A0A5K4F104_SCHMA Loading...

Striatin-interacting protein

AlphaFold DB , UniProt , Accession A0A5K4F104, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 922 aa.

						>A0A5K4F104_SCHMA|A0A5K4F104
MDCPIEDIDKKDPVVEQNTDVNFVYNDTDEYSVEIAELYSYSEEPEFHINRECFEKDFHKFVSVKWFEASNAERHSHIQRLLDHLESSDCEIRQRATRSLLYLLQGNFGDCELEEDQITWARHNVYLCIESGLLQAIIELLLFEIHYDSWGVNSIGNDSATNNTTCNGSTKPGQSTVTTTIIDTNQNSTVTSTRQSNITMKDSANLRVLLSILYIMVETVRDGMLTDHTQQQYQQTVTVNDKHIPITTIQASNDPMAKLREQFVEDLAMPIEKDGDLTLTAVLFGMIHRFCSGIDPHFPMKKVLLLLWKVLLITLGPLSNLLVRKNQARARYGLPPVLEDSVHVIQKVRASSPPVMCITDQVLSRMQRNNTNNNINNNNRHPIISQSNQSPRQGSLAGGRLAFEQQQQQQQQSVVTAVTFPFSADSSKLPIIQSQSQSTEEFTTTSGFDTPRPSSPVSSDTINHDDGTNNRDTSDLLTSSNLNQPNFNHHQVILPGLSNLYMDEKSLPWKPKVKKKDLEAFLTSVRLKFIGFHVPNDIVSLAGLPEPIHEAVRVMREHLYISLGEMQIERENEIAQNPLSMVGESIPNTPVERLYRSMYPLLPQYMIALLKILLAASPTSRTKTESINILAEMTPETMPTDGTEETILDSDNKRHREIIVKAISALLLLLLKHFKLNHIYQFEYVSQYLVFANCIPLILKFFNQEITLYITSKNTLSCLEFPARLIGEQEALSIDMVFGDWVSCCWRNMFSCINLLRILNMLTKWKHSRIMLLVVFKSAPILKRALRVRHAMLQLYVLKLLKLQSRYFGRQWRKNNMSIMSAIYQKVRHRLTDDWAYGNDVDALPWQFQVEECSLRTNVDQFNQRHYTDHWFDPEYKPVDNCLMNVLSQSTELSNEFKENYEKWLEEEVFSVPINWSHVLAH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.1	Very low	35.5	Very low	236 Å²	236	161.5 Å²	161.5	100%	1.163	83%	0.832	S	S	*	*				0	126.7	0	-78.3	-147.2	-177.5	0	0	106.8
2	D	38.2	Very low	35.1	Very low	168 Å²	168	159.3 Å²	159.3	90%	0.898	82%	0.823	S	S	*	*			trans	-57.4	132.7	-160.6	-51.8	-67.6	0	0	0	112.9
3	C	30.8	Very low	35	Very low	120 Å²	120	155.4 Å²	155.4	81%	0.811	81%	0.814	S	S	*	*			trans	-122.3	131	160.8	-90.2	0	0	0	0	107.9
4	P	42.6	Very low	35	Very low	113 Å²	113	153.6 Å²	153.6	73%	0.734	81%	0.812	S	S	*	*			trans	-84.9	145.3	-157.6	19.1	-3.8	0	0	0	111.3	E6	P4-E6 PolarHBondContact O-N 2.75Å; P4-E6 VanDerWaalsContact O-N 3.08Å
5	I	38.6	Very low	35.1	Very low	160 Å²	160	151.1 Å²	151.1	82%	0.821	81%	0.805	S	S	*	*			trans	-71.1	95.7	172	-59.3	165.4	0	0	0	106.6
6	E	35.2	Very low	35.3	Very low	170 Å²	170	150.4 Å²	150.4	79%	0.794	80%	0.796	S	S	*	*			trans	-85.3	115.5	163.8	-77.6	-173.8	166.3	0	0	108.2	P4 I8	P4-E6 PolarHBondContact O-N 2.75Å; P4-E6 VanDerWaalsContact O-N 3.08Å; E6-I8 PolarHBondContact O-N 3.17Å
7	D	34.3	Very low	35.8	Very low	153 Å²	153	151.6 Å²	151.6	82%	0.818	80%	0.796	S	S	*	*			trans	-54.8	100.1	173.8	-80	-45.6	0	0	0	110.2	D9	D7-D9 VanDerWaalsContact C-N 3.27Å; D7-D9 PolarHBondContact O-N 2.73Å
8	I	35.6	Very low	36.7	Very low	155 Å²	155	148.1 Å²	148.1	80%	0.795	78%	0.778	S	S	*	*			trans	-72.1	91.8	167.5	-62.2	172.9	0	0	0	106.7	E6 K10	E6-I8 PolarHBondContact O-N 3.17Å; I8-K10 VanDerWaalsContact C-N 3.33Å; I8-K10 PolarHBondContact O-N 3.01Å
9	D	36	Very low	38.2	Very low	141 Å²	141	145.9 Å²	145.9	75%	0.754	77%	0.771	S	S	*	*			trans	-58.6	94	170.1	-136.6	1.5	0	0	0	108.2	D7 K11	D7-D9 VanDerWaalsContact C-N 3.27Å; D7-D9 PolarHBondContact O-N 2.73Å; D9-K11 PolarHBondContact O-N 2.74Å
10	K	33	Very low	40	Very low	180 Å²	180	141.1 Å²	141.1	78%	0.783	75%	0.746	S	S	*	*			trans	-64.2	81.7	174	-77	-176.5	177.1	-179.4	0	109.6	I8 D12	I8-K10 VanDerWaalsContact C-N 3.33Å; I8-K10 PolarHBondContact O-N 3.01Å; K10-D12 PolarHBondContact O-N 3.4Å
11	K	30.7	Very low	41.8	Very low	181 Å²	181	135.8 Å²	135.8	79%	0.787	72%	0.719	S	S	*	*			trans	-88.1	87.9	152.5	-81.8	179.8	179.1	168.4	0	107.2	D9 P13	D9-K11 PolarHBondContact O-N 2.74Å; K11-P13 WeakPolarHBondContact O-CD 3.35Å; K11-P13 VanDerWaalsContact O-N 3.12Å
12	D	30.2	Very low	43.8	Very low	135 Å²	135	131.1 Å²	131.1	72%	0.722	70%	0.699	S	S	*	*			trans	-51.5	119.7	162.8	-72.2	-40.8	0	0	0	107.1	K10 V14	K10-D12 PolarHBondContact O-N 3.4Å; D12-V14 PolarHBondContact O-N 3Å
13	P	33.6	Very low	46	Very low	108 Å²	108	124.1 Å²	124.1	70%	0.701	66%	0.66	S	S	*	*			trans	-64.9	118	179.7	26.5	-30.2	0	0	0	105.9	K11 V15	K11-P13 WeakPolarHBondContact O-CD 3.35Å; K11-P13 VanDerWaalsContact O-N 3.12Å; P13-V15 PolarHBondContact O-N 3.3Å
14	V	35.4	Very low	48.6	Very low	130 Å²	130	122.4 Å²	122.4	79%	0.788	65%	0.646	S	S	*	*			trans	-56.7	97.3	166.5	178.6	0	0	0	0	105.3	D12 E16	D12-V14 PolarHBondContact O-N 3Å; V14-E16 PolarHBondContact O-N 3.06Å
15	V	36.2	Very low	50.8	Low	117 Å²	117	117.6 Å²	117.6	71%	0.709	61%	0.613	S	S	*	*			trans	-63.6	90.1	167.9	179.2	0	0	0	0	103.8	P13 Q17	P13-V15 PolarHBondContact O-N 3.3Å; V15-Q17 VanDerWaalsContact C-N 3.28Å; V15-Q17 PolarHBondContact O-N 3.02Å
16	E	38.6	Very low	53.3	Low	140 Å²	140	114.3 Å²	114.3	65%	0.654	60%	0.597	S	S	*	*			trans	-53.1	105.7	162.8	-82.2	-170.7	160.8	0	0	104.8	V14 N18	V14-E16 PolarHBondContact O-N 3.06Å; E16-N18 PolarHBondContact O-N 3.44Å; E16-N18 PolarHBondContact OE2-ND2 3.46Å
17	Q	44.5	Very low	55.8	Low	171 Å²	171	107.5 Å²	107.5	80%	0.799	57%	0.567	S	S	*	*			trans	-64.5	72	172.4	-79.7	173.8	-18.6	0	0	108	V15 T19	V15-Q17 VanDerWaalsContact C-N 3.28Å; V15-Q17 PolarHBondContact O-N 3.02Å; Q17-T19 PolarHBondContact O-N 3.14Å
18	N	50.8	Low	58.4	Low	87 Å²	87	101.1 Å²	101.1	47%	0.465	53%	0.533	S	S	.	.			trans	-88.3	27.7	177.8	-89.2	-31.2	0	0	0	110.5	E16 R789	E16-N18 PolarHBondContact O-N 3.44Å; E16-N18 PolarHBondContact OE2-ND2 3.46Å; N18-R789 VanDerWaalsContact C-NH1 3.28Å; N18-R789 PolarHBondContact O-NH1 3.07Å; N18-R789 PolarHBondContact O-NH2 3.13Å
19	T	65.4	Low	61	Low	108 Å²	108	95.5 Å²	95.5	66%	0.663	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-85.3	138.1	177.2	45.2	0	0	0	0	110.2	Q17	Q17-T19 PolarHBondContact O-N 3.14Å
20	D	75.3	Confident	63.6	Low	49 Å²	49	95.2 Å²	95.2	26%	0.262	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-66.3	142.9	170.1	-65.4	-37.3	0	0	0	108.5	N22 R349 R789	D20-N22 PolarHBondContact O-N 2.93Å; D20-R349 IonicContact OD2-CZ 3.39Å; D20-R349 IonicContact OD2-NE 2.76Å; D20-R349 PolarHBondContact OD2-NE 3.37Å; D20-R349 VanDerWaalsContact OD2-NE 3.08Å; D20-R349 IonicContact OD2-NH2 2.66Å; D20-R349 PolarHBondContact OD2-NH2 3.26Å; D20-R789 IonicContact OD1-CZ 2.99Å; D20-R789 IonicContact OD1-NE 3.43Å; D20-R789 PolarHBondContact OD1-NE 3.11Å; D20-R789 IonicContact OD1-NH2 2.87Å; D20-R789 PolarHBondContact OD1-NH2 2.91Å; D20-R789 IonicContact OD2-NH2 3.49Å
21	V	76.5	Confident	66.4	Low	30 Å²	30	87.5 Å²	87.5	18%	0.182	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-71.8	121.6	-178.8	-178.3	0	0	0	0	108.4	F23 C744 M749 R789	V21-F23 HydrophobicContact CG1-CB 4.32Å; V21-F23 PolarHBondContact O-N 3.49Å; V21-F23 VanDerWaalsContact O-N 3.16Å; V21-C744 HydrophobicContact CG1-CB 3.72Å; V21-C744 WeakPolarHBondContact CG1-SG 3.48Å; V21-M749 HydrophobicContact CB-CE 4.14Å; V21-M749 HydrophobicContact CG1-CE 3.68Å; V21-M749 HydrophobicContact CG2-CE 4.41Å; V21-R789 PolarHBondContact N-O 2.94Å; V21-R789 VanDerWaalsContact N-O 3.08Å
22	N	77.6	Confident	69.3	Low	138 Å²	138	80.9 Å²	80.9	74%	0.738	44%	0.441	S	S	*	.			trans	-78.9	98.2	176.3	-170.1	22.5	0	0	0	109.2	D20	D20-N22 PolarHBondContact O-N 2.93Å
23	F	86	Confident	72.3	Confident	20 Å²	20	76.9 Å²	76.9	9%	0.088	42%	0.422	C	S	.	.			trans	-144.3	132.3	-179.3	172.7	-92	0	0	0	109.8	V21 Y25 W746 M749 F750 I753 H790	V21-F23 HydrophobicContact CG1-CB 4.32Å; V21-F23 PolarHBondContact O-N 3.49Å; V21-F23 VanDerWaalsContact O-N 3.16Å; F23-Y25 HydrophobicContact CE1-CD2 4.11Å; F23-Y25 HydrophobicContact CE1-CG 4.42Å; F23-Y25 HydrophobicContact CZ-CD2 4.37Å; F23-W746 AromaticContact CD2-CD1 3.7Å; F23-W746 HydrophobicContact CD2-CG 4.32Å; F23-W746 HydrophobicContact CE2-CB 4.38Å; F23-W746 AromaticContact CE2-CD1 3.26Å; F23-W746 HydrophobicContact CE2-CD2 4.14Å; F23-W746 AromaticContact CE2-CE2 3.98Å; F23-W746 AromaticContact CE2-CG 3.68Å; F23-W746 HydrophobicContact CE2-CG 3.68Å; F23-W746 AromaticContact CE2-NE1 3.41Å; F23-W746 AromaticContact CZ-NE1 3.95Å; F23-M749 HydrophobicContact CB-CG 4.33Å; F23-M749 HydrophobicContact CD1-CG 3.59Å; F23-M749 HydrophobicContact CD2-CB 3.86Å; F23-M749 HydrophobicContact CD2-CG 3.61Å; F23-M749 HydrophobicContact CE1-CG 3.63Å; F23-M749 HydrophobicContact CE2-CB 3.71Å; F23-M749 HydrophobicContact CE2-CG 3.66Å; F23-M749 HydrophobicContact CG-CB 4.33Å; F23-M749 HydrophobicContact CG-CG 3.57Å; F23-M749 HydrophobicContact CZ-CB 4.07Å; F23-M749 HydrophobicContact CZ-CG 3.69Å; F23-F750 HydrophobicContact CZ-CB 4.15Å; F23-I753 HydrophobicContact CD1-CD1 4.21Å; F23-I753 HydrophobicContact CE1-CD1 3.56Å; F23-I753 HydrophobicContact CZ-CD1 4.29Å; F23-H790 AromaticContact CD1-CE1 3.55Å; F23-H790 AromaticContact CD1-NE2 3.56Å
24	V	85	Confident	75.2	Confident	84 Å²	84	71.8 Å²	71.8	51%	0.509	39%	0.388	S	S	.	.			trans	-109.2	117.7	173.6	-178.1	0	0	0	0	108.1	N26	V24-N26 PolarHBondContact O-N 3.36Å
25	Y	89.3	Confident	78.1	Confident	12 Å²	12	66.1 Å²	66.1	5%	0.047	35%	0.354	C	S	.	.			trans	-76.2	117.8	175.7	-176	-84.6	0	0	0	109.9	F23 F750 I753 N754 R757 M792	F23-Y25 HydrophobicContact CE1-CD2 4.11Å; F23-Y25 HydrophobicContact CE1-CG 4.42Å; F23-Y25 HydrophobicContact CZ-CD2 4.37Å; Y25-F750 HydrophobicContact CD2-CD2 4.02Å; Y25-F750 AromaticContact CE2-CD2 3.53Å; Y25-F750 HydrophobicContact CE2-CD2 3.53Å; Y25-F750 AromaticContact CE2-CE2 3.82Å; Y25-F750 HydrophobicContact CE2-CE2 3.82Å; Y25-F750 HydrophobicContact CE2-CG 4.43Å; Y25-F750 AromaticContact CZ-CE2 3.84Å; Y25-I753 HydrophobicContact CD2-CB 4.14Å; Y25-I753 HydrophobicContact CD2-CD1 3.86Å; Y25-I753 HydrophobicContact CD2-CG2 3.71Å; Y25-I753 HydrophobicContact CE2-CB 4.05Å; Y25-I753 HydrophobicContact CE2-CG2 3.56Å; Y25-N754 WeakPolarHBondContact CE2-OD1 3.24Å; Y25-N754 PolarHBondContact OH-OD1 3.03Å; Y25-R757 PolarHBondContact OH-NH1 2.96Å; Y25-M792 VanDerWaalsContact CB-SD 3.6Å; Y25-M792 HydrophobicContact CD1-CE 4.11Å; Y25-M792 HydrophobicContact CD1-SD 4.09Å; Y25-M792 HydrophobicContact CD2-SD 3.88Å; Y25-M792 HydrophobicContact CG-CE 4.19Å; Y25-M792 HydrophobicContact CG-SD 3.56Å; Y25-M792 VanDerWaalsContact CG-SD 3.56Å
26	N	89.3	Confident	80.8	Confident	91 Å²	91	60.9 Å²	60.9	49%	0.487	32%	0.323	S	S	.	.			trans	-128.1	162.9	167.9	-77.9	-21.1	0	0	0	109.7	V24 T28 F750	V24-N26 PolarHBondContact O-N 3.36Å; N26-T28 WeakPolarHBondContact CB-O 3.36Å; N26-T28 PolarHBondContact O-N 2.84Å; N26-F750 WeakPolarHBondContact O-CD2 3.31Å; N26-F750 WeakPolarHBondContact O-CE2 3.48Å
27	D	87.6	Confident	83.5	Confident	28 Å²	28	54.3 Å²	54.3	15%	0.15	29%	0.292	C	S	.	.	S	Bend	trans	-67.1	-24.4	179.2	-68.5	-25.6	0	0	0	112.2	W308 L312 L318	D27-W308 WeakPolarHBondContact O-CZ2 3.4Å; D27-L312 HydrophobicContact CB-CD1 4.35Å; D27-L318 WeakPolarHBondContact OD1-CB 3.45Å; D27-L318 WeakPolarHBondContact OD1-CD1 3.34Å; D27-L318 WeakPolarHBondContact OD1-CG 3.44Å; D27-L318 WeakPolarHBondContact OD2-CA 3.46Å; D27-L318 WeakPolarHBondContact OD2-CB 3.35Å; D27-L318 PolarHBondContact OD2-N 3.25Å
28	T	89.1	Confident	85.9	Confident	19 Å²	19	46.2 Å²	46.2	12%	0.117	25%	0.254	C	S	.	.	S	Bend	trans	-141.5	160.7	178.1	60.9	0	0	0	0	109.8	N26 L312	N26-T28 WeakPolarHBondContact CB-O 3.36Å; N26-T28 PolarHBondContact O-N 2.84Å; T28-L312 HydrophobicContact CG2-CD2 3.3Å
29	D	90.4	Very high	88	Confident	36 Å²	36	42.5 Å²	42.5	19%	0.193	23%	0.234	C	C	.	.			trans	-83.9	-173.6	170	-143.7	-26.1	0	0	0	110.8	V33 E34 W746	D29-V33 HydrophobicContact CB-CB 4.38Å; D29-V33 HydrophobicContact CB-CG1 4.27Å; D29-E34 HydrophobicContact CB-CG 4.08Å; D29-E34 PolarHBondContact N-OE1 3.01Å; D29-W746 HydrophobicContact CB-CD2 4.4Å; D29-W746 HydrophobicContact CB-CE3 4.13Å; D29-W746 HydrophobicContact CB-CH2 4.09Å; D29-W746 HydrophobicContact CB-CZ2 4.34Å; D29-W746 HydrophobicContact CB-CZ3 3.95Å; D29-W746 VanDerWaalsContact OD2-CD2 3.3Å
30	E	90.6	Very high	89.2	Confident	136 Å²	136	37.5 Å²	37.5	64%	0.636	20%	0.203	S	C	*	.			trans	-60.9	147.9	172.8	-64.6	-178.9	-177.1	0	0	112.2	S32 V33 E34	E30-S32 VanDerWaalsContact C-N 3.35Å; E30-S32 PolarHBondContact O-N 3.37Å; E30-V33 HydrophobicContact CB-CG2 4.22Å; E30-V33 PolarHBondContact O-N 3.1Å; E30-V33 VanDerWaalsContact O-N 3.14Å; E30-E34 WeakPolarHBondContact O-CG 3.27Å; E30-E34 PolarHBondContact O-N 3.13Å
31	Y	92.3	Very high	89.8	Confident	18 Å²	18	36.2 Å²	36.2	7%	0.071	20%	0.195	C	C	.	.	H	α-helix	trans	-54.3	-47	-176.2	174	-99.5	0	0	0	112.9	V33 E34 I35 I118 E218 T219 D222	Y31-V33 VanDerWaalsContact C-N 3.34Å; Y31-V33 PolarHBondContact O-N 3.2Å; Y31-E34 PolarHBondContact O-N 2.95Å; Y31-I35 HydrophobicContact CD1-CG1 4.4Å; Y31-I35 HydrophobicContact CD2-CG1 4.25Å; Y31-I35 HydrophobicContact CE1-CG1 3.99Å; Y31-I35 HydrophobicContact CE2-CD1 3.97Å; Y31-I35 HydrophobicContact CE2-CG1 3.84Å; Y31-I35 WeakPolarHBondContact O-CG1 3.29Å; Y31-I35 PolarHBondContact O-N 3.21Å; Y31-I118 HydrophobicContact CD1-CG2 3.98Å; Y31-I118 HydrophobicContact CE1-CG2 3.87Å; Y31-E218 HydrophobicContact CD2-CG 4.15Å; Y31-E218 HydrophobicContact CE2-CG 4.15Å; Y31-T219 PolarHBondContact OH-OG1 3.41Å; Y31-D222 HydrophobicContact CD2-CB 3.86Å
32	S	92	Very high	90.3	Very high	41 Å²	41	36.4 Å²	36.4	29%	0.287	20%	0.197	S	C	.	.	H	α-helix	trans	-58.8	-45.2	178.8	49	0	0	0	0	111.7	E30 I35 A36	E30-S32 VanDerWaalsContact C-N 3.35Å; E30-S32 PolarHBondContact O-N 3.37Å; S32-I35 PolarHBondContact O-N 3.12Å; S32-A36 VanDerWaalsContact O-CB 3.31Å; S32-A36 WeakPolarHBondContact O-CB 3.32Å; S32-A36 PolarHBondContact O-N 3.33Å
33	V	92.2	Very high	90.8	Very high	52 Å²	52	30.1 Å²	30.1	32%	0.315	16%	0.164	S	C	.	.	H	α-helix	trans	-63.5	-43.8	178.2	-179	0	0	0	0	111.2	D29 E30 Y31 I35 A36 E37	D29-V33 HydrophobicContact CB-CB 4.38Å; D29-V33 HydrophobicContact CB-CG1 4.27Å; E30-V33 HydrophobicContact CB-CG2 4.22Å; E30-V33 PolarHBondContact O-N 3.1Å; E30-V33 VanDerWaalsContact O-N 3.14Å; Y31-V33 VanDerWaalsContact C-N 3.34Å; Y31-V33 PolarHBondContact O-N 3.2Å; V33-I35 VanDerWaalsContact C-N 3.33Å; V33-I35 PolarHBondContact O-N 3.25Å; V33-A36 PolarHBondContact O-N 3.3Å; V33-E37 WeakPolarHBondContact O-CG 3.29Å; V33-E37 PolarHBondContact O-N 3.23Å
34	E	94.9	Very high	91	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-67.6	-31.9	-179.8	-67.3	-76	-169	0	0	112.9	D29 E30 Y31 Y214 E218 K309 K661	D29-E34 HydrophobicContact CB-CG 4.08Å; D29-E34 PolarHBondContact N-OE1 3.01Å; E30-E34 WeakPolarHBondContact O-CG 3.27Å; E30-E34 PolarHBondContact O-N 3.13Å; Y31-E34 PolarHBondContact O-N 2.95Å; E34-Y214 WeakPolarHBondContact O-CE1 3.46Å; E34-Y214 PolarHBondContact O-OH 2.9Å; E34-E218 HydrophobicContact CB-CG 4.39Å; E34-E218 WeakPolarHBondContact CB-OE1 3.4Å; E34-K309 IonicContact OE1-NZ 3.08Å; E34-K309 PolarHBondContact OE1-NZ 3.33Å; E34-K309 WeakPolarHBondContact OE2-CE 3.4Å; E34-K309 IonicContact OE2-NZ 3.16Å; E34-K309 PolarHBondContact OE2-NZ 2.84Å; E34-K661 IonicContact OE1-NZ 3.72Å; E34-K661 PolarHBondContact OE1-NZ 3.03Å; E34-K661 IonicContact OE2-NZ 3.72Å; E34-K661 PolarHBondContact OE2-NZ 3.37Å
35	I	95.8	Very high	91.1	Very high	11 Å²	11	31.4 Å²	31.4	6%	0.056	17%	0.171	C	C	.	.	H	α-helix	trans	-74	-40	171.6	-62.1	-64.4	0	0	0	110.7	Y31 S32 V33 E37 L38 Y39 Y214 I215 E218 F721	Y31-I35 HydrophobicContact CD1-CG1 4.4Å; Y31-I35 HydrophobicContact CD2-CG1 4.25Å; Y31-I35 HydrophobicContact CE1-CG1 3.99Å; Y31-I35 HydrophobicContact CE2-CD1 3.97Å; Y31-I35 HydrophobicContact CE2-CG1 3.84Å; Y31-I35 WeakPolarHBondContact O-CG1 3.29Å; Y31-I35 PolarHBondContact O-N 3.21Å; S32-I35 PolarHBondContact O-N 3.12Å; V33-I35 VanDerWaalsContact C-N 3.33Å; V33-I35 PolarHBondContact O-N 3.25Å; I35-E37 VanDerWaalsContact C-N 3.35Å; I35-E37 PolarHBondContact O-N 3.04Å; I35-L38 WeakPolarHBondContact O-CB 3.2Å; I35-L38 PolarHBondContact O-N 3.36Å; I35-Y39 HydrophobicContact CG2-CE2 4.32Å; I35-Y39 WeakPolarHBondContact O-CD2 3.46Å; I35-Y214 HydrophobicContact CD1-CE1 4.29Å; I35-I215 HydrophobicContact CD1-CG1 4.24Å; I35-E218 HydrophobicContact CD1-CB 4.19Å; I35-E218 HydrophobicContact CD1-CG 3.86Å; I35-F721 HydrophobicContact CG2-CD1 3.86Å; I35-F721 HydrophobicContact CG2-CE1 3.73Å
36	A	94.2	Very high	91.2	Very high	7 Å²	7	32.1 Å²	32.1	6%	0.058	18%	0.175	C	C	.	.	H	α-helix	trans	-64.4	-37.9	179.2	0	0	0	0	0	112.5	S32 V33 L38 Y39 R654 E720 F721	S32-A36 VanDerWaalsContact O-CB 3.31Å; S32-A36 WeakPolarHBondContact O-CB 3.32Å; S32-A36 PolarHBondContact O-N 3.33Å; V33-A36 PolarHBondContact O-N 3.3Å; A36-L38 PolarHBondContact O-N 2.91Å; A36-Y39 PolarHBondContact O-N 2.94Å; A36-Y39 VanDerWaalsContact O-N 3.17Å; A36-R654 PolarHBondContact O-NH2 2.82Å; A36-E720 HydrophobicContact CB-CB 4.42Å; A36-E720 WeakPolarHBondContact CB-OE2 3.37Å; A36-F721 VanDerWaalsContact CB-O 3.26Å; A36-F721 WeakPolarHBondContact CB-O 3.22Å
37	E	94.2	Very high	91.4	Very high	3 Å²	3	28.4 Å²	28.4	1%	0.014	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21	176.1	-77	-171.6	176.3	0	0	114.4	V33 I35 Y39 I658 K661 R747	V33-E37 WeakPolarHBondContact O-CG 3.29Å; V33-E37 PolarHBondContact O-N 3.23Å; I35-E37 VanDerWaalsContact C-N 3.35Å; I35-E37 PolarHBondContact O-N 3.04Å; E37-Y39 PolarHBondContact O-N 3.28Å; E37-I658 HydrophobicContact CB-CD1 3.97Å; E37-I658 HydrophobicContact CB-CG1 4.36Å; E37-I658 HydrophobicContact CG-CD1 3.97Å; E37-I658 HydrophobicContact CG-CG1 4.11Å; E37-K661 VanDerWaalsContact CD-NZ 3.26Å; E37-K661 IonicContact OE1-NZ 3.19Å; E37-K661 PolarHBondContact OE1-NZ 2.98Å; E37-K661 WeakPolarHBondContact OE2-CE 3.37Å; E37-K661 IonicContact OE2-NZ 3.9Å; E37-K661 PolarHBondContact OE2-NZ 2.83Å; E37-R747 VanDerWaalsContact OE1-CD 3.26Å; E37-R747 WeakPolarHBondContact OE1-CD 3.45Å; E37-R747 VanDerWaalsContact OE1-CG 3.3Å; E37-R747 WeakPolarHBondContact OE1-CG 3.41Å; E37-R747 IonicContact OE1-NH1 3.61Å
38	L	95.2	Very high	91.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-36.5	175.5	-177.7	62.7	0	0	0	111.1	I35 A36 Y214 I215 K301 K302	I35-L38 WeakPolarHBondContact O-CB 3.2Å; I35-L38 PolarHBondContact O-N 3.36Å; A36-L38 PolarHBondContact O-N 2.91Å; L38-Y214 HydrophobicContact CB-CD1 4.33Å; L38-Y214 HydrophobicContact CB-CE1 4.3Å; L38-Y214 HydrophobicContact CD1-CD1 3.91Å; L38-Y214 HydrophobicContact CD1-CD2 4.47Å; L38-Y214 HydrophobicContact CD1-CE1 4.47Å; L38-Y214 HydrophobicContact CD1-CG 3.87Å; L38-Y214 HydrophobicContact CD2-CD1 3.81Å; L38-Y214 HydrophobicContact CD2-CG 4.38Å; L38-Y214 HydrophobicContact CG-CD1 4.24Å; L38-I215 HydrophobicContact CD2-CD1 4.45Å; L38-I215 HydrophobicContact CD2-CG1 4.07Å; L38-K301 WeakPolarHBondContact O-CE 3.45Å; L38-K301 PolarHBondContact O-NZ 2.95Å; L38-K302 HydrophobicContact CD1-CB 4.34Å; L38-K302 HydrophobicContact CD1-CD 4.12Å; L38-K302 HydrophobicContact CD1-CG 3.96Å; L38-K302 PolarHBondContact O-NZ 2.75Å
39	Y	94.4	Very high	91.9	Very high	9 Å²	9	34 Å²	34	4%	0.035	18%	0.18	C	C	.	.	S	Bend	trans	-99.9	137.4	-171.4	-56.1	-71.8	0	0	0	112.1	I35 A36 E37 E43 F47 Q105 I215 K301 R654 F721	I35-Y39 HydrophobicContact CG2-CE2 4.32Å; I35-Y39 WeakPolarHBondContact O-CD2 3.46Å; A36-Y39 PolarHBondContact O-N 2.94Å; A36-Y39 VanDerWaalsContact O-N 3.17Å; E37-Y39 PolarHBondContact O-N 3.28Å; Y39-E43 WeakPolarHBondContact CA-OE1 3.18Å; Y39-F47 HydrophobicContact CD1-CE1 4.23Å; Y39-F47 HydrophobicContact CD1-CE2 4.49Å; Y39-F47 AromaticContact CD1-CZ 3.69Å; Y39-F47 HydrophobicContact CD1-CZ 3.69Å; Y39-F47 HydrophobicContact CD2-CE1 4.28Å; Y39-F47 AromaticContact CD2-CZ 3.86Å; Y39-F47 HydrophobicContact CD2-CZ 3.86Å; Y39-F47 HydrophobicContact CE1-CE1 4.16Å; Y39-F47 HydrophobicContact CE1-CZ 4.1Å; Y39-F47 HydrophobicContact CE2-CE1 4.19Å; Y39-F47 HydrophobicContact CE2-CZ 4.23Å; Y39-F47 HydrophobicContact CG-CE1 4.29Å; Y39-F47 HydrophobicContact CG-CE2 4.47Å; Y39-F47 AromaticContact CG-CZ 3.57Å; Y39-F47 HydrophobicContact CG-CZ 3.57Å; Y39-Q105 VanDerWaalsContact CZ-NE2 3.28Å; Y39-Q105 PolarHBondContact OH-NE2 2.94Å; Y39-I215 WeakPolarHBondContact OH-CD1 3.47Å; Y39-K301 VanDerWaalsContact C-NZ 3.33Å; Y39-R654 PolarHBondContact O-NH1 3.28Å; Y39-F721 HydrophobicContact CD2-CB 4.09Å; Y39-F721 HydrophobicContact CD2-CD1 4.19Å; Y39-F721 HydrophobicContact CD2-CG 4.08Å; Y39-F721 HydrophobicContact CE2-CD1 4.02Å; Y39-F721 HydrophobicContact CE2-CE1 4.34Å; Y39-F721 HydrophobicContact CE2-CG 4.21Å
