.6	0	0	0	0	0	115.1
692	E	26.3	Very low	26.1	Very low	196 Å²	196	139.9 Å²	139.9	92%	0.916	78%	0.784	S	S	*	*			trans	-110	125.8	166.3	-81	-171.5	152.8	0	0	111.2
693	E	27.9	Very low	25.9	Very low	198 Å²	198	139.3 Å²	139.3	93%	0.925	78%	0.781	S	S	*	*			trans	-64.4	135	157.3	-68.4	179.1	148.8	0	0	109.2
694	S	24.8	Very low	25.8	Very low	122 Å²	122	142.9 Å²	142.9	85%	0.853	79%	0.788	S	S	*	*			trans	-129.5	127.5	159.9	56.4	0	0	0	0	110.4
695	S	23.8	Very low	25.5	Very low	109 Å²	109	137.7 Å²	137.7	76%	0.762	79%	0.785	S	S	*	*			trans	-93.9	133.5	177.2	53.4	0	0	0	0	111.4
696	D	25	Very low	25.5	Very low	142 Å²	142	138.9 Å²	138.9	76%	0.759	79%	0.792	S	S	*	*			trans	88.7	128.5	131.3	-88.4	3.7	0	0	0	124.7
697	K	26.2	Very low	25.4	Very low	194 Å²	194	137.2 Å²	137.2	84%	0.843	79%	0.793	S	S	*	*			trans	86.1	135.1	151.7	-67.1	171.4	-174.2	179.1	0	117.8
698	A	23.6	Very low	25.4	Very low	87 Å²	87	135 Å²	135	72%	0.719	80%	0.795	S	S	*	*			cis	-159.3	151.6	-1.6	0	0	0	0	0	106.5
699	V	24	Very low	25.7	Very low	141 Å²	141	133.8 Å²	133.8	86%	0.855	80%	0.795	S	S	*	*				-178.1	140.6	92.5	162.4	0	0	0	0	108.6
700	S	20.7	Very low	25.6	Very low	102 Å²	102	133.9 Å²	133.9	71%	0.713	80%	0.799	S	S	*	*			trans	-74.8	-172	-178.6	52.7	0	0	0	0	116
701	P	30.5	Very low	25.8	Very low	111 Å²	111	131.9 Å²	131.9	72%	0.721	80%	0.8	S	S	*	*			cis	-130.6	177.3	-25.2	22	2	0	0	0	113.3
702	V	23.9	Very low	25.7	Very low	129 Å²	129	132.3 Å²	132.3	78%	0.782	80%	0.796	S	S	*	*				165.1	116.6	127.1	164.3	0	0	0	0	111.2
703	Q	22	Very low	26	Very low	152 Å²	152	129.1 Å²	129.1	71%	0.71	79%	0.792	S	S	*	*			trans	2.6	152	141.9	-95.6	169.1	-47.4	0	0	119.5
704	E	23.4	Very low	25.7	Very low	170 Å²	170	122.9 Å²	122.9	79%	0.794	78%	0.782	S	S	*	*			cis	-180	164	9.2	-143.1	160.6	-141	0	0	106.7
705	G	24.1	Very low	26.1	Very low	73 Å²	73	122.7 Å²	122.7	75%	0.753	78%	0.777	S	S	*	*			trans	123.3	87.4	146.1	0	0	0	0	0	121.7
706	C	22.4	Very low	26	Very low	119 Å²	119	126.5 Å²	126.5	80%	0.804	78%	0.783	S	S	*	*			trans	25.9	125.4	135.3	-75.6	0	0	0	0	125.2
707	N	24.6	Very low	26	Very low	167 Å²	167	128.3 Å²	128.3	89%	0.893	79%	0.787	S	S	*	*				39.2	133.1	121.9	-63.9	-16.1	0	0	0	123.5
708	G	24.9	Very low	26.4	Very low	77 Å²	77	124.7 Å²	124.7	79%	0.794	78%	0.783	S	S	*	*			trans	178.3	135.4	153	0	0	0	0	0	114.9
709	P	32.1	Very low	26.4	Very low	117 Å²	117	124.9 Å²	124.9	76%	0.76	78%	0.784	S	S	*	*			trans	-113.2	157.7	-169.1	38.1	-26	0	0	0	117.4
710	I	29	Very low	26.5	Very low	158 Å²	158	123.8 Å²	123.8	81%	0.81	78%	0.779	S	S	*	*			trans	38.3	131.6	142.2	-55.6	173.7	0	0	0	119.1
711	P	32.7	Very low	26.6	Very low	125 Å²	125	125.2 Å²	125.2	81%	0.812	78%	0.778	S	S	*	*				-153.8	166.8	81.2	36	-11.8	0	0	0	120
712	A	27.9	Very low	26.5	Very low	89 Å²	89	128.4 Å²	128.4	74%	0.736	78%	0.783	S	S	*	*			trans	-78.7	170.1	173.8	0	0	0	0	0	113.1
713	P	31.8	Very low	26.4	Very low	129 Å²	129	128.6 Å²	128.6	84%	0.838	79%	0.785	S	S	*	*				-149.4	168.4	93.4	34	-13.6	0	0	0	116.3
714	G	22.1	Very low	26.5	Very low	68 Å²	68	124.9 Å²	124.9	70%	0.701	79%	0.787	S	S	*	*			trans	-72.1	-170.4	172	0	0	0	0	0	114.1
715	P	32.4	Very low	26.5	Very low	117 Å²	117	122.6 Å²	122.6	76%	0.76	79%	0.79	S	S	*	*				-150.9	170.2	52.8	38	-15.7	0	0	0	119.1
716	Q	23.6	Very low	26.4	Very low	189 Å²	189	127.2 Å²	127.2	88%	0.883	80%	0.797	S	S	*	*			trans	74.5	127.6	139.3	-77	167.3	-1.7	0	0	124.9
717	E	23.9	Very low	26.6	Very low	181 Å²	181	130.6 Å²	130.6	85%	0.846	80%	0.798	S	S	*	*			trans	-60.8	-179.2	162.5	-75.3	-174.2	160.5	0	0	114.1
718	P	35.2	Very low	26.6	Very low	118 Å²	118	134.3 Å²	134.3	77%	0.766	80%	0.8	S	S	*	*			cis	-146.8	176.9	21.8	39.4	-16.7	0	0	0	118.2
719	A	23.8	Very low	26.8	Very low	90 Å²	90	140.3 Å²	140.3	74%	0.744	80%	0.804	S	S	*	*				163.7	104.6	128.6	0	0	0	0	0	114.9
720	T	24.9	Very low	26.8	Very low	119 Å²	119	143.2 Å²	143.2	73%	0.73	81%	0.812	S	S	*	*			trans	23	131.3	131.7	50.9	0	0	0	0	124.8
721	N	23.7	Very low	26.8	Very low	132 Å²	132	140.4 Å²	140.4	71%	0.706	81%	0.807	S	S	*	*				75.8	120.8	129.5	-60.9	-11.5	0	0	0	121.4
722	H	27.5	Very low	26.8	Very low	178 Å²	178	139.2 Å²	139.2	82%	0.824	80%	0.801	S	S	*	*				-172.3	122.4	104.2	-90.1	-67	0	0	0	113.7
723	T	23.1	Very low	27	Very low	133 Å²	133	140.8 Å²	140.8	82%	0.816	80%	0.801	S	S	*	*			trans	-9.2	142.3	149.3	46.8	0	0	0	0	122.2
724	G	23	Very low	27	Very low	74 Å²	74	144.5 Å²	144.5	76%	0.763	80%	0.799	S	S	*	*				146	93.3	129.5	0	0	0	0	0	121
725	S	23.1	Very low	27.4	Very low	121 Å²	121	150.8 Å²	150.8	85%	0.846	80%	0.801	S	S	*	*			trans	63.9	98.2	139.4	-173.2	0	0	0	0	121.7
726	D	23.4	Very low	27.4	Very low	170 Å²	170	150.1 Å²	150.1	91%	0.909	80%	0.795	S	S	*	*			trans	-87.8	119.7	164.4	-103.2	-34.6	0	0	0	112.6
727	K	25.4	Very low	27.8	Very low	190 Å²	190	146.5 Å²	146.5	83%	0.826	78%	0.781	S	S	*	*			trans	-144.8	127.9	155.8	-89	-170.6	-177.5	174.2	0	110.9
728	R	24.6	Very low	28	Very low	246 Å²	246	144.8 Å²	144.8	93%	0.928	77%	0.773	S	S	*	*			trans	106.7	86.6	158.1	-64.5	178.8	177	170.6	-0.4	117.4
729	K	30	Very low	27.8	Very low	202 Å²	202	150 Å²	150	88%	0.878	78%	0.777	S	S	*	*			trans	-75.1	117.4	143.2	-72.7	176.2	176.3	176.6	0	109
730	L	31.7	Very low	28	Very low	178 Å²	178	151.9 Å²	151.9	93%	0.932	77%	0.774	S	S	*	*			trans	167.3	78.6	149.9	-106.5	135.9	0	0	0	110.8
731	S	28.1	Very low	28.4	Very low	100 Å²	100	155 Å²	155	70%	0.699	78%	0.778	S	S	*	*			trans	-157.9	5.4	166.3	61.3	0	0	0	0	116.3
732	S	33.6	Very low	28.4	Very low	100 Å²	100	153.5 Å²	153.5	70%	0.699	78%	0.778	S	S	*	*	S	Bend	trans	-95.5	-9.1	-174.7	-173.2	0	0	0	0	115.7
733	V	33.1	Very low	28.2	Very low	121 Å²	121	151.1 Å²	151.1	73%	0.733	78%	0.782	S	S	*	*	S	Bend	trans	-94.1	-13.8	-176.4	-178.5	0	0	0	0	112.9