40	S	91.3	Very high	92.2	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.021	17%	0.172	C	C	.	.			trans	-83.2	154.7	164.3	-57.3	0	0	0	0	109	S42 E43 K301	S40-S42 PolarHBondContact O-N 2.91Å; S40-E43 PolarHBondContact N-OE1 3.16Å; S40-E43 WeakPolarHBondContact O-CB 3.12Å; S40-E43 PolarHBondContact O-N 3.43Å; S40-K301 VanDerWaalsContact N-NZ 3.17Å; S40-K301 PolarHBondContact OG-NZ 2.99Å
41	Y	88.9	Confident	92.4	Very high	22 Å²	22	29.6 Å²	29.6	9%	0.086	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-65.9	-29.4	178.4	-55.7	-37.7	0	0	0	111.6	E43 E44 I647 D651 R654 L716 L719 E720	Y41-E43 PolarHBondContact O-N 3.37Å; Y41-E43 VanDerWaalsContact O-N 3.13Å; Y41-E44 WeakPolarHBondContact O-CB 3.3Å; Y41-E44 PolarHBondContact O-N 3.04Å; Y41-E44 VanDerWaalsContact O-N 3.14Å; Y41-I647 HydrophobicContact CD2-CG2 4.19Å; Y41-D651 HydrophobicContact CD2-CB 3.63Å; Y41-D651 VanDerWaalsContact CD2-CG 3.41Å; Y41-D651 HydrophobicContact CE2-CB 4.04Å; Y41-D651 HydrophobicContact CG-CB 4.47Å; Y41-D651 PolarHBondContact N-OD2 3.5Å; Y41-R654 VanDerWaalsContact OH-CD 3.23Å; Y41-R654 WeakPolarHBondContact OH-CD 3.43Å; Y41-R654 PolarHBondContact OH-NE 3.15Å; Y41-L716 HydrophobicContact CD2-CD1 4.29Å; Y41-L716 HydrophobicContact CE2-CB 3.98Å; Y41-L716 HydrophobicContact CE2-CD1 3.8Å; Y41-L716 HydrophobicContact CE2-CG 3.99Å; Y41-L716 PolarHBondContact OH-N 3.28Å; Y41-L719 HydrophobicContact CD1-CB 3.71Å; Y41-L719 WeakPolarHBondContact CD1-O 3.43Å; Y41-L719 HydrophobicContact CD2-CB 4.42Å; Y41-L719 HydrophobicContact CD2-CD1 4.05Å; Y41-L719 HydrophobicContact CE1-CB 3.8Å; Y41-L719 HydrophobicContact CE2-CD1 4.45Å; Y41-L719 HydrophobicContact CG-CB 4.05Å; Y41-L719 HydrophobicContact CG-CD1 4.2Å; Y41-E720 HydrophobicContact CE1-CG 4.47Å; Y41-E720 PolarHBondContact OH-OE1 2.94Å; Y41-E720 VanDerWaalsContact OH-OE1 3.1Å
42	S	85.6	Confident	92.5	Very high	34 Å²	34	33.1 Å²	33.1	24%	0.238	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-63.5	-13.5	173.2	-50	0	0	0	0	114.3	S40 E44	S40-S42 PolarHBondContact O-N 2.91Å; S42-E44 VanDerWaalsContact C-N 3.31Å
43	E	89.1	Confident	92.7	Very high	6 Å²	6	32 Å²	32	3%	0.028	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-83.3	-1.9	175.9	-62.1	-179.5	-93.4	0	0	112.6	Y39 S40 Y41 P45 E46 F47 R207 K302	Y39-E43 WeakPolarHBondContact CA-OE1 3.18Å; S40-E43 PolarHBondContact N-OE1 3.16Å; S40-E43 WeakPolarHBondContact O-CB 3.12Å; S40-E43 PolarHBondContact O-N 3.43Å; Y41-E43 PolarHBondContact O-N 3.37Å; Y41-E43 VanDerWaalsContact O-N 3.13Å; E43-P45 VanDerWaalsContact C-CD 3.46Å; E43-E46 WeakPolarHBondContact O-CB 3.41Å; E43-E46 PolarHBondContact O-N 3.37Å; E43-F47 WeakPolarHBondContact O-CD2 3.45Å; E43-R207 IonicContact OE2-CZ 2.72Å; E43-R207 IonicContact OE2-NH1 3.89Å; E43-R207 PolarHBondContact OE2-NH1 2.92Å; E43-K302 VanDerWaalsContact CD-NZ 3.35Å; E43-K302 IonicContact OE1-NZ 2.91Å; E43-K302 PolarHBondContact OE1-NZ 2.87Å; E43-K302 VanDerWaalsContact OE2-CE 3.25Å; E43-K302 WeakPolarHBondContact OE2-CE 3.46Å; E43-K302 IonicContact OE2-NZ 3.3Å; E43-K302 PolarHBondContact OE2-NZ 3.39Å
44	E	88.6	Confident	92.8	Very high	50 Å²	50	29.8 Å²	29.8	23%	0.234	15%	0.15	C	C	.	.	H	α-helix	trans	-47.1	-47.4	-180	-177.6	179.2	-169.1	0	0	113.9	Y41 S42 E46 F47 R724 Q729	Y41-E44 WeakPolarHBondContact O-CB 3.3Å; Y41-E44 PolarHBondContact O-N 3.04Å; Y41-E44 VanDerWaalsContact O-N 3.14Å; S42-E44 VanDerWaalsContact C-N 3.31Å; E44-E46 PolarHBondContact O-N 3.05Å; E44-F47 WeakPolarHBondContact O-CD2 3.22Å; E44-F47 PolarHBondContact O-N 3.33Å; E44-R724 IonicContact OE1-CZ 3.89Å; E44-R724 IonicContact OE1-NE 3.02Å; E44-R724 PolarHBondContact OE1-NE 3.43Å; E44-R724 IonicContact OE1-NH2 3.31Å; E44-R724 PolarHBondContact OE1-NH2 2.82Å; E44-R724 IonicContact OE2-NE 3.43Å; E44-Q729 PolarHBondContact OE1-NE2 3.2Å
45	P	88.9	Confident	92.8	Very high	81 Å²	81	32.5 Å²	32.5	53%	0.526	16%	0.163	S	C	.	.	H	α-helix	trans	-63.4	-27.1	179.9	-22.2	34.8	0	0	0	113.5	E43 F47 H48 I49	E43-P45 VanDerWaalsContact C-CD 3.46Å; P45-F47 VanDerWaalsContact C-N 3.32Å; P45-F47 PolarHBondContact O-N 3.16Å; P45-H48 PolarHBondContact O-N 2.72Å; P45-I49 PolarHBondContact O-N 3.14Å
46	E	91.3	Very high	92.7	Very high	28 Å²	28	37.9 Å²	37.9	13%	0.131	19%	0.186	C	C	.	.	H	α-helix	trans	-71	-28	-176.9	-60.9	-171.9	-177.3	0	0	112.5	E43 E44 H48 I49 N50 R207	E43-E46 WeakPolarHBondContact O-CB 3.41Å; E43-E46 PolarHBondContact O-N 3.37Å; E44-E46 PolarHBondContact O-N 3.05Å; E46-H48 VanDerWaalsContact C-N 3.3Å; E46-H48 PolarHBondContact O-N 2.72Å; E46-I49 PolarHBondContact O-N 3.5Å; E46-N50 PolarHBondContact O-N 3.34Å; E46-N50 PolarHBondContact O-ND2 3.08Å; E46-N50 PolarHBondContact O-OD1 2.96Å; E46-R207 VanDerWaalsContact CD-NH1 3.27Å; E46-R207 IonicContact OE1-CZ 2.76Å; E46-R207 IonicContact OE1-NH1 3.82Å; E46-R207 PolarHBondContact OE1-NH1 3.3Å; E46-R207 VanDerWaalsContact OE1-NH1 3.1Å; E46-R207 IonicContact OE1-NH2 3.03Å; E46-R207 PolarHBondContact OE1-NH2 3.24Å; E46-R207 IonicContact OE2-CZ 3.94Å; E46-R207 IonicContact OE2-NH1 2.83Å; E46-R207 PolarHBondContact OE2-NH1 3.47Å; E46-R207 IonicContact OE2-NH2 2.65Å
47	F	93.5	Very high	92.5	Very high	12 Å²	12	38.3 Å²	38.3	5%	0.053	19%	0.187	C	C	.	.	H	α-helix	trans	-61.3	-40.2	175.3	-67.9	-86.2	0	0	0	111.8	Y39 E43 E44 P45 N50 R51 Q105 F108 F721 L725	Y39-F47 HydrophobicContact CD1-CE1 4.23Å; Y39-F47 HydrophobicContact CD1-CE2 4.49Å; Y39-F47 AromaticContact CD1-CZ 3.69Å; Y39-F47 HydrophobicContact CD1-CZ 3.69Å; Y39-F47 HydrophobicContact CD2-CE1 4.28Å; Y39-F47 AromaticContact CD2-CZ 3.86Å; Y39-F47 HydrophobicContact CD2-CZ 3.86Å; Y39-F47 HydrophobicContact CE1-CE1 4.16Å; Y39-F47 HydrophobicContact CE1-CZ 4.1Å; Y39-F47 HydrophobicContact CE2-CE1 4.19Å; Y39-F47 HydrophobicContact CE2-CZ 4.23Å; Y39-F47 HydrophobicContact CG-CE1 4.29Å; Y39-F47 HydrophobicContact CG-CE2 4.47Å; Y39-F47 AromaticContact CG-CZ 3.57Å; Y39-F47 HydrophobicContact CG-CZ 3.57Å; E43-F47 WeakPolarHBondContact O-CD2 3.45Å; E44-F47 WeakPolarHBondContact O-CD2 3.22Å; E44-F47 PolarHBondContact O-N 3.33Å; P45-F47 VanDerWaalsContact C-N 3.32Å; P45-F47 PolarHBondContact O-N 3.16Å; F47-N50 PolarHBondContact O-N 2.92Å; F47-R51 PolarHBondContact O-N 2.88Å; F47-Q105 VanDerWaalsContact CD1-NE2 3.33Å; F47-F108 HydrophobicContact CB-CZ 3.92Å; F47-F108 HydrophobicContact CD1-CE1 4.17Å; F47-F108 HydrophobicContact CD1-CZ 4.39Å; F47-F721 HydrophobicContact CD1-CD2 4.01Å; F47-F721 HydrophobicContact CD1-CE2 4.01Å; F47-F721 AromaticContact CE1-CD2 3.28Å; F47-F721 HydrophobicContact CE1-CD2 3.28Å; F47-F721 AromaticContact CE1-CE2 3.56Å; F47-F721 HydrophobicContact CE1-CE2 3.56Å; F47-F721 HydrophobicContact CE1-CG 4.09Å; F47-F721 HydrophobicContact CZ-CB 4.31Å; F47-F721 AromaticContact CZ-CD2 3.71Å; F47-F721 HydrophobicContact CZ-CD2 3.71Å; F47-F721 HydrophobicContact CZ-CE2 4.42Å; F47-F721 HydrophobicContact CZ-CG 4.21Å; F47-L725 HydrophobicContact CB-CD1 3.77Å; F47-L725 HydrophobicContact CB-CD2 4.27Å; F47-L725 HydrophobicContact CD1-CD1 3.56Å; F47-L725 HydrophobicContact CD2-CD1 4.1Å; F47-L725 HydrophobicContact CE1-CD1 4.07Å; F47-L725 HydrophobicContact CG-CD1 3.55Å
48	H	92.9	Very high	92.5	Very high	99 Å²	99	38.3 Å²	38.3	46%	0.458	19%	0.187	S	C	.	.	H	α-helix	trans	-67.5	-38.9	176.6	-64.7	-65.1	0	0	0	112	P45 E46 N50 R51 E52	P45-H48 PolarHBondContact O-N 2.72Å; E46-H48 VanDerWaalsContact C-N 3.3Å; E46-H48 PolarHBondContact O-N 2.72Å; H48-N50 VanDerWaalsContact C-N 3.32Å; H48-N50 PolarHBondContact O-N 2.91Å; H48-R51 PolarHBondContact O-N 2.81Å; H48-E52 WeakPolarHBondContact O-CB 3.41Å; H48-E52 PolarHBondContact O-N 3.16Å
49	I	94.3	Very high	92.4	Very high	67 Å²	67	43 Å²	43	34%	0.344	21%	0.209	S	C	.	.	H	α-helix	trans	-64.1	-41.1	175.5	-57.6	169.2	0	0	0	110.3	P45 E46 E52 C53	P45-I49 PolarHBondContact O-N 3.14Å; E46-I49 PolarHBondContact O-N 3.5Å; I49-E52 PolarHBondContact O-N 3.4Å; I49-C53 WeakPolarHBondContact O-CB 3.44Å; I49-C53 PolarHBondContact O-N 2.57Å; I49-C53 PolarHBondContact O-SG 3.13Å
50	N	95.5	Very high	92.3	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-63.7	-43.6	178.5	-61.2	-15.3	0	0	0	111.2	E46 F47 H48 C53 F54 R98	E46-N50 PolarHBondContact O-N 3.34Å; E46-N50 PolarHBondContact O-ND2 3.08Å; E46-N50 PolarHBondContact O-OD1 2.96Å; F47-N50 PolarHBondContact O-N 2.92Å; H48-N50 VanDerWaalsContact C-N 3.32Å; H48-N50 PolarHBondContact O-N 2.91Å; N50-C53 PolarHBondContact O-N 3.39Å; N50-F54 PolarHBondContact O-N 3.37Å; N50-F54 VanDerWaalsContact O-N 3.11Å; N50-R98 WeakPolarHBondContact OD1-CB 3.49Å; N50-R98 VanDerWaalsContact OD1-CG 3.3Å; N50-R98 WeakPolarHBondContact OD1-CG 3.42Å; N50-R98 PolarHBondContact OD1-NH1 2.75Å
51	R	94.8	Very high	92.3	Very high	76 Å²	76	55.4 Å²	55.4	29%	0.287	26%	0.263	S	S	.	.	H	α-helix	trans	-58.1	-49.9	172.8	177.7	-179.4	175.8	159	11.4	111.9	F47 H48 C53 F54 E55 Y102	F47-R51 PolarHBondContact O-N 2.88Å; H48-R51 PolarHBondContact O-N 2.81Å; R51-C53 VanDerWaalsContact C-N 3.32Å; R51-C53 PolarHBondContact O-N 3.02Å; R51-F54 WeakPolarHBondContact O-CB 3.4Å; R51-F54 PolarHBondContact O-N 3.29Å; R51-F54 VanDerWaalsContact O-N 3.16Å; R51-E55 HydrophobicContact CG-CG 4.26Å; R51-E55 IonicContact CZ-OE1 3.3Å; R51-E55 VanDerWaalsContact CZ-OE1 3.27Å; R51-E55 IonicContact NE-OE1 3.98Å; R51-E55 PolarHBondContact NE-OE1 2.94Å; R51-E55 IonicContact NE-OE2 3.3Å; R51-E55 IonicContact NH2-OE1 3.01Å; R51-E55 PolarHBondContact NH2-OE1 3.15Å; R51-E55 WeakPolarHBondContact O-CG 3.29Å; R51-E55 PolarHBondContact O-N 3.49Å; R51-Y102 HydrophobicContact CB-CD2 3.78Å; R51-Y102 HydrophobicContact CB-CE2 3.6Å; R51-Y102 HydrophobicContact CB-CG 4.42Å; R51-Y102 HydrophobicContact CG-CD2 4.44Å; R51-Y102 HydrophobicContact CG-CE2 3.8Å
52	E	95.2	Very high	92.3	Very high	91 Å²	91	54.9 Å²	54.9	43%	0.425	26%	0.262	S	S	.	.	H	α-helix	trans	-61.4	-40.7	-179.4	-172.8	-172.3	176.4	0	0	111.8	H48 I49 F54 K56	H48-E52 WeakPolarHBondContact O-CB 3.41Å; H48-E52 PolarHBondContact O-N 3.16Å; I49-E52 PolarHBondContact O-N 3.4Å; E52-F54 VanDerWaalsContact C-N 3.32Å; E52-F54 PolarHBondContact O-N 3.05Å; E52-K56 HydrophobicContact CG-CD 4.01Å; E52-K56 HydrophobicContact CG-CG 4.42Å; E52-K56 VanDerWaalsContact O-CB 3.27Å; E52-K56 WeakPolarHBondContact O-CB 3.49Å; E52-K56 VanDerWaalsContact O-CG 3.29Å; E52-K56 WeakPolarHBondContact O-CG 3.27Å; E52-K56 PolarHBondContact O-N 3.35Å; E52-K56 WeakPolarHBondContact OE1-CE 3.46Å; E52-K56 IonicContact OE1-NZ 3.31Å; E52-K56 PolarHBondContact OE1-NZ 3.47Å
53	C	94.7	Very high	92.4	Very high	18 Å²	18	59 Å²	59	12%	0.122	29%	0.29	C	S	.	.	H	α-helix	trans	-60.7	-41.7	175.7	-69.4	0	0	0	0	111.8	I49 N50 R51 D57 R95 R98	I49-C53 WeakPolarHBondContact O-CB 3.44Å; I49-C53 PolarHBondContact O-N 2.57Å; I49-C53 PolarHBondContact O-SG 3.13Å; N50-C53 PolarHBondContact O-N 3.39Å; R51-C53 VanDerWaalsContact C-N 3.32Å; R51-C53 PolarHBondContact O-N 3.02Å; C53-D57 PolarHBondContact O-N 2.93Å; C53-R95 HydrophobicContact CB-CG 3.89Å; C53-R98 HydrophobicContact CB-CB 4.18Å
54	F	95.9	Very high	92.5	Very high	5 Å²	5	61.1 Å²	61.1	2%	0.022	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-55.3	176.5	174.5	-91.6	0	0	0	112.1	N50 R51 E52 K56 D57 F58 W66 H77 S99 Y102 L103 N107	N50-F54 PolarHBondContact O-N 3.37Å; N50-F54 VanDerWaalsContact O-N 3.11Å; R51-F54 WeakPolarHBondContact O-CB 3.4Å; R51-F54 PolarHBondContact O-N 3.29Å; R51-F54 VanDerWaalsContact O-N 3.16Å; E52-F54 VanDerWaalsContact C-N 3.32Å; E52-F54 PolarHBondContact O-N 3.05Å; F54-K56 VanDerWaalsContact C-N 3.29Å; F54-K56 PolarHBondContact O-N 2.98Å; F54-D57 PolarHBondContact O-N 3.47Å; F54-F58 HydrophobicContact CD1-CB 4.35Å; F54-F58 HydrophobicContact CE1-CB 4Å; F54-F58 HydrophobicContact CE1-CD1 4.1Å; F54-F58 HydrophobicContact CE1-CG 4.07Å; F54-F58 HydrophobicContact CE2-CB 4.42Å; F54-F58 HydrophobicContact CZ-CB 4.03Å; F54-F58 HydrophobicContact CZ-CD1 4.19Å; F54-F58 HydrophobicContact CZ-CD2 4.2Å; F54-F58 AromaticContact CZ-CG 3.88Å; F54-F58 HydrophobicContact CZ-CG 3.88Å; F54-F58 WeakPolarHBondContact O-CB 3.16Å; F54-F58 PolarHBondContact O-N 3.11Å; F54-W66 HydrophobicContact CE2-CE3 4.22Å; F54-W66 HydrophobicContact CE2-CZ3 4.42Å; F54-W66 HydrophobicContact CZ-CB 4.38Å; F54-W66 HydrophobicContact CZ-CD2 4.12Å; F54-W66 AromaticContact CZ-CE3 3.68Å; F54-W66 HydrophobicContact CZ-CE3 3.68Å; F54-W66 HydrophobicContact CZ-CG 4.42Å; F54-W66 HydrophobicContact CZ-CZ3 4.3Å; F54-H77 AromaticContact CD2-NE2 3.73Å; F54-H77 AromaticContact CE2-CD2 3.82Å; F54-H77 AromaticContact CE2-NE2 3.44Å; F54-H77 WeakPolarHBondContact CE2-NE2 3.49Å; F54-S99 WeakPolarHBondContact CA-OG 3.3Å; F54-S99 WeakPolarHBondContact CD2-OG 3.49Å; F54-Y102 HydrophobicContact CB-CD1 3.46Å; F54-Y102 VanDerWaalsContact CB-CD1 3.46Å; F54-Y102 HydrophobicContact CB-CE1 4.12Å; F54-Y102 HydrophobicContact CB-CG 4.19Å; F54-Y102 AromaticContact CD1-CD1 3.62Å; F54-Y102 HydrophobicContact CD1-CD1 3.62Å; F54-Y102 AromaticContact CD1-CE1 3.47Å; F54-Y102 HydrophobicContact CD1-CE1 3.47Å; F54-Y102 VanDerWaalsContact CD1-CE1 3.47Å; F54-Y102 HydrophobicContact CD2-CD1 4.02Å; F54-Y102 HydrophobicContact CE1-CD1 4.36Å; F54-Y102 HydrophobicContact CE1-CE1 4.01Å; F54-Y102 AromaticContact CG-CD1 3.42Å; F54-Y102 HydrophobicContact CG-CD1 3.42Å; F54-Y102 VanDerWaalsContact CG-CD1 3.42Å; F54-Y102 AromaticContact CG-CE1 3.83Å; F54-Y102 HydrophobicContact CG-CE1 3.83Å; F54-L103 HydrophobicContact CE2-CD1 4.22Å; F54-N107 WeakPolarHBondContact CZ-ND2 3.39Å
55	E	94.1	Very high	92.6	Very high	57 Å²	57	63.8 Å²	63.8	27%	0.266	32%	0.315	S	S	.	.	H	α-helix	trans	-59	-41.9	-175.7	-73.1	178.4	169.1	0	0	111.4	R51 D57 H59	R51-E55 HydrophobicContact CG-CG 4.26Å; R51-E55 IonicContact CZ-OE1 3.3Å; R51-E55 VanDerWaalsContact CZ-OE1 3.27Å; R51-E55 IonicContact NE-OE1 3.98Å; R51-E55 PolarHBondContact NE-OE1 2.94Å; R51-E55 IonicContact NE-OE2 3.3Å; R51-E55 IonicContact NH2-OE1 3.01Å; R51-E55 PolarHBondContact NH2-OE1 3.15Å; R51-E55 WeakPolarHBondContact O-CG 3.29Å; R51-E55 PolarHBondContact O-N 3.49Å; E55-D57 VanDerWaalsContact C-N 3.3Å; E55-D57 PolarHBondContact O-N 3.38Å; E55-H59 VanDerWaalsContact O-CB 3.29Å; E55-H59 WeakPolarHBondContact O-CB 3.49Å; E55-H59 PolarHBondContact O-CD2 2.95Å; E55-H59 PolarHBondContact O-N 3.2Å
56	K	92.9	Very high	92.7	Very high	125 Å²	125	60 Å²	60	54%	0.543	29%	0.29	S	S	.	.	H	α-helix	trans	-63.1	-32.7	176.7	-78	179.6	171.8	174.3	0	113.4	E52 F54 K60	E52-K56 HydrophobicContact CG-CD 4.01Å; E52-K56 HydrophobicContact CG-CG 4.42Å; E52-K56 VanDerWaalsContact O-CB 3.27Å; E52-K56 WeakPolarHBondContact O-CB 3.49Å; E52-K56 VanDerWaalsContact O-CG 3.29Å; E52-K56 WeakPolarHBondContact O-CG 3.27Å; E52-K56 PolarHBondContact O-N 3.35Å; E52-K56 WeakPolarHBondContact OE1-CE 3.46Å; E52-K56 IonicContact OE1-NZ 3.31Å; E52-K56 PolarHBondContact OE1-NZ 3.47Å; F54-K56 VanDerWaalsContact C-N 3.29Å; F54-K56 PolarHBondContact O-N 2.98Å; K56-K60 WeakPolarHBondContact O-CD 3.36Å; K56-K60 WeakPolarHBondContact O-CE 3.41Å; K56-K60 WeakPolarHBondContact O-CG 3.43Å
57	D	91.8	Very high	92.7	Very high	16 Å²	16	61 Å²	61	9%	0.086	29%	0.294	C	S	.	.	H	α-helix	trans	-86.5	-43.4	178.6	-165.9	72.8	0	0	0	112.3	C53 F54 E55 K60 F61 H77 R80	C53-D57 PolarHBondContact O-N 2.93Å; F54-D57 PolarHBondContact O-N 3.47Å; E55-D57 VanDerWaalsContact C-N 3.3Å; E55-D57 PolarHBondContact O-N 3.38Å; D57-K60 PolarHBondContact O-N 3.31Å; D57-K60 IonicContact OD1-NZ 2.81Å; D57-F61 WeakPolarHBondContact O-CD2 3.34Å; D57-H77 IonicContact OD2-CE1 3.28Å; D57-H77 PolarHBondContact OD2-CE1 3.45Å; D57-H77 VanDerWaalsContact OD2-CE1 3.28Å; D57-H77 IonicContact OD2-ND1 3.66Å; D57-R80 PolarHBondContact O-NH2 3.37Å; D57-R80 IonicContact OD2-CZ 3.44Å; D57-R80 IonicContact OD2-NE 3.05Å; D57-R80 PolarHBondContact OD2-NE 3.28Å; D57-R80 VanDerWaalsContact OD2-NE 3.16Å; D57-R80 IonicContact OD2-NH2 2.82Å; D57-R80 PolarHBondContact OD2-NH2 3.1Å
58	F	93.9	Very high	92.6	Very high	2 Å²	2	66.8 Å²	66.8	1%	0.009	32%	0.321	C	S	.	.	H	α-helix	trans	-64.4	-47.6	-177.8	-174.9	-114	0	0	0	111.7	F54 K60 F61 V62 V64 W66 A69 H77	F54-F58 HydrophobicContact CD1-CB 4.35Å; F54-F58 HydrophobicContact CE1-CB 4Å; F54-F58 HydrophobicContact CE1-CD1 4.1Å; F54-F58 HydrophobicContact CE1-CG 4.07Å; F54-F58 HydrophobicContact CE2-CB 4.42Å; F54-F58 HydrophobicContact CZ-CB 4.03Å; F54-F58 HydrophobicContact CZ-CD1 4.19Å; F54-F58 HydrophobicContact CZ-CD2 4.2Å; F54-F58 AromaticContact CZ-CG 3.88Å; F54-F58 HydrophobicContact CZ-CG 3.88Å; F54-F58 WeakPolarHBondContact O-CB 3.16Å; F54-F58 PolarHBondContact O-N 3.11Å; F58-K60 PolarHBondContact O-N 3.11Å; F58-K60 VanDerWaalsContact O-N 3.13Å; F58-F61 PolarHBondContact O-N 2.95Å; F58-V62 HydrophobicContact CD2-CB 4.41Å; F58-V62 HydrophobicContact CE1-CB 4.01Å; F58-V62 HydrophobicContact CE1-CG1 3.98Å; F58-V62 HydrophobicContact CE2-CB 3.85Å; F58-V62 HydrophobicContact CE2-CG1 4.21Å; F58-V62 HydrophobicContact CE2-CG2 3.88Å; F58-V62 HydrophobicContact CZ-CB 3.63Å; F58-V62 HydrophobicContact CZ-CG1 3.56Å; F58-V62 HydrophobicContact CZ-CG2 4.1Å; F58-V62 PolarHBondContact O-N 3Å; F58-V64 WeakPolarHBondContact CE1-O 3.39Å; F58-W66 HydrophobicContact CD2-CE3 4.06Å; F58-W66 HydrophobicContact CD2-CZ3 4.12Å; F58-W66 HydrophobicContact CE1-CE3 4.37Å; F58-W66 AromaticContact CE2-CE3 3.5Å; F58-W66 HydrophobicContact CE2-CE3 3.5Å; F58-W66 AromaticContact CE2-CZ3 3.64Å; F58-W66 HydrophobicContact CE2-CZ3 3.64Å; F58-W66 AromaticContact CZ-CE3 3.68Å; F58-W66 HydrophobicContact CZ-CE3 3.68Å; F58-W66 HydrophobicContact CZ-CZ3 4.26Å; F58-A69 HydrophobicContact CZ-CB 4.01Å; F58-H77 HydrophobicContact CD2-CB 4.24Å; F58-H77 AromaticContact CD2-CD2 3.73Å; F58-H77 AromaticContact CD2-CG 3.7Å; F58-H77 AromaticContact CD2-ND1 3.9Å; F58-H77 AromaticContact CD2-NE2 3.93Å; F58-H77 HydrophobicContact CE2-CB 4.4Å
59	H	93	Very high	92.5	Very high	98 Å²	98	62.3 Å²	62.3	45%	0.454	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-6.3	-176.9	-68.6	-45.6	0	0	0	115.5	E55 F61 V62	E55-H59 VanDerWaalsContact O-CB 3.29Å; E55-H59 WeakPolarHBondContact O-CB 3.49Å; E55-H59 PolarHBondContact O-CD2 2.95Å; E55-H59 PolarHBondContact O-N 3.2Å; H59-F61 PolarHBondContact O-N 3.4Å; H59-V62 WeakPolarHBondContact CA-O 3.39Å; H59-V62 PolarHBondContact ND1-O 3.48Å; H59-V62 VanDerWaalsContact ND1-O 3.13Å
60	K	91.5	Very high	92.4	Very high	143 Å²	143	61.8 Å²	61.8	62%	0.622	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-23.3	168.1	-72.4	169	-174.5	168.2	0	112.7	K56 D57 F58	K56-K60 WeakPolarHBondContact O-CD 3.36Å; K56-K60 WeakPolarHBondContact O-CE 3.41Å; K56-K60 WeakPolarHBondContact O-CG 3.43Å; D57-K60 PolarHBondContact O-N 3.31Å; D57-K60 IonicContact OD1-NZ 2.81Å; F58-K60 PolarHBondContact O-N 3.11Å; F58-K60 VanDerWaalsContact O-N 3.13Å
61	F	91.3	Very high	92.2	Very high	130 Å²	130	66.2 Å²	66.2	57%	0.57	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.7	-31.3	-171.4	-58.4	-96.1	0	0	0	112.8	D57 F58 H59 R80	D57-F61 WeakPolarHBondContact O-CD2 3.34Å; F58-F61 PolarHBondContact O-N 2.95Å; H59-F61 PolarHBondContact O-N 3.4Å; F61-R80 VanDerWaalsContact CE2-NH2 3.35Å
62	V	89.6	Confident	92.1	Very high	12 Å²	12	66.2 Å²	66.2	7%	0.073	34%	0.343	C	S	.	.			trans	-125.2	122.8	-177.3	-177	0	0	0	0	109.6	F58 H59 V64 A69 E73	F58-V62 HydrophobicContact CD2-CB 4.41Å; F58-V62 HydrophobicContact CE1-CB 4.01Å; F58-V62 HydrophobicContact CE1-CG1 3.98Å; F58-V62 HydrophobicContact CE2-CB 3.85Å; F58-V62 HydrophobicContact CE2-CG1 4.21Å; F58-V62 HydrophobicContact CE2-CG2 3.88Å; F58-V62 HydrophobicContact CZ-CB 3.63Å; F58-V62 HydrophobicContact CZ-CG1 3.56Å; F58-V62 HydrophobicContact CZ-CG2 4.1Å; F58-V62 PolarHBondContact O-N 3Å; H59-V62 WeakPolarHBondContact CA-O 3.39Å; H59-V62 PolarHBondContact ND1-O 3.48Å; H59-V62 VanDerWaalsContact ND1-O 3.13Å; V62-V64 HydrophobicContact CG1-CG2 3.53Å; V62-A69 HydrophobicContact CG1-CB 4.36Å; V62-E73 HydrophobicContact CG2-CB 4.12Å; V62-E73 HydrophobicContact CG2-CG 4.24Å
63	S	87.5	Confident	92	Very high	119 Å²	119	65.4 Å²	65.4	83%	0.832	34%	0.34	S	S	*	.			trans	-87.6	-10.8	-176.3	59	0	0	0	0	114.5
64	V	91.7	Very high	92	Very high	52 Å²	52	65.4 Å²	65.4	32%	0.315	34%	0.337	S	S	.	.	S	Bend	trans	-93.9	170.4	180	-62.4	0	0	0	0	111.4	F58 V62 E68 A69	F58-V64 WeakPolarHBondContact CE1-O 3.39Å; V62-V64 HydrophobicContact CG1-CG2 3.53Å; V64-E68 HydrophobicContact CB-CB 4.02Å; V64-E68 HydrophobicContact CG2-CB 4.18Å; V64-A69 HydrophobicContact CG2-CB 4.28Å
65	K	89.3	Confident	91.9	Very high	105 Å²	105	68.3 Å²	68.3	46%	0.457	35%	0.351	S	S	.	.			trans	-69.3	158.9	172.7	-66.5	-174.1	173.5	-163.5	0	111.5	F67 E68 A69 D110	K65-F67 PolarHBondContact O-N 3.21Å; K65-E68 HydrophobicContact CB-CG 4.46Å; K65-E68 PolarHBondContact O-N 3.34Å; K65-A69 PolarHBondContact O-N 3.42Å; K65-A69 VanDerWaalsContact O-N 3.1Å; K65-D110 IonicContact NZ-OD1 3.43Å
66	W	92.8	Very high	91.9	Very high	1 Å²	1	69.1 Å²	69.1	0%	0.004	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-39.1	-179.8	179.8	-107.1	0	0	0	112.9	F54 F58 E68 A69 R74 H77 I78 L103 N107 N124 L127	F54-W66 HydrophobicContact CE2-CE3 4.22Å; F54-W66 HydrophobicContact CE2-CZ3 4.42Å; F54-W66 HydrophobicContact CZ-CB 4.38Å; F54-W66 HydrophobicContact CZ-CD2 4.12Å; F54-W66 AromaticContact CZ-CE3 3.68Å; F54-W66 HydrophobicContact CZ-CE3 3.68Å; F54-W66 HydrophobicContact CZ-CG 4.42Å; F54-W66 HydrophobicContact CZ-CZ3 4.3Å; F58-W66 HydrophobicContact CD2-CE3 4.06Å; F58-W66 HydrophobicContact CD2-CZ3 4.12Å; F58-W66 HydrophobicContact CE1-CE3 4.37Å; F58-W66 AromaticContact CE2-CE3 3.5Å; F58-W66 HydrophobicContact CE2-CE3 3.5Å; F58-W66 AromaticContact CE2-CZ3 3.64Å; F58-W66 HydrophobicContact CE2-CZ3 3.64Å; F58-W66 AromaticContact CZ-CE3 3.68Å; F58-W66 HydrophobicContact CZ-CE3 3.68Å; F58-W66 HydrophobicContact CZ-CZ3 4.26Å; W66-E68 VanDerWaalsContact C-N 3.26Å; W66-E68 PolarHBondContact O-N 3.24Å; W66-A69 WeakPolarHBondContact O-CB 3.18Å; W66-A69 PolarHBondContact O-N 3.15Å; W66-R74 HydrophobicContact CD2-CG 4.38Å; W66-R74 HydrophobicContact CE3-CG 4.28Å; W66-R74 HydrophobicContact CH2-CB 3.51Å; W66-R74 HydrophobicContact CH2-CG 3.61Å; W66-R74 HydrophobicContact CZ2-CB 3.82Å; W66-R74 HydrophobicContact CZ2-CG 3.66Å; W66-R74 HydrophobicContact CZ3-CB 4.13Å; W66-R74 HydrophobicContact CZ3-CG 3.93Å; W66-R74 PolarHBondContact O-NE 3.2Å; W66-R74 VanDerWaalsContact O-NE 3.12Å; W66-R74 PolarHBondContact O-NH2 3.32Å; W66-H77 HydrophobicContact CZ3-CB 4.28Å; W66-H77 AromaticContact CZ3-CD2 3.77Å; W66-I78 HydrophobicContact CH2-CD1 4.33Å; W66-I78 HydrophobicContact CH2-CG1 4.39Å; W66-L103 HydrophobicContact CD2-CD1 3.95Å; W66-L103 HydrophobicContact CE3-CD1 4.44Å; W66-L103 HydrophobicContact CH2-CD1 3.84Å; W66-L103 HydrophobicContact CH2-CD2 4.34Å; W66-L103 HydrophobicContact CZ2-CD1 3.29Å; W66-L103 HydrophobicContact CZ2-CD2 4.28Å; W66-L103 HydrophobicContact CZ2-CG 4.39Å; W66-L103 HydrophobicContact CZ3-CD1 4.38Å; W66-N107 VanDerWaalsContact CD1-OD1 3.25Å; W66-N124 PolarHBondContact NE1-OD1 3.5Å; W66-L127 HydrophobicContact CZ2-CD2 4.19Å
67	F	90.4	Very high	92	Very high	49 Å²	49	63.3 Å²	63.3	22%	0.215	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-23.7	-179.4	-53	-28.2	0	0	0	113.5	K65 R74 N107 D110 W120	K65-F67 PolarHBondContact O-N 3.21Å; F67-R74 PolarHBondContact O-NH2 3.07Å; F67-N107 HydrophobicContact CE1-CB 3.86Å; F67-N107 HydrophobicContact CZ-CB 3.98Å; F67-D110 HydrophobicContact CD2-CB 3.92Å; F67-D110 HydrophobicContact CE2-CB 3.29Å; F67-D110 HydrophobicContact CZ-CB 3.73Å; F67-W120 HydrophobicContact CB-CH2 4.11Å; F67-W120 HydrophobicContact CB-CZ2 3.66Å; F67-W120 AromaticContact CD1-CD1 3.95Å; F67-W120 AromaticContact CD1-CD2 3.35Å; F67-W120 HydrophobicContact CD1-CD2 3.35Å; F67-W120 AromaticContact CD1-CE2 3.21Å; F67-W120 AromaticContact CD1-CE3 3.73Å; F67-W120 HydrophobicContact CD1-CE3 3.73Å; F67-W120 AromaticContact CD1-CG 3.84Å; F67-W120 HydrophobicContact CD1-CG 3.84Å; F67-W120 AromaticContact CD1-CH2 3.9Å; F67-W120 HydrophobicContact CD1-CH2 3.9Å; F67-W120 AromaticContact CD1-CZ2 3.52Å; F67-W120 HydrophobicContact CD1-CZ2 3.52Å; F67-W120 AromaticContact CD1-CZ3 3.99Å; F67-W120 HydrophobicContact CD1-CZ3 3.99Å; F67-W120 AromaticContact CD1-NE1 3.59Å; F67-W120 HydrophobicContact CE1-CB 3.97Å; F67-W120 AromaticContact CE1-CD1 3.54Å; F67-W120 AromaticContact CE1-CD2 3.41Å; F67-W120 HydrophobicContact CE1-CD2 3.41Å; F67-W120 VanDerWaalsContact CE1-CD2 3.41Å; F67-W120 AromaticContact CE1-CE2 3.64Å; F67-W120 AromaticContact CE1-CE3 3.98Å; F67-W120 HydrophobicContact CE1-CE3 3.98Å; F67-W120 AromaticContact CE1-CG 3.37Å; F67-W120 HydrophobicContact CE1-CG 3.37Å; F67-W120 HydrophobicContact CE1-CZ2 4.39Å; F67-W120 AromaticContact CE1-NE1 3.69Å; F67-W120 HydrophobicContact CG-CD2 4.29Å; F67-W120 AromaticContact CG-CE2 3.7Å; F67-W120 HydrophobicContact CG-CH2 4.37Å; F67-W120 AromaticContact CG-CZ2 3.75Å; F67-W120 HydrophobicContact CG-CZ2 3.75Å; F67-W120 AromaticContact CG-NE1 3.86Å; F67-W120 HydrophobicContact CZ-CB 4.49Å; F67-W120 AromaticContact CZ-CD1 3.74Å; F67-W120 HydrophobicContact CZ-CD2 4.36Å; F67-W120 AromaticContact CZ-CG 3.96Å; F67-W120 HydrophobicContact CZ-CG 3.96Å
68	E	91	Very high	92.2	Very high	135 Å²	135	62.6 Å²	62.6	63%	0.631	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-15.6	179.5	-64.2	173.7	177.3	0	0	112.4	V64 K65 W66	V64-E68 HydrophobicContact CB-CB 4.02Å; V64-E68 HydrophobicContact CG2-CB 4.18Å; K65-E68 HydrophobicContact CB-CG 4.46Å; K65-E68 PolarHBondContact O-N 3.34Å; W66-E68 VanDerWaalsContact C-N 3.26Å; W66-E68 PolarHBondContact O-N 3.24Å
69	A	91	Very high	92.3	Very high	4 Å²	4	66.4 Å²	66.4	3%	0.033	35%	0.351	C	S	.	.	S	Bend	trans	-63.7	142.4	178.2	0	0	0	0	0	111.9	F58 V62 V64 K65 W66 E73 R74	F58-A69 HydrophobicContact CZ-CB 4.01Å; V62-A69 HydrophobicContact CG1-CB 4.36Å; V64-A69 HydrophobicContact CG2-CB 4.28Å; K65-A69 PolarHBondContact O-N 3.42Å; K65-A69 VanDerWaalsContact O-N 3.1Å; W66-A69 WeakPolarHBondContact O-CB 3.18Å; W66-A69 PolarHBondContact O-N 3.15Å; A69-E73 HydrophobicContact CB-CB 4.35Å; A69-R74 HydrophobicContact CB-CG 4.11Å; A69-R74 PolarHBondContact O-NE 3.49Å; A69-R74 PolarHBondContact O-NH2 2.91Å
70	S	93	Very high	92.4	Very high	56 Å²	56	63.4 Å²	63.4	39%	0.392	34%	0.336	S	S	.	.			trans	-66.8	154.3	173.7	67.7	0	0	0	0	111.3	A72 E73 R74	S70-A72 PolarHBondContact O-N 3.18Å; S70-E73 WeakPolarHBondContact CB-OE2 3.42Å; S70-E73 PolarHBondContact N-OE2 3.5Å; S70-E73 PolarHBondContact O-N 3.27Å; S70-E73 VanDerWaalsContact OG-CG 3.24Å; S70-E73 WeakPolarHBondContact OG-CG 3.45Å; S70-E73 PolarHBondContact OG-N 2.94Å; S70-E73 PolarHBondContact OG-OE2 3.39Å; S70-R74 WeakPolarHBondContact O-CG 3.48Å; S70-R74 PolarHBondContact O-N 3.09Å
71	N	90.6	Very high	92.7	Very high	96 Å²	96	56.7 Å²	56.7	51%	0.513	31%	0.307	S	S	.	.	H	α-helix	trans	-56.2	-35.5	176.6	-71.5	-22.8	0	0	0	112.2	R74 H75	N71-R74 PolarHBondContact O-N 2.99Å; N71-R74 PolarHBondContact OD1-NH1 3.47Å; N71-H75 PolarHBondContact O-N 3.5Å; N71-H75 PolarHBondContact O-ND1 3.5Å
72	A	92.3	Very high	92.9	Very high	76 Å²	76	51.2 Å²	51.2	63%	0.628	28%	0.283	S	S	*	.	H	α-helix	trans	-64.9	-41.7	177	0	0	0	0	0	112.3	S70 S76	S70-A72 PolarHBondContact O-N 3.18Å; A72-S76 VanDerWaalsContact O-CB 3.31Å; A72-S76 WeakPolarHBondContact O-CB 3.22Å; A72-S76 PolarHBondContact O-N 2.78Å
73	E	93.5	Very high	93.2	Very high	75 Å²	75	55.5 Å²	55.5	35%	0.35	31%	0.306	S	S	.	.	H	α-helix	trans	-65.3	-41	175.6	-72.4	161.9	148.1	0	0	111.6	V62 A69 S70 S76 H77	V62-E73 HydrophobicContact CG2-CB 4.12Å; V62-E73 HydrophobicContact CG2-CG 4.24Å; A69-E73 HydrophobicContact CB-CB 4.35Å; S70-E73 WeakPolarHBondContact CB-OE2 3.42Å; S70-E73 PolarHBondContact N-OE2 3.5Å; S70-E73 PolarHBondContact O-N 3.27Å; S70-E73 VanDerWaalsContact OG-CG 3.24Å; S70-E73 WeakPolarHBondContact OG-CG 3.45Å; S70-E73 PolarHBondContact OG-N 2.94Å; S70-E73 PolarHBondContact OG-OE2 3.39Å; E73-S76 PolarHBondContact O-N 3.48Å; E73-H77 WeakPolarHBondContact O-CB 3.49Å; E73-H77 PolarHBondContact O-N 3.33Å
74	R	94.6	Very high	93.6	Very high	17 Å²	17	52.7 Å²	52.7	6%	0.064	28%	0.28	C	S	.	.	H	α-helix	trans	-62.1	-48.9	176.8	-65.2	-179.2	-177.5	137.2	5.6	112.1	W66 F67 A69 S70 N71 S76 H77 I78 L127	W66-R74 HydrophobicContact CD2-CG 4.38Å; W66-R74 HydrophobicContact CE3-CG 4.28Å; W66-R74 HydrophobicContact CH2-CB 3.51Å; W66-R74 HydrophobicContact CH2-CG 3.61Å; W66-R74 HydrophobicContact CZ2-CB 3.82Å; W66-R74 HydrophobicContact CZ2-CG 3.66Å; W66-R74 HydrophobicContact CZ3-CB 4.13Å; W66-R74 HydrophobicContact CZ3-CG 3.93Å; W66-R74 PolarHBondContact O-NE 3.2Å; W66-R74 VanDerWaalsContact O-NE 3.12Å; W66-R74 PolarHBondContact O-NH2 3.32Å; F67-R74 PolarHBondContact O-NH2 3.07Å; A69-R74 HydrophobicContact CB-CG 4.11Å; A69-R74 PolarHBondContact O-NE 3.49Å; A69-R74 PolarHBondContact O-NH2 2.91Å; S70-R74 WeakPolarHBondContact O-CG 3.48Å; S70-R74 PolarHBondContact O-N 3.09Å; N71-R74 PolarHBondContact O-N 2.99Å; N71-R74 PolarHBondContact OD1-NH1 3.47Å; R74-S76 PolarHBondContact O-N 3Å; R74-H77 PolarHBondContact O-N 3.4Å; R74-I78 WeakPolarHBondContact O-CG1 3.46Å; R74-I78 PolarHBondContact O-N 2.92Å; R74-L127 HydrophobicContact CB-CD2 3.86Å
75	H	94.1	Very high	93.8	Very high	67 Å²	67	50.6 Å²	50.6	31%	0.31	27%	0.267	S	S	.	.	H	α-helix	trans	-61	-44.8	175.8	-75.3	87.6	0	0	0	111.3	N71 H77 I78 Q79 L127	N71-H75 PolarHBondContact O-N 3.5Å; N71-H75 PolarHBondContact O-ND1 3.5Å; H75-H77 VanDerWaalsContact C-N 3.29Å; H75-H77 PolarHBondContact O-N 3.4Å; H75-I78 PolarHBondContact O-N 3.09Å; H75-Q79 WeakPolarHBondContact O-CB 3.39Å; H75-Q79 VanDerWaalsContact O-CG 3.29Å; H75-Q79 WeakPolarHBondContact O-CG 3.32Å; H75-Q79 PolarHBondContact O-N 3.4Å; H75-L127 WeakPolarHBondContact CE1-CD1 3.32Å; H75-L127 VanDerWaalsContact NE2-CD1 3.27Å; H75-L127 WeakPolarHBondContact NE2-CD1 3.38Å
76	S	94.7	Very high	94	Very high	74 Å²	74	53.3 Å²	53.3	52%	0.517	28%	0.281	S	S	.	.	H	α-helix	trans	-61	-37.9	178.7	-179.1	0	0	0	0	112.4	A72 E73 R74 R80	A72-S76 VanDerWaalsContact O-CB 3.31Å; A72-S76 WeakPolarHBondContact O-CB 3.22Å; A72-S76 PolarHBondContact O-N 2.78Å; E73-S76 PolarHBondContact O-N 3.48Å; R74-S76 PolarHBondContact O-N 3Å; S76-R80 PolarHBondContact O-N 2.83Å; S76-R80 VanDerWaalsContact O-N 3.14Å
77	H	95.4	Very high	94	Very high	3 Å²	3	54.5 Å²	54.5	1%	0.014	29%	0.29	C	S	.	.	H	α-helix	trans	-66.5	-46.3	175.4	-176.6	57.4	0	0	0	112.1	F54 D57 F58 W66 E73 R74 H75 R80 L81	F54-H77 AromaticContact CD2-NE2 3.73Å; F54-H77 AromaticContact CE2-CD2 3.82Å; F54-H77 AromaticContact CE2-NE2 3.44Å; F54-H77 WeakPolarHBondContact CE2-NE2 3.49Å; D57-H77 IonicContact OD2-CE1 3.28Å; D57-H77 PolarHBondContact OD2-CE1 3.45Å; D57-H77 VanDerWaalsContact OD2-CE1 3.28Å; D57-H77 IonicContact OD2-ND1 3.66Å; F58-H77 HydrophobicContact CD2-CB 4.24Å; F58-H77 AromaticContact CD2-CD2 3.73Å; F58-H77 AromaticContact CD2-CG 3.7Å; F58-H77 AromaticContact CD2-ND1 3.9Å; F58-H77 AromaticContact CD2-NE2 3.93Å; F58-H77 HydrophobicContact CE2-CB 4.4Å; W66-H77 HydrophobicContact CZ3-CB 4.28Å; W66-H77 AromaticContact CZ3-CD2 3.77Å; E73-H77 WeakPolarHBondContact O-CB 3.49Å; E73-H77 PolarHBondContact O-N 3.33Å; R74-H77 PolarHBondContact O-N 3.4Å; H75-H77 VanDerWaalsContact C-N 3.29Å; H75-H77 PolarHBondContact O-N 3.4Å; H77-R80 PolarHBondContact ND1-NH2 2.89Å; H77-R80 PolarHBondContact O-N 2.79Å; H77-L81 WeakPolarHBondContact O-CG 3.39Å; H77-L81 PolarHBondContact O-N 3.21Å
78	I	96	Very high	94	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-45.6	179.2	-68.1	165.4	0	0	0	110.8	W66 R74 H75 R80 L81 L82 L103 L127	W66-I78 HydrophobicContact CH2-CD1 4.33Å; W66-I78 HydrophobicContact CH2-CG1 4.39Å; R74-I78 WeakPolarHBondContact O-CG1 3.46Å; R74-I78 PolarHBondContact O-N 2.92Å; H75-I78 PolarHBondContact O-N 3.09Å; I78-R80 VanDerWaalsContact C-N 3.3Å; I78-R80 PolarHBondContact O-N 2.82Å; I78-L81 WeakPolarHBondContact O-CB 2.98Å; I78-L81 PolarHBondContact O-N 3.23Å; I78-L82 HydrophobicContact CG2-CD1 4.29Å; I78-L82 HydrophobicContact CG2-CG 4.44Å; I78-L82 WeakPolarHBondContact O-CG 3.35Å; I78-L82 PolarHBondContact O-N 2.77Å; I78-L103 HydrophobicContact CD1-CD2 4.01Å; I78-L103 HydrophobicContact CG1-CD2 3.81Å; I78-L127 HydrophobicContact CD1-CB 4.35Å; I78-L127 HydrophobicContact CD1-CD2 3.39Å; I78-L127 HydrophobicContact CD1-CG 3.49Å; I78-L127 VanDerWaalsContact CD1-CG 3.49Å
79	Q	95.7	Very high	94.1	Very high	82 Å²	82	55 Å²	55	38%	0.383	31%	0.308	S	S	.	.	H	α-helix	trans	-58.1	-43.2	176.8	-70.6	-63	-36.4	0	0	111.5	H75 L81 L82 D83 S131	H75-Q79 WeakPolarHBondContact O-CB 3.39Å; H75-Q79 VanDerWaalsContact O-CG 3.29Å; H75-Q79 WeakPolarHBondContact O-CG 3.32Å; H75-Q79 PolarHBondContact O-N 3.4Å; Q79-L81 VanDerWaalsContact C-N 3.33Å; Q79-L81 PolarHBondContact O-N 2.95Å; Q79-L82 WeakPolarHBondContact O-CB 3.25Å; Q79-L82 PolarHBondContact O-N 2.99Å; Q79-L82 VanDerWaalsContact O-N 3.15Å; Q79-D83 VanDerWaalsContact O-CG 3.31Å; Q79-D83 PolarHBondContact O-N 3.47Å; Q79-S131 PolarHBondContact NE2-O 3.25Å
80	R	95.6	Very high	94.2	Very high	36 Å²	36	57 Å²	57	14%	0.136	32%	0.322	C	S	.	.	H	α-helix	trans	-62.3	-38.8	174.1	-176.3	176.8	66.7	-131.5	5.7	112.8	D57 F61 S76 H77 I78 L82 D83 H84	D57-R80 PolarHBondContact O-NH2 3.37Å; D57-R80 IonicContact OD2-CZ 3.44Å; D57-R80 IonicContact OD2-NE 3.05Å; D57-R80 PolarHBondContact OD2-NE 3.28Å; D57-R80 VanDerWaalsContact OD2-NE 3.16Å; D57-R80 IonicContact OD2-NH2 2.82Å; D57-R80 PolarHBondContact OD2-NH2 3.1Å; F61-R80 VanDerWaalsContact CE2-NH2 3.35Å; S76-R80 PolarHBondContact O-N 2.83Å; S76-R80 VanDerWaalsContact O-N 3.14Å; H77-R80 PolarHBondContact ND1-NH2 2.89Å; H77-R80 PolarHBondContact O-N 2.79Å; I78-R80 VanDerWaalsContact C-N 3.3Å; I78-R80 PolarHBondContact O-N 2.82Å; R80-L82 VanDerWaalsContact C-N 3.32Å; R80-D83 PolarHBondContact O-N 3.42Å; R80-H84 VanDerWaalsContact O-CG 3.23Å; R80-H84 PolarHBondContact O-N 3.06Å; R80-H84 PolarHBondContact O-ND1 3.46Å
81	L	96.3	Very high	94.2	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-65.1	-37.8	175.4	-68.3	177.4	0	0	0	111.4	H77 I78 Q79 H84 L85 A96 L100	H77-L81 WeakPolarHBondContact O-CG 3.39Å; H77-L81 PolarHBondContact O-N 3.21Å; I78-L81 WeakPolarHBondContact O-CB 2.98Å; I78-L81 PolarHBondContact O-N 3.23Å; Q79-L81 VanDerWaalsContact C-N 3.33Å; Q79-L81 PolarHBondContact O-N 2.95Å; L81-H84 WeakPolarHBondContact O-CB 3.27Å; L81-H84 PolarHBondContact O-N 3.39Å; L81-L85 WeakPolarHBondContact O-CG 3.44Å; L81-L85 PolarHBondContact O-N 2.85Å; L81-L85 VanDerWaalsContact O-N 3.15Å; L81-A96 HydrophobicContact CD2-CB 4.34Å; L81-L100 HydrophobicContact CB-CD1 4.31Å; L81-L100 HydrophobicContact CB-CD2 4.02Å; L81-L100 HydrophobicContact CB-CG 4.06Å; L81-L100 HydrophobicContact CD1-CD2 3.78Å; L81-L100 HydrophobicContact CD1-CG 3.93Å
82	L	96.4	Very high	94.4	Very high	15 Å²	15	58.5 Å²	58.5	8%	0.079	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-45.5	173.9	-65.2	174.7	0	0	0	111.4	I78 Q79 R80 H84 L85 S131 L133 A136	I78-L82 HydrophobicContact CG2-CD1 4.29Å; I78-L82 HydrophobicContact CG2-CG 4.44Å; I78-L82 WeakPolarHBondContact O-CG 3.35Å; I78-L82 PolarHBondContact O-N 2.77Å; Q79-L82 WeakPolarHBondContact O-CB 3.25Å; Q79-L82 PolarHBondContact O-N 2.99Å; Q79-L82 VanDerWaalsContact O-N 3.15Å; R80-L82 VanDerWaalsContact C-N 3.32Å; L82-H84 PolarHBondContact O-N 3.04Å; L82-L85 HydrophobicContact CD2-CD1 4.02Å; L82-L85 VanDerWaalsContact O-CB 3.32Å; L82-L85 WeakPolarHBondContact O-CB 3.1Å; L82-L85 PolarHBondContact O-N 2.96Å; L82-S131 WeakPolarHBondContact CD1-O 3.23Å; L82-L133 HydrophobicContact CD2-CB 4.31Å; L82-L133 HydrophobicContact CD2-CD1 3.55Å; L82-A136 HydrophobicContact CD2-CB 4.1Å
83	D	95.7	Very high	94.5	Very high	103 Å²	103	55.7 Å²	55.7	55%	0.551	29%	0.294	S	S	*	.	H	α-helix	trans	-57.3	-37.6	174.2	-62.7	-27	0	0	0	111.5	Q79 R80 L85 E86	Q79-D83 VanDerWaalsContact O-CG 3.31Å; Q79-D83 PolarHBondContact O-N 3.47Å; R80-D83 PolarHBondContact O-N 3.42Å; D83-L85 VanDerWaalsContact C-N 3.32Å; D83-L85 PolarHBondContact O-N 2.61Å; D83-E86 PolarHBondContact O-N 3.38Å
84	H	95.8	Very high	94.6	Very high	59 Å²	59	55.5 Å²	55.5	27%	0.273	29%	0.293	S	S	.	.	H	α-helix	trans	-70.3	-23.3	176.1	-67	155.9	0	0	0	113.8	R80 L81 L82 E86 S87 I92 A96	R80-H84 VanDerWaalsContact O-CG 3.23Å; R80-H84 PolarHBondContact O-N 3.06Å; R80-H84 PolarHBondContact O-ND1 3.46Å; L81-H84 WeakPolarHBondContact O-CB 3.27Å; L81-H84 PolarHBondContact O-N 3.39Å; L82-H84 PolarHBondContact O-N 3.04Å; H84-E86 VanDerWaalsContact C-N 3.26Å; H84-E86 PolarHBondContact O-N 3.26Å; H84-S87 WeakPolarHBondContact O-CB 3.28Å; H84-S87 PolarHBondContact O-N 3.34Å; H84-I92 HydrophobicContact CB-CG2 3.95Å; H84-A96 HydrophobicContact CB-CB 3.63Å
85	L	95.1	Very high	94.6	Very high	9 Å²	9	60 Å²	60	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-68.9	-26.9	174	-63.7	-178.5	0	0	0	112	L81 L82 D83 S87 R93 A96 T97 L100 L133 A136 I137 L140	L81-L85 WeakPolarHBondContact O-CG 3.44Å; L81-L85 PolarHBondContact O-N 2.85Å; L81-L85 VanDerWaalsContact O-N 3.15Å; L82-L85 HydrophobicContact CD2-CD1 4.02Å; L82-L85 VanDerWaalsContact O-CB 3.32Å; L82-L85 WeakPolarHBondContact O-CB 3.1Å; L82-L85 PolarHBondContact O-N 2.96Å; D83-L85 VanDerWaalsContact C-N 3.32Å; D83-L85 PolarHBondContact O-N 2.61Å; L85-S87 VanDerWaalsContact C-N 3.26Å; L85-S87 PolarHBondContact O-N 3.42Å; L85-R93 WeakPolarHBondContact O-CD 3.23Å; L85-R93 WeakPolarHBondContact O-CG 3.48Å; L85-A96 HydrophobicContact CD2-CB 3.93Å; L85-T97 WeakPolarHBondContact CD2-OG1 3.46Å; L85-L100 HydrophobicContact CD1-CD1 3.77Å; L85-L100 HydrophobicContact CD2-CD1 4.09Å; L85-L100 HydrophobicContact CG-CD1 4.15Å; L85-L133 HydrophobicContact CD1-CD1 4.31Å; L85-A136 HydrophobicContact CD1-CB 4.23Å; L85-I137 HydrophobicContact CD1-CD1 3.85Å; L85-L140 HydrophobicContact CB-CD2 4.38Å; L85-L140 HydrophobicContact CD2-CD2 3.86Å
86	E	93.6	Very high	94.7	Very high	161 Å²	161	57 Å²	57	75%	0.752	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-3.1	177.4	-60.5	-176.4	179.6	0	0	113.1	D83 H84	D83-E86 PolarHBondContact O-N 3.38Å; H84-E86 VanDerWaalsContact C-N 3.26Å; H84-E86 PolarHBondContact O-N 3.26Å
87	S	93.5	Very high	94.8	Very high	27 Å²	27	53.5 Å²	53.5	19%	0.189	27%	0.272	C	S	.	.			trans	-60.1	138.6	179.2	175.2	0	0	0	0	112.1	H84 L85 D89 R93	H84-S87 WeakPolarHBondContact O-CB 3.28Å; H84-S87 PolarHBondContact O-N 3.34Å; L85-S87 VanDerWaalsContact C-N 3.26Å; L85-S87 PolarHBondContact O-N 3.42Å; S87-D89 VanDerWaalsContact C-N 3.25Å; S87-D89 PolarHBondContact O-N 2.85Å; S87-D89 PolarHBondContact OG-N 2.95Å; S87-D89 VanDerWaalsContact OG-N 3.16Å; S87-R93 VanDerWaalsContact O-CD 3.25Å; S87-R93 WeakPolarHBondContact O-CD 3.48Å; S87-R93 VanDerWaalsContact O-CG 3.27Å; S87-R93 WeakPolarHBondContact O-CG 3.44Å; S87-R93 PolarHBondContact O-NH1 3.41Å
88	S	90.3	Very high	94.9	Very high	123 Å²	123	55.3 Å²	55.3	86%	0.86	28%	0.279	S	S	*	.	S	Bend	trans	-65.9	-29.7	171.7	56.2	0	0	0	0	112.6	C90 R93	S88-C90 PolarHBondContact O-N 3.42Å; S88-R93 PolarHBondContact O-NH1 3.42Å
89	D	93.5	Very high	95	Very high	71 Å²	71	55.4 Å²	55.4	38%	0.38	28%	0.279	S	S	.	.			trans	-74	118.3	176.3	-173.3	-10.2	0	0	0	111.4	S87 E91 I92 R93	S87-D89 VanDerWaalsContact C-N 3.25Å; S87-D89 PolarHBondContact O-N 2.85Å; S87-D89 PolarHBondContact OG-N 2.95Å; S87-D89 VanDerWaalsContact OG-N 3.16Å; D89-E91 VanDerWaalsContact C-N 3.31Å; D89-E91 PolarHBondContact O-N 3.25Å; D89-E91 PolarHBondContact OD1-N 3.4Å; D89-I92 HydrophobicContact CB-CB 4.24Å; D89-I92 HydrophobicContact CB-CD1 3.88Å; D89-I92 HydrophobicContact CB-CG1 3.98Å; D89-I92 PolarHBondContact O-N 3.31Å; D89-R93 PolarHBondContact O-N 3.25Å