734	R	29.9	Very low	28.3	Very low	208 Å²	208	150 Å²	150	79%	0.785	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-17.7	-176.2	-157.4	172.8	-178.3	177.5	0.2	114.3
735	R	31.6	Very low	28.4	Very low	200 Å²	200	152 Å²	152	76%	0.755	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-21.4	-179.6	-75.9	-176.8	-173.4	161.7	2.2	114.1
736	T	33	Very low	28.5	Very low	102 Å²	102	151.9 Å²	151.9	63%	0.626	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-27.6	-179	-33.6	0	0	0	0	112.3
737	L	30.9	Very low	28.6	Very low	114 Å²	114	149.8 Å²	149.8	60%	0.597	78%	0.779	S	S	*	*	S	Bend	trans	-83	-16.3	179.8	-92.1	154.6	0	0	0	114.4
738	Q	29.4	Very low	28.5	Very low	145 Å²	145	144.5 Å²	144.5	68%	0.678	78%	0.778	S	S	*	*	S	Bend	trans	-87.9	-9.6	-179.4	-113.8	171	-20	0	0	114.1
739	R	30.1	Very low	28.5	Very low	226 Å²	226	142.2 Å²	142.2	85%	0.853	78%	0.779	S	S	*	*	S	Bend	trans	-91.8	-5.7	175.9	-73.1	-176.2	-179	168.9	-1.3	114.1
740	L	28.9	Very low	28.3	Very low	130 Å²	130	139.2 Å²	139.2	68%	0.681	78%	0.777	S	S	*	*	S	Bend	trans	-90	-7.5	-178.9	-84.2	160	0	0	0	114
741	F	31.5	Very low	28.1	Very low	185 Å²	185	139.7 Å²	139.7	81%	0.811	77%	0.774	S	S	*	*	S	Bend	trans	-135.5	49.3	-172.7	-71.3	-72.7	0	0	0	114.3
742	S	24.9	Very low	28	Very low	100 Å²	100	141.2 Å²	141.2	70%	0.699	78%	0.78	S	S	*	*			trans	-159.5	99.1	167.2	52.2	0	0	0	0	112.1
743	S	23.7	Very low	27.9	Very low	129 Å²	129	145.2 Å²	145.2	90%	0.902	79%	0.787	S	S	*	*			trans	-130	101.3	159.3	64.5	0	0	0	0	109
744	S	25.4	Very low	27.6	Very low	109 Å²	109	147.9 Å²	147.9	76%	0.762	79%	0.792	S	S	*	*			trans	-124.9	118.1	163.9	55.5	0	0	0	0	108.8
745	S	25.2	Very low	27.6	Very low	117 Å²	117	145.6 Å²	145.6	82%	0.818	80%	0.795	S	S	*	*			trans	16.1	123	149.9	59.1	0	0	0	0	119.8
746	S	24.3	Very low	27.4	Very low	118 Å²	118	141.8 Å²	141.8	83%	0.825	79%	0.794	S	S	*	*				-158.3	130.4	129.3	68.6	0	0	0	0	111.5
747	S	25.3	Very low	27.6	Very low	126 Å²	126	142 Å²	142	88%	0.881	80%	0.797	S	S	*	*			trans	-60	143.4	169.7	48.2	0	0	0	0	113.8
748	G	23.6	Very low	27.9	Very low	78 Å²	78	141.8 Å²	141.8	80%	0.804	80%	0.803	S	S	*	*			trans	-163.4	105.9	161.8	0	0	0	0	0	109.5
749	Q	25.2	Very low	28.4	Very low	199 Å²	199	139.8 Å²	139.8	93%	0.93	80%	0.802	S	S	*	*			trans	-72.2	136	173.1	-70.3	170.7	-38.6	0	0	110
750	T	24.3	Very low	29.3	Very low	138 Å²	138	135.7 Å²	135.7	85%	0.847	80%	0.796	S	S	*	*			trans	-147.5	119.7	144.7	-35.9	0	0	0	0	108.2
751	E	28	Very low	30.2	Very low	188 Å²	188	134.4 Å²	134.4	88%	0.879	79%	0.794	S	S	*	*			trans	-69.2	130	176.9	-67.1	171.5	150.2	0	0	110.4
752	T	25.5	Very low	31.2	Very low	132 Å²	132	128.1 Å²	128.1	81%	0.81	77%	0.769	S	S	*	*			trans	-148.5	122.2	151.6	-33.6	0	0	0	0	108.1	E754	T752-E754 PolarHBondContact O-N 3.34Å
753	Q	31.1	Very low	32.7	Very low	184 Å²	184	128.2 Å²	128.2	86%	0.86	77%	0.766	S	S	*	*			trans	-79.8	107.6	-172.2	-171.4	172.3	2.2	0	0	108.6
754	E	27.8	Very low	34.5	Very low	178 Å²	178	124 Å²	124	83%	0.832	73%	0.732	S	S	*	*			trans	-110.6	120.9	169.5	-87.1	-174.6	158	0	0	109.6	T752 V756	T752-E754 PolarHBondContact O-N 3.34Å; E754-V756 PolarHBondContact O-N 2.9Å
755	D	28.9	Very low	36.8	Very low	159 Å²	159	120.9 Å²	120.9	85%	0.85	71%	0.71	S	S	*	*			trans	-65.2	107.3	179.8	-79.1	-42	0	0	0	111.1
756	V	27.9	Very low	39.1	Very low	120 Å²	120	120.2 Å²	120.2	73%	0.727	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-73	129.1	168.3	177.9	0	0	0	0	108.1	E754	E754-V756 PolarHBondContact O-N 2.9Å
757	P	37.2	Very low	41.4	Very low	108 Å²	108	122.4 Å²	122.4	70%	0.701	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-59.4	135.7	168.7	25.1	-30.9	0	0	0	108.1
758	P	36.9	Very low	43.9	Very low	109 Å²	109	120.7 Å²	120.7	71%	0.708	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-58.5	142	-167.8	23.3	-32.4	0	0	0	110.1	L760	P758-L760 PolarHBondContact O-N 3.5Å; P758-L760 VanDerWaalsContact O-N 3.15Å
759	P	40.3	Very low	46.5	Very low	102 Å²	102	118.6 Å²	118.6	66%	0.662	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-55.3	127.4	169.2	25	-31.2	0	0	0	106.6	T761	P759-T761 PolarHBondContact O-N 3.1Å
760	L	48.4	Very low	49.1	Very low	140 Å²	140	115.7 Å²	115.7	73%	0.733	63%	0.633	S	S	*	*			trans	-58.1	95.9	174	-70.5	161.6	0	0	0	107.1	V665 P758 D762	V665-L760 HydrophobicContact CG1-CB 3.98Å; V665-L760 HydrophobicContact CG1-CD1 3.82Å; V665-L760 HydrophobicContact CG1-CD2 3.6Å; V665-L760 HydrophobicContact CG1-CG 3.95Å; V665-L760 HydrophobicContact CG2-CB 4.32Å; P758-L760 PolarHBondContact O-N 3.5Å; P758-L760 VanDerWaalsContact O-N 3.15Å; L760-D762 PolarHBondContact O-N 3.28Å
761	T	48.2	Very low	51.7	Low	104 Å²	104	111.8 Å²	111.8	64%	0.638	62%	0.615	S	S	*	*			trans	-76.5	112	178.6	30.8	0	0	0	0	106.6	P759 T763	P759-T761 PolarHBondContact O-N 3.1Å; T761-T763 PolarHBondContact O-N 3.38Å
762	D	52.7	Low	54.4	Low	53 Å²	53	104.2 Å²	104.2	28%	0.283	58%	0.578	S	S	.	*			trans	-58.4	102.2	168	-160.8	-10.5	0	0	0	106.9	R664 L760 M764	R664-D762 IonicContact CZ-OD2 2.6Å; R664-D762 IonicContact NE-OD2 2.64Å; R664-D762 PolarHBondContact NE-OD2 3.1Å; R664-D762 IonicContact NH2-OD2 3.4Å; R664-D762 PolarHBondContact NH2-OD2 3.02Å; L760-D762 PolarHBondContact O-N 3.28Å; D762-M764 PolarHBondContact O-N 3.29Å
763	T	56	Low	57.2	Low	102 Å²	102	100.9 Å²	100.9	63%	0.626	55%	0.553	S	S	*	*			trans	-84.9	-0.1	-172.7	38	0	0	0	0	112.1	R668 T761	R668-T763 PolarHBondContact NH1-OG1 3.38Å; T761-T763 PolarHBondContact O-N 3.38Å
764	M	62.5	Low	59.6	Low	41 Å²	41	97.8 Å²	97.8	20%	0.202	54%	0.539	C	S	.	.			trans	-75.9	139.8	179.6	-74.6	-177.9	131.4	0	0	111.7	D762 E768 I769 W772	D762-M764 PolarHBondContact O-N 3.29Å; M764-E768 WeakPolarHBondContact CA-OE2 3.41Å; M764-E768 HydrophobicContact CB-CB 4.01Å; M764-E768 HydrophobicContact CE-CB 4.31Å; M764-E768 HydrophobicContact CG-CB 4.25Å; M764-I769 HydrophobicContact CB-CD1 4.33Å; M764-I769 HydrophobicContact CB-CG1 3.64Å; M764-W772 HydrophobicContact CE-CB 4.28Å
765	S	72.9	Confident	62.3	Low	42 Å²	42	95.6 Å²	95.6	29%	0.294	53%	0.529	S	S	.	.			trans	-66	154.8	168.1	69.8	0	0	0	0	110.4	E767 E768 I769	S765-E767 PolarHBondContact O-N 3Å; S765-E768 PolarHBondContact N-OE2 3.42Å; S765-E768 WeakPolarHBondContact O-CB 3.37Å; S765-E768 PolarHBondContact O-N 3.4Å; S765-E768 VanDerWaalsContact OG-CG 3.26Å; S765-E768 WeakPolarHBondContact OG-CG 2.99Å; S765-E768 PolarHBondContact OG-N 3.43Å; S765-E768 PolarHBondContact OG-OE1 2.67Å; S765-I769 WeakPolarHBondContact O-CG1 3.42Å; S765-I769 PolarHBondContact O-N 3.42Å
766	P	73.6	Confident	65	Low	104 Å²	104	88.2 Å²	88.2	68%	0.675	49%	0.489	S	S	*	.	H	α-helix	trans	-58.5	-21.4	178.7	-23.6	33	0	0	0	114.2	K770	P766-K770 PolarHBondContact O-N 3.12Å
767	E	73.3	Confident	67.8	Low	164 Å²	164	83.5 Å²	83.5	77%	0.766	46%	0.46	S	S	*	.	H	α-helix	trans	-81.1	-38.7	176.4	-62.1	-175.2	173.5	0	0	111.1	S765 K770 A771	S765-E767 PolarHBondContact O-N 3Å; E767-K770 PolarHBondContact O-N 2.89Å; E767-A771 PolarHBondContact O-N 3.49Å
768	E	77.5	Confident	70.2	Confident	90 Å²	90	82.7 Å²	82.7	42%	0.421	45%	0.449	S	S	.	.	H	α-helix	trans	-65.9	-37.8	172.5	-74.9	157.1	-136.9	0	0	112.5	M764 S765 K770 A771 W772	M764-E768 WeakPolarHBondContact CA-OE2 3.41Å; M764-E768 HydrophobicContact CB-CB 4.01Å; M764-E768 HydrophobicContact CE-CB 4.31Å; M764-E768 HydrophobicContact CG-CB 4.25Å; S765-E768 PolarHBondContact N-OE2 3.42Å; S765-E768 WeakPolarHBondContact O-CB 3.37Å; S765-E768 PolarHBondContact O-N 3.4Å; S765-E768 VanDerWaalsContact OG-CG 3.26Å; S765-E768 WeakPolarHBondContact OG-CG 2.99Å; S765-E768 PolarHBondContact OG-N 3.43Å; S765-E768 PolarHBondContact OG-OE1 2.67Å; E768-K770 VanDerWaalsContact C-N 3.34Å; E768-A771 PolarHBondContact O-N 2.99Å; E768-W772 WeakPolarHBondContact O-CB 3.18Å; E768-W772 PolarHBondContact O-N 3.3Å
769	I	78.1	Confident	72.6	Confident	33 Å²	33	81.2 Å²	81.2	17%	0.169	43%	0.432	C	S	.	.	H	α-helix	trans	-61.6	-45.7	175.5	-65.1	171.4	0	0	0	109.9	M764 S765 A771 W772 E773	M764-I769 HydrophobicContact CB-CD1 4.33Å; M764-I769 HydrophobicContact CB-CG1 3.64Å; S765-I769 WeakPolarHBondContact O-CG1 3.42Å; S765-I769 PolarHBondContact O-N 3.42Å; I769-A771 PolarHBondContact O-N 3.24Å; I769-W772 PolarHBondContact O-N 3.29Å; I769-E773 HydrophobicContact CG2-CG 4.24Å; I769-E773 WeakPolarHBondContact CG2-OE1 3.41Å; I769-E773 WeakPolarHBondContact O-CB 3.23Å; I769-E773 VanDerWaalsContact O-CG 3.24Å; I769-E773 WeakPolarHBondContact O-CG 3.28Å; I769-E773 PolarHBondContact O-N 3.4Å
770	K	79	Confident	74.8	Confident	138 Å²	138	80.8 Å²	80.8	60%	0.6	43%	0.429	S	S	*	.	H	α-helix	trans	-63.8	-41	177.7	-80.2	-175.7	175.6	-174.2	0	112.9	P766 E767 E768 E773 E774	P766-K770 PolarHBondContact O-N 3.12Å; E767-K770 PolarHBondContact O-N 2.89Å; E768-K770 VanDerWaalsContact C-N 3.34Å; K770-E773 PolarHBondContact O-N 3.07Å; K770-E774 WeakPolarHBondContact O-CB 3.41Å; K770-E774 WeakPolarHBondContact O-CG 3.43Å; K770-E774 PolarHBondContact O-N 3.14Å
771	A	80.8	Confident	76.5	Confident	57 Å²	57	74.4 Å²	74.4	47%	0.471	40%	0.396	S	S	.	.	H	α-helix	trans	-64.4	-42.2	177.5	0	0	0	0	0	111.4	E767 E768 I769 E774 E775	E767-A771 PolarHBondContact O-N 3.49Å; E768-A771 PolarHBondContact O-N 2.99Å; I769-A771 PolarHBondContact O-N 3.24Å; A771-E774 PolarHBondContact O-N 3.16Å; A771-E775 PolarHBondContact O-N 3.19Å; A771-E775 VanDerWaalsContact O-N 3.08Å
772	W	83.6	Confident	78.1	Confident	29 Å²	29	73.1 Å²	73.1	11%	0.11	39%	0.385	C	S	.	.	H	α-helix	trans	-64.5	-45	174.5	178.5	84.6	0	0	0	112	R664 M764 E768 I769 E774 E775 E776	R664-W772 HydrophobicContact CB-CH2 4.48Å; R664-W772 HydrophobicContact CB-CZ2 4.45Å; R664-W772 VanDerWaalsContact CD-CE3 3.49Å; R664-W772 HydrophobicContact CG-CD2 3.81Å; R664-W772 HydrophobicContact CG-CE3 3.57Å; R664-W772 HydrophobicContact CG-CH2 3.3Å; R664-W772 HydrophobicContact CG-CZ2 3.54Å; R664-W772 HydrophobicContact CG-CZ3 3.32Å; M764-W772 HydrophobicContact CE-CB 4.28Å; E768-W772 WeakPolarHBondContact O-CB 3.18Å; E768-W772 PolarHBondContact O-N 3.3Å; I769-W772 PolarHBondContact O-N 3.29Å; W772-E774 VanDerWaalsContact C-N 3.3Å; W772-E774 PolarHBondContact O-N 3.38Å; W772-E775 PolarHBondContact O-N 3.06Å; W772-E776 HydrophobicContact CD2-CG 3.8Å; W772-E776 VanDerWaalsContact CE2-CG 3.42Å; W772-E776 HydrophobicContact CE3-CG 4.08Å; W772-E776 HydrophobicContact CG-CG 4.47Å; W772-E776 HydrophobicContact CH2-CG 3.73Å; W772-E776 HydrophobicContact CZ2-CG 3.41Å; W772-E776 VanDerWaalsContact CZ2-CG 3.41Å; W772-E776 HydrophobicContact CZ3-CG 4.04Å; W772-E776 WeakPolarHBondContact O-CB 3.39Å; W772-E776 WeakPolarHBondContact O-CG 3.44Å; W772-E776 PolarHBondContact O-N 3.39Å
773	E	83.6	Confident	79.4	Confident	61 Å²	61	71.4 Å²	71.4	29%	0.285	38%	0.376	S	S	.	.	H	α-helix	trans	-60.4	-40.5	175.8	-73.2	175.6	174.1	0	0	111.3	L659 R664 I769 K770 E776 L777	L659-E773 HydrophobicContact CD2-CB 4.22Å; L659-E773 HydrophobicContact CD2-CG 4.06Å; R664-E773 IonicContact NH1-OE1 3.92Å; I769-E773 HydrophobicContact CG2-CG 4.24Å; I769-E773 WeakPolarHBondContact CG2-OE1 3.41Å; I769-E773 WeakPolarHBondContact O-CB 3.23Å; I769-E773 VanDerWaalsContact O-CG 3.24Å; I769-E773 WeakPolarHBondContact O-CG 3.28Å; I769-E773 PolarHBondContact O-N 3.4Å; K770-E773 PolarHBondContact O-N 3.07Å; E773-E776 PolarHBondContact O-N 3.06Å; E773-L777 WeakPolarHBondContact O-CB 3.31Å; E773-L777 WeakPolarHBondContact O-CD1 3.35Å; E773-L777 WeakPolarHBondContact O-CG 3.32Å; E773-L777 PolarHBondContact O-N 2.7Å