90	C	92.6	Very high	95.1	Very high	47 Å²	47	51.5 Å²	51.5	32%	0.318	26%	0.261	S	S	.	.	H	α-helix	trans	-60.8	-36.3	178.8	-172.3	0	0	0	0	112.7	S88 I92 R93 Q94	S88-C90 PolarHBondContact O-N 3.42Å; C90-I92 VanDerWaalsContact C-N 3.34Å; C90-I92 PolarHBondContact O-N 2.8Å; C90-R93 PolarHBondContact O-N 3.49Å; C90-Q94 WeakPolarHBondContact O-CB 3.39Å; C90-Q94 VanDerWaalsContact O-CG 3.27Å; C90-Q94 WeakPolarHBondContact O-CG 3.29Å; C90-Q94 PolarHBondContact O-N 3.07Å; C90-Q94 PolarHBondContact SG-NE2 3.23Å
91	E	93.7	Very high	95.2	Very high	127 Å²	127	50 Å²	50	59%	0.593	26%	0.255	S	S	*	.	H	α-helix	trans	-68.2	-37	-179.4	-66.7	-167.7	175.9	0	0	112	D89 R95	D89-E91 VanDerWaalsContact C-N 3.31Å; D89-E91 PolarHBondContact O-N 3.25Å; D89-E91 PolarHBondContact OD1-N 3.4Å; E91-R95 WeakPolarHBondContact O-CB 3.34Å; E91-R95 PolarHBondContact O-N 3.28Å
92	I	94.4	Very high	95.2	Very high	55 Å²	55	50 Å²	50	28%	0.282	26%	0.255	S	S	.	.	H	α-helix	trans	-65.5	-47.8	176.3	-63.6	179.4	0	0	0	109.7	H84 D89 C90 Q94 R95 A96	H84-I92 HydrophobicContact CB-CG2 3.95Å; D89-I92 HydrophobicContact CB-CB 4.24Å; D89-I92 HydrophobicContact CB-CD1 3.88Å; D89-I92 HydrophobicContact CB-CG1 3.98Å; D89-I92 PolarHBondContact O-N 3.31Å; C90-I92 VanDerWaalsContact C-N 3.34Å; C90-I92 PolarHBondContact O-N 2.8Å; I92-Q94 PolarHBondContact O-N 3Å; I92-R95 PolarHBondContact O-N 3.01Å; I92-A96 WeakPolarHBondContact O-CB 3.47Å; I92-A96 PolarHBondContact O-N 3.35Å
93	R	94.8	Very high	95.2	Very high	18 Å²	18	49.2 Å²	49.2	7%	0.068	25%	0.252	C	S	.	.	H	α-helix	trans	-57	-52.1	176	-65.7	-161.3	-56.4	-79.2	-0.9	111.1	L85 S87 S88 D89 C90 R95 A96 T97 E144	L85-R93 WeakPolarHBondContact O-CD 3.23Å; L85-R93 WeakPolarHBondContact O-CG 3.48Å; S87-R93 VanDerWaalsContact O-CD 3.25Å; S87-R93 WeakPolarHBondContact O-CD 3.48Å; S87-R93 VanDerWaalsContact O-CG 3.27Å; S87-R93 WeakPolarHBondContact O-CG 3.44Å; S87-R93 PolarHBondContact O-NH1 3.41Å; S88-R93 PolarHBondContact O-NH1 3.42Å; D89-R93 PolarHBondContact O-N 3.25Å; C90-R93 PolarHBondContact O-N 3.49Å; R93-R95 VanDerWaalsContact C-N 3.31Å; R93-R95 PolarHBondContact O-N 3.37Å; R93-A96 WeakPolarHBondContact O-CB 3.49Å; R93-A96 PolarHBondContact O-N 3.48Å; R93-A96 VanDerWaalsContact O-N 3.09Å; R93-T97 PolarHBondContact O-N 3.03Å; R93-T97 PolarHBondContact O-OG1 3.28Å; R93-E144 IonicContact CZ-OE1 2.58Å; R93-E144 IonicContact NE-OE1 3.24Å; R93-E144 PolarHBondContact NE-OE1 3.42Å; R93-E144 IonicContact NH2-OE1 2.98Å; R93-E144 PolarHBondContact NH2-OE1 3.37Å
94	Q	94.3	Very high	95.3	Very high	71 Å²	71	44.4 Å²	44.4	33%	0.332	23%	0.226	S	C	.	.	H	α-helix	trans	-57.9	-41.5	-179.4	-74.1	179.2	12.2	0	0	112.7	C90 I92 R98	C90-Q94 WeakPolarHBondContact O-CB 3.39Å; C90-Q94 VanDerWaalsContact O-CG 3.27Å; C90-Q94 WeakPolarHBondContact O-CG 3.29Å; C90-Q94 PolarHBondContact O-N 3.07Å; C90-Q94 PolarHBondContact SG-NE2 3.23Å; I92-Q94 PolarHBondContact O-N 3Å; Q94-R98 WeakPolarHBondContact O-CB 3.34Å; Q94-R98 VanDerWaalsContact O-CG 3.28Å; Q94-R98 WeakPolarHBondContact O-CG 3.28Å; Q94-R98 PolarHBondContact O-N 3.49Å
95	R	95.5	Very high	95.3	Very high	112 Å²	112	41.7 Å²	41.7	42%	0.423	21%	0.213	S	C	.	.	H	α-helix	trans	-65.3	-41.3	176.9	-167.1	-179.9	-58.3	119.6	5.8	111.6	C53 E91 I92 R93 R98 S99	C53-R95 HydrophobicContact CB-CG 3.89Å; E91-R95 WeakPolarHBondContact O-CB 3.34Å; E91-R95 PolarHBondContact O-N 3.28Å; I92-R95 PolarHBondContact O-N 3.01Å; R93-R95 VanDerWaalsContact C-N 3.31Å; R93-R95 PolarHBondContact O-N 3.37Å; R95-R98 PolarHBondContact O-N 2.91Å; R95-S99 WeakPolarHBondContact O-CB 3.42Å; R95-S99 PolarHBondContact O-N 2.98Å
96	A	96.6	Very high	95.3	Very high	3 Å²	3	41.2 Å²	41.2	3%	0.025	21%	0.211	C	C	.	.	H	α-helix	trans	-65	-45.9	176.4	0	0	0	0	0	111.8	L81 H84 L85 I92 R93 R98 S99 L100	L81-A96 HydrophobicContact CD2-CB 4.34Å; H84-A96 HydrophobicContact CB-CB 3.63Å; L85-A96 HydrophobicContact CD2-CB 3.93Å; I92-A96 WeakPolarHBondContact O-CB 3.47Å; I92-A96 PolarHBondContact O-N 3.35Å; R93-A96 WeakPolarHBondContact O-CB 3.49Å; R93-A96 PolarHBondContact O-N 3.48Å; R93-A96 VanDerWaalsContact O-N 3.09Å; A96-R98 VanDerWaalsContact C-N 3.35Å; A96-R98 PolarHBondContact O-N 2.86Å; A96-S99 WeakPolarHBondContact O-CB 3.33Å; A96-S99 PolarHBondContact O-N 3.5Å; A96-L100 WeakPolarHBondContact O-CG 3.27Å; A96-L100 PolarHBondContact O-N 3.31Å
97	T	97	Very high	95.3	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-42	176.6	-43.3	0	0	0	0	111.6	L85 R93 L100 L101 I137 V208 L209 I212	L85-T97 WeakPolarHBondContact CD2-OG1 3.46Å; R93-T97 PolarHBondContact O-N 3.03Å; R93-T97 PolarHBondContact O-OG1 3.28Å; T97-L100 PolarHBondContact O-N 2.93Å; T97-L101 PolarHBondContact O-N 3.25Å; T97-I137 HydrophobicContact CG2-CD1 4.45Å; T97-V208 HydrophobicContact CG2-CB 4.37Å; T97-V208 HydrophobicContact CG2-CG1 3.5Å; T97-L209 HydrophobicContact CG2-CD2 3.45Å; T97-L209 VanDerWaalsContact CG2-CD2 3.45Å; T97-L209 HydrophobicContact CG2-CG 4.12Å; T97-I212 HydrophobicContact CG2-CD1 3.5Å; T97-I212 VanDerWaalsContact CG2-CD1 3.5Å
98	R	97.2	Very high	95.3	Very high	41 Å²	41	32.5 Å²	32.5	16%	0.155	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-41.1	175.2	-75.2	179.5	176.9	-107	6.3	112.6	N50 C53 Q94 R95 A96 L101 Y102 V208	N50-R98 WeakPolarHBondContact OD1-CB 3.49Å; N50-R98 VanDerWaalsContact OD1-CG 3.3Å; N50-R98 WeakPolarHBondContact OD1-CG 3.42Å; N50-R98 PolarHBondContact OD1-NH1 2.75Å; C53-R98 HydrophobicContact CB-CB 4.18Å; Q94-R98 WeakPolarHBondContact O-CB 3.34Å; Q94-R98 VanDerWaalsContact O-CG 3.28Å; Q94-R98 WeakPolarHBondContact O-CG 3.28Å; Q94-R98 PolarHBondContact O-N 3.49Å; R95-R98 PolarHBondContact O-N 2.91Å; A96-R98 VanDerWaalsContact C-N 3.35Å; A96-R98 PolarHBondContact O-N 2.86Å; R98-L101 PolarHBondContact O-N 3.46Å; R98-Y102 PolarHBondContact O-N 3.04Å; R98-V208 HydrophobicContact CG-CG1 4.46Å; R98-V208 HydrophobicContact CG-CG2 4.32Å
99	S	96.9	Very high	95.2	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.007	14%	0.137	C	C	.	.	H	α-helix	trans	-60.4	-45.9	174.2	-177.8	0	0	0	0	111.5	F54 R95 A96 L101 Y102 L103	F54-S99 WeakPolarHBondContact CA-OG 3.3Å; F54-S99 WeakPolarHBondContact CD2-OG 3.49Å; R95-S99 WeakPolarHBondContact O-CB 3.42Å; R95-S99 PolarHBondContact O-N 2.98Å; A96-S99 WeakPolarHBondContact O-CB 3.33Å; A96-S99 PolarHBondContact O-N 3.5Å; S99-L101 PolarHBondContact O-N 3.32Å; S99-Y102 PolarHBondContact O-N 3.5Å; S99-L103 PolarHBondContact O-N 2.89Å
100	L	97.6	Very high	95	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.1	-42.3	175.2	-74.4	165.3	0	0	0	111.9	L81 L85 A96 T97 Y102 L103 L104 L133 I212	L81-L100 HydrophobicContact CB-CD1 4.31Å; L81-L100 HydrophobicContact CB-CD2 4.02Å; L81-L100 HydrophobicContact CB-CG 4.06Å; L81-L100 HydrophobicContact CD1-CD2 3.78Å; L81-L100 HydrophobicContact CD1-CG 3.93Å; L85-L100 HydrophobicContact CD1-CD1 3.77Å; L85-L100 HydrophobicContact CD2-CD1 4.09Å; L85-L100 HydrophobicContact CG-CD1 4.15Å; A96-L100 WeakPolarHBondContact O-CG 3.27Å; A96-L100 PolarHBondContact O-N 3.31Å; T97-L100 PolarHBondContact O-N 2.93Å; L100-Y102 PolarHBondContact O-N 2.94Å; L100-L103 WeakPolarHBondContact O-CB 3.43Å; L100-L103 PolarHBondContact O-N 3.37Å; L100-L104 WeakPolarHBondContact O-CG 3.29Å; L100-L104 PolarHBondContact O-N 3.21Å; L100-L133 HydrophobicContact CD1-CD1 3.78Å; L100-L133 HydrophobicContact CD2-CD1 4.28Å; L100-I212 HydrophobicContact CB-CD1 4.07Å
101	L	97.7	Very high	94.8	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.021	12%	0.118	C	C	.	.	H	α-helix	trans	-61.3	-43.7	176.9	-179.8	59	0	0	0	111.6	T97 R98 S99 L103 L104 Q105 V208 I212 I215	T97-L101 PolarHBondContact O-N 3.25Å; R98-L101 PolarHBondContact O-N 3.46Å; S99-L101 PolarHBondContact O-N 3.32Å; L101-L103 VanDerWaalsContact C-N 3.3Å; L101-L103 PolarHBondContact O-N 2.89Å; L101-L104 PolarHBondContact O-N 2.93Å; L101-Q105 HydrophobicContact CD1-CG 4.24Å; L101-Q105 HydrophobicContact CG-CG 4.4Å; L101-Q105 WeakPolarHBondContact O-CB 3.21Å; L101-Q105 WeakPolarHBondContact O-CG 2.98Å; L101-Q105 PolarHBondContact O-N 3.13Å; L101-V208 HydrophobicContact CB-CG1 3.95Å; L101-V208 HydrophobicContact CD2-CB 4.24Å; L101-V208 HydrophobicContact CD2-CG1 3.75Å; L101-V208 HydrophobicContact CD2-CG2 4.19Å; L101-V208 HydrophobicContact CG-CG1 4.47Å; L101-I212 HydrophobicContact CB-CD1 4.27Å; L101-I212 HydrophobicContact CB-CG1 3.99Å; L101-I212 HydrophobicContact CD1-CG1 4.02Å; L101-I215 HydrophobicContact CD1-CD1 3.63Å
102	Y	97.6	Very high	94.6	Very high	1 Å²	1	26.7 Å²	26.7	0%	0.004	13%	0.128	C	C	.	.	H	α-helix	trans	-60.1	-40.8	175.3	174.5	-104.8	0	0	0	112.5	R51 F54 R98 S99 L100 Q105 G106 N107 F108 G109	R51-Y102 HydrophobicContact CB-CD2 3.78Å; R51-Y102 HydrophobicContact CB-CE2 3.6Å; R51-Y102 HydrophobicContact CB-CG 4.42Å; R51-Y102 HydrophobicContact CG-CD2 4.44Å; R51-Y102 HydrophobicContact CG-CE2 3.8Å; F54-Y102 HydrophobicContact CB-CD1 3.46Å; F54-Y102 VanDerWaalsContact CB-CD1 3.46Å; F54-Y102 HydrophobicContact CB-CE1 4.12Å; F54-Y102 HydrophobicContact CB-CG 4.19Å; F54-Y102 AromaticContact CD1-CD1 3.62Å; F54-Y102 HydrophobicContact CD1-CD1 3.62Å; F54-Y102 AromaticContact CD1-CE1 3.47Å; F54-Y102 HydrophobicContact CD1-CE1 3.47Å; F54-Y102 VanDerWaalsContact CD1-CE1 3.47Å; F54-Y102 HydrophobicContact CD2-CD1 4.02Å; F54-Y102 HydrophobicContact CE1-CD1 4.36Å; F54-Y102 HydrophobicContact CE1-CE1 4.01Å; F54-Y102 AromaticContact CG-CD1 3.42Å; F54-Y102 HydrophobicContact CG-CD1 3.42Å; F54-Y102 VanDerWaalsContact CG-CD1 3.42Å; F54-Y102 AromaticContact CG-CE1 3.83Å; F54-Y102 HydrophobicContact CG-CE1 3.83Å; R98-Y102 PolarHBondContact O-N 3.04Å; S99-Y102 PolarHBondContact O-N 3.5Å; L100-Y102 PolarHBondContact O-N 2.94Å; Y102-Q105 WeakPolarHBondContact O-CB 3.44Å; Y102-Q105 PolarHBondContact O-N 3.33Å; Y102-G106 PolarHBondContact O-N 3.46Å; Y102-N107 HydrophobicContact CE1-CB 4.24Å; Y102-N107 WeakPolarHBondContact CE1-ND2 3.28Å; Y102-N107 PolarHBondContact O-N 2.85Å; Y102-F108 HydrophobicContact CD2-CD1 4.18Å; Y102-F108 AromaticContact CD2-CE1 3.5Å; Y102-F108 HydrophobicContact CD2-CE1 3.5Å; Y102-F108 VanDerWaalsContact CD2-CE1 3.5Å; Y102-F108 AromaticContact CD2-CZ 3.77Å; Y102-F108 HydrophobicContact CD2-CZ 3.77Å; Y102-F108 AromaticContact CE2-CD1 3.94Å; Y102-F108 HydrophobicContact CE2-CD1 3.94Å; Y102-F108 HydrophobicContact CE2-CD2 4.45Å; Y102-F108 AromaticContact CE2-CE1 3.54Å; Y102-F108 HydrophobicContact CE2-CE1 3.54Å; Y102-F108 HydrophobicContact CE2-CE2 4.07Å; Y102-F108 HydrophobicContact CE2-CG 4.37Å; Y102-F108 AromaticContact CE2-CZ 3.59Å; Y102-F108 HydrophobicContact CE2-CZ 3.59Å; Y102-G109 PolarHBondContact OH-N 3.29Å
103	L	96.2	Very high	94.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.2	-46.8	175.4	-179.3	68.8	0	0	0	111.3	F54 W66 I78 S99 L100 L101 Q105 G106 N107 N124	F54-L103 HydrophobicContact CE2-CD1 4.22Å; W66-L103 HydrophobicContact CD2-CD1 3.95Å; W66-L103 HydrophobicContact CE3-CD1 4.44Å; W66-L103 HydrophobicContact CH2-CD1 3.84Å; W66-L103 HydrophobicContact CH2-CD2 4.34Å; W66-L103 HydrophobicContact CZ2-CD1 3.29Å; W66-L103 HydrophobicContact CZ2-CD2 4.28Å; W66-L103 HydrophobicContact CZ2-CG 4.39Å; W66-L103 HydrophobicContact CZ3-CD1 4.38Å; I78-L103 HydrophobicContact CD1-CD2 4.01Å; I78-L103 HydrophobicContact CG1-CD2 3.81Å; S99-L103 PolarHBondContact O-N 2.89Å; L100-L103 WeakPolarHBondContact O-CB 3.43Å; L100-L103 PolarHBondContact O-N 3.37Å; L101-L103 VanDerWaalsContact C-N 3.3Å; L101-L103 PolarHBondContact O-N 2.89Å; L103-Q105 VanDerWaalsContact C-N 3.28Å; L103-Q105 PolarHBondContact O-N 2.97Å; L103-G106 PolarHBondContact O-N 3.31Å; L103-N107 WeakPolarHBondContact CD1-OD1 3.26Å; L103-N124 HydrophobicContact CD1-CB 4.23Å; L103-N124 WeakPolarHBondContact CD1-ND2 3.49Å; L103-N124 HydrophobicContact CG-CB 4.08Å; L103-N124 WeakPolarHBondContact O-CB 3.47Å; L103-N124 PolarHBondContact O-ND2 2.99Å
104	L	97.3	Very high	94	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-70	-23.9	177.7	-62.5	-175.2	0	0	0	113.4	L100 L101 G106 A121 V125 C128 L133 I212 I215 M216	L100-L104 WeakPolarHBondContact O-CG 3.29Å; L100-L104 PolarHBondContact O-N 3.21Å; L101-L104 PolarHBondContact O-N 2.93Å; L104-G106 PolarHBondContact O-N 2.93Å; L104-A121 WeakPolarHBondContact O-CB 3.24Å; L104-V125 HydrophobicContact CD2-CB 4.33Å; L104-V125 HydrophobicContact CD2-CG2 3.78Å; L104-C128 HydrophobicContact CD2-CB 4.05Å; L104-L133 HydrophobicContact CD1-CD2 4.01Å; L104-I212 HydrophobicContact CD1-CB 4.14Å; L104-I212 HydrophobicContact CD1-CG1 4.15Å; L104-I212 HydrophobicContact CD1-CG2 3.61Å; L104-I215 HydrophobicContact CB-CD1 4.32Å; L104-I215 HydrophobicContact CB-CG2 4.15Å; L104-M216 HydrophobicContact CD1-CG 4.01Å; L104-M216 HydrophobicContact CD1-SD 4.44Å
105	Q	96.4	Very high	93.8	Very high	2 Å²	2	36 Å²	36	1%	0.009	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	6.4	168.1	-72.1	171	-26.6	0	0	112.8	Y39 F47 L101 Y102 L103 F108 Q117 I215 F721	Y39-Q105 VanDerWaalsContact CZ-NE2 3.28Å; Y39-Q105 PolarHBondContact OH-NE2 2.94Å; F47-Q105 VanDerWaalsContact CD1-NE2 3.33Å; L101-Q105 HydrophobicContact CD1-CG 4.24Å; L101-Q105 HydrophobicContact CG-CG 4.4Å; L101-Q105 WeakPolarHBondContact O-CB 3.21Å; L101-Q105 WeakPolarHBondContact O-CG 2.98Å; L101-Q105 PolarHBondContact O-N 3.13Å; Y102-Q105 WeakPolarHBondContact O-CB 3.44Å; Y102-Q105 PolarHBondContact O-N 3.33Å; L103-Q105 VanDerWaalsContact C-N 3.28Å; L103-Q105 PolarHBondContact O-N 2.97Å; Q105-F108 HydrophobicContact CB-CD1 4.11Å; Q105-F108 HydrophobicContact CB-CE1 4.25Å; Q105-Q117 PolarHBondContact O-NE2 2.95Å; Q105-I215 HydrophobicContact CG-CD1 4.31Å; Q105-F721 HydrophobicContact CB-CE2 4.41Å; Q105-F721 HydrophobicContact CB-CZ 3.94Å; Q105-F721 HydrophobicContact CG-CE2 4.48Å; Q105-F721 HydrophobicContact CG-CZ 4.1Å
106	G	95	Very high	93.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.5	25.7	170.4	0	0	0	0	0	115.2	Y102 L103 L104 F108 A121	Y102-G106 PolarHBondContact O-N 3.46Å; L103-G106 PolarHBondContact O-N 3.31Å; L104-G106 PolarHBondContact O-N 2.93Å; G106-F108 PolarHBondContact O-N 3.32Å; G106-F108 VanDerWaalsContact O-N 3.1Å; G106-A121 VanDerWaalsContact CA-CA 3.5Å
107	N	93.3	Very high	93.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.172	C	C	.	.			trans	47.3	44.7	178	-58.7	84.1	0	0	0	112.5	F54 W66 F67 Y102 L103 G109 D110 N124	F54-N107 WeakPolarHBondContact CZ-ND2 3.39Å; W66-N107 VanDerWaalsContact CD1-OD1 3.25Å; F67-N107 HydrophobicContact CE1-CB 3.86Å; F67-N107 HydrophobicContact CZ-CB 3.98Å; Y102-N107 HydrophobicContact CE1-CB 4.24Å; Y102-N107 WeakPolarHBondContact CE1-ND2 3.28Å; Y102-N107 PolarHBondContact O-N 2.85Å; L103-N107 WeakPolarHBondContact CD1-OD1 3.26Å; N107-G109 PolarHBondContact O-N 3.31Å; N107-D110 PolarHBondContact O-N 3.04Å; N107-N124 PolarHBondContact OD1-ND2 2.98Å
108	F	92.8	Very high	93.3	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.018	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-52.4	-25.3	-172.7	58.7	-98.5	0	0	0	113.8	F47 Y102 Q105 G106 D110 C111 Q117 F721 L725 I726	F47-F108 HydrophobicContact CB-CZ 3.92Å; F47-F108 HydrophobicContact CD1-CE1 4.17Å; F47-F108 HydrophobicContact CD1-CZ 4.39Å; Y102-F108 HydrophobicContact CD2-CD1 4.18Å; Y102-F108 AromaticContact CD2-CE1 3.5Å; Y102-F108 HydrophobicContact CD2-CE1 3.5Å; Y102-F108 VanDerWaalsContact CD2-CE1 3.5Å; Y102-F108 AromaticContact CD2-CZ 3.77Å; Y102-F108 HydrophobicContact CD2-CZ 3.77Å; Y102-F108 AromaticContact CE2-CD1 3.94Å; Y102-F108 HydrophobicContact CE2-CD1 3.94Å; Y102-F108 HydrophobicContact CE2-CD2 4.45Å; Y102-F108 AromaticContact CE2-CE1 3.54Å; Y102-F108 HydrophobicContact CE2-CE1 3.54Å; Y102-F108 HydrophobicContact CE2-CE2 4.07Å; Y102-F108 HydrophobicContact CE2-CG 4.37Å; Y102-F108 AromaticContact CE2-CZ 3.59Å; Y102-F108 HydrophobicContact CE2-CZ 3.59Å; Q105-F108 HydrophobicContact CB-CD1 4.11Å; Q105-F108 HydrophobicContact CB-CE1 4.25Å; G106-F108 PolarHBondContact O-N 3.32Å; G106-F108 VanDerWaalsContact O-N 3.1Å; F108-D110 PolarHBondContact O-N 2.76Å; F108-C111 PolarHBondContact O-N 2.87Å; F108-C111 VanDerWaalsContact O-N 3.09Å; F108-Q117 HydrophobicContact CB-CG 3.91Å; F108-F721 HydrophobicContact CD1-CE2 4.09Å; F108-F721 HydrophobicContact CE1-CE2 4.45Å; F108-L725 HydrophobicContact CD1-CD1 4.39Å; F108-L725 HydrophobicContact CD2-CB 3.81Å; F108-L725 HydrophobicContact CD2-CD1 4.07Å; F108-L725 HydrophobicContact CE1-CD1 4.13Å; F108-L725 HydrophobicContact CE2-CB 4.05Å; F108-L725 HydrophobicContact CE2-CD1 3.81Å; F108-L725 HydrophobicContact CE2-CG 4.41Å; F108-L725 HydrophobicContact CG-CB 4.48Å; F108-L725 HydrophobicContact CG-CD1 4.38Å; F108-L725 HydrophobicContact CZ-CD1 3.86Å; F108-I726 HydrophobicContact CB-CD1 4.29Å; F108-I726 HydrophobicContact CB-CG1 4.18Å
109	G	89	Confident	93.1	Very high	23 Å²	23	37.8 Å²	37.8	24%	0.237	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-66	-16.3	178.4	0	0	0	0	0	115.2	Y102 N107	Y102-G109 PolarHBondContact OH-N 3.29Å; N107-G109 PolarHBondContact O-N 3.31Å
110	D	88.4	Confident	92.9	Very high	38 Å²	38	40.4 Å²	40.4	20%	0.203	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-103.8	-5.1	173.5	-76.6	-40.6	0	0	0	112.8	K65 F67 N107 F108	K65-D110 IonicContact NZ-OD1 3.43Å; F67-D110 HydrophobicContact CD2-CB 3.92Å; F67-D110 HydrophobicContact CE2-CB 3.29Å; F67-D110 HydrophobicContact CZ-CB 3.73Å; N107-D110 PolarHBondContact O-N 3.04Å; F108-D110 PolarHBondContact O-N 2.76Å
111	C	90.2	Very high	92.8	Very high	13 Å²	13	40.5 Å²	40.5	9%	0.088	21%	0.207	C	C	.	.			trans	-89.4	142.7	-177.2	-62.1	0	0	0	0	111.6	F108 D116 Q117 I726	F108-C111 PolarHBondContact O-N 2.87Å; F108-C111 VanDerWaalsContact O-N 3.09Å; C111-D116 HydrophobicContact CB-CB 4.41Å; C111-Q117 HydrophobicContact CB-CB 4.23Å; C111-Q117 VanDerWaalsContact SG-CA 3.6Å; C111-I726 HydrophobicContact CB-CD1 4.34Å
112	E	88.4	Confident	92.7	Very high	173 Å²	173	44.3 Å²	44.3	81%	0.808	22%	0.221	S	C	*	.	S	Bend	trans	-96.8	-28.1	171.6	-63.7	-176.8	180	0	0	112	I726	E112-I726 WeakPolarHBondContact O-CG2 3.41Å
113	L	89.3	Confident	92.5	Very high	100 Å²	100	47.7 Å²	47.7	52%	0.524	24%	0.237	S	C	.	.	S	Bend	trans	-123.2	151.7	-178.3	-59	174.1	0	0	0	111.3	E115 D116 Q117	L113-E115 VanDerWaalsContact C-N 3.28Å; L113-E115 PolarHBondContact O-N 3.46Å; L113-D116 PolarHBondContact O-N 3.04Å; L113-Q117 PolarHBondContact O-N 2.87Å
114	E	88.4	Confident	92.5	Very high	88 Å²	88	47.7 Å²	47.7	41%	0.411	24%	0.237	S	C	.	.	H	α-helix	trans	-64.3	-33.7	174.9	-60.4	-176.4	-155.9	0	0	112.3	D116 Q117 I118 P722 A723 I726	E114-D116 VanDerWaalsContact C-N 3.3Å; E114-D116 PolarHBondContact O-N 3.39Å; E114-Q117 WeakPolarHBondContact O-CB 3.17Å; E114-Q117 PolarHBondContact O-N 2.92Å; E114-I118 WeakPolarHBondContact O-CG1 3.49Å; E114-I118 PolarHBondContact O-N 3.1Å; E114-P722 HydrophobicContact CB-CG 4.21Å; E114-P722 HydrophobicContact CG-CG 4.08Å; E114-A723 WeakPolarHBondContact OE1-CA 3.36Å; E114-A723 VanDerWaalsContact OE1-CB 3.26Å; E114-A723 WeakPolarHBondContact OE1-CB 3.48Å; E114-I726 HydrophobicContact CG-CD1 4.36Å
115	E	89.8	Confident	92.4	Very high	151 Å²	151	47.7 Å²	47.7	71%	0.706	24%	0.237	S	C	*	.	H	α-helix	trans	-63.1	-37.1	177.9	-64.3	-175.8	178.4	0	0	112.1	L113 T119	L113-E115 VanDerWaalsContact C-N 3.28Å; L113-E115 PolarHBondContact O-N 3.46Å; E115-T119 WeakPolarHBondContact O-CB 3.33Å; E115-T119 PolarHBondContact O-N 3.49Å; E115-T119 PolarHBondContact O-OG1 2.95Å