774	E	83.4	Confident	80.2	Confident	119 Å²	119	75.3 Å²	75.3	56%	0.556	39%	0.386	S	S	*	.	H	α-helix	trans	-63.9	-38.7	176.3	-79.8	-177.3	178.2	0	0	112.7	R617 K770 A771 W772	R617-E774 PolarHBondContact NH2-O 3.39Å; K770-E774 WeakPolarHBondContact O-CB 3.41Å; K770-E774 WeakPolarHBondContact O-CG 3.43Å; K770-E774 PolarHBondContact O-N 3.14Å; A771-E774 PolarHBondContact O-N 3.16Å; W772-E774 VanDerWaalsContact C-N 3.3Å; W772-E774 PolarHBondContact O-N 3.38Å
775	E	84.3	Confident	80.6	Confident	133 Å²	133	78.8 Å²	78.8	62%	0.621	40%	0.402	S	S	*	.	H	α-helix	trans	-70.4	-42.9	176.4	-171.7	174.6	-174.8	0	0	112	A771 W772 L777 D778	A771-E775 PolarHBondContact O-N 3.19Å; A771-E775 VanDerWaalsContact O-N 3.08Å; W772-E775 PolarHBondContact O-N 3.06Å; E775-L777 VanDerWaalsContact C-N 3.32Å; E775-L777 PolarHBondContact O-N 2.82Å; E775-D778 PolarHBondContact O-N 3.19Å
776	E	84.8	Confident	81.1	Confident	4 Å²	4	77.5 Å²	77.5	2%	0.019	39%	0.392	C	S	.	.	H	α-helix	trans	-66.3	-33.2	177.8	-75.1	-56.8	113.5	0	0	113.1	W658 R663 W772 E773 D778 K779	W658-E776 PolarHBondContact NE1-OE2 2.61Å; R663-E776 IonicContact CZ-OE2 2.92Å; R663-E776 IonicContact NH1-OE2 3.45Å; R663-E776 PolarHBondContact NH1-OE2 2.98Å; R663-E776 IonicContact NH2-OE2 3.2Å; R663-E776 PolarHBondContact NH2-OE2 3.49Å; W772-E776 HydrophobicContact CD2-CG 3.8Å; W772-E776 VanDerWaalsContact CE2-CG 3.42Å; W772-E776 HydrophobicContact CE3-CG 4.08Å; W772-E776 HydrophobicContact CG-CG 4.47Å; W772-E776 HydrophobicContact CH2-CG 3.73Å; W772-E776 HydrophobicContact CZ2-CG 3.41Å; W772-E776 VanDerWaalsContact CZ2-CG 3.41Å; W772-E776 HydrophobicContact CZ3-CG 4.04Å; W772-E776 WeakPolarHBondContact O-CB 3.39Å; W772-E776 WeakPolarHBondContact O-CG 3.44Å; W772-E776 PolarHBondContact O-N 3.39Å; E773-E776 PolarHBondContact O-N 3.06Å; E776-D778 PolarHBondContact O-N 3.43Å; E776-K779 WeakPolarHBondContact O-CB 3.33Å; E776-K779 PolarHBondContact O-N 3.16Å; E776-K779 WeakPolarHBondContact OE1-CE 3.46Å; E776-K779 IonicContact OE1-NZ 3.93Å; E776-K779 PolarHBondContact OE1-NZ 3.35Å; E776-K779 IonicContact OE2-NZ 3.39Å; E776-K779 PolarHBondContact OE2-NZ 3.28Å
777	L	87	Confident	81.5	Confident	21 Å²	21	80.5 Å²	80.5	11%	0.11	39%	0.39	C	S	.	.	H	α-helix	trans	-65.4	-24.1	177.6	-77.4	170.1	0	0	0	112.3	F616 R617 N620 L655 L659 E773 E775 K779	F616-L777 CarbonylContact C-O 3.59Å; F616-L777 HydrophobicContact CB-CD2 4.02Å; F616-L777 PolarHBondContact N-O 3.47Å; R617-L777 HydrophobicContact CB-CB 4.14Å; R617-L777 WeakPolarHBondContact CB-O 3.48Å; R617-L777 PolarHBondContact N-O 2.95Å; N620-L777 HydrophobicContact CB-CD2 4.37Å; L655-L777 HydrophobicContact CD1-CD2 4.22Å; L659-L777 HydrophobicContact CD1-CD2 4.39Å; L659-L777 HydrophobicContact CD2-CD2 4.41Å; L659-L777 HydrophobicContact CD2-CG 4.37Å; E773-L777 WeakPolarHBondContact O-CB 3.31Å; E773-L777 WeakPolarHBondContact O-CD1 3.35Å; E773-L777 WeakPolarHBondContact O-CG 3.32Å; E773-L777 PolarHBondContact O-N 2.7Å; E775-L777 VanDerWaalsContact C-N 3.32Å; E775-L777 PolarHBondContact O-N 2.82Å; L777-K779 VanDerWaalsContact C-N 3.31Å
778	D	87.1	Confident	82	Confident	90 Å²	90	75.7 Å²	75.7	48%	0.481	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-7	179.7	-71.6	-35.8	0	0	0	113.6	T615 R617 E775 E776	T615-D778 WeakPolarHBondContact CG2-O 3.37Å; R617-D778 IonicContact CZ-OD1 3.34Å; R617-D778 IonicContact CZ-OD2 3.81Å; R617-D778 IonicContact NE-OD1 2.71Å; R617-D778 PolarHBondContact NE-OD1 2.91Å; R617-D778 IonicContact NE-OD2 3.92Å; R617-D778 VanDerWaalsContact NH2-CG 3.29Å; R617-D778 IonicContact NH2-OD1 3.11Å; R617-D778 PolarHBondContact NH2-OD1 3.11Å; R617-D778 VanDerWaalsContact NH2-OD1 3.11Å; R617-D778 IonicContact NH2-OD2 2.86Å; R617-D778 PolarHBondContact NH2-OD2 3.44Å; E775-D778 PolarHBondContact O-N 3.19Å; E776-D778 PolarHBondContact O-N 3.43Å
779	K	86.8	Confident	82.3	Confident	78 Å²	78	75.1 Å²	75.1	34%	0.339	37%	0.369	S	S	.	.	S	Bend	trans	-72.4	148.1	174.2	-66.5	-179.1	177.8	174.2	0	111.7	T615 F616 W658 E776 L777	T615-K779 VanDerWaalsContact CA-O 3.29Å; T615-K779 WeakPolarHBondContact CA-O 3.36Å; T615-K779 WeakPolarHBondContact CB-O 3.48Å; F616-K779 WeakPolarHBondContact CD2-O 3.36Å; F616-K779 PolarHBondContact N-O 2.67Å; F616-K779 VanDerWaalsContact N-O 3.11Å; W658-K779 HydrophobicContact CZ2-CD 4.27Å; E776-K779 WeakPolarHBondContact O-CB 3.33Å; E776-K779 PolarHBondContact O-N 3.16Å; E776-K779 WeakPolarHBondContact OE1-CE 3.46Å; E776-K779 IonicContact OE1-NZ 3.93Å; E776-K779 PolarHBondContact OE1-NZ 3.35Å; E776-K779 IonicContact OE2-NZ 3.39Å; E776-K779 PolarHBondContact OE2-NZ 3.28Å; L777-K779 VanDerWaalsContact C-N 3.31Å
780	P	86.3	Confident	82.5	Confident	93 Å²	93	78.2 Å²	78.2	60%	0.604	39%	0.391	S	S	*	.	B	Isolated β-bridge	trans	-66.1	146.5	173.8	29.3	-34.4	0	0	0	110.3	F616	F616-P780 WeakPolarHBondContact CE2-O 3.48Å
781	V	85.3	Confident	82.5	Confident	7 Å²	7	73.6 Å²	73.6	4%	0.042	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-76.6	126.1	172.4	-178.9	0	0	0	0	108.5	S614 F616 L619 M783 I786	S614-V781 PolarHBondContact O-N 3.02Å; F616-V781 HydrophobicContact CB-CG2 4.48Å; F616-V781 HydrophobicContact CD1-CG2 3.82Å; F616-V781 HydrophobicContact CD2-CG2 3.94Å; F616-V781 HydrophobicContact CE1-CG1 4.26Å; F616-V781 HydrophobicContact CE1-CG2 3.95Å; F616-V781 HydrophobicContact CE2-CB 4.33Å; F616-V781 HydrophobicContact CE2-CG2 4.05Å; F616-V781 HydrophobicContact CG-CG2 3.82Å; F616-V781 HydrophobicContact CZ-CB 4.26Å; F616-V781 HydrophobicContact CZ-CG1 4.14Å; F616-V781 HydrophobicContact CZ-CG2 4.05Å; L619-V781 HydrophobicContact CD2-CG2 4.29Å; V781-M783 HydrophobicContact CB-CE 3.61Å; V781-M783 HydrophobicContact CB-SD 4.24Å; V781-M783 HydrophobicContact CG1-CE 3.65Å; V781-M783 HydrophobicContact CG1-SD 3.69Å; V781-M783 HydrophobicContact CG2-CE 4.4Å; V781-M783 PolarHBondContact O-N 3.25Å; V781-I786 HydrophobicContact CG1-CD1 4.06Å
782	D	80.6	Confident	82.3	Confident	76 Å²	76	74.8 Å²	74.8	41%	0.406	38%	0.379	S	S	.	.			trans	-75.2	115	170.1	-163.4	-17.4	0	0	0	109.4	E784	D782-E784 PolarHBondContact OD1-N 2.92Å
783	M	80.1	Confident	82.1	Confident	18 Å²	18	76.4 Å²	76.4	9%	0.089	39%	0.387	C	S	.	.			trans	-96.3	-9.5	-177.1	-57.8	-65.7	-176.6	0	0	112.4	L610 L633 V781 E785 I786	L610-M783 HydrophobicContact CD2-CE 3.66Å; L610-M783 HydrophobicContact CD2-SD 4.45Å; L610-M783 HydrophobicContact CG-CE 3.97Å; L633-M783 HydrophobicContact CD1-CE 4.28Å; L633-M783 HydrophobicContact CD1-SD 4.38Å; V781-M783 HydrophobicContact CB-CE 3.61Å; V781-M783 HydrophobicContact CB-SD 4.24Å; V781-M783 HydrophobicContact CG1-CE 3.65Å; V781-M783 HydrophobicContact CG1-SD 3.69Å; V781-M783 HydrophobicContact CG2-CE 4.4Å; V781-M783 PolarHBondContact O-N 3.25Å; M783-E785 PolarHBondContact O-N 2.73Å; M783-I786 PolarHBondContact O-N 2.57Å; M783-I786 HydrophobicContact SD-CD1 4.12Å
784	E	74.4	Confident	82	Confident	183 Å²	183	82.5 Å²	82.5	86%	0.855	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-26	-179.3	-64.4	-172.2	176.7	0	0	111.9	D782	D782-E784 PolarHBondContact OD1-N 2.92Å
785	E	70.9	Confident	82	Confident	114 Å²	114	79.8 Å²	79.8	53%	0.533	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-7.4	-177.5	-59	-179.9	162.1	0	0	113	W681 M783	W681-E785 VanDerWaalsContact NE1-CD 3.26Å; W681-E785 PolarHBondContact NE1-OE1 2.86Å; W681-E785 PolarHBondContact NE1-OE2 3.36Å; M783-E785 PolarHBondContact O-N 2.73Å
786	I	81.8	Confident	82.1	Confident	15 Å²	15	78.4 Å²	78.4	8%	0.077	41%	0.405	C	S	.	.	S	Bend	trans	-99.7	134.6	-177.8	-55.8	175.6	0	0	0	109.4	I646 L651 V654 V781 M783 I788	I646-I786 HydrophobicContact CD1-CG2 4.12Å; I646-I786 HydrophobicContact CG2-CG2 3.81Å; L651-I786 HydrophobicContact CD2-CD1 4.43Å; V654-I786 HydrophobicContact CG1-CD1 4.43Å; V654-I786 HydrophobicContact CG2-CD1 4.48Å; V654-I786 HydrophobicContact CG2-CG1 4.49Å; V781-I786 HydrophobicContact CG1-CD1 4.06Å; M783-I786 PolarHBondContact O-N 2.57Å; M783-I786 HydrophobicContact SD-CD1 4.12Å; I786-I788 PolarHBondContact O-N 3.47Å
787	R	82.4	Confident	82.2	Confident	168 Å²	168	83.3 Å²	83.3	63%	0.634	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-69.3	116.5	176.2	-172.4	177.8	176.8	166.2	4.2	109.9	D789	R787-D789 IonicContact NE-OD1 3.54Å
788	I	84.9	Confident	82.1	Confident	63 Å²	63	91.6 Å²	91.6	32%	0.323	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-103.5	118	177.3	-60.3	161.4	0	0	0	108.9	L633 I646 I786 P790	L633-I788 HydrophobicContact CD2-CD1 3.5Å; L633-I788 VanDerWaalsContact CD2-CD1 3.5Å; L633-I788 HydrophobicContact CD2-CG1 3.93Å; L633-I788 HydrophobicContact CD2-CG2 4.16Å; I646-I788 HydrophobicContact CD1-CG1 4.26Å; I646-I788 HydrophobicContact CG1-CG1 4.3Å; I786-I788 PolarHBondContact O-N 3.47Å; I788-P790 WeakPolarHBondContact O-CD 3.34Å
789	D	82.1	Confident	81.9	Confident	78 Å²	78	88.6 Å²	88.6	42%	0.417	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	119.9	172.7	-72.2	-31.8	0	0	0	109.8	G644 S645 R787	G644-D789 CarbonylContact C-O 3.59Å; G644-D789 WeakPolarHBondContact CA-O 3.19Å; S645-D789 PolarHBondContact N-O 3.08Å; S645-D789 PolarHBondContact O-N 3.21Å; S645-D789 VanDerWaalsContact O-N 3.14Å; R787-D789 IonicContact NE-OD1 3.54Å
790	P	83.3	Confident	81.6	Confident	98 Å²	98	85.6 Å²	85.6	64%	0.636	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	146.8	-178.4	27.7	-34.4	0	0	0	111	I788 P792	I788-P790 WeakPolarHBondContact O-CD 3.34Å; P790-P792 VanDerWaalsContact O-CD 3.26Å; P790-P792 WeakPolarHBondContact O-CD 3.2Å
791	S	79.2	Confident	81	Confident	41 Å²	41	83.9 Å²	83.9	29%	0.287	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-70.5	118.4	177.1	69.7	0	0	0	0	110.5	F793	S791-F793 VanDerWaalsContact C-N 3.25Å; S791-F793 PolarHBondContact O-N 2.94Å
792	P	76.4	Confident	80.4	Confident	82 Å²	82	86.2 Å²	86.2	53%	0.532	43%	0.427	S	S	.	.			trans	-81.3	-1.7	-170.1	25.8	-26.1	0	0	0	114	P790 C815	P790-P792 VanDerWaalsContact O-CD 3.26Å; P790-P792 WeakPolarHBondContact O-CD 3.2Å; P792-C815 HydrophobicContact CG-CB 3.62Å
793	F	79.3	Confident	80.1	Confident	63 Å²	63	89.4 Å²	89.4	28%	0.276	44%	0.437	S	S	.	.			trans	-153.7	152.5	-178.8	62	-88.5	0	0	0	111.8	S791 T812 C815 M816	S791-F793 VanDerWaalsContact C-N 3.25Å; S791-F793 PolarHBondContact O-N 2.94Å; F793-T812 HydrophobicContact CB-CG2 4.1Å; F793-T812 HydrophobicContact CD1-CG2 3.58Å; F793-T812 HydrophobicContact CE1-CG2 4.23Å; F793-T812 HydrophobicContact CG-CG2 3.82Å; F793-C815 HydrophobicContact CE1-CB 4.25Å; F793-M816 HydrophobicContact CD2-CE 4.05Å; F793-M816 HydrophobicContact CE1-CG 3.82Å; F793-M816 HydrophobicContact CE2-CE 3.34Å; F793-M816 HydrophobicContact CE2-CG 3.96Å; F793-M816 HydrophobicContact CZ-CB 4.4Å; F793-M816 HydrophobicContact CZ-CE 3.73Å; F793-M816 HydrophobicContact CZ-CG 3.27Å; F793-M816 HydrophobicContact CZ-SD 4.39Å
794	Q	81.8	Confident	79.7	Confident	188 Å²	188	88.9 Å²	88.9	88%	0.879	44%	0.436	S	S	*	.			trans	-128.9	136.4	168.8	-171.1	178.1	6.6	0	0	108.7
795	L	82.7	Confident	79.4	Confident	62 Å²	62	82.4 Å²	82.4	33%	0.325	40%	0.403	S	S	.	.			trans	-111.3	120.1	-176.6	-165.2	65.8	0	0	0	110.1	V599 T799 A804	V599-L795 HydrophobicContact CB-CD2 4.24Å; V599-L795 HydrophobicContact CG1-CD2 3.61Å; V599-L795 HydrophobicContact CG1-CG 4.15Å; V599-L795 HydrophobicContact CG2-CD2 3.57Å; V599-L795 HydrophobicContact CG2-CG 3.99Å; L795-T799 HydrophobicContact CD1-CG2 4.33Å; L795-A804 HydrophobicContact CD1-CB 4.23Å; L795-A804 HydrophobicContact CD2-CB 4.35Å
796	V	88.1	Confident	79	Confident	104 Å²	104	79.7 Å²	79.7	63%	0.63	40%	0.401	S	S	*	.			trans	-70.9	133.5	177.9	-178.2	0	0	0	0	109.6	R798 T799	V796-R798 VanDerWaalsContact C-N 3.28Å; V796-R798 PolarHBondContact O-N 3.17Å; V796-T799 WeakPolarHBondContact CB-OG1 3.29Å; V796-T799 WeakPolarHBondContact O-CB 3.15Å; V796-T799 PolarHBondContact O-N 3.24Å; V796-T799 PolarHBondContact O-OG1 3.35Å