116	D	90.7	Very high	92.4	Very high	68 Å²	68	48.5 Å²	48.5	36%	0.364	24%	0.24	S	C	.	.	H	α-helix	trans	-67.2	-43.3	176.1	-65.5	-31.6	0	0	0	110.5	C111 L113 E114 I118 T119 W120	C111-D116 HydrophobicContact CB-CB 4.41Å; L113-D116 PolarHBondContact O-N 3.04Å; E114-D116 VanDerWaalsContact C-N 3.3Å; E114-D116 PolarHBondContact O-N 3.39Å; D116-I118 PolarHBondContact O-N 3.02Å; D116-T119 PolarHBondContact O-N 3.2Å; D116-W120 VanDerWaalsContact O-CD1 3.29Å; D116-W120 PolarHBondContact O-N 3.32Å
117	Q	93.8	Very high	92.4	Very high	8 Å²	8	48.9 Å²	48.9	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-58.7	-46.8	176.9	178.4	-78.8	-37.5	0	0	111.3	Q105 F108 C111 L113 E114 T119 W120 A121 P722 I726	Q105-Q117 PolarHBondContact O-NE2 2.95Å; F108-Q117 HydrophobicContact CB-CG 3.91Å; C111-Q117 HydrophobicContact CB-CB 4.23Å; C111-Q117 VanDerWaalsContact SG-CA 3.6Å; L113-Q117 PolarHBondContact O-N 2.87Å; E114-Q117 WeakPolarHBondContact O-CB 3.17Å; E114-Q117 PolarHBondContact O-N 2.92Å; Q117-T119 VanDerWaalsContact C-N 3.31Å; Q117-T119 PolarHBondContact O-N 3.49Å; Q117-W120 PolarHBondContact O-N 2.89Å; Q117-A121 VanDerWaalsContact O-CB 3.24Å; Q117-A121 WeakPolarHBondContact O-CB 3.44Å; Q117-A121 PolarHBondContact O-N 3.25Å; Q117-P722 HydrophobicContact CG-CB 4.16Å; Q117-P722 HydrophobicContact CG-CG 4.49Å; Q117-I726 HydrophobicContact CB-CD1 3.69Å; Q117-I726 HydrophobicContact CG-CD1 4.08Å
118	I	93.5	Very high	92.5	Very high	32 Å²	32	48.9 Å²	48.9	16%	0.164	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-41.3	178.7	-68.1	171	0	0	0	110.5	Y31 E114 D116 A121 R122	Y31-I118 HydrophobicContact CD1-CG2 3.98Å; Y31-I118 HydrophobicContact CE1-CG2 3.87Å; E114-I118 WeakPolarHBondContact O-CG1 3.49Å; E114-I118 PolarHBondContact O-N 3.1Å; D116-I118 PolarHBondContact O-N 3.02Å; I118-A121 PolarHBondContact O-N 2.89Å; I118-R122 WeakPolarHBondContact O-CG 3.38Å; I118-R122 PolarHBondContact O-N 3Å
119	T	92.5	Very high	92.6	Very high	86 Å²	86	49.6 Å²	49.6	53%	0.528	25%	0.246	S	C	.	.	H	α-helix	trans	-62.9	-46.4	179.5	-59.1	0	0	0	0	111.3	E115 D116 Q117 R122 H123	E115-T119 WeakPolarHBondContact O-CB 3.33Å; E115-T119 PolarHBondContact O-N 3.49Å; E115-T119 PolarHBondContact O-OG1 2.95Å; D116-T119 PolarHBondContact O-N 3.2Å; Q117-T119 VanDerWaalsContact C-N 3.31Å; Q117-T119 PolarHBondContact O-N 3.49Å; T119-R122 PolarHBondContact O-N 3.24Å; T119-H123 PolarHBondContact O-N 3.44Å
120	W	94	Very high	92.8	Very high	57 Å²	57	53.6 Å²	53.6	22%	0.216	26%	0.258	C	S	.	.	H	α-helix	trans	-71.4	-37.2	177.6	-80.1	106.5	0	0	0	113.1	F67 D116 Q117 R122 H123 N124	F67-W120 HydrophobicContact CB-CH2 4.11Å; F67-W120 HydrophobicContact CB-CZ2 3.66Å; F67-W120 AromaticContact CD1-CD1 3.95Å; F67-W120 AromaticContact CD1-CD2 3.35Å; F67-W120 HydrophobicContact CD1-CD2 3.35Å; F67-W120 AromaticContact CD1-CE2 3.21Å; F67-W120 AromaticContact CD1-CE3 3.73Å; F67-W120 HydrophobicContact CD1-CE3 3.73Å; F67-W120 AromaticContact CD1-CG 3.84Å; F67-W120 HydrophobicContact CD1-CG 3.84Å; F67-W120 AromaticContact CD1-CH2 3.9Å; F67-W120 HydrophobicContact CD1-CH2 3.9Å; F67-W120 AromaticContact CD1-CZ2 3.52Å; F67-W120 HydrophobicContact CD1-CZ2 3.52Å; F67-W120 AromaticContact CD1-CZ3 3.99Å; F67-W120 HydrophobicContact CD1-CZ3 3.99Å; F67-W120 AromaticContact CD1-NE1 3.59Å; F67-W120 HydrophobicContact CE1-CB 3.97Å; F67-W120 AromaticContact CE1-CD1 3.54Å; F67-W120 AromaticContact CE1-CD2 3.41Å; F67-W120 HydrophobicContact CE1-CD2 3.41Å; F67-W120 VanDerWaalsContact CE1-CD2 3.41Å; F67-W120 AromaticContact CE1-CE2 3.64Å; F67-W120 AromaticContact CE1-CE3 3.98Å; F67-W120 HydrophobicContact CE1-CE3 3.98Å; F67-W120 AromaticContact CE1-CG 3.37Å; F67-W120 HydrophobicContact CE1-CG 3.37Å; F67-W120 HydrophobicContact CE1-CZ2 4.39Å; F67-W120 AromaticContact CE1-NE1 3.69Å; F67-W120 HydrophobicContact CG-CD2 4.29Å; F67-W120 AromaticContact CG-CE2 3.7Å; F67-W120 HydrophobicContact CG-CH2 4.37Å; F67-W120 AromaticContact CG-CZ2 3.75Å; F67-W120 HydrophobicContact CG-CZ2 3.75Å; F67-W120 AromaticContact CG-NE1 3.86Å; F67-W120 HydrophobicContact CZ-CB 4.49Å; F67-W120 AromaticContact CZ-CD1 3.74Å; F67-W120 HydrophobicContact CZ-CD2 4.36Å; F67-W120 AromaticContact CZ-CG 3.96Å; F67-W120 HydrophobicContact CZ-CG 3.96Å; D116-W120 VanDerWaalsContact O-CD1 3.29Å; D116-W120 PolarHBondContact O-N 3.32Å; Q117-W120 PolarHBondContact O-N 2.89Å; W120-R122 VanDerWaalsContact C-N 3.3Å; W120-R122 PolarHBondContact O-N 3.12Å; W120-H123 HydrophobicContact CE3-CB 4.45Å; W120-H123 AromaticContact CE3-CD2 3.82Å; W120-H123 AromaticContact CZ3-CD2 3.61Å; W120-H123 PolarHBondContact O-N 3.16Å; W120-N124 VanDerWaalsContact O-CB 3.28Å; W120-N124 WeakPolarHBondContact O-CB 3.46Å; W120-N124 PolarHBondContact O-N 3.11Å; W120-N124 PolarHBondContact O-ND2 3.42Å
121	A	95.2	Very high	93.1	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-56.1	-47.5	173	0	0	0	0	0	110.7	L104 G106 Q117 I118 N124 V125	L104-A121 WeakPolarHBondContact O-CB 3.24Å; G106-A121 VanDerWaalsContact CA-CA 3.5Å; Q117-A121 VanDerWaalsContact O-CB 3.24Å; Q117-A121 WeakPolarHBondContact O-CB 3.44Å; Q117-A121 PolarHBondContact O-N 3.25Å; I118-A121 PolarHBondContact O-N 2.89Å; A121-N124 PolarHBondContact O-N 3.01Å; A121-V125 VanDerWaalsContact O-CG2 3.23Å; A121-V125 WeakPolarHBondContact O-CG2 3.31Å; A121-V125 PolarHBondContact O-N 3.05Å
122	R	94.9	Very high	93.3	Very high	85 Å²	85	53.7 Å²	53.7	32%	0.321	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-50	175.8	-73.1	174.8	170.7	163.8	-1.8	112	I118 T119 W120 N124 V125 Y126 T219 D222	I118-R122 WeakPolarHBondContact O-CG 3.38Å; I118-R122 PolarHBondContact O-N 3Å; T119-R122 PolarHBondContact O-N 3.24Å; W120-R122 VanDerWaalsContact C-N 3.3Å; W120-R122 PolarHBondContact O-N 3.12Å; R122-N124 VanDerWaalsContact C-N 3.33Å; R122-N124 PolarHBondContact O-N 3.4Å; R122-V125 PolarHBondContact O-N 3.19Å; R122-Y126 WeakPolarHBondContact O-CD2 3.4Å; R122-Y126 PolarHBondContact O-N 2.77Å; R122-T219 HydrophobicContact CB-CG2 4.33Å; R122-T219 HydrophobicContact CG-CG2 3.93Å; R122-D222 IonicContact CZ-OD2 3.27Å; R122-D222 IonicContact NE-OD2 2.92Å; R122-D222 IonicContact NH2-OD2 2.61Å; R122-D222 PolarHBondContact NH2-OD2 3.49Å
123	H	93.7	Very high	93.6	Very high	72 Å²	72	45.4 Å²	45.4	33%	0.333	23%	0.23	S	C	.	.	H	α-helix	trans	-57.1	-47.4	178.9	179	68.2	0	0	0	112.1	T119 W120 V125 Y126 L127	T119-H123 PolarHBondContact O-N 3.44Å; W120-H123 HydrophobicContact CE3-CB 4.45Å; W120-H123 AromaticContact CE3-CD2 3.82Å; W120-H123 AromaticContact CZ3-CD2 3.61Å; W120-H123 PolarHBondContact O-N 3.16Å; H123-V125 PolarHBondContact O-N 3.2Å; H123-Y126 PolarHBondContact O-N 3.36Å; H123-L127 WeakPolarHBondContact O-CB 3.49Å; H123-L127 PolarHBondContact O-N 3.47Å; H123-L127 VanDerWaalsContact O-N 3.08Å
124	N	95.5	Very high	93.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.5	-38.8	-179	-69.4	-16.2	0	0	0	112.4	W66 L103 N107 W120 A121 R122 Y126 L127 C128	W66-N124 PolarHBondContact NE1-OD1 3.5Å; L103-N124 HydrophobicContact CD1-CB 4.23Å; L103-N124 WeakPolarHBondContact CD1-ND2 3.49Å; L103-N124 HydrophobicContact CG-CB 4.08Å; L103-N124 WeakPolarHBondContact O-CB 3.47Å; L103-N124 PolarHBondContact O-ND2 2.99Å; N107-N124 PolarHBondContact OD1-ND2 2.98Å; W120-N124 VanDerWaalsContact O-CB 3.28Å; W120-N124 WeakPolarHBondContact O-CB 3.46Å; W120-N124 PolarHBondContact O-N 3.11Å; W120-N124 PolarHBondContact O-ND2 3.42Å; A121-N124 PolarHBondContact O-N 3.01Å; R122-N124 VanDerWaalsContact C-N 3.33Å; R122-N124 PolarHBondContact O-N 3.4Å; N124-Y126 PolarHBondContact O-N 3.05Å; N124-L127 PolarHBondContact O-N 3.03Å; N124-C128 WeakPolarHBondContact O-CB 3.11Å; N124-C128 PolarHBondContact O-N 3.45Å; N124-C128 PolarHBondContact O-SG 3.08Å
125	V	96.7	Very high	94.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-57.7	-49.3	175	167.2	0	0	0	0	110.9	L104 A121 R122 H123 L127 C128 I129 I215 M216 T219	L104-V125 HydrophobicContact CD2-CB 4.33Å; L104-V125 HydrophobicContact CD2-CG2 3.78Å; A121-V125 VanDerWaalsContact O-CG2 3.23Å; A121-V125 WeakPolarHBondContact O-CG2 3.31Å; A121-V125 PolarHBondContact O-N 3.05Å; R122-V125 PolarHBondContact O-N 3.19Å; H123-V125 PolarHBondContact O-N 3.2Å; V125-L127 PolarHBondContact O-N 3.22Å; V125-C128 PolarHBondContact O-N 3Å; V125-I129 HydrophobicContact CG1-CD1 3.7Å; V125-I129 HydrophobicContact CG1-CG1 4.39Å; V125-I129 VanDerWaalsContact O-CG1 3.29Å; V125-I129 WeakPolarHBondContact O-CG1 3.2Å; V125-I129 PolarHBondContact O-N 3.06Å; V125-I215 HydrophobicContact CG2-CG2 3.85Å; V125-M216 HydrophobicContact CG1-CB 4.46Å; V125-M216 HydrophobicContact CG1-CG 4.38Å; V125-T219 HydrophobicContact CB-CG2 3.89Å; V125-T219 HydrophobicContact CG1-CG2 3.84Å; V125-T219 HydrophobicContact CG2-CG2 4.05Å
126	Y	95.2	Very high	94.5	Very high	20 Å²	20	35 Å²	35	8%	0.078	18%	0.183	C	C	.	.	H	α-helix	trans	-64.1	-42.9	-179.7	-73	-66.4	0	0	0	112.2	R122 H123 N124 C128 I129 E130 V220 M256 L259 R260	R122-Y126 WeakPolarHBondContact O-CD2 3.4Å; R122-Y126 PolarHBondContact O-N 2.77Å; H123-Y126 PolarHBondContact O-N 3.36Å; N124-Y126 PolarHBondContact O-N 3.05Å; Y126-C128 VanDerWaalsContact C-N 3.29Å; Y126-C128 PolarHBondContact O-N 3.33Å; Y126-I129 PolarHBondContact O-N 3.37Å; Y126-I129 VanDerWaalsContact O-N 3.15Å; Y126-E130 WeakPolarHBondContact O-CG 3.44Å; Y126-E130 PolarHBondContact O-N 3.39Å; Y126-V220 HydrophobicContact CE1-CG2 4.41Å; Y126-M256 HydrophobicContact CD1-CE 4.32Å; Y126-M256 HydrophobicContact CD1-CG 3.93Å; Y126-M256 HydrophobicContact CD1-SD 3.22Å; Y126-M256 WeakPolarHBondContact CD1-SD 3.17Å; Y126-M256 HydrophobicContact CD2-CE 3.87Å; Y126-M256 HydrophobicContact CD2-CG 4.46Å; Y126-M256 HydrophobicContact CD2-SD 3.83Å; Y126-M256 HydrophobicContact CE1-CG 3.75Å; Y126-M256 HydrophobicContact CE1-SD 3.71Å; Y126-M256 HydrophobicContact CE2-CE 4.49Å; Y126-M256 HydrophobicContact CE2-CG 4.35Å; Y126-M256 HydrophobicContact CE2-SD 4.29Å; Y126-M256 HydrophobicContact CG-CE 3.78Å; Y126-M256 HydrophobicContact CG-CG 4.27Å; Y126-M256 HydrophobicContact CG-SD 3.27Å; Y126-L259 HydrophobicContact CD1-CD2 4.03Å; Y126-R260 HydrophobicContact CE1-CG 3.82Å; Y126-R260 WeakPolarHBondContact OH-CD 3.4Å; Y126-R260 PolarHBondContact OH-NH1 3.49Å
127	L	94.4	Very high	94.8	Very high	8 Å²	8	31.7 Å²	31.7	4%	0.042	17%	0.165	C	C	.	.	H	α-helix	trans	-58.7	-40.5	175.8	-176.2	66.4	0	0	0	112.5	W66 R74 H75 I78 H123 N124 V125 S131	W66-L127 HydrophobicContact CZ2-CD2 4.19Å; R74-L127 HydrophobicContact CB-CD2 3.86Å; H75-L127 WeakPolarHBondContact CE1-CD1 3.32Å; H75-L127 VanDerWaalsContact NE2-CD1 3.27Å; H75-L127 WeakPolarHBondContact NE2-CD1 3.38Å; I78-L127 HydrophobicContact CD1-CB 4.35Å; I78-L127 HydrophobicContact CD1-CD2 3.39Å; I78-L127 HydrophobicContact CD1-CG 3.49Å; I78-L127 VanDerWaalsContact CD1-CG 3.49Å; H123-L127 WeakPolarHBondContact O-CB 3.49Å; H123-L127 PolarHBondContact O-N 3.47Å; H123-L127 VanDerWaalsContact O-N 3.08Å; N124-L127 PolarHBondContact O-N 3.03Å; V125-L127 PolarHBondContact O-N 3.22Å; L127-S131 PolarHBondContact O-N 2.97Å; L127-S131 PolarHBondContact O-OG 3.49Å
128	C	96.2	Very high	94.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-69.5	-37.7	175.7	-76	0	0	0	0	112.8	L104 N124 V125 Y126 S131 G132 L133	L104-C128 HydrophobicContact CD2-CB 4.05Å; N124-C128 WeakPolarHBondContact O-CB 3.11Å; N124-C128 PolarHBondContact O-N 3.45Å; N124-C128 PolarHBondContact O-SG 3.08Å; V125-C128 PolarHBondContact O-N 3Å; Y126-C128 VanDerWaalsContact C-N 3.29Å; Y126-C128 PolarHBondContact O-N 3.33Å; C128-S131 PolarHBondContact O-N 3.42Å; C128-G132 PolarHBondContact O-N 3.33Å; C128-L133 HydrophobicContact CB-CB 4.04Å; C128-L133 HydrophobicContact CB-CD2 3.55Å; C128-L133 HydrophobicContact CB-CG 4.42Å; C128-L133 WeakPolarHBondContact O-CB 3.49Å; C128-L133 PolarHBondContact O-N 2.96Å
129	I	94.9	Very high	94.9	Very high	19 Å²	19	35 Å²	35	10%	0.097	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-46.1	175.2	-69.4	166.8	0	0	0	110.2	V125 Y126 S131 G132 M216 V220 L259 F263	V125-I129 HydrophobicContact CG1-CD1 3.7Å; V125-I129 HydrophobicContact CG1-CG1 4.39Å; V125-I129 VanDerWaalsContact O-CG1 3.29Å; V125-I129 WeakPolarHBondContact O-CG1 3.2Å; V125-I129 PolarHBondContact O-N 3.06Å; Y126-I129 PolarHBondContact O-N 3.37Å; Y126-I129 VanDerWaalsContact O-N 3.15Å; I129-S131 PolarHBondContact O-N 3.41Å; I129-G132 PolarHBondContact O-N 3.32Å; I129-M216 HydrophobicContact CD1-CE 4.44Å; I129-M216 HydrophobicContact CG1-CE 3.54Å; I129-V220 HydrophobicContact CD1-CG2 3.42Å; I129-V220 VanDerWaalsContact CD1-CG2 3.42Å; I129-L259 HydrophobicContact CG2-CD1 3.96Å; I129-L259 HydrophobicContact CG2-CD2 4.18Å; I129-L259 HydrophobicContact CG2-CG 3.97Å; I129-F263 HydrophobicContact CD1-CD2 3.81Å; I129-F263 HydrophobicContact CD1-CE2 3.88Å; I129-F263 HydrophobicContact CD1-CG 4.42Å; I129-F263 HydrophobicContact CG1-CD2 3.99Å; I129-F263 HydrophobicContact CG1-CE2 4.01Å; I129-F263 HydrophobicContact CG2-CD2 3.91Å
130	E	93.2	Very high	95	Very high	106 Å²	106	31.5 Å²	31.5	50%	0.495	16%	0.158	S	C	.	.	H	α-helix	trans	-58.4	-31	175.5	-70.1	-179.6	167.8	0	0	112.4	Y126 G132 L259	Y126-E130 WeakPolarHBondContact O-CG 3.44Å; Y126-E130 PolarHBondContact O-N 3.39Å; E130-G132 VanDerWaalsContact C-N 3.31Å; E130-G132 PolarHBondContact O-N 3.06Å; E130-L259 HydrophobicContact CG-CD1 4.04Å; E130-L259 HydrophobicContact CG-CD2 3.48Å; E130-L259 VanDerWaalsContact CG-CD2 3.48Å; E130-L259 HydrophobicContact CG-CG 4.41Å
131	S	93.9	Very high	95.1	Very high	14 Å²	14	28.9 Å²	28.9	10%	0.098	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-4.7	178.1	-61.9	0	0	0	0	114.3	Q79 L82 L127 C128 I129	Q79-S131 PolarHBondContact NE2-O 3.25Å; L82-S131 WeakPolarHBondContact CD1-O 3.23Å; L127-S131 PolarHBondContact O-N 2.97Å; L127-S131 PolarHBondContact O-OG 3.49Å; C128-S131 PolarHBondContact O-N 3.42Å; I129-S131 PolarHBondContact O-N 3.41Å
132	G	94.3	Very high	95	Very high	39 Å²	39	30 Å²	30	40%	0.402	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.5	17.1	178.8	0	0	0	0	0	115.6	C128 I129 E130 L134 Q135	C128-G132 PolarHBondContact O-N 3.33Å; I129-G132 PolarHBondContact O-N 3.32Å; E130-G132 VanDerWaalsContact C-N 3.31Å; E130-G132 PolarHBondContact O-N 3.06Å; G132-L134 VanDerWaalsContact C-N 3.26Å; G132-L134 PolarHBondContact O-N 3.03Å; G132-Q135 PolarHBondContact O-N 3.39Å
133	L	96.2	Very high	94.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.7	-32.4	-175.1	-179.1	64	0	0	0	113.9	L82 L85 L100 L104 C128 Q135 A136 I137 I212 M216	L82-L133 HydrophobicContact CD2-CB 4.31Å; L82-L133 HydrophobicContact CD2-CD1 3.55Å; L85-L133 HydrophobicContact CD1-CD1 4.31Å; L100-L133 HydrophobicContact CD1-CD1 3.78Å; L100-L133 HydrophobicContact CD2-CD1 4.28Å; L104-L133 HydrophobicContact CD1-CD2 4.01Å; C128-L133 HydrophobicContact CB-CB 4.04Å; C128-L133 HydrophobicContact CB-CD2 3.55Å; C128-L133 HydrophobicContact CB-CG 4.42Å; C128-L133 WeakPolarHBondContact O-CB 3.49Å; C128-L133 PolarHBondContact O-N 2.96Å; L133-Q135 PolarHBondContact O-N 3.47Å; L133-A136 PolarHBondContact O-N 3.04Å; L133-I137 HydrophobicContact CD1-CD1 3.95Å; L133-I137 HydrophobicContact CD1-CG1 3.47Å; L133-I137 VanDerWaalsContact CD1-CG1 3.47Å; L133-I137 HydrophobicContact CG-CG1 3.87Å; L133-I137 VanDerWaalsContact O-CG1 3.3Å; L133-I137 WeakPolarHBondContact O-CG1 3.3Å; L133-I137 PolarHBondContact O-N 3.49Å; L133-I212 HydrophobicContact CD2-CG2 4.13Å; L133-M216 HydrophobicContact CB-CE 4.07Å; L133-M216 HydrophobicContact CD2-CE 4.21Å; L133-M216 HydrophobicContact CD2-SD 3.81Å; L133-M216 HydrophobicContact CG-CE 4.16Å; L133-M216 HydrophobicContact CG-SD 4.05Å
134	L	95.7	Very high	94.8	Very high	12 Å²	12	29.7 Å²	29.7	6%	0.063	16%	0.155	C	C	.	.	H	α-helix	trans	-58.9	-53	-175.4	176.6	64.4	0	0	0	111.4	G132 I137 I138 L213 M216 F263 D266 L267	G132-L134 VanDerWaalsContact C-N 3.26Å; G132-L134 PolarHBondContact O-N 3.03Å; L134-I137 PolarHBondContact O-N 2.85Å; L134-I138 HydrophobicContact CD1-CD1 3.8Å; L134-I138 HydrophobicContact CD1-CG1 4.31Å; L134-I138 HydrophobicContact CG-CD1 3.93Å; L134-I138 WeakPolarHBondContact O-CG1 3.45Å; L134-I138 PolarHBondContact O-N 3.22Å; L134-L213 HydrophobicContact CD1-CD2 3.94Å; L134-M216 HydrophobicContact CB-CE 4Å; L134-F263 HydrophobicContact CB-CE2 4.16Å; L134-F263 HydrophobicContact CD1-CE2 3.9Å; L134-F263 HydrophobicContact CD1-CZ 4.25Å; L134-F263 HydrophobicContact CD2-CD2 3.8Å; L134-F263 HydrophobicContact CD2-CE2 3.69Å; L134-F263 HydrophobicContact CD2-CZ 4.44Å; L134-F263 HydrophobicContact CG-CE2 4.12Å; L134-D266 HydrophobicContact CD2-CB 4.02Å; L134-L267 HydrophobicContact CD1-CD2 3.96Å; L134-L267 HydrophobicContact CD2-CD2 4.22Å; L134-L267 HydrophobicContact CD2-CG 4.24Å
135	Q	94.2	Very high	94.7	Very high	82 Å²	82	30 Å²	30	38%	0.383	16%	0.157	S	C	.	.	H	α-helix	trans	-64.7	-45	-177.1	-174.1	62.6	21	0	0	110.8	G132 L133 I137 I138 E139	G132-Q135 PolarHBondContact O-N 3.39Å; L133-Q135 PolarHBondContact O-N 3.47Å; Q135-I137 VanDerWaalsContact C-N 3.31Å; Q135-I137 PolarHBondContact O-N 2.74Å; Q135-I138 PolarHBondContact O-N 3.25Å; Q135-E139 WeakPolarHBondContact CG-OE1 3.45Å; Q135-E139 PolarHBondContact NE2-OE1 3.03Å; Q135-E139 WeakPolarHBondContact O-CG 3.48Å; Q135-E139 PolarHBondContact O-N 3.45Å
136	A	95.2	Very high	94.4	Very high	25 Å²	25	36 Å²	36	21%	0.207	18%	0.184	C	C	.	.	H	α-helix	trans	-57.9	-41.7	178.6	0	0	0	0	0	112.6	L82 L85 L133 L140	L82-A136 HydrophobicContact CD2-CB 4.1Å; L85-A136 HydrophobicContact CD1-CB 4.23Å; L133-A136 PolarHBondContact O-N 3.04Å; A136-L140 VanDerWaalsContact O-CB 3.29Å; A136-L140 WeakPolarHBondContact O-CB 3.32Å; A136-L140 PolarHBondContact O-N 3.25Å
137	I	97	Very high	94.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-75.2	-34.2	179.5	-64.3	-70.7	0	0	0	112.1	L85 T97 L133 L134 Q135 L141 L209 I212 L213	L85-I137 HydrophobicContact CD1-CD1 3.85Å; T97-I137 HydrophobicContact CG2-CD1 4.45Å; L133-I137 HydrophobicContact CD1-CD1 3.95Å; L133-I137 HydrophobicContact CD1-CG1 3.47Å; L133-I137 VanDerWaalsContact CD1-CG1 3.47Å; L133-I137 HydrophobicContact CG-CG1 3.87Å; L133-I137 VanDerWaalsContact O-CG1 3.3Å; L133-I137 WeakPolarHBondContact O-CG1 3.3Å; L133-I137 PolarHBondContact O-N 3.49Å; L134-I137 PolarHBondContact O-N 2.85Å; Q135-I137 VanDerWaalsContact C-N 3.31Å; Q135-I137 PolarHBondContact O-N 2.74Å; I137-L141 VanDerWaalsContact O-CB 3.29Å; I137-L141 WeakPolarHBondContact O-CB 3.27Å; I137-L141 PolarHBondContact O-N 3.31Å; I137-L209 HydrophobicContact CD1-CD2 3.97Å; I137-L209 HydrophobicContact CG2-CD2 4.15Å; I137-I212 HydrophobicContact CD1-CD1 3.98Å; I137-I212 HydrophobicContact CD1-CG2 4.2Å; I137-I212 HydrophobicContact CG1-CG2 3.89Å; I137-I212 HydrophobicContact CG2-CG2 4.17Å; I137-L213 HydrophobicContact CB-CD2 4.21Å; I137-L213 HydrophobicContact CG2-CD1 4.12Å; I137-L213 HydrophobicContact CG2-CD2 3.71Å; I137-L213 HydrophobicContact CG2-CG 3.6Å
138	I	95.3	Very high	93.7	Very high	7 Å²	7	44.1 Å²	44.1	4%	0.036	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-47.8	174.1	-71.6	172.8	0	0	0	110.2	L134 Q135 L140 L141 L142 L213 I271 L279	L134-I138 HydrophobicContact CD1-CD1 3.8Å; L134-I138 HydrophobicContact CD1-CG1 4.31Å; L134-I138 HydrophobicContact CG-CD1 3.93Å; L134-I138 WeakPolarHBondContact O-CG1 3.45Å; L134-I138 PolarHBondContact O-N 3.22Å; Q135-I138 PolarHBondContact O-N 3.25Å; I138-L140 PolarHBondContact O-N 3.35Å; I138-L141 WeakPolarHBondContact O-CB 3.35Å; I138-L141 PolarHBondContact O-N 2.99Å; I138-L142 HydrophobicContact CG2-CD1 4.47Å; I138-L142 WeakPolarHBondContact O-CG 3.19Å; I138-L142 PolarHBondContact O-N 2.82Å; I138-L213 HydrophobicContact CG1-CD2 4.1Å; I138-I271 HydrophobicContact CG2-CD1 3.68Å; I138-I271 HydrophobicContact CG2-CG1 4.06Å; I138-I271 HydrophobicContact CG2-CG2 3.94Å; I138-L279 HydrophobicContact CD1-CD2 4.32Å