797	E	85	Confident	77.9	Confident	107 Å²	107	81.6 Å²	81.6	50%	0.5	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-38.4	-174.2	-67.9	-173.4	160.1	0	0	113.9	V599 E600 M603 T799	V599-E797 WeakPolarHBondContact CB-O 3.23Å; V599-E797 PolarHBondContact N-O 3.44Å; E600-E797 HydrophobicContact CB-CB 4.24Å; E600-E797 PolarHBondContact N-O 2.99Å; E600-E797 VanDerWaalsContact N-O 3.16Å; M603-E797 HydrophobicContact CE-CG 4.34Å; M603-E797 HydrophobicContact SD-CG 4.42Å; E797-T799 PolarHBondContact O-N 3.2Å
798	R	85.3	Confident	76.6	Confident	196 Å²	196	77.5 Å²	77.5	74%	0.74	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	11.8	176.7	-69.1	-167.2	169	-172.4	-0.6	114.3	F598 V796 S800	F598-R798 WeakPolarHBondContact CD1-O 3.31Å; V796-R798 VanDerWaalsContact C-N 3.28Å; V796-R798 PolarHBondContact O-N 3.17Å; R798-S800 PolarHBondContact O-N 3.19Å
799	T	83.1	Confident	74.8	Confident	27 Å²	27	76.9 Å²	76.9	17%	0.166	40%	0.404	C	S	.	.			trans	-66.5	126.1	170.5	-54	0	0	0	0	108.3	V599 L795 V796 E797 K803 A804	V599-T799 WeakPolarHBondContact CG2-O 3.27Å; V599-T799 PolarHBondContact N-O 3.24Å; V599-T799 VanDerWaalsContact N-O 3.1Å; L795-T799 HydrophobicContact CD1-CG2 4.33Å; V796-T799 WeakPolarHBondContact CB-OG1 3.29Å; V796-T799 WeakPolarHBondContact O-CB 3.15Å; V796-T799 PolarHBondContact O-N 3.24Å; V796-T799 PolarHBondContact O-OG1 3.35Å; E797-T799 PolarHBondContact O-N 3.2Å; T799-K803 HydrophobicContact CG2-CB 3.56Å; T799-A804 HydrophobicContact CG2-CB 4Å
800	S	81.1	Confident	72.7	Confident	15 Å²	15	76.2 Å²	76.2	11%	0.105	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-65.8	151.6	174.5	66.4	0	0	0	0	110.6	Y595 R798 H802 K803 A804	Y595-S800 WeakPolarHBondContact O-CB 3.5Å; R798-S800 PolarHBondContact O-N 3.19Å; S800-H802 PolarHBondContact O-N 3.26Å; S800-H802 VanDerWaalsContact O-N 3.11Å; S800-K803 PolarHBondContact O-N 3.05Å; S800-K803 PolarHBondContact OG-N 3.39Å; S800-A804 PolarHBondContact O-N 2.94Å
801	L	73.6	Confident	70.2	Confident	56 Å²	56	76 Å²	76	29%	0.293	40%	0.404	S	S	.	.	H	α-helix	trans	-55	-33.7	179.7	-176.9	60.4	0	0	0	112.9	I597 I602 R805	I597-L801 HydrophobicContact CB-CB 4.35Å; I597-L801 HydrophobicContact CB-CD2 4.48Å; I597-L801 HydrophobicContact CD1-CD2 4.5Å; I597-L801 HydrophobicContact CG2-CD2 4.49Å; I597-L801 WeakPolarHBondContact O-CB 3.31Å; I597-L801 PolarHBondContact O-N 2.98Å; I602-L801 HydrophobicContact CD1-CD1 3.73Å; I602-L801 HydrophobicContact CD1-CD2 4.35Å; L801-R805 VanDerWaalsContact O-CB 3.31Å; L801-R805 WeakPolarHBondContact O-CB 3.49Å; L801-R805 PolarHBondContact O-N 3.28Å
802	H	71.6	Confident	68.1	Low	57 Å²	57	75.1 Å²	75.1	26%	0.264	40%	0.397	S	S	.	.	H	α-helix	trans	-63.7	-47.7	174.8	-173.4	-71.1	0	0	0	112.2	L587 Y595 S800 R805 A806	L587-H802 HydrophobicContact CD1-CB 4.27Å; Y595-H802 HydrophobicContact CD1-CB 4.08Å; Y595-H802 HydrophobicContact CE1-CB 3.9Å; Y595-H802 AromaticContact CE1-CD2 3.86Å; Y595-H802 AromaticContact CE1-CG 3.77Å; Y595-H802 AromaticContact CZ-CD2 3.88Å; S800-H802 PolarHBondContact O-N 3.26Å; S800-H802 VanDerWaalsContact O-N 3.11Å; H802-R805 WeakPolarHBondContact O-CB 3.37Å; H802-R805 PolarHBondContact O-N 2.83Å; H802-A806 PolarHBondContact O-N 3.06Å
803	K	75.4	Confident	66.1	Low	142 Å²	142	72.8 Å²	72.8	62%	0.617	38%	0.381	S	S	*	.	H	α-helix	trans	-68.8	-41.8	178.5	-73	-177	178.9	-176.2	0	111.5	T799 S800 R805 A806 A807	T799-K803 HydrophobicContact CG2-CB 3.56Å; S800-K803 PolarHBondContact O-N 3.05Å; S800-K803 PolarHBondContact OG-N 3.39Å; K803-R805 PolarHBondContact O-N 3.35Å; K803-A806 PolarHBondContact O-N 3.13Å; K803-A806 VanDerWaalsContact O-N 3.08Å; K803-A807 PolarHBondContact O-N 3.26Å
804	A	72.4	Confident	63.9	Low	7 Å²	7	70.9 Å²	70.9	6%	0.058	37%	0.374	C	S	.	.	H	α-helix	trans	-60.8	-34.2	176.5	0	0	0	0	0	111.8	V599 L795 T799 S800 K808	V599-A804 HydrophobicContact CG2-CB 3.67Å; L795-A804 HydrophobicContact CD1-CB 4.23Å; L795-A804 HydrophobicContact CD2-CB 4.35Å; T799-A804 HydrophobicContact CG2-CB 4Å; S800-A804 PolarHBondContact O-N 2.94Å; A804-K808 WeakPolarHBondContact O-CG 3.44Å; A804-K808 PolarHBondContact O-N 3.49Å
805	R	66.4	Low	61.5	Low	48 Å²	48	63.3 Å²	63.3	18%	0.181	34%	0.342	C	S	.	.	H	α-helix	trans	-69.9	-45.9	171	179.8	-160.5	-179.2	140.3	4.3	112.5	L584 P585 E586 L801 H802 K803 A807 K808	L584-R805 HydrophobicContact CD2-CB 4.4Å; L584-R805 HydrophobicContact CD2-CG 3.68Å; L584-R805 PolarHBondContact O-NH2 3.48Å; P585-R805 VanDerWaalsContact O-CZ 3.22Å; P585-R805 PolarHBondContact O-NH1 2.65Å; P585-R805 PolarHBondContact O-NH2 3.08Å; E586-R805 VanDerWaalsContact CA-NH2 3.33Å; L801-R805 VanDerWaalsContact O-CB 3.31Å; L801-R805 WeakPolarHBondContact O-CB 3.49Å; L801-R805 PolarHBondContact O-N 3.28Å; H802-R805 WeakPolarHBondContact O-CB 3.37Å; H802-R805 PolarHBondContact O-N 2.83Å; K803-R805 PolarHBondContact O-N 3.35Å; R805-A807 PolarHBondContact O-N 2.89Å; R805-K808 WeakPolarHBondContact O-CA 3.44Å; R805-K808 WeakPolarHBondContact O-CB 3.47Å; R805-K808 PolarHBondContact O-N 3.5Å
806	A	63.6	Low	59.1	Low	57 Å²	57	61.4 Å²	61.4	47%	0.471	33%	0.332	S	S	.	.	H	α-helix	trans	-59.3	-33.2	178	0	0	0	0	0	111.7	H802 K803 K808	H802-A806 PolarHBondContact O-N 3.06Å; K803-A806 PolarHBondContact O-N 3.13Å; K803-A806 VanDerWaalsContact O-N 3.08Å; A806-K808 VanDerWaalsContact C-N 3.33Å
807	A	59.3	Low	56.6	Low	54 Å²	54	60.5 Å²	60.5	45%	0.446	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-17.5	173.5	0	0	0	0	0	114.3	K803 R805 T809 T812	K803-A807 PolarHBondContact O-N 3.26Å; R805-A807 PolarHBondContact O-N 2.89Å; A807-T809 PolarHBondContact O-N 3.47Å; A807-T812 PolarHBondContact O-OG1 3.35Å
808	K	54.5	Low	54.1	Low	83 Å²	83	58.1 Å²	58.1	36%	0.361	31%	0.308	S	S	.	.			trans	-81	69.2	170.3	-75	178.9	-178.3	-173.1	0	109.6	A804 R805 A806 V813 M816	A804-K808 WeakPolarHBondContact O-CG 3.44Å; A804-K808 PolarHBondContact O-N 3.49Å; R805-K808 WeakPolarHBondContact O-CA 3.44Å; R805-K808 WeakPolarHBondContact O-CB 3.47Å; R805-K808 PolarHBondContact O-N 3.5Å; A806-K808 VanDerWaalsContact C-N 3.33Å; K808-V813 HydrophobicContact CB-CG2 3.99Å; K808-M816 HydrophobicContact CD-SD 4.36Å; K808-M816 HydrophobicContact CG-SD 4.27Å
809	T	46.1	Very low	51.5	Low	50 Å²	50	50.4 Å²	50.4	31%	0.307	29%	0.285	S	S	.	.			trans	-66.3	158.9	161.8	38.7	0	0	0	0	109.9	Y288 A807 C811 T812 V813	Y288-T809 HydrophobicContact CE1-CG2 4.36Å; Y288-T809 HydrophobicContact CE2-CG2 4.05Å; A807-T809 PolarHBondContact O-N 3.47Å; T809-C811 PolarHBondContact O-N 2.94Å; T809-C811 VanDerWaalsContact O-N 3.13Å; T809-T812 PolarHBondContact N-OG1 3.46Å; T809-T812 PolarHBondContact O-N 2.91Å; T809-T812 PolarHBondContact O-OG1 2.99Å; T809-T812 VanDerWaalsContact O-OG1 3.05Å; T809-T812 PolarHBondContact OG1-OG1 2.92Å; T809-V813 PolarHBondContact O-N 2.92Å
810	P	38.3	Very low	49	Very low	63 Å²	63	51 Å²	51	41%	0.409	29%	0.289	S	S	.	.	H	α-helix	trans	-56.6	-27.8	-179.9	9	-19.2	0	0	0	113.8	Y288 T814	Y288-P810 HydrophobicContact CD2-CG 4.18Å; Y288-P810 HydrophobicContact CG-CG 4.35Å; P810-T814 PolarHBondContact O-N 2.95Å; P810-T814 PolarHBondContact O-OG1 3.26Å
811	C	32	Very low	46.4	Very low	94 Å²	94	52.3 Å²	52.3	64%	0.635	30%	0.301	S	S	*	.	H	α-helix	trans	-65.1	-44.7	170.3	-65.4	0	0	0	0	112	T809 V813 T814 C815	T809-C811 PolarHBondContact O-N 2.94Å; T809-C811 VanDerWaalsContact O-N 3.13Å; C811-V813 PolarHBondContact O-N 3.38Å; C811-T814 PolarHBondContact O-N 3.38Å; C811-C815 PolarHBondContact O-N 2.96Å
812	T	34.2	Very low	44.4	Very low	22 Å²	22	51 Å²	51	14%	0.135	29%	0.293	C	S	.	.	H	α-helix	trans	-70.6	-28.9	177	4	0	0	0	0	113.3	F793 A807 T809 T814 M816	F793-T812 HydrophobicContact CB-CG2 4.1Å; F793-T812 HydrophobicContact CD1-CG2 3.58Å; F793-T812 HydrophobicContact CE1-CG2 4.23Å; F793-T812 HydrophobicContact CG-CG2 3.82Å; A807-T812 PolarHBondContact O-OG1 3.35Å; T809-T812 PolarHBondContact N-OG1 3.46Å; T809-T812 PolarHBondContact O-N 2.91Å; T809-T812 PolarHBondContact O-OG1 2.99Å; T809-T812 VanDerWaalsContact O-OG1 3.05Å; T809-T812 PolarHBondContact OG1-OG1 2.92Å; T812-T814 VanDerWaalsContact C-N 3.31Å; T812-M816 WeakPolarHBondContact O-CB 3.08Å; T812-M816 WeakPolarHBondContact O-CG 3.45Å; T812-M816 PolarHBondContact O-N 3.41Å
813	V	35.1	Very low	42.3	Very low	34 Å²	34	50.3 Å²	50.3	21%	0.206	29%	0.294	C	S	.	.	H	α-helix	trans	-71.9	-28.8	177.3	177.1	0	0	0	0	111.8	K808 T809 C811 K817	K808-V813 HydrophobicContact CB-CG2 3.99Å; T809-V813 PolarHBondContact O-N 2.92Å; C811-V813 PolarHBondContact O-N 3.38Å; V813-K817 PolarHBondContact O-N 3.31Å
814	T	33.3	Very low	40.1	Very low	22 Å²	22	51 Å²	51	14%	0.135	30%	0.3	C	S	.	.	H	α-helix	trans	-84.6	-44.4	178.8	-39.7	0	0	0	0	110.8	Y253 P810 C811 T812 M816 K817 E818	Y253-T814 HydrophobicContact CD1-CG2 3.8Å; Y253-T814 HydrophobicContact CE1-CG2 3.56Å; Y253-T814 HydrophobicContact CG-CG2 4.44Å; P810-T814 PolarHBondContact O-N 2.95Å; P810-T814 PolarHBondContact O-OG1 3.26Å; C811-T814 PolarHBondContact O-N 3.38Å; T812-T814 VanDerWaalsContact C-N 3.31Å; T814-M816 VanDerWaalsContact C-N 3.27Å; T814-M816 PolarHBondContact O-N 3.31Å; T814-K817 WeakPolarHBondContact O-CA 3.29Å; T814-K817 WeakPolarHBondContact O-CB 3.28Å; T814-K817 PolarHBondContact O-N 3.38Å; T814-E818 PolarHBondContact O-N 3.33Å
815	C	29.8	Very low	38	Very low	29 Å²	29	55.9 Å²	55.9	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-33.4	167	-70.8	0	0	0	0	112.4	P792 F793 C811 K817 E818 S819	P792-C815 HydrophobicContact CG-CB 3.62Å; F793-C815 HydrophobicContact CE1-CB 4.25Å; C811-C815 PolarHBondContact O-N 2.96Å; C815-K817 VanDerWaalsContact C-N 3.27Å; C815-K817 PolarHBondContact O-N 3.15Å; C815-E818 CarbonylContact O-C 3.57Å; C815-E818 PolarHBondContact O-N 3.5Å; C815-S819 PolarHBondContact O-N 2.89Å
816	M	33.7	Very low	36.3	Very low	23 Å²	23	55.9 Å²	55.9	11%	0.113	33%	0.325	C	S	.	.	H	α-helix	trans	-68.3	-21.1	171.2	-86.9	-174.2	171.8	0	0	113.4	F793 K808 T812 T814 E818 C820	F793-M816 HydrophobicContact CD2-CE 4.05Å; F793-M816 HydrophobicContact CE1-CG 3.82Å; F793-M816 HydrophobicContact CE2-CE 3.34Å; F793-M816 HydrophobicContact CE2-CG 3.96Å; F793-M816 HydrophobicContact CZ-CB 4.4Å; F793-M816 HydrophobicContact CZ-CE 3.73Å; F793-M816 HydrophobicContact CZ-CG 3.27Å; F793-M816 HydrophobicContact CZ-SD 4.39Å; K808-M816 HydrophobicContact CD-SD 4.36Å; K808-M816 HydrophobicContact CG-SD 4.27Å; T812-M816 WeakPolarHBondContact O-CB 3.08Å; T812-M816 WeakPolarHBondContact O-CG 3.45Å; T812-M816 PolarHBondContact O-N 3.41Å; T814-M816 VanDerWaalsContact C-N 3.27Å; T814-M816 PolarHBondContact O-N 3.31Å; M816-E818 VanDerWaalsContact C-N 3.34Å; M816-C820 HydrophobicContact CB-CB 4.44Å; M816-C820 CarbonylContact O-C 3.59Å; M816-C820 WeakPolarHBondContact O-CA 3.17Å; M816-C820 WeakPolarHBondContact O-CB 3.32Å; M816-C820 PolarHBondContact O-N 2.93Å
817	K	34.9	Very low	34.7	Very low	84 Å²	84	56.6 Å²	56.6	37%	0.365	32%	0.32	S	S	.	.	H	α-helix	trans	-76.2	-27.8	172.1	-82.4	173.8	179.2	168.6	0	111.9	G192 V194 V813 T814 C815	G192-K817 WeakPolarHBondContact O-CE 3.47Å; G192-K817 PolarHBondContact O-NZ 3.38Å; V194-K817 VanDerWaalsContact CG2-NZ 3.32Å; V813-K817 PolarHBondContact O-N 3.31Å; T814-K817 WeakPolarHBondContact O-CA 3.29Å; T814-K817 WeakPolarHBondContact O-CB 3.28Å; T814-K817 PolarHBondContact O-N 3.38Å; C815-K817 VanDerWaalsContact C-N 3.27Å; C815-K817 PolarHBondContact O-N 3.15Å