139	E	94	Very high	93.2	Very high	103 Å²	103	46.6 Å²	46.6	48%	0.481	24%	0.243	S	C	.	.	H	α-helix	trans	-61.9	-43.9	177.7	-71.4	175.8	-172.3	0	0	111.4	Q135 L141 L142 F143	Q135-E139 WeakPolarHBondContact CG-OE1 3.45Å; Q135-E139 PolarHBondContact NE2-OE1 3.03Å; Q135-E139 WeakPolarHBondContact O-CG 3.48Å; Q135-E139 PolarHBondContact O-N 3.45Å; E139-L141 VanDerWaalsContact C-N 3.33Å; E139-L141 PolarHBondContact O-N 2.74Å; E139-L142 PolarHBondContact O-N 3.33Å; E139-F143 WeakPolarHBondContact O-CB 3.44Å; E139-F143 PolarHBondContact O-N 3.36Å
140	L	95	Very high	92.8	Very high	12 Å²	12	47.5 Å²	47.5	6%	0.063	25%	0.245	C	C	.	.	H	α-helix	trans	-64.3	-37	175.6	-176.7	56.6	0	0	0	112.4	L85 A136 I138 F143 E144 L209	L85-L140 HydrophobicContact CB-CD2 4.38Å; L85-L140 HydrophobicContact CD2-CD2 3.86Å; A136-L140 VanDerWaalsContact O-CB 3.29Å; A136-L140 WeakPolarHBondContact O-CB 3.32Å; A136-L140 PolarHBondContact O-N 3.25Å; I138-L140 PolarHBondContact O-N 3.35Å; L140-F143 HydrophobicContact CD1-CD1 4.35Å; L140-F143 PolarHBondContact O-N 3.25Å; L140-E144 HydrophobicContact CD1-CG 3.93Å; L140-E144 HydrophobicContact CG-CG 4.33Å; L140-E144 WeakPolarHBondContact O-CB 3.34Å; L140-E144 VanDerWaalsContact O-CG 3.25Å; L140-E144 WeakPolarHBondContact O-CG 3.46Å; L140-E144 PolarHBondContact O-N 2.87Å; L140-L209 HydrophobicContact CB-CD2 4.41Å; L140-L209 HydrophobicContact CD2-CD2 3.65Å; L140-L209 HydrophobicContact CG-CD1 4.22Å; L140-L209 HydrophobicContact CG-CD2 3.92Å
141	L	95.9	Very high	91.5	Very high	1 Å²	1	45 Å²	45	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-62.1	-46.5	173.6	177.1	66.3	0	0	0	111.1	I137 I138 E139 F143 E144 I145 L206 L209 L210 L213 L279	I137-L141 VanDerWaalsContact O-CB 3.29Å; I137-L141 WeakPolarHBondContact O-CB 3.27Å; I137-L141 PolarHBondContact O-N 3.31Å; I138-L141 WeakPolarHBondContact O-CB 3.35Å; I138-L141 PolarHBondContact O-N 2.99Å; E139-L141 VanDerWaalsContact C-N 3.33Å; E139-L141 PolarHBondContact O-N 2.74Å; L141-F143 VanDerWaalsContact C-N 3.29Å; L141-F143 PolarHBondContact O-N 3.47Å; L141-E144 PolarHBondContact O-N 2.87Å; L141-I145 HydrophobicContact CD1-CG2 4.01Å; L141-I145 VanDerWaalsContact O-CG1 3.3Å; L141-I145 WeakPolarHBondContact O-CG1 3.39Å; L141-I145 WeakPolarHBondContact O-CG2 3.29Å; L141-I145 PolarHBondContact O-N 3.35Å; L141-L206 HydrophobicContact CD1-CD2 4.13Å; L141-L209 HydrophobicContact CD1-CB 4.48Å; L141-L210 HydrophobicContact CD1-CD2 4.3Å; L141-L210 HydrophobicContact CD2-CD2 4.21Å; L141-L213 HydrophobicContact CD2-CD1 3.87Å; L141-L279 HydrophobicContact CD2-CD1 4.33Å
142	L	93.8	Very high	89.5	Confident	24 Å²	24	49.6 Å²	49.6	13%	0.126	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-40.1	177.6	-69.6	179.4	0	0	0	112	I138 E139 I145 H146 Y147 I271 V282	I138-L142 HydrophobicContact CG2-CD1 4.47Å; I138-L142 WeakPolarHBondContact O-CG 3.19Å; I138-L142 PolarHBondContact O-N 2.82Å; E139-L142 PolarHBondContact O-N 3.33Å; L142-I145 HydrophobicContact CD2-CD1 4.23Å; L142-I145 WeakPolarHBondContact O-CG1 3.47Å; L142-H146 PolarHBondContact O-N 3.44Å; L142-Y147 HydrophobicContact CD2-CD1 4.35Å; L142-Y147 HydrophobicContact CD2-CD2 3.97Å; L142-Y147 HydrophobicContact CD2-CG 3.8Å; L142-Y147 WeakPolarHBondContact O-CB 3.4Å; L142-Y147 PolarHBondContact O-N 3.24Å; L142-I271 HydrophobicContact CD1-CD1 4.28Å; L142-I271 HydrophobicContact CD1-CG2 3.94Å; L142-V282 HydrophobicContact CD2-CB 4.48Å; L142-V282 HydrophobicContact CD2-CG1 3.89Å; L142-V282 HydrophobicContact CD2-CG2 3.71Å
143	F	92.6	Very high	86.9	Confident	116 Å²	116	53.4 Å²	53.4	51%	0.509	29%	0.286	S	S	.	.	H	α-helix	trans	-63.7	-49.3	175.7	-179.8	-100.4	0	0	0	112.1	E139 L140 L141 I145 H146	E139-F143 WeakPolarHBondContact O-CB 3.44Å; E139-F143 PolarHBondContact O-N 3.36Å; L140-F143 HydrophobicContact CD1-CD1 4.35Å; L140-F143 PolarHBondContact O-N 3.25Å; L141-F143 VanDerWaalsContact C-N 3.29Å; L141-F143 PolarHBondContact O-N 3.47Å; F143-I145 PolarHBondContact O-N 3.3Å; F143-H146 PolarHBondContact O-N 3.42Å; F143-H146 PolarHBondContact O-ND1 2.67Å
144	E	92.1	Very high	84	Confident	36 Å²	36	58.7 Å²	58.7	17%	0.168	32%	0.323	C	S	.	.	H	α-helix	trans	-72.1	-25.2	-176.1	-67.3	-74	155.9	0	0	113.3	R93 L140 L141 H146 N205 L206 L209	R93-E144 IonicContact CZ-OE1 2.58Å; R93-E144 IonicContact NE-OE1 3.24Å; R93-E144 PolarHBondContact NE-OE1 3.42Å; R93-E144 IonicContact NH2-OE1 2.98Å; R93-E144 PolarHBondContact NH2-OE1 3.37Å; L140-E144 HydrophobicContact CD1-CG 3.93Å; L140-E144 HydrophobicContact CG-CG 4.33Å; L140-E144 WeakPolarHBondContact O-CB 3.34Å; L140-E144 VanDerWaalsContact O-CG 3.25Å; L140-E144 WeakPolarHBondContact O-CG 3.46Å; L140-E144 PolarHBondContact O-N 2.87Å; L141-E144 PolarHBondContact O-N 2.87Å; E144-H146 VanDerWaalsContact C-N 3.28Å; E144-N205 PolarHBondContact OE1-ND2 3.45Å; E144-N205 PolarHBondContact OE2-ND2 3.33Å; E144-L206 HydrophobicContact CB-CD2 3.98Å; E144-L209 HydrophobicContact CB-CD1 4.2Å; E144-L209 HydrophobicContact CG-CD1 4.02Å
145	I	92.6	Very high	80.8	Confident	7 Å²	7	65.3 Å²	65.3	4%	0.036	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	3	170.6	72.3	-173.3	0	0	0	113.1	L141 L142 F143 Y147 W150 L206 V282 M286 F298	L141-I145 HydrophobicContact CD1-CG2 4.01Å; L141-I145 VanDerWaalsContact O-CG1 3.3Å; L141-I145 WeakPolarHBondContact O-CG1 3.39Å; L141-I145 WeakPolarHBondContact O-CG2 3.29Å; L141-I145 PolarHBondContact O-N 3.35Å; L142-I145 HydrophobicContact CD2-CD1 4.23Å; L142-I145 WeakPolarHBondContact O-CG1 3.47Å; F143-I145 PolarHBondContact O-N 3.3Å; I145-Y147 VanDerWaalsContact C-N 3.32Å; I145-Y147 HydrophobicContact CD1-CD2 4.25Å; I145-Y147 PolarHBondContact O-N 3.45Å; I145-W150 HydrophobicContact CB-CZ2 4.34Å; I145-W150 HydrophobicContact CD1-CH2 3.99Å; I145-W150 HydrophobicContact CD1-CZ2 3.72Å; I145-W150 HydrophobicContact CG1-CZ2 4.05Å; I145-W150 PolarHBondContact O-NE1 3.42Å; I145-L206 HydrophobicContact CG2-CD1 4.41Å; I145-L206 HydrophobicContact CG2-CD2 3.64Å; I145-V282 HydrophobicContact CD1-CG1 3.64Å; I145-M286 HydrophobicContact CG2-CE 4.06Å; I145-F298 HydrophobicContact CB-CE1 4.45Å; I145-F298 HydrophobicContact CB-CZ 4.3Å; I145-F298 HydrophobicContact CG2-CE1 4.16Å; I145-F298 HydrophobicContact CG2-CZ 4.35Å
146	H	91	Very high	77.6	Confident	125 Å²	125	64.3 Å²	64.3	58%	0.579	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	51	-175.5	-59.1	-65.1	0	0	0	112.5	L142 F143 E144 D148 S149 W150	L142-H146 PolarHBondContact O-N 3.44Å; F143-H146 PolarHBondContact O-N 3.42Å; F143-H146 PolarHBondContact O-ND1 2.67Å; E144-H146 VanDerWaalsContact C-N 3.28Å; H146-D148 PolarHBondContact O-N 3.45Å; H146-D148 VanDerWaalsContact O-N 3.16Å; H146-S149 WeakPolarHBondContact O-CB 3.25Å; H146-S149 PolarHBondContact O-N 2.94Å; H146-S149 PolarHBondContact O-OG 3.49Å; H146-W150 VanDerWaalsContact O-CD1 3.32Å
147	Y	89.4	Confident	74.4	Confident	55 Å²	55	70.6 Å²	70.6	22%	0.216	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-55.1	-36.6	-172	-174	-95.9	0	0	0	113.1	L142 I145 S149 W150 L277 V282	L142-Y147 HydrophobicContact CD2-CD1 4.35Å; L142-Y147 HydrophobicContact CD2-CD2 3.97Å; L142-Y147 HydrophobicContact CD2-CG 3.8Å; L142-Y147 WeakPolarHBondContact O-CB 3.4Å; L142-Y147 PolarHBondContact O-N 3.24Å; I145-Y147 VanDerWaalsContact C-N 3.32Å; I145-Y147 HydrophobicContact CD1-CD2 4.25Å; I145-Y147 PolarHBondContact O-N 3.45Å; Y147-S149 PolarHBondContact O-N 3.02Å; Y147-W150 AromaticContact CD2-CD2 3.62Å; Y147-W150 HydrophobicContact CD2-CD2 3.62Å; Y147-W150 AromaticContact CD2-CE2 3.96Å; Y147-W150 AromaticContact CD2-CE3 3.47Å; Y147-W150 HydrophobicContact CD2-CE3 3.47Å; Y147-W150 VanDerWaalsContact CD2-CE3 3.47Å; Y147-W150 HydrophobicContact CD2-CG 4.21Å; Y147-W150 HydrophobicContact CD2-CH2 4.04Å; Y147-W150 HydrophobicContact CD2-CZ2 4.2Å; Y147-W150 AromaticContact CD2-CZ3 3.66Å; Y147-W150 HydrophobicContact CD2-CZ3 3.66Å; Y147-W150 AromaticContact CE2-CD2 3.88Å; Y147-W150 HydrophobicContact CE2-CD2 3.88Å; Y147-W150 AromaticContact CE2-CE3 3.26Å; Y147-W150 HydrophobicContact CE2-CE3 3.26Å; Y147-W150 HydrophobicContact CE2-CH2 4.27Å; Y147-W150 AromaticContact CE2-CZ3 3.47Å; Y147-W150 HydrophobicContact CE2-CZ3 3.47Å; Y147-W150 VanDerWaalsContact CE2-CZ3 3.47Å; Y147-W150 HydrophobicContact CG-CD2 4.46Å; Y147-W150 WeakPolarHBondContact O-CB 3.43Å; Y147-W150 VanDerWaalsContact O-CD1 3.22Å; Y147-W150 VanDerWaalsContact O-CG 3.23Å; Y147-W150 PolarHBondContact O-N 3.49Å; Y147-L277 HydrophobicContact CD1-CD2 4.14Å; Y147-L277 HydrophobicContact CE1-CD1 4.37Å; Y147-L277 HydrophobicContact CE1-CD2 3.41Å; Y147-L277 VanDerWaalsContact CE1-CD2 3.41Å; Y147-L277 HydrophobicContact CE2-CD1 4.27Å; Y147-L277 HydrophobicContact CE2-CD2 4.46Å; Y147-L277 WeakPolarHBondContact OH-CD1 3.28Å; Y147-V282 HydrophobicContact CE2-CG2 4.26Å
148	D	85.9	Confident	71.1	Confident	144 Å²	144	78.3 Å²	78.3	77%	0.77	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-57.2	-27.6	178.3	-57.5	-27.1	0	0	0	113.5	H146 W150	H146-D148 PolarHBondContact O-N 3.45Å; H146-D148 VanDerWaalsContact O-N 3.16Å; D148-W150 PolarHBondContact O-N 3.41Å
149	S	85.9	Confident	67.7	Low	52 Å²	52	83.8 Å²	83.8	36%	0.364	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-73.4	-13	177.4	72.8	0	0	0	0	113.6	H146 Y147 G151	H146-S149 WeakPolarHBondContact O-CB 3.25Å; H146-S149 PolarHBondContact O-N 2.94Å; H146-S149 PolarHBondContact O-OG 3.49Å; Y147-S149 PolarHBondContact O-N 3.02Å; S149-G151 VanDerWaalsContact C-N 3.31Å; S149-G151 PolarHBondContact O-N 3.04Å
150	W	84.7	Confident	64.5	Low	38 Å²	38	83.4 Å²	83.4	14%	0.144	49%	0.493	C	S	.	.	G	3₁₀ helix	trans	-70.4	-29.2	-172.7	-66.7	28.7	0	0	0	111.9	I145 H146 Y147 D148 M286 R289 F298	I145-W150 HydrophobicContact CB-CZ2 4.34Å; I145-W150 HydrophobicContact CD1-CH2 3.99Å; I145-W150 HydrophobicContact CD1-CZ2 3.72Å; I145-W150 HydrophobicContact CG1-CZ2 4.05Å; I145-W150 PolarHBondContact O-NE1 3.42Å; H146-W150 VanDerWaalsContact O-CD1 3.32Å; Y147-W150 AromaticContact CD2-CD2 3.62Å; Y147-W150 HydrophobicContact CD2-CD2 3.62Å; Y147-W150 AromaticContact CD2-CE2 3.96Å; Y147-W150 AromaticContact CD2-CE3 3.47Å; Y147-W150 HydrophobicContact CD2-CE3 3.47Å; Y147-W150 VanDerWaalsContact CD2-CE3 3.47Å; Y147-W150 HydrophobicContact CD2-CG 4.21Å; Y147-W150 HydrophobicContact CD2-CH2 4.04Å; Y147-W150 HydrophobicContact CD2-CZ2 4.2Å; Y147-W150 AromaticContact CD2-CZ3 3.66Å; Y147-W150 HydrophobicContact CD2-CZ3 3.66Å; Y147-W150 AromaticContact CE2-CD2 3.88Å; Y147-W150 HydrophobicContact CE2-CD2 3.88Å; Y147-W150 AromaticContact CE2-CE3 3.26Å; Y147-W150 HydrophobicContact CE2-CE3 3.26Å; Y147-W150 HydrophobicContact CE2-CH2 4.27Å; Y147-W150 AromaticContact CE2-CZ3 3.47Å; Y147-W150 HydrophobicContact CE2-CZ3 3.47Å; Y147-W150 VanDerWaalsContact CE2-CZ3 3.47Å; Y147-W150 HydrophobicContact CG-CD2 4.46Å; Y147-W150 WeakPolarHBondContact O-CB 3.43Å; Y147-W150 VanDerWaalsContact O-CD1 3.22Å; Y147-W150 VanDerWaalsContact O-CG 3.23Å; Y147-W150 PolarHBondContact O-N 3.49Å; D148-W150 PolarHBondContact O-N 3.41Å; W150-M286 HydrophobicContact CH2-CG 3.88Å; W150-M286 HydrophobicContact CZ2-CG 4.35Å; W150-R289 VanDerWaalsContact NE1-NH1 3.19Å; W150-F298 HydrophobicContact CZ2-CE2 4.47Å; W150-F298 HydrophobicContact CZ2-CZ 4.42Å
151	G	67.4	Low	61.4	Low	52 Å²	52	89.8 Å²	89.8	54%	0.536	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-29.6	-179.7	0	0	0	0	0	115	S149 N153	S149-G151 VanDerWaalsContact C-N 3.31Å; S149-G151 PolarHBondContact O-N 3.04Å; G151-N153 VanDerWaalsContact C-N 3.33Å; G151-N153 PolarHBondContact O-N 3.18Å
152	V	51.6	Low	57.9	Low	111 Å²	111	96.8 Å²	96.8	67%	0.673	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-70.7	-29.5	-172	-176.3	0	0	0	0	112.3	S154	V152-S154 VanDerWaalsContact C-N 3.32Å; V152-S154 PolarHBondContact O-N 3.42Å
153	N	38.6	Very low	54.5	Low	120 Å²	120	102.7 Å²	102.7	64%	0.642	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-81	-6.3	-174.6	-71.2	-23.9	0	0	0	114.6	G151	G151-N153 VanDerWaalsContact C-N 3.33Å; G151-N153 PolarHBondContact O-N 3.18Å
154	S	36.8	Very low	51.5	Low	111 Å²	111	103.3 Å²	103.3	78%	0.776	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-91.7	-6.4	179.9	-91.1	0	0	0	0	115	V152	V152-S154 VanDerWaalsContact C-N 3.32Å; V152-S154 PolarHBondContact O-N 3.42Å
155	I	28.2	Very low	48.2	Very low	150 Å²	150	107.8 Å²	107.8	77%	0.769	65%	0.645	S	S	*	*	S	Bend	trans	-114.9	-1.1	-174.3	-55.4	176.9	0	0	0	113.2	N157	I155-N157 PolarHBondContact O-N 3.32Å; I155-N157 VanDerWaalsContact O-N 3.09Å
156	G	26.2	Very low	44.8	Very low	62 Å²	62	113.6 Å²	113.6	64%	0.639	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	87	-179.2	0	0	0	0	0	113.5
157	N	27.4	Very low	41.5	Very low	157 Å²	157	115.9 Å²	115.9	84%	0.84	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.1	9.4	150.4	-106.6	0.3	0	0	0	117.7	I155	I155-N157 PolarHBondContact O-N 3.32Å; I155-N157 VanDerWaalsContact O-N 3.09Å
158	D	28.2	Very low	38.4	Very low	162 Å²	162	116.5 Å²	116.5	87%	0.866	73%	0.725	S	S	*	*			trans	-114	75.1	174.1	-72.7	-26.9	0	0	0	111.1
159	S	25.1	Very low	35.4	Very low	122 Å²	122	114.8 Å²	114.8	85%	0.853	72%	0.724	S	S	*	*			trans	-156.6	127.2	163.7	-74.1	0	0	0	0	110.2
160	A	25.9	Very low	32.5	Very low	95 Å²	95	118.7 Å²	118.7	79%	0.785	75%	0.746	S	S	*	*			trans	84.3	93.5	174.7	0	0	0	0	0	116.8
161	T	28.9	Very low	29.7	Very low	145 Å²	145	126.2 Å²	126.2	89%	0.89	78%	0.78	S	S	*	*				-158.6	112.7	109	35.5	0	0	0	0	110.5
162	N	22.9	Very low	27.8	Very low	149 Å²	149	129.8 Å²	129.8	80%	0.797	79%	0.793	S	S	*	*			trans	-72.8	153.3	165.1	-75.5	-23.4	0	0	0	111
163	N	24	Very low	26.6	Very low	147 Å²	147	127.6 Å²	127.6	79%	0.786	79%	0.793	S	S	*	*			trans	75.3	109.3	156.4	-56	-19.1	0	0	0	117.9
164	T	28.3	Very low	25.9	Very low	129 Å²	129	131.1 Å²	131.1	79%	0.791	81%	0.806	S	S	*	*				172.8	132.1	91.2	-57	0	0	0	0	109.9
165	T	22.4	Very low	25.4	Very low	131 Å²	131	131.3 Å²	131.3	80%	0.804	81%	0.807	S	S	*	*			trans	-52.6	134.2	173	23.3	0	0	0	0	115.2
166	C	22.1	Very low	25.3	Very low	128 Å²	128	128.8 Å²	128.8	87%	0.865	80%	0.799	S	S	*	*			trans	-155.9	125.7	141.5	52.1	0	0	0	0	112.7
167	N	22.1	Very low	25.3	Very low	174 Å²	174	132.5 Å²	132.5	93%	0.93	81%	0.808	S	S	*	*			trans	-71.6	151.3	176.3	-75.1	-35.3	0	0	0	112.5
168	G	24.1	Very low	25.2	Very low	68 Å²	68	130 Å²	130	70%	0.701	80%	0.799	S	S	*	*			trans	132.5	88.5	145.9	0	0	0	0	0	118
169	S	22	Very low	25	Very low	108 Å²	108	128.4 Å²	128.4	76%	0.755	80%	0.795	S	S	*	*			trans	39.1	112.6	134.1	59.9	0	0	0	0	120.2
170	T	25.6	Very low	25	Very low	133 Å²	133	128.3 Å²	128.3	82%	0.816	79%	0.789	S	S	*	*				167.8	128.5	106.6	27.2	0	0	0	0	114.3
171	K	26	Very low	25.1	Very low	197 Å²	197	130.9 Å²	130.9	86%	0.857	79%	0.788	S	S	*	*			trans	69.6	139.2	150.9	-73.1	-176	177.3	179.8	0	121.2	G173	K171-G173 PolarHBondContact O-N 3.07Å
172	P	28.3	Very low	25	Very low	127 Å²	127	130.3 Å²	130.3	83%	0.825	78%	0.779	S	S	*	*			trans	-88.3	107.6	-162.2	35	-29.3	0	0	0	111.1
173	G	25.9	Very low	25	Very low	64 Å²	64	130.3 Å²	130.3	66%	0.66	78%	0.779	S	S	*	*			trans	-87.5	127.8	164	0	0	0	0	0	109.7	K171 S175	K171-G173 PolarHBondContact O-N 3.07Å; G173-S175 PolarHBondContact O-N 3.33Å
174	Q	24.7	Very low	25.3	Very low	195 Å²	195	129 Å²	129	91%	0.911	78%	0.776	S	S	*	*			trans	-58.2	113.2	174.9	-67.7	163.4	-24.8	0	0	110.2
175	S	25.5	Very low	25.1	Very low	114 Å²	114	130 Å²	130	80%	0.797	78%	0.776	S	S	*	*			trans	-106.2	91.3	174.9	-59	0	0	0	0	109.4	G173 V177	G173-S175 PolarHBondContact O-N 3.33Å; S175-V177 PolarHBondContact O-N 3Å
176	T	26	Very low	25.3	Very low	98 Å²	98	131.9 Å²	131.9	60%	0.601	78%	0.776	S	S	*	*			trans	-55.5	121.6	170.1	-51.4	0	0	0	0	110.3	T178	T176-T178 PolarHBondContact O-N 3.29Å
177	V	25.2	Very low	25.5	Very low	139 Å²	139	133.8 Å²	133.8	84%	0.842	78%	0.778	S	S	*	*			trans	-65.8	85.6	171.9	-179	0	0	0	0	108.4	S175	S175-V177 PolarHBondContact O-N 3Å
178	T	25.2	Very low	25.6	Very low	105 Å²	105	129.8 Å²	129.8	64%	0.644	76%	0.763	S	S	*	*			trans	-85.5	111.7	166.1	-52.7	0	0	0	0	105.3	T176 T180	T176-T178 PolarHBondContact O-N 3.29Å; T178-T180 VanDerWaalsContact C-N 3.31Å; T178-T180 PolarHBondContact O-N 2.97Å
179	T	24.1	Very low	25.6	Very low	128 Å²	128	133.1 Å²	133.1	79%	0.785	77%	0.77	S	S	*	*			trans	-54.7	98.9	170.6	-41.3	0	0	0	0	107.7	I181	T179-I181 PolarHBondContact O-N 3.36Å; T179-I181 VanDerWaalsContact O-N 3.12Å
180	T	26.2	Very low	25.9	Very low	120 Å²	120	133.8 Å²	133.8	74%	0.736	77%	0.77	S	S	*	*			trans	-65.2	112.1	178.3	21.9	0	0	0	0	107.5	T178 I182	T178-T180 VanDerWaalsContact C-N 3.31Å; T178-T180 PolarHBondContact O-N 2.97Å; T180-I182 PolarHBondContact O-N 3.1Å; T180-I182 VanDerWaalsContact O-N 3.12Å
181	I	27	Very low	25.8	Very low	149 Å²	149	132.9 Å²	132.9	76%	0.764	76%	0.764	S	S	*	*			trans	-51.3	117.4	154.9	-64.9	170.5	0	0	0	105.1	T179 D183	T179-I181 PolarHBondContact O-N 3.36Å; T179-I181 VanDerWaalsContact O-N 3.12Å; I181-D183 VanDerWaalsContact C-N 3.3Å; I181-D183 PolarHBondContact O-N 2.98Å
182	I	27.5	Very low	25.8	Very low	133 Å²	133	128.7 Å²	128.7	68%	0.682	76%	0.76	S	S	*	*			trans	-63.8	94	179	-61.9	168.9	0	0	0	106.9	T180 T184	T180-I182 PolarHBondContact O-N 3.1Å; T180-I182 VanDerWaalsContact O-N 3.12Å; I182-T184 VanDerWaalsContact C-N 3.26Å; I182-T184 HydrophobicContact CG2-CG2 3.45Å; I182-T184 VanDerWaalsContact CG2-CG2 3.45Å; I182-T184 PolarHBondContact O-N 3.28Å
183	D	23.8	Very low	26.1	Very low	150 Å²	150	128.8 Å²	128.8	80%	0.802	76%	0.758	S	S	*	*			trans	-77	86.9	157.7	-83.8	-25.6	0	0	0	106.5	I181 N185	I181-D183 VanDerWaalsContact C-N 3.3Å; I181-D183 PolarHBondContact O-N 2.98Å; D183-N185 PolarHBondContact O-N 3.31Å
184	T	29	Very low	26.2	Very low	118 Å²	118	136.7 Å²	136.7	72%	0.724	77%	0.768	S	S	*	*			trans	-64.1	84.9	167.3	38.3	0	0	0	0	109.6	I182	I182-T184 VanDerWaalsContact C-N 3.26Å; I182-T184 HydrophobicContact CG2-CG2 3.45Å; I182-T184 VanDerWaalsContact CG2-CG2 3.45Å; I182-T184 PolarHBondContact O-N 3.28Å
185	N	24	Very low	26.9	Very low	150 Å²	150	135.6 Å²	135.6	80%	0.802	76%	0.763	S	S	*	*			trans	-110.2	70.2	156.9	-98	-15.4	0	0	0	107.9	D183	D183-N185 PolarHBondContact O-N 3.31Å
186	Q	26.9	Very low	27.8	Very low	172 Å²	172	134.3 Å²	134.3	80%	0.804	75%	0.754	S	S	*	*			trans	-123.4	125.7	157.9	-70.5	-167.5	7	0	0	107.6	S188	Q186-S188 PolarHBondContact O-N 3.39Å
187	N	25.7	Very low	29.2	Very low	167 Å²	167	136.7 Å²	136.7	89%	0.893	76%	0.763	S	S	*	*			trans	-69.1	56.4	-173.6	-73.7	-29.3	0	0	0	112.4
188	S	24.3	Very low	31	Very low	90 Å²	90	132.1 Å²	132.1	63%	0.629	73%	0.733	S	S	*	*			trans	-83.6	111.4	160.6	-49.7	0	0	0	0	105.6	Q186 V190	Q186-S188 PolarHBondContact O-N 3.39Å; S188-V190 PolarHBondContact O-N 3.39Å
189	T	24.6	Very low	32.8	Very low	138 Å²	138	129.4 Å²	129.4	85%	0.847	72%	0.717	S	S	*	*			trans	-61.8	72.2	173.2	48.3	0	0	0	0	109.9	T191	T189-T191 PolarHBondContact O-N 3.04Å
190	V	27.4	Very low	34.9	Very low	122 Å²	122	124.6 Å²	124.6	74%	0.739	69%	0.686	S	S	*	*			trans	-70.6	94.8	158.6	-179.7	0	0	0	0	103	S188 S192	S188-V190 PolarHBondContact O-N 3.39Å; V190-S192 PolarHBondContact O-N 3.18Å
191	T	25.3	Very low	37	Very low	114 Å²	114	126.2 Å²	126.2	70%	0.699	68%	0.682	S	S	*	*			trans	-39.5	109.8	163.9	39.5	0	0	0	0	106.4	T189 T193	T189-T191 PolarHBondContact O-N 3.04Å; T191-T193 VanDerWaalsContact C-N 3.28Å; T191-T193 PolarHBondContact O-N 3.48Å
192	S	25.2	Very low	39.3	Very low	110 Å²	110	123.4 Å²	123.4	77%	0.769	67%	0.669	S	S	*	*			trans	-45.6	107.2	165.7	-53.3	0	0	0	0	104.6	V190 R194	V190-S192 PolarHBondContact O-N 3.18Å; S192-R194 PolarHBondContact O-N 3.01Å
193	T	33.4	Very low	42	Very low	129 Å²	129	117.2 Å²	117.2	79%	0.791	64%	0.638	S	S	*	*			trans	-56.3	101.5	164.1	35.5	0	0	0	0	101.9	T191 Q195	T191-T193 VanDerWaalsContact C-N 3.28Å; T191-T193 PolarHBondContact O-N 3.48Å; T193-Q195 PolarHBondContact O-N 3.24Å
194	R	29.5	Very low	45.1	Very low	229 Å²	229	110.7 Å²	110.7	86%	0.864	60%	0.604	S	S	*	*			trans	-40.5	125.1	163.6	-82.7	178.1	165	-177.7	-4.6	103.4	S192 S196	S192-R194 PolarHBondContact O-N 3.01Å; R194-S196 PolarHBondContact O-N 3.39Å
195	Q	39.4	Very low	48.1	Very low	173 Å²	173	106.1 Å²	106.1	81%	0.808	58%	0.576	S	S	*	*			trans	-47.5	89.4	167.3	-73	163.1	-26.8	0	0	105.9	T193 N197	T193-Q195 PolarHBondContact O-N 3.24Å; Q195-N197 PolarHBondContact O-N 3.08Å
196	S	44.9	Very low	51.4	Low	87 Å²	87	99.4 Å²	99.4	61%	0.608	54%	0.54	S	S	*	.			trans	-63.5	129.2	166.9	47	0	0	0	0	102	R194 I198	R194-S196 PolarHBondContact O-N 3.39Å; S196-I198 PolarHBondContact O-N 3.38Å
197	N	54.7	Low	54.7	Low	147 Å²	147	91.3 Å²	91.3	79%	0.786	50%	0.502	S	S	*	.			trans	-60.4	96	176.7	-67.1	-26.8	0	0	0	106.4	Q195 T199	Q195-N197 PolarHBondContact O-N 3.08Å; N197-T199 WeakPolarHBondContact O-CG2 3.44Å; N197-T199 PolarHBondContact O-N 2.85Å
198	I	61.8	Low	58	Low	43 Å²	43	83.5 Å²	83.5	22%	0.221	46%	0.46	C	S	.	.			trans	-65.9	122.3	178.4	-66.6	157.8	0	0	0	105.7	S196 D202 P296 H297	S196-I198 PolarHBondContact O-N 3.38Å; I198-D202 WeakPolarHBondContact CA-OD2 3.3Å; I198-D202 HydrophobicContact CG2-CB 4.43Å; I198-P296 HydrophobicContact CD1-CB 3.44Å; I198-P296 VanDerWaalsContact CD1-CB 3.44Å; I198-P296 HydrophobicContact CD1-CG 3.32Å; I198-H297 HydrophobicContact CG2-CB 3.96Å
199	T	65	Low	61.5	Low	49 Å²	49	79.2 Å²	79.2	30%	0.301	43%	0.43	S	S	.	.			trans	-105.6	165.8	-175.8	65.5	0	0	0	0	110.7	N197 K201 D202	N197-T199 WeakPolarHBondContact O-CG2 3.44Å; N197-T199 PolarHBondContact O-N 2.85Å; T199-K201 PolarHBondContact O-N 3.33Å; T199-K201 VanDerWaalsContact O-N 3.11Å; T199-K201 PolarHBondContact OG1-N 3.23Å; T199-D202 PolarHBondContact N-OD2 3.16Å; T199-D202 PolarHBondContact O-N 2.81Å; T199-D202 VanDerWaalsContact O-N 3.15Å; T199-D202 PolarHBondContact OG1-OD2 2.8Å
200	M	67.7	Low	65	Low	26 Å²	26	72.7 Å²	72.7	13%	0.128	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-25.4	173.8	-57.1	-161.1	-35.1	0	0	112.9	D202 S203 A204 R207 E632	M200-D202 VanDerWaalsContact C-N 3.34Å; M200-S203 PolarHBondContact O-N 3.38Å; M200-S203 PolarHBondContact O-OG 2.82Å; M200-S203 VanDerWaalsContact O-OG 3.11Å; M200-A204 PolarHBondContact O-N 3.47Å; M200-R207 PolarHBondContact O-NH2 2.79Å; M200-E632 WeakPolarHBondContact CG-O 3.28Å
201	K	69.3	Low	68.3	Low	154 Å²	154	66.9 Å²	66.9	67%	0.67	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-34.8	-179.9	-168.8	176.6	-180	176.4	0	112.2	T199 S203 A204	T199-K201 PolarHBondContact O-N 3.33Å; T199-K201 VanDerWaalsContact O-N 3.11Å; T199-K201 PolarHBondContact OG1-N 3.23Å; K201-S203 PolarHBondContact O-N 2.91Å; K201-A204 WeakPolarHBondContact O-CB 3.23Å; K201-A204 PolarHBondContact O-N 3.38Å
202	D	75.7	Confident	71.8	Confident	90 Å²	90	61.5 Å²	61.5	48%	0.481	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-25	-179.4	-56.6	-34.7	0	0	0	111.9	I198 T199 M200	I198-D202 WeakPolarHBondContact CA-OD2 3.3Å; I198-D202 HydrophobicContact CG2-CB 4.43Å; T199-D202 PolarHBondContact N-OD2 3.16Å; T199-D202 PolarHBondContact O-N 2.81Å; T199-D202 VanDerWaalsContact O-N 3.15Å; T199-D202 PolarHBondContact OG1-OD2 2.8Å; M200-D202 VanDerWaalsContact C-N 3.34Å
203	S	85	Confident	75.3	Confident	4 Å²	4	56.2 Å²	56.2	3%	0.028	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	1	179.8	67.2	0	0	0	0	113.9	M200 K201 N205 L206 R207 H297	M200-S203 PolarHBondContact O-N 3.38Å; M200-S203 PolarHBondContact O-OG 2.82Å; M200-S203 VanDerWaalsContact O-OG 3.11Å; K201-S203 PolarHBondContact O-N 2.91Å; S203-N205 PolarHBondContact O-N 3.22Å; S203-L206 PolarHBondContact O-N 2.93Å; S203-R207 WeakPolarHBondContact O-CB 3.05Å; S203-R207 WeakPolarHBondContact O-CG 3.47Å; S203-R207 PolarHBondContact O-N 3.43Å; S203-R207 PolarHBondContact OG-NE 3.39Å; S203-H297 WeakPolarHBondContact CB-O 3.37Å
204	A	88.4	Confident	78.4	Confident	12 Å²	12	50.1 Å²	50.1	10%	0.099	25%	0.247	C	C	.	.	H	α-helix	trans	-58.4	-46.4	-168.3	0	0	0	0	0	112.9	M200 K201 R207 V208	M200-A204 PolarHBondContact O-N 3.47Å; K201-A204 WeakPolarHBondContact O-CB 3.23Å; K201-A204 PolarHBondContact O-N 3.38Å; A204-R207 PolarHBondContact O-N 2.97Å; A204-V208 WeakPolarHBondContact O-CG2 3.32Å; A204-V208 PolarHBondContact O-N 2.97Å
205	N	91.8	Very high	81.7	Confident	22 Å²	22	39.3 Å²	39.3	12%	0.118	21%	0.207	C	C	.	.	H	α-helix	trans	-63.6	-47.1	-179.8	-164.3	24.9	0	0	0	111.9	E144 S203 R207 V208 L209	E144-N205 PolarHBondContact OE1-ND2 3.45Å; E144-N205 PolarHBondContact OE2-ND2 3.33Å; S203-N205 PolarHBondContact O-N 3.22Å; N205-R207 VanDerWaalsContact C-N 3.31Å; N205-R207 PolarHBondContact O-N 3Å; N205-V208 PolarHBondContact O-N 3.36Å; N205-L209 WeakPolarHBondContact O-CG 3.13Å; N205-L209 PolarHBondContact O-N 3.48Å
206	L	94.3	Very high	84.4	Confident	9 Å²	9	31.1 Å²	31.1	5%	0.047	17%	0.168	C	C	.	.	H	α-helix	trans	-61.4	-39.2	176.8	-63.8	180	0	0	0	111.8	L141 E144 I145 S203 V208 L209 L210 F298 P299	L141-L206 HydrophobicContact CD1-CD2 4.13Å; E144-L206 HydrophobicContact CB-CD2 3.98Å; I145-L206 HydrophobicContact CG2-CD1 4.41Å; I145-L206 HydrophobicContact CG2-CD2 3.64Å; S203-L206 PolarHBondContact O-N 2.93Å; L206-V208 VanDerWaalsContact C-N 3.34Å; L206-V208 PolarHBondContact O-N 3.06Å; L206-L209 PolarHBondContact O-N 3.4Å; L206-L210 WeakPolarHBondContact O-CB 3.42Å; L206-L210 WeakPolarHBondContact O-CD1 3.42Å; L206-L210 WeakPolarHBondContact O-CG 3.28Å; L206-L210 PolarHBondContact O-N 2.92Å; L206-F298 HydrophobicContact CD1-CD1 3.6Å; L206-F298 HydrophobicContact CD1-CE1 3.82Å; L206-P299 HydrophobicContact CB-CG 4.42Å
207	R	94.5	Very high	87	Confident	3 Å²	3	27 Å²	27	1%	0.011	14%	0.14	C	C	.	.	H	α-helix	trans	-60.6	-42.5	175.5	-79.3	-169.6	-65.6	107.1	-1.2	111.7	E43 E46 M200 S203 A204 N205 S211 P299 K302	E43-R207 IonicContact OE2-CZ 2.72Å; E43-R207 IonicContact OE2-NH1 3.89Å; E43-R207 PolarHBondContact OE2-NH1 2.92Å; E46-R207 VanDerWaalsContact CD-NH1 3.27Å; E46-R207 IonicContact OE1-CZ 2.76Å; E46-R207 IonicContact OE1-NH1 3.82Å; E46-R207 PolarHBondContact OE1-NH1 3.3Å; E46-R207 VanDerWaalsContact OE1-NH1 3.1Å; E46-R207 IonicContact OE1-NH2 3.03Å; E46-R207 PolarHBondContact OE1-NH2 3.24Å; E46-R207 IonicContact OE2-CZ 3.94Å; E46-R207 IonicContact OE2-NH1 2.83Å; E46-R207 PolarHBondContact OE2-NH1 3.47Å; E46-R207 IonicContact OE2-NH2 2.65Å; M200-R207 PolarHBondContact O-NH2 2.79Å; S203-R207 WeakPolarHBondContact O-CB 3.05Å; S203-R207 WeakPolarHBondContact O-CG 3.47Å; S203-R207 PolarHBondContact O-N 3.43Å; S203-R207 PolarHBondContact OG-NE 3.39Å; A204-R207 PolarHBondContact O-N 2.97Å; N205-R207 VanDerWaalsContact C-N 3.31Å; N205-R207 PolarHBondContact O-N 3Å; R207-S211 VanDerWaalsContact O-CB 3.26Å; R207-S211 WeakPolarHBondContact O-CB 3.26Å; R207-S211 PolarHBondContact O-N 3.49Å; R207-S211 PolarHBondContact O-OG 3.07Å; R207-P299 HydrophobicContact CG-CB 3.5Å; R207-P299 HydrophobicContact CG-CG 3.69Å; R207-K302 HydrophobicContact CB-CD 4.1Å; R207-K302 HydrophobicContact CG-CD 4.08Å
208	V	96.2	Very high	89	Confident	3 Å²	3	20 Å²	20	2%	0.018	10%	0.102	C	C	.	.	H	α-helix	trans	-64.3	-49	177.2	178	0	0	0	0	110.4	T97 R98 L101 A204 N205 L206 L210 S211 I212	T97-V208 HydrophobicContact CG2-CB 4.37Å; T97-V208 HydrophobicContact CG2-CG1 3.5Å; R98-V208 HydrophobicContact CG-CG1 4.46Å; R98-V208 HydrophobicContact CG-CG2 4.32Å; L101-V208 HydrophobicContact CB-CG1 3.95Å; L101-V208 HydrophobicContact CD2-CB 4.24Å; L101-V208 HydrophobicContact CD2-CG1 3.75Å; L101-V208 HydrophobicContact CD2-CG2 4.19Å; L101-V208 HydrophobicContact CG-CG1 4.47Å; A204-V208 WeakPolarHBondContact O-CG2 3.32Å; A204-V208 PolarHBondContact O-N 2.97Å; N205-V208 PolarHBondContact O-N 3.36Å; L206-V208 VanDerWaalsContact C-N 3.34Å; L206-V208 PolarHBondContact O-N 3.06Å; V208-L210 PolarHBondContact O-N 3.31Å; V208-S211 WeakPolarHBondContact O-CB 3.47Å; V208-S211 PolarHBondContact O-N 3.49Å; V208-I212 HydrophobicContact CG1-CD1 4.37Å; V208-I212 WeakPolarHBondContact O-CG1 3.39Å; V208-I212 PolarHBondContact O-N 3.29Å
209	L	97.4	Very high	90.6	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-59.7	-48	179.4	-67.5	170.6	0	0	0	112.6	T97 I137 L140 L141 E144 N205 L206 S211 I212 L213	T97-L209 HydrophobicContact CG2-CD2 3.45Å; T97-L209 VanDerWaalsContact CG2-CD2 3.45Å; T97-L209 HydrophobicContact CG2-CG 4.12Å; I137-L209 HydrophobicContact CD1-CD2 3.97Å; I137-L209 HydrophobicContact CG2-CD2 4.15Å; L140-L209 HydrophobicContact CB-CD2 4.41Å; L140-L209 HydrophobicContact CD2-CD2 3.65Å; L140-L209 HydrophobicContact CG-CD1 4.22Å; L140-L209 HydrophobicContact CG-CD2 3.92Å; L141-L209 HydrophobicContact CD1-CB 4.48Å; E144-L209 HydrophobicContact CB-CD1 4.2Å; E144-L209 HydrophobicContact CG-CD1 4.02Å; N205-L209 WeakPolarHBondContact O-CG 3.13Å; N205-L209 PolarHBondContact O-N 3.48Å; L206-L209 PolarHBondContact O-N 3.4Å; L209-S211 VanDerWaalsContact C-N 3.27Å; L209-S211 PolarHBondContact O-N 3.16Å; L209-I212 PolarHBondContact O-N 2.89Å; L209-L213 PolarHBondContact O-N 3.47Å; L209-L213 VanDerWaalsContact O-N 3.1Å
210	L	97.7	Very high	92.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.4	-32.3	178	-67.5	166.6	0	0	0	112	L141 L206 V208 Y214 L283 M286 P299 K302 V303 L306	L141-L210 HydrophobicContact CD1-CD2 4.3Å; L141-L210 HydrophobicContact CD2-CD2 4.21Å; L206-L210 WeakPolarHBondContact O-CB 3.42Å; L206-L210 WeakPolarHBondContact O-CD1 3.42Å; L206-L210 WeakPolarHBondContact O-CG 3.28Å; L206-L210 PolarHBondContact O-N 2.92Å; V208-L210 PolarHBondContact O-N 3.31Å; L210-Y214 VanDerWaalsContact O-CB 3.31Å; L210-Y214 WeakPolarHBondContact O-CB 3.33Å; L210-Y214 PolarHBondContact O-N 2.99Å; L210-L283 HydrophobicContact CD2-CD2 4.07Å; L210-M286 HydrophobicContact CD1-CE 4.43Å; L210-P299 HydrophobicContact CD1-CG 3.5Å; L210-K302 HydrophobicContact CB-CB 4.05Å; L210-K302 HydrophobicContact CD1-CB 4.32Å; L210-V303 HydrophobicContact CD1-CG2 3.62Å; L210-V303 HydrophobicContact CD2-CG2 4.38Å; L210-L306 HydrophobicContact CD2-CD2 3.71Å
211	S	97.7	Very high	93.4	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.007	8%	0.076	C	C	.	.	H	α-helix	trans	-67.6	-43.1	175.3	-61.5	0	0	0	0	111.6	R207 V208 L209 Y214 I215 K302	R207-S211 VanDerWaalsContact O-CB 3.26Å; R207-S211 WeakPolarHBondContact O-CB 3.26Å; R207-S211 PolarHBondContact O-N 3.49Å; R207-S211 PolarHBondContact O-OG 3.07Å; V208-S211 WeakPolarHBondContact O-CB 3.47Å; V208-S211 PolarHBondContact O-N 3.49Å; L209-S211 VanDerWaalsContact C-N 3.27Å; L209-S211 PolarHBondContact O-N 3.16Å; S211-Y214 PolarHBondContact O-N 3.07Å; S211-I215 WeakPolarHBondContact O-CD1 3.49Å; S211-I215 VanDerWaalsContact O-CG1 3.23Å; S211-I215 WeakPolarHBondContact O-CG1 3.45Å; S211-I215 PolarHBondContact O-N 3.36Å; S211-K302 WeakPolarHBondContact OG-CD 2.88Å
212	I	98.4	Very high	94.5	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-56.8	-53.2	174.3	-71.8	173.7	0	0	0	110.2	T97 L100 L101 L104 L133 I137 V208 L209 Y214 I215 M216	T97-I212 HydrophobicContact CG2-CD1 3.5Å; T97-I212 VanDerWaalsContact CG2-CD1 3.5Å; L100-I212 HydrophobicContact CB-CD1 4.07Å; L101-I212 HydrophobicContact CB-CD1 4.27Å; L101-I212 HydrophobicContact CB-CG1 3.99Å; L101-I212 HydrophobicContact CD1-CG1 4.02Å; L104-I212 HydrophobicContact CD1-CB 4.14Å; L104-I212 HydrophobicContact CD1-CG1 4.15Å; L104-I212 HydrophobicContact CD1-CG2 3.61Å; L133-I212 HydrophobicContact CD2-CG2 4.13Å; I137-I212 HydrophobicContact CD1-CD1 3.98Å; I137-I212 HydrophobicContact CD1-CG2 4.2Å; I137-I212 HydrophobicContact CG1-CG2 3.89Å; I137-I212 HydrophobicContact CG2-CG2 4.17Å; V208-I212 HydrophobicContact CG1-CD1 4.37Å; V208-I212 WeakPolarHBondContact O-CG1 3.39Å; V208-I212 PolarHBondContact O-N 3.29Å; L209-I212 PolarHBondContact O-N 2.89Å; I212-Y214 VanDerWaalsContact C-N 3.31Å; I212-Y214 PolarHBondContact O-N 3.35Å; I212-I215 PolarHBondContact O-N 3.45Å; I212-M216 HydrophobicContact CG2-SD 3.78Å; I212-M216 VanDerWaalsContact O-CG 3.27Å; I212-M216 WeakPolarHBondContact O-CG 3.3Å; I212-M216 PolarHBondContact O-N 2.9Å
213	L	98.2	Very high	95.2	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-58.7	-43.5	178.9	-70.2	173.6	0	0	0	111.8	L134 I137 I138 L141 L209 M216 V217 L306	L134-L213 HydrophobicContact CD1-CD2 3.94Å; I137-L213 HydrophobicContact CB-CD2 4.21Å; I137-L213 HydrophobicContact CG2-CD1 4.12Å; I137-L213 HydrophobicContact CG2-CD2 3.71Å; I137-L213 HydrophobicContact CG2-CG 3.6Å; I138-L213 HydrophobicContact CG1-CD2 4.1Å; L141-L213 HydrophobicContact CD2-CD1 3.87Å; L209-L213 PolarHBondContact O-N 3.47Å; L209-L213 VanDerWaalsContact O-N 3.1Å; L213-M216 PolarHBondContact O-N 3.12Å; L213-V217 WeakPolarHBondContact O-CB 3.28Å; L213-V217 WeakPolarHBondContact O-CG2 3.45Å; L213-V217 PolarHBondContact O-N 2.83Å; L213-L306 HydrophobicContact CB-CD1 3.85Å; L213-L306 HydrophobicContact CB-CD2 3.74Å; L213-L306 HydrophobicContact CB-CG 4.48Å; L213-L306 HydrophobicContact CD1-CD2 3.94Å
214	Y	98.5	Very high	95.2	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-62.4	-48.5	179.8	-177.8	-89	0	0	0	111.9	E34 I35 L38 L210 S211 I212 M216 V217 E218 L305 L306 K309	E34-Y214 WeakPolarHBondContact O-CE1 3.46Å; E34-Y214 PolarHBondContact O-OH 2.9Å; I35-Y214 HydrophobicContact CD1-CE1 4.29Å; L38-Y214 HydrophobicContact CB-CD1 4.33Å; L38-Y214 HydrophobicContact CB-CE1 4.3Å; L38-Y214 HydrophobicContact CD1-CD1 3.91Å; L38-Y214 HydrophobicContact CD1-CD2 4.47Å; L38-Y214 HydrophobicContact CD1-CE1 4.47Å; L38-Y214 HydrophobicContact CD1-CG 3.87Å; L38-Y214 HydrophobicContact CD2-CD1 3.81Å; L38-Y214 HydrophobicContact CD2-CG 4.38Å; L38-Y214 HydrophobicContact CG-CD1 4.24Å; L210-Y214 VanDerWaalsContact O-CB 3.31Å; L210-Y214 WeakPolarHBondContact O-CB 3.33Å; L210-Y214 PolarHBondContact O-N 2.99Å; S211-Y214 PolarHBondContact O-N 3.07Å; I212-Y214 VanDerWaalsContact C-N 3.31Å; I212-Y214 PolarHBondContact O-N 3.35Å; Y214-M216 VanDerWaalsContact C-N 3.31Å; Y214-M216 PolarHBondContact O-N 3.43Å; Y214-V217 PolarHBondContact O-N 3.31Å; Y214-E218 HydrophobicContact CD1-CB 4.35Å; Y214-E218 HydrophobicContact CE1-CB 4.14Å; Y214-E218 HydrophobicContact CE1-CG 4.24Å; Y214-E218 WeakPolarHBondContact O-CB 3.42Å; Y214-E218 PolarHBondContact O-N 2.95Å; Y214-L305 HydrophobicContact CD2-CB 3.96Å; Y214-L305 HydrophobicContact CE2-CB 3.59Å; Y214-L305 HydrophobicContact CE2-CG 4.49Å; Y214-L306 HydrophobicContact CD2-CB 4.41Å; Y214-K309 HydrophobicContact CD2-CG 4.18Å; Y214-K309 HydrophobicContact CE2-CB 4.42Å; Y214-K309 HydrophobicContact CE2-CD 4.47Å; Y214-K309 HydrophobicContact CE2-CG 3.45Å; Y214-K309 VanDerWaalsContact CE2-CG 3.45Å; Y214-K309 VanDerWaalsContact OH-CE 3.3Å; Y214-K309 WeakPolarHBondContact OH-CE 3.42Å
215	I	98.2	Very high	94.9	Very high	3 Å²	3	11.2 Å²	11.2	2%	0.015	6%	0.059	C	C	.	.	H	α-helix	trans	-60.9	-43.3	180	-64.8	163.5	0	0	0	110.4	I35 L38 Y39 L101 L104 Q105 V125 S211 I212 T219	I35-I215 HydrophobicContact CD1-CG1 4.24Å; L38-I215 HydrophobicContact CD2-CD1 4.45Å; L38-I215 HydrophobicContact CD2-CG1 4.07Å; Y39-I215 WeakPolarHBondContact OH-CD1 3.47Å; L101-I215 HydrophobicContact CD1-CD1 3.63Å; L104-I215 HydrophobicContact CB-CD1 4.32Å; L104-I215 HydrophobicContact CB-CG2 4.15Å; Q105-I215 HydrophobicContact CG-CD1 4.31Å; V125-I215 HydrophobicContact CG2-CG2 3.85Å; S211-I215 WeakPolarHBondContact O-CD1 3.49Å; S211-I215 VanDerWaalsContact O-CG1 3.23Å; S211-I215 WeakPolarHBondContact O-CG1 3.45Å; S211-I215 PolarHBondContact O-N 3.36Å; I212-I215 PolarHBondContact O-N 3.45Å; I215-T219 WeakPolarHBondContact O-CB 3.26Å; I215-T219 PolarHBondContact O-N 3.49Å; I215-T219 PolarHBondContact O-OG1 3.23Å
216	M	98.1	Very high	94	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-59.8	-52.4	177	-67.8	172.6	76	0	0	111.2	L104 V125 I129 L133 L134 I212 L213 Y214 E218 T219 V220 F263	L104-M216 HydrophobicContact CD1-CG 4.01Å; L104-M216 HydrophobicContact CD1-SD 4.44Å; V125-M216 HydrophobicContact CG1-CB 4.46Å; V125-M216 HydrophobicContact CG1-CG 4.38Å; I129-M216 HydrophobicContact CD1-CE 4.44Å; I129-M216 HydrophobicContact CG1-CE 3.54Å; L133-M216 HydrophobicContact CB-CE 4.07Å; L133-M216 HydrophobicContact CD2-CE 4.21Å; L133-M216 HydrophobicContact CD2-SD 3.81Å; L133-M216 HydrophobicContact CG-CE 4.16Å; L133-M216 HydrophobicContact CG-SD 4.05Å; L134-M216 HydrophobicContact CB-CE 4Å; I212-M216 HydrophobicContact CG2-SD 3.78Å; I212-M216 VanDerWaalsContact O-CG 3.27Å; I212-M216 WeakPolarHBondContact O-CG 3.3Å; I212-M216 PolarHBondContact O-N 2.9Å; L213-M216 PolarHBondContact O-N 3.12Å; Y214-M216 VanDerWaalsContact C-N 3.31Å; Y214-M216 PolarHBondContact O-N 3.43Å; M216-E218 PolarHBondContact O-N 3.11Å; M216-T219 PolarHBondContact O-N 3.29Å; M216-V220 WeakPolarHBondContact O-CG2 3.5Å; M216-V220 PolarHBondContact O-N 2.97Å; M216-F263 HydrophobicContact CB-CE2 4.4Å; M216-F263 HydrophobicContact CB-CZ 4.09Å; M216-F263 HydrophobicContact CE-CE2 4.07Å
217	V	97.6	Very high	92.7	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-61.2	-47.5	-179.1	172.5	0	0	0	0	111.6	L213 Y214 V220 R221 F263 L267 L306 K309 V310 I313	L213-V217 WeakPolarHBondContact O-CB 3.28Å; L213-V217 WeakPolarHBondContact O-CG2 3.45Å; L213-V217 PolarHBondContact O-N 2.83Å; Y214-V217 PolarHBondContact O-N 3.31Å; V217-V220 PolarHBondContact O-N 3.45Å; V217-R221 VanDerWaalsContact O-CB 3.28Å; V217-R221 WeakPolarHBondContact O-CB 3.46Å; V217-R221 PolarHBondContact O-N 3.17Å; V217-F263 HydrophobicContact CG2-CE1 4.33Å; V217-F263 HydrophobicContact CG2-CZ 4.19Å; V217-L267 HydrophobicContact CG2-CD1 4Å; V217-L267 HydrophobicContact CG2-CD2 4.45Å; V217-L306 HydrophobicContact CG2-CD1 4.09Å; V217-K309 HydrophobicContact CG1-CB 3.76Å; V217-V310 HydrophobicContact CG1-CG2 4.18Å; V217-V310 HydrophobicContact CG2-CG2 3.9Å; V217-I313 HydrophobicContact CG1-CG2 4.11Å
218	E	97	Very high	91	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-65.5	-41.4	-177.7	-179	62.9	-170	0	0	111.6	Y31 E34 I35 Y214 M216 R221 D222 K309	Y31-E218 HydrophobicContact CD2-CG 4.15Å; Y31-E218 HydrophobicContact CE2-CG 4.15Å; E34-E218 HydrophobicContact CB-CG 4.39Å; E34-E218 WeakPolarHBondContact CB-OE1 3.4Å; I35-E218 HydrophobicContact CD1-CB 4.19Å; I35-E218 HydrophobicContact CD1-CG 3.86Å; Y214-E218 HydrophobicContact CD1-CB 4.35Å; Y214-E218 HydrophobicContact CE1-CB 4.14Å; Y214-E218 HydrophobicContact CE1-CG 4.24Å; Y214-E218 WeakPolarHBondContact O-CB 3.42Å; Y214-E218 PolarHBondContact O-N 2.95Å; M216-E218 PolarHBondContact O-N 3.11Å; E218-R221 VanDerWaalsContact CD-CZ 3.45Å; E218-R221 PolarHBondContact O-N 3.13Å; E218-R221 IonicContact OE1-CZ 3.84Å; E218-R221 IonicContact OE1-NH1 3.61Å; E218-R221 PolarHBondContact OE1-NH1 3.49Å; E218-R221 IonicContact OE1-NH2 3.38Å; E218-R221 PolarHBondContact OE1-NH2 2.97Å; E218-R221 IonicContact OE2-CZ 2.68Å; E218-R221 IonicContact OE2-NH1 2.83Å; E218-R221 PolarHBondContact OE2-NH1 2.6Å; E218-R221 IonicContact OE2-NH2 3.25Å; E218-D222 WeakPolarHBondContact O-CB 3.37Å; E218-D222 PolarHBondContact O-N 2.61Å; E218-K309 WeakPolarHBondContact OE2-CD 3.28Å; E218-K309 WeakPolarHBondContact OE2-CE 3.24Å; E218-K309 IonicContact OE2-NZ 2.81Å
219	T	96.3	Very high	89.2	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-66.7	-43.4	178.2	-60.6	0	0	0	0	112.1	Y31 R122 V125 I215 M216 D222 G223	Y31-T219 PolarHBondContact OH-OG1 3.41Å; R122-T219 HydrophobicContact CB-CG2 4.33Å; R122-T219 HydrophobicContact CG-CG2 3.93Å; V125-T219 HydrophobicContact CB-CG2 3.89Å; V125-T219 HydrophobicContact CG1-CG2 3.84Å; V125-T219 HydrophobicContact CG2-CG2 4.05Å; I215-T219 WeakPolarHBondContact O-CB 3.26Å; I215-T219 PolarHBondContact O-N 3.49Å; I215-T219 PolarHBondContact O-OG1 3.23Å; M216-T219 PolarHBondContact O-N 3.29Å; T219-D222 PolarHBondContact O-N 3.03Å; T219-G223 PolarHBondContact O-N 3.04Å