818	E	32.8	Very low	33.2	Very low	57 Å²	57	54.3 Å²	54.3	27%	0.266	30%	0.302	S	S	.	.	H	α-helix	trans	-98.3	-17.1	-178.7	-79.4	160.4	-168.5	0	0	113.7	P252 Y253 T630 T814 C815 M816	P252-E818 WeakPolarHBondContact CG-OE1 3.12Å; Y253-E818 PolarHBondContact OH-OE2 3.38Å; T630-E818 WeakPolarHBondContact CB-O 3.48Å; T630-E818 WeakPolarHBondContact CG2-O 3.12Å; T630-E818 PolarHBondContact OG1-O 3.4Å; T814-E818 PolarHBondContact O-N 3.33Å; C815-E818 CarbonylContact O-C 3.57Å; C815-E818 PolarHBondContact O-N 3.5Å; M816-E818 VanDerWaalsContact C-N 3.34Å
819	S	30.3	Very low	31.9	Very low	35 Å²	35	57.3 Å²	57.3	25%	0.245	32%	0.317	C	S	.	.	H	α-helix	trans	-111.8	-5.1	166.9	-49.8	0	0	0	0	112.7	S645 C815	S645-S819 PolarHBondContact OG-OG 3.04Å; S645-S819 VanDerWaalsContact OG-OG 3.05Å; C815-S819 PolarHBondContact O-N 2.89Å
820	C	29.9	Very low	31.2	Very low	38 Å²	38	61.2 Å²	61.2	26%	0.257	33%	0.33	S	S	.	.			trans	-140.3	79.2	-177	-114.6	0	0	0	0	111.5	M816 F822 S823	M816-C820 HydrophobicContact CB-CB 4.44Å; M816-C820 CarbonylContact O-C 3.59Å; M816-C820 WeakPolarHBondContact O-CA 3.17Å; M816-C820 WeakPolarHBondContact O-CB 3.32Å; M816-C820 PolarHBondContact O-N 2.93Å; C820-F822 HydrophobicContact CB-CB 4.4Å; C820-F822 PolarHBondContact O-N 2.8Å; C820-S823 PolarHBondContact O-N 2.93Å; C820-S823 VanDerWaalsContact O-N 3.13Å
821	A	28.2	Very low	30.6	Very low	44 Å²	44	60.4 Å²	60.4	36%	0.364	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	11.1	152.3	0	0	0	0	0	113.8	L628	L628-A821 HydrophobicContact CB-CB 4.01Å; L628-A821 HydrophobicContact CD2-CB 3.46Å; L628-A821 VanDerWaalsContact CD2-CB 3.46Å; L628-A821 HydrophobicContact CG-CB 4.18Å
822	F	30.9	Very low	30.4	Very low	28 Å²	28	64.5 Å²	64.5	12%	0.123	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-13.4	168.8	-78.8	-84.5	0	0	0	114.9	V604 K606 V607 C820 H824 Q825 L826	V604-F822 HydrophobicContact CB-CD1 3.59Å; V604-F822 HydrophobicContact CB-CE1 3.73Å; V604-F822 HydrophobicContact CG1-CD1 3.81Å; V604-F822 HydrophobicContact CG1-CE1 3.43Å; V604-F822 VanDerWaalsContact CG1-CE1 3.43Å; V604-F822 HydrophobicContact CG2-CD1 3.9Å; V604-F822 HydrophobicContact CG2-CE1 4.4Å; K606-F822 WeakPolarHBondContact O-CZ 3.5Å; V607-F822 HydrophobicContact CB-CE2 4.25Å; V607-F822 HydrophobicContact CB-CZ 4.18Å; V607-F822 HydrophobicContact CG1-CE2 3.88Å; V607-F822 HydrophobicContact CG1-CZ 4.27Å; V607-F822 HydrophobicContact CG2-CE1 4.45Å; V607-F822 HydrophobicContact CG2-CE2 3.86Å; V607-F822 HydrophobicContact CG2-CZ 3.77Å; C820-F822 HydrophobicContact CB-CB 4.4Å; C820-F822 PolarHBondContact O-N 2.8Å; F822-H824 PolarHBondContact O-N 2.95Å; F822-Q825 PolarHBondContact O-N 3.1Å; F822-L826 HydrophobicContact CB-CD1 4.19Å; F822-L826 PolarHBondContact O-N 3.25Å
823	S	27.1	Very low	30.1	Very low	42 Å²	42	71.3 Å²	71.3	29%	0.294	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-17.5	-176.6	-148.6	0	0	0	0	113.8	C820 Q825	C820-S823 PolarHBondContact O-N 2.93Å; C820-S823 VanDerWaalsContact O-N 3.13Å; S823-Q825 VanDerWaalsContact C-N 3.28Å; S823-Q825 PolarHBondContact O-N 3.31Å
824	H	28.6	Very low	29.8	Very low	157 Å²	157	77.6 Å²	77.6	73%	0.727	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-10.6	170.5	-100.5	-76.4	0	0	0	114.1	F822	F822-H824 PolarHBondContact O-N 2.95Å
825	Q	28.8	Very low	29.7	Very low	110 Å²	110	80.4 Å²	80.4	51%	0.514	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-22.3	176.5	-84.9	178.9	-20.4	0	0	114	F822 S823 L827	F822-Q825 PolarHBondContact O-N 3.1Å; S823-Q825 VanDerWaalsContact C-N 3.28Å; S823-Q825 PolarHBondContact O-N 3.31Å; Q825-L827 PolarHBondContact O-N 3.35Å
826	L	31.8	Very low	29.6	Very low	48 Å²	48	83.1 Å²	83.1	25%	0.251	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-18.3	-170.6	-82.8	156.8	0	0	0	115.5	I602 F822	I602-L826 HydrophobicContact CG2-CD2 3.95Å; F822-L826 HydrophobicContact CB-CD1 4.19Å; F822-L826 PolarHBondContact O-N 3.25Å
827	L	29.6	Very low	29.4	Very low	71 Å²	71	86.4 Å²	86.4	37%	0.372	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	7.3	-177.5	-84.3	157.5	0	0	0	114	L26 L584 Q825	L26-L827 HydrophobicContact CD2-CB 3.67Å; L584-L827 HydrophobicContact CD1-CD2 3.65Å; Q825-L827 PolarHBondContact O-N 3.35Å
828	G	26.8	Very low	29.1	Very low	7 Å²	7	86.5 Å²	86.5	7%	0.072	44%	0.444	C	S	.	.	S	Bend	trans	-103.3	-19.3	-176.3	0	0	0	0	0	116.2	G27 K830	G27-G828 VanDerWaalsContact CA-CA 3.42Å; G27-G828 WeakPolarHBondContact CA-O 3.46Å; G27-G828 VanDerWaalsContact N-CA 3.35Å; G828-K830 PolarHBondContact O-N 3.25Å
829	H	28.4	Very low	28.9	Very low	145 Å²	145	88.4 Å²	88.4	67%	0.671	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	112.5	-175.1	-110.1	-82	0	0	0	110.9
830	K	30.4	Very low	28.8	Very low	132 Å²	132	91.9 Å²	91.9	57%	0.574	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	35.2	171.5	-57.5	-179	177.4	172.6	0	119.3	G828 K832	G828-K830 PolarHBondContact O-N 3.25Å; K830-K832 PolarHBondContact O-N 3.36Å
831	S	26.8	Very low	28.7	Very low	47 Å²	47	95.8 Å²	95.8	33%	0.329	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	28.7	161.7	-46.8	0	0	0	0	114.8
832	K	27.4	Very low	28.7	Very low	179 Å²	179	99.8 Å²	99.8	78%	0.778	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	1.5	170.7	-89.3	-169.8	174.5	-170.6	0	113	K830	K830-K832 PolarHBondContact O-N 3.36Å
833	L	28.3	Very low	28.6	Very low	165 Å²	165	105.8 Å²	105.8	86%	0.864	53%	0.525	S	S	*	.			trans	-131	14.8	178.7	-94.4	145.2	0	0	0	112.6
834	I	28.7	Very low	28.7	Very low	166 Å²	166	111.5 Å²	111.5	85%	0.851	55%	0.546	S	S	*	.			trans	-115.3	0	175.7	-58.6	176.8	0	0	0	109.3

Retrieved 834 of 834 residues in 2143.1 ms (Link to these results)

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