220	V	95.7	Very high	87	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-65.7	-43.7	176	173.1	0	0	0	0	110.6	Y126 I129 M216 V217 D222 G223 M224 R260 F263 I313	Y126-V220 HydrophobicContact CE1-CG2 4.41Å; I129-V220 HydrophobicContact CD1-CG2 3.42Å; I129-V220 VanDerWaalsContact CD1-CG2 3.42Å; M216-V220 WeakPolarHBondContact O-CG2 3.5Å; M216-V220 PolarHBondContact O-N 2.97Å; V217-V220 PolarHBondContact O-N 3.45Å; V220-D222 PolarHBondContact O-N 2.97Å; V220-G223 PolarHBondContact O-N 3.28Å; V220-M224 WeakPolarHBondContact O-CG 3.26Å; V220-M224 PolarHBondContact O-N 3.37Å; V220-R260 HydrophobicContact CG1-CB 3.97Å; V220-R260 HydrophobicContact CG1-CG 3.84Å; V220-F263 HydrophobicContact CB-CD1 3.92Å; V220-F263 HydrophobicContact CB-CE1 3.94Å; V220-F263 HydrophobicContact CG1-CD1 3.63Å; V220-F263 HydrophobicContact CG1-CE1 4.15Å; V220-F263 HydrophobicContact CG1-CG 4.34Å; V220-F263 HydrophobicContact CG2-CD1 3.86Å; V220-F263 HydrophobicContact CG2-CE1 3.91Å; V220-F263 HydrophobicContact CG2-CG 4.21Å; V220-F263 HydrophobicContact CG2-CZ 4.33Å; V220-I313 HydrophobicContact CB-CD1 4.27Å; V220-I313 HydrophobicContact CG1-CD1 3.86Å
221	R	94.7	Very high	84.8	Confident	21 Å²	21	30.3 Å²	30.3	8%	0.079	16%	0.156	C	C	.	.	H	α-helix	trans	-59.3	-45.2	176.6	-175.7	-125.7	61	-154.8	-0.3	111.9	V217 E218 M224 L225 I313	V217-R221 VanDerWaalsContact O-CB 3.28Å; V217-R221 WeakPolarHBondContact O-CB 3.46Å; V217-R221 PolarHBondContact O-N 3.17Å; E218-R221 VanDerWaalsContact CD-CZ 3.45Å; E218-R221 PolarHBondContact O-N 3.13Å; E218-R221 IonicContact OE1-CZ 3.84Å; E218-R221 IonicContact OE1-NH1 3.61Å; E218-R221 PolarHBondContact OE1-NH1 3.49Å; E218-R221 IonicContact OE1-NH2 3.38Å; E218-R221 PolarHBondContact OE1-NH2 2.97Å; E218-R221 IonicContact OE2-CZ 2.68Å; E218-R221 IonicContact OE2-NH1 2.83Å; E218-R221 PolarHBondContact OE2-NH1 2.6Å; E218-R221 IonicContact OE2-NH2 3.25Å; R221-M224 PolarHBondContact O-N 3.08Å; R221-L225 PolarHBondContact O-N 2.99Å; R221-I313 HydrophobicContact CB-CB 4.41Å; R221-I313 HydrophobicContact CB-CD1 3.84Å; R221-I313 HydrophobicContact CB-CG1 4.12Å; R221-I313 HydrophobicContact CG-CB 4.45Å; R221-I313 HydrophobicContact CG-CG1 4.34Å
222	D	93.1	Very high	82.5	Confident	16 Å²	16	36.6 Å²	36.6	9%	0.086	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-44.1	176.9	-165.7	64.3	0	0	0	111.9	Y31 R122 E218 T219 V220 M224 L225 T226	Y31-D222 HydrophobicContact CD2-CB 3.86Å; R122-D222 IonicContact CZ-OD2 3.27Å; R122-D222 IonicContact NE-OD2 2.92Å; R122-D222 IonicContact NH2-OD2 2.61Å; R122-D222 PolarHBondContact NH2-OD2 3.49Å; E218-D222 WeakPolarHBondContact O-CB 3.37Å; E218-D222 PolarHBondContact O-N 2.61Å; T219-D222 PolarHBondContact O-N 3.03Å; V220-D222 PolarHBondContact O-N 2.97Å; D222-M224 VanDerWaalsContact C-N 3.32Å; D222-M224 PolarHBondContact O-N 3.48Å; D222-L225 WeakPolarHBondContact O-CB 3.41Å; D222-L225 PolarHBondContact O-N 3.05Å; D222-T226 PolarHBondContact O-N 3.23Å; D222-T226 VanDerWaalsContact O-N 3.11Å
223	G	89.8	Confident	79.7	Confident	8 Å²	8	44.2 Å²	44.2	8%	0.082	22%	0.215	C	C	.	.	H	α-helix	trans	-54.4	-44.9	173.6	0	0	0	0	0	112.9	T219 V220 L225 T226 D227	T219-G223 PolarHBondContact O-N 3.04Å; V220-G223 PolarHBondContact O-N 3.28Å; G223-L225 VanDerWaalsContact C-N 3.3Å; G223-L225 PolarHBondContact O-N 3.47Å; G223-T226 PolarHBondContact O-N 2.99Å; G223-T226 PolarHBondContact O-OG1 3.13Å; G223-D227 PolarHBondContact O-N 3.21Å
224	M	86.1	Confident	76.7	Confident	52 Å²	52	51.4 Å²	51.4	26%	0.256	25%	0.248	S	C	.	.	H	α-helix	trans	-61.6	-35.7	176.6	-64.7	-176.6	79.3	0	0	113.1	V220 R221 D222 H228 R260 V264 I313	V220-M224 WeakPolarHBondContact O-CG 3.26Å; V220-M224 PolarHBondContact O-N 3.37Å; R221-M224 PolarHBondContact O-N 3.08Å; D222-M224 VanDerWaalsContact C-N 3.32Å; D222-M224 PolarHBondContact O-N 3.48Å; M224-H228 PolarHBondContact O-CD2 3.28Å; M224-H228 PolarHBondContact O-N 3.27Å; M224-R260 HydrophobicContact CG-CB 4.34Å; M224-V264 HydrophobicContact CE-CG2 4.48Å; M224-V264 HydrophobicContact SD-CG2 3.82Å; M224-I313 HydrophobicContact SD-CD1 4.13Å; M224-I313 HydrophobicContact SD-CG1 4.03Å
225	L	81.6	Confident	73.7	Confident	95 Å²	95	58.6 Å²	58.6	50%	0.497	28%	0.282	S	S	.	.	H	α-helix	trans	-68.5	-40	178.1	-174.5	66.3	0	0	0	111.5	R221 D222 G223 H228 T229	R221-L225 PolarHBondContact O-N 2.99Å; D222-L225 WeakPolarHBondContact O-CB 3.41Å; D222-L225 PolarHBondContact O-N 3.05Å; G223-L225 VanDerWaalsContact C-N 3.3Å; G223-L225 PolarHBondContact O-N 3.47Å; L225-H228 PolarHBondContact O-N 3.11Å; L225-T229 PolarHBondContact O-N 3.3Å; L225-T229 VanDerWaalsContact O-N 3.12Å; L225-T229 PolarHBondContact O-OG1 3.16Å
226	T	73.6	Confident	70.7	Confident	55 Å²	55	63.3 Å²	63.3	34%	0.337	31%	0.311	S	S	.	.	H	α-helix	trans	-64	-40.1	179.3	60.5	0	0	0	0	112.6	D222 G223 T229 Q230	D222-T226 PolarHBondContact O-N 3.23Å; D222-T226 VanDerWaalsContact O-N 3.11Å; G223-T226 PolarHBondContact O-N 2.99Å; G223-T226 PolarHBondContact O-OG1 3.13Å; T226-T229 PolarHBondContact O-N 3.11Å; T226-Q230 WeakPolarHBondContact O-CG 3.34Å; T226-Q230 PolarHBondContact O-N 2.86Å
227	D	66.6	Low	67.5	Low	32 Å²	32	68.4 Å²	68.4	17%	0.171	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-46.7	176	-68	-18	0	0	0	112.1	G223 T229 Q230 Q231 R260	G223-D227 PolarHBondContact O-N 3.21Å; D227-T229 PolarHBondContact O-N 2.97Å; D227-Q230 PolarHBondContact O-N 3.28Å; D227-Q230 VanDerWaalsContact O-N 3.16Å; D227-Q231 WeakPolarHBondContact O-CB 3.33Å; D227-Q231 VanDerWaalsContact O-CG 3.31Å; D227-Q231 WeakPolarHBondContact O-CG 3.15Å; D227-Q231 PolarHBondContact O-N 2.68Å; D227-R260 IonicContact OD1-NH2 3.85Å; D227-R260 PolarHBondContact OD1-NH2 3.39Å; D227-R260 IonicContact OD2-CZ 3.68Å; D227-R260 VanDerWaalsContact OD2-CZ 3.25Å; D227-R260 IonicContact OD2-NE 3.66Å; D227-R260 PolarHBondContact OD2-NE 3.45Å; D227-R260 IonicContact OD2-NH2 3.16Å; D227-R260 PolarHBondContact OD2-NH2 3.11Å
228	H	58.9	Low	64.4	Low	90 Å²	90	74.6 Å²	74.6	42%	0.417	38%	0.38	S	S	.	.	H	α-helix	trans	-61.1	-36.7	179.3	-73.4	-45.6	0	0	0	111.7	M224 L225 Q232	M224-H228 PolarHBondContact O-CD2 3.28Å; M224-H228 PolarHBondContact O-N 3.27Å; L225-H228 PolarHBondContact O-N 3.11Å; H228-Q232 WeakPolarHBondContact O-CG 3.48Å; H228-Q232 PolarHBondContact O-N 2.87Å; H228-Q232 VanDerWaalsContact O-N 3.11Å
229	T	57.7	Low	61.4	Low	60 Å²	60	80 Å²	80	37%	0.368	41%	0.413	S	S	.	.	H	α-helix	trans	-66.8	-45.3	176	-51.2	0	0	0	0	110.4	L225 T226 D227 Q231 Q232 Y233	L225-T229 PolarHBondContact O-N 3.3Å; L225-T229 VanDerWaalsContact O-N 3.12Å; L225-T229 PolarHBondContact O-OG1 3.16Å; T226-T229 PolarHBondContact O-N 3.11Å; D227-T229 PolarHBondContact O-N 2.97Å; T229-Q231 PolarHBondContact O-N 3.31Å; T229-Q232 PolarHBondContact O-N 2.83Å; T229-Y233 HydrophobicContact CG2-CD2 4.1Å; T229-Y233 HydrophobicContact CG2-CE2 3.88Å; T229-Y233 VanDerWaalsContact O-CD2 3.24Å; T229-Y233 WeakPolarHBondContact O-CD2 3.36Å; T229-Y233 PolarHBondContact O-N 3.42Å; T229-Y233 VanDerWaalsContact O-N 3.11Å
230	Q	52.6	Low	58.7	Low	116 Å²	116	86.9 Å²	86.9	54%	0.542	45%	0.449	S	S	.	.	H	α-helix	trans	-63.8	-40.8	177.3	-70.1	178.7	12.4	0	0	112.8	T226 D227 Q232 Y233 Q234	T226-Q230 WeakPolarHBondContact O-CG 3.34Å; T226-Q230 PolarHBondContact O-N 2.86Å; D227-Q230 PolarHBondContact O-N 3.28Å; D227-Q230 VanDerWaalsContact O-N 3.16Å; Q230-Q232 VanDerWaalsContact C-N 3.33Å; Q230-Q232 PolarHBondContact O-N 3.12Å; Q230-Y233 PolarHBondContact O-N 3.32Å; Q230-Q234 PolarHBondContact O-N 3.07Å
231	Q	49.8	Very low	55.9	Low	85 Å²	85	94.6 Å²	94.6	40%	0.397	49%	0.491	S	S	.	.	H	α-helix	trans	-63.6	-38.3	176.4	-71.9	173.7	8.9	0	0	111.9	D227 T229 Q234 Q235	D227-Q231 WeakPolarHBondContact O-CB 3.33Å; D227-Q231 VanDerWaalsContact O-CG 3.31Å; D227-Q231 WeakPolarHBondContact O-CG 3.15Å; D227-Q231 PolarHBondContact O-N 2.68Å; T229-Q231 PolarHBondContact O-N 3.31Å; Q231-Q234 PolarHBondContact O-N 3.11Å; Q231-Q235 WeakPolarHBondContact O-CG 3.45Å; Q231-Q235 PolarHBondContact O-N 3.27Å
232	Q	49.5	Very low	53	Low	133 Å²	133	102.7 Å²	102.7	62%	0.621	53%	0.526	S	S	*	.	H	α-helix	trans	-65.9	-37.1	174.2	-76	-178.9	-8.5	0	0	112.4	H228 T229 Q230 Q235 T236	H228-Q232 WeakPolarHBondContact O-CG 3.48Å; H228-Q232 PolarHBondContact O-N 2.87Å; H228-Q232 VanDerWaalsContact O-N 3.11Å; T229-Q232 PolarHBondContact O-N 2.83Å; Q230-Q232 VanDerWaalsContact C-N 3.33Å; Q230-Q232 PolarHBondContact O-N 3.12Å; Q232-Q235 PolarHBondContact O-N 2.91Å; Q232-T236 PolarHBondContact O-N 3.02Å; Q232-T236 PolarHBondContact O-OG1 3.45Å
233	Y	40	Very low	50.1	Low	160 Å²	160	111.3 Å²	111.3	63%	0.627	57%	0.566	S	S	*	*	H	α-helix	trans	-67.1	-41.5	174.7	-86	-74.4	0	0	0	112.5	T229 Q230 Q235 T236 V237	T229-Y233 HydrophobicContact CG2-CD2 4.1Å; T229-Y233 HydrophobicContact CG2-CE2 3.88Å; T229-Y233 VanDerWaalsContact O-CD2 3.24Å; T229-Y233 WeakPolarHBondContact O-CD2 3.36Å; T229-Y233 PolarHBondContact O-N 3.42Å; T229-Y233 VanDerWaalsContact O-N 3.11Å; Q230-Y233 PolarHBondContact O-N 3.32Å; Y233-Q235 PolarHBondContact O-N 3.38Å; Y233-T236 PolarHBondContact O-N 3.28Å; Y233-T236 VanDerWaalsContact O-N 3.08Å; Y233-T236 PolarHBondContact O-OG1 3.2Å; Y233-V237 PolarHBondContact O-N 3.14Å
234	Q	34.4	Very low	47.2	Very low	150 Å²	150	117.4 Å²	117.4	70%	0.701	60%	0.595	S	S	*	*	H	α-helix	trans	-62.9	-30.8	177.7	-72.1	178.1	7.3	0	0	112.8	Q230 Q231 T236	Q230-Q234 PolarHBondContact O-N 3.07Å; Q231-Q234 PolarHBondContact O-N 3.11Å; Q234-T236 VanDerWaalsContact C-N 3.32Å; Q234-T236 PolarHBondContact O-N 3.05Å
235	Q	36.7	Very low	44.6	Very low	152 Å²	152	119.8 Å²	119.8	71%	0.71	62%	0.615	S	S	*	*	H	α-helix	trans	-73.5	-20.9	175.9	-71.2	177.8	2.8	0	0	113.8	Q231 Q232 Y233	Q231-Q235 WeakPolarHBondContact O-CG 3.45Å; Q231-Q235 PolarHBondContact O-N 3.27Å; Q232-Q235 PolarHBondContact O-N 2.91Å; Y233-Q235 PolarHBondContact O-N 3.38Å
236	T	35.9	Very low	42.2	Very low	102 Å²	102	122.3 Å²	122.3	63%	0.626	63%	0.627	S	S	*	*	H	α-helix	trans	-95.5	-10.9	-175.6	50.5	0	0	0	0	114.2	Q232 Y233 Q234 T238	Q232-T236 PolarHBondContact O-N 3.02Å; Q232-T236 PolarHBondContact O-OG1 3.45Å; Y233-T236 PolarHBondContact O-N 3.28Å; Y233-T236 VanDerWaalsContact O-N 3.08Å; Y233-T236 PolarHBondContact O-OG1 3.2Å; Q234-T236 VanDerWaalsContact C-N 3.32Å; Q234-T236 PolarHBondContact O-N 3.05Å; T236-T238 PolarHBondContact O-N 2.94Å
237	V	29.2	Very low	40.1	Very low	107 Å²	107	125.7 Å²	125.7	65%	0.648	65%	0.648	S	S	*	*			trans	-93.4	76	173.3	-171.1	0	0	0	0	109.8	Y233 V239	Y233-V237 PolarHBondContact O-N 3.14Å; V237-V239 HydrophobicContact CG1-CG2 4.37Å
238	T	33.1	Very low	38.3	Very low	130 Å²	130	128.6 Å²	128.6	80%	0.798	67%	0.667	S	S	*	*			trans	-103.6	105.5	164	36.9	0	0	0	0	109.2	T236	T236-T238 PolarHBondContact O-N 2.94Å
239	V	35	Very low	37.3	Very low	115 Å²	115	132 Å²	132	70%	0.697	69%	0.686	S	S	*	*			trans	-89.3	122.2	171.6	174.2	0	0	0	0	108.2	V237	V237-V239 HydrophobicContact CG1-CG2 4.37Å
240	N	38.9	Very low	36.2	Very low	144 Å²	144	137 Å²	137	77%	0.77	71%	0.706	S	S	*	*	S	Bend	trans	61.5	104.2	163.6	-61.1	-14.1	0	0	0	118.3	K242	N240-K242 PolarHBondContact O-N 3.19Å
241	D	36.9	Very low	35.7	Very low	163 Å²	163	134.7 Å²	134.7	87%	0.872	71%	0.706	S	S	*	*	S	Bend	trans	17.5	84.2	146.8	-66.4	-29.1	0	0	0	117.4
242	K	34.5	Very low	35.6	Very low	191 Å²	191	133.4 Å²	133.4	83%	0.83	71%	0.706	S	S	*	*			trans	-168.8	103.5	137.4	-101.5	160.9	-168.4	-174.7	0	108.7	N240 I244	N240-K242 PolarHBondContact O-N 3.19Å; K242-I244 PolarHBondContact O-N 2.9Å
243	H	30.6	Very low	36	Very low	197 Å²	197	133.1 Å²	133.1	91%	0.912	71%	0.709	S	S	*	*			trans	-60.2	100.5	171.3	-109.2	-85.2	0	0	0	109.7
244	I	30.2	Very low	37.9	Very low	136 Å²	136	128.9 Å²	128.9	70%	0.697	70%	0.698	S	S	*	*			trans	-118.8	115.9	154.6	-56.9	176.3	0	0	0	105	K242 I246	K242-I244 PolarHBondContact O-N 2.9Å; I244-I246 PolarHBondContact O-N 3.44Å
245	P	30.3	Very low	40.2	Very low	103 Å²	103	126.1 Å²	126.1	67%	0.669	69%	0.693	S	S	*	*			trans	-67.3	105.2	177.7	28.3	-30.8	0	0	0	107.3	T247	P245-T247 PolarHBondContact O-N 2.93Å
246	I	31.3	Very low	42.5	Very low	147 Å²	147	121.4 Å²	121.4	75%	0.754	67%	0.671	S	S	*	*			trans	-71.9	82.9	168.8	-58.8	174.6	0	0	0	106.1	I244 T248	I244-I246 PolarHBondContact O-N 3.44Å; I246-T248 PolarHBondContact O-N 2.84Å
247	T	30.1	Very low	44.9	Very low	127 Å²	127	117 Å²	117	78%	0.779	65%	0.645	S	S	*	*			trans	-77.8	68	162	-22.6	0	0	0	0	107.2	P245	P245-T247 PolarHBondContact O-N 2.93Å
248	T	29.2	Very low	47.8	Very low	92 Å²	92	117.2 Å²	117.2	56%	0.564	64%	0.637	S	S	*	*			trans	-140	86.3	160.3	-47.9	0	0	0	0	104.7	I246 Q250	I246-T248 PolarHBondContact O-N 2.84Å; T248-Q250 HydrophobicContact CG2-CG 3.89Å; T248-Q250 PolarHBondContact O-N 3.33Å
249	I	36.7	Very low	50.6	Low	162 Å²	162	112.6 Å²	112.6	83%	0.831	61%	0.607	S	S	*	*			trans	-60.4	87.2	154.6	-57.9	169.7	0	0	0	103.2	A251	I249-A251 PolarHBondContact O-N 2.95Å
250	Q	34.5	Very low	53.3	Low	166 Å²	166	107.8 Å²	107.8	78%	0.776	58%	0.577	S	S	*	*			trans	-60.6	98.9	159.5	-73.2	-177.2	-17.3	0	0	102.6	T248 S252	T248-Q250 HydrophobicContact CG2-CG 3.89Å; T248-Q250 PolarHBondContact O-N 3.33Å; Q250-S252 PolarHBondContact O-N 3.31Å
251	A	42.4	Very low	55.8	Low	66 Å²	66	107.2 Å²	107.2	55%	0.545	57%	0.569	S	S	.	*			trans	-44.5	118.8	164.3	0	0	0	0	0	104.6	I249 N253	I249-A251 PolarHBondContact O-N 2.95Å; A251-N253 VanDerWaalsContact C-N 3.29Å; A251-N253 PolarHBondContact O-N 2.76Å
252	S	48.8	Very low	58.5	Low	58 Å²	58	104.5 Å²	104.5	41%	0.406	55%	0.551	S	S	.	*			trans	-52.9	104	179.1	45.2	0	0	0	0	105.7	Q250 D254	Q250-S252 PolarHBondContact O-N 3.31Å; S252-D254 PolarHBondContact O-N 2.82Å
253	N	58.1	Low	61.3	Low	127 Å²	127	95.5 Å²	95.5	68%	0.679	51%	0.512	S	S	*	.			trans	-73.1	19.9	177.1	-88.2	-27.8	0	0	0	110.6	A251 P255 K258	A251-N253 VanDerWaalsContact C-N 3.29Å; A251-N253 PolarHBondContact O-N 2.76Å; N253-P255 VanDerWaalsContact O-CD 3.3Å; N253-P255 WeakPolarHBondContact O-CD 3.37Å; N253-K258 PolarHBondContact OD1-NZ 2.86Å
254	D	78.7	Confident	64.4	Low	72 Å²	72	87.2 Å²	87.2	39%	0.385	48%	0.476	S	S	.	.			trans	-63.4	113.9	171.4	-176	5.6	0	0	0	107.7	S252 M256 A257 K258	S252-D254 PolarHBondContact O-N 2.82Å; D254-M256 PolarHBondContact O-N 2.64Å; D254-M256 VanDerWaalsContact O-N 3.13Å; D254-M256 WeakPolarHBondContact OD1-CB 3.43Å; D254-M256 PolarHBondContact OD1-N 3.1Å; D254-M256 VanDerWaalsContact OD1-N 3.14Å; D254-A257 HydrophobicContact CB-CB 4.26Å; D254-A257 PolarHBondContact O-N 2.96Å; D254-A257 VanDerWaalsContact O-N 3.11Å; D254-K258 PolarHBondContact O-N 2.71Å
255	P	83.4	Confident	67.3	Low	92 Å²	92	84.5 Å²	84.5	60%	0.597	46%	0.46	S	S	*	.	H	α-helix	trans	-55.1	-30	177.9	23.5	-34.4	0	0	0	111.5	N253 K258 L259	N253-P255 VanDerWaalsContact O-CD 3.3Å; N253-P255 WeakPolarHBondContact O-CD 3.37Å; P255-K258 PolarHBondContact O-N 2.93Å; P255-L259 WeakPolarHBondContact O-CB 3.28Å; P255-L259 PolarHBondContact O-N 2.97Å
256	M	84.4	Confident	70.2	Confident	53 Å²	53	83.2 Å²	83.2	26%	0.261	45%	0.447	S	S	.	.	H	α-helix	trans	-67.1	-38.4	179.8	-155.3	71.5	88.5	0	0	112.5	Y126 D254 L259 R260	Y126-M256 HydrophobicContact CD1-CE 4.32Å; Y126-M256 HydrophobicContact CD1-CG 3.93Å; Y126-M256 HydrophobicContact CD1-SD 3.22Å; Y126-M256 WeakPolarHBondContact CD1-SD 3.17Å; Y126-M256 HydrophobicContact CD2-CE 3.87Å; Y126-M256 HydrophobicContact CD2-CG 4.46Å; Y126-M256 HydrophobicContact CD2-SD 3.83Å; Y126-M256 HydrophobicContact CE1-CG 3.75Å; Y126-M256 HydrophobicContact CE1-SD 3.71Å; Y126-M256 HydrophobicContact CE2-CE 4.49Å; Y126-M256 HydrophobicContact CE2-CG 4.35Å; Y126-M256 HydrophobicContact CE2-SD 4.29Å; Y126-M256 HydrophobicContact CG-CE 3.78Å; Y126-M256 HydrophobicContact CG-CG 4.27Å; Y126-M256 HydrophobicContact CG-SD 3.27Å; D254-M256 PolarHBondContact O-N 2.64Å; D254-M256 VanDerWaalsContact O-N 3.13Å; D254-M256 WeakPolarHBondContact OD1-CB 3.43Å; D254-M256 PolarHBondContact OD1-N 3.1Å; D254-M256 VanDerWaalsContact OD1-N 3.14Å; M256-L259 PolarHBondContact O-N 3.2Å; M256-L259 HydrophobicContact SD-CD2 4.18Å; M256-R260 WeakPolarHBondContact O-CG 3.38Å; M256-R260 PolarHBondContact O-N 3.3Å
257	A	87.5	Confident	73.2	Confident	8 Å²	8	76.4 Å²	76.4	7%	0.066	41%	0.412	C	S	.	.	H	α-helix	trans	-64.4	-42.5	177.3	0	0	0	0	0	111.3	D254 L259 R260 E261	D254-A257 HydrophobicContact CB-CB 4.26Å; D254-A257 PolarHBondContact O-N 2.96Å; D254-A257 VanDerWaalsContact O-N 3.11Å; A257-L259 VanDerWaalsContact C-N 3.34Å; A257-L259 PolarHBondContact O-N 3.47Å; A257-R260 PolarHBondContact O-N 3.17Å; A257-E261 WeakPolarHBondContact O-CG 3.36Å; A257-E261 PolarHBondContact O-N 3.07Å
258	K	89.5	Confident	76	Confident	112 Å²	112	70.9 Å²	70.9	49%	0.487	38%	0.38	S	S	.	.	H	α-helix	trans	-63.7	-40	175.1	-67.6	-179.4	-178	171.5	0	111.9	N253 D254 P255 R260 E261 Q262	N253-K258 PolarHBondContact OD1-NZ 2.86Å; D254-K258 PolarHBondContact O-N 2.71Å; P255-K258 PolarHBondContact O-N 2.93Å; K258-R260 VanDerWaalsContact C-N 3.34Å; K258-R260 PolarHBondContact O-N 3.11Å; K258-E261 PolarHBondContact O-N 3.29Å; K258-Q262 WeakPolarHBondContact O-CB 3.25Å; K258-Q262 PolarHBondContact O-N 2.92Å
259	L	90.9	Very high	78.8	Confident	34 Å²	34	69.7 Å²	69.7	18%	0.178	37%	0.369	C	S	.	.	H	α-helix	trans	-62.2	-41.3	176	-171.9	69.4	0	0	0	111.7	Y126 I129 E130 P255 M256 A257 Q262 F263	Y126-L259 HydrophobicContact CD1-CD2 4.03Å; I129-L259 HydrophobicContact CG2-CD1 3.96Å; I129-L259 HydrophobicContact CG2-CD2 4.18Å; I129-L259 HydrophobicContact CG2-CG 3.97Å; E130-L259 HydrophobicContact CG-CD1 4.04Å; E130-L259 HydrophobicContact CG-CD2 3.48Å; E130-L259 VanDerWaalsContact CG-CD2 3.48Å; E130-L259 HydrophobicContact CG-CG 4.41Å; P255-L259 WeakPolarHBondContact O-CB 3.28Å; P255-L259 PolarHBondContact O-N 2.97Å; M256-L259 PolarHBondContact O-N 3.2Å; M256-L259 HydrophobicContact SD-CD2 4.18Å; A257-L259 VanDerWaalsContact C-N 3.34Å; A257-L259 PolarHBondContact O-N 3.47Å; L259-Q262 PolarHBondContact O-N 2.85Å; L259-F263 WeakPolarHBondContact O-CB 3.26Å; L259-F263 PolarHBondContact O-N 3.24Å
260	R	92.3	Very high	81.1	Confident	13 Å²	13	64.1 Å²	64.1	5%	0.049	34%	0.343	C	S	.	.	H	α-helix	trans	-62.3	-45.7	173.9	-69.1	-169.8	-80.8	-80	-6.2	112	Y126 V220 M224 D227 M256 A257 K258 Q262 F263 V264	Y126-R260 HydrophobicContact CE1-CG 3.82Å; Y126-R260 WeakPolarHBondContact OH-CD 3.4Å; Y126-R260 PolarHBondContact OH-NH1 3.49Å; V220-R260 HydrophobicContact CG1-CB 3.97Å; V220-R260 HydrophobicContact CG1-CG 3.84Å; M224-R260 HydrophobicContact CG-CB 4.34Å; D227-R260 IonicContact OD1-NH2 3.85Å; D227-R260 PolarHBondContact OD1-NH2 3.39Å; D227-R260 IonicContact OD2-CZ 3.68Å; D227-R260 VanDerWaalsContact OD2-CZ 3.25Å; D227-R260 IonicContact OD2-NE 3.66Å; D227-R260 PolarHBondContact OD2-NE 3.45Å; D227-R260 IonicContact OD2-NH2 3.16Å; D227-R260 PolarHBondContact OD2-NH2 3.11Å; M256-R260 WeakPolarHBondContact O-CG 3.38Å; M256-R260 PolarHBondContact O-N 3.3Å; A257-R260 PolarHBondContact O-N 3.17Å; K258-R260 VanDerWaalsContact C-N 3.34Å; K258-R260 PolarHBondContact O-N 3.11Å; R260-Q262 VanDerWaalsContact C-N 3.35Å; R260-F263 PolarHBondContact O-N 3.15Å; R260-V264 VanDerWaalsContact O-CG2 3.32Å; R260-V264 WeakPolarHBondContact O-CG2 3.46Å; R260-V264 PolarHBondContact O-N 2.94Å
261	E	91.4	Very high	83.4	Confident	132 Å²	132	57.7 Å²	57.7	62%	0.617	31%	0.314	S	S	*	.	H	α-helix	trans	-60.9	-44.3	177.9	-72.5	176.1	176.9	0	0	111.7	A257 K258 V264 E265	A257-E261 WeakPolarHBondContact O-CG 3.36Å; A257-E261 PolarHBondContact O-N 3.07Å; K258-E261 PolarHBondContact O-N 3.29Å; E261-V264 PolarHBondContact O-N 2.68Å; E261-E265 PolarHBondContact O-N 3.01Å; E261-E265 VanDerWaalsContact O-N 3.07Å
262	Q	93	Very high	84.9	Confident	106 Å²	106	59.4 Å²	59.4	50%	0.495	31%	0.311	S	S	.	.	H	α-helix	trans	-60.7	-47.9	175.2	-174.7	61.5	43	0	0	111.3	K258 L259 R260 V264 E265 D266	K258-Q262 WeakPolarHBondContact O-CB 3.25Å; K258-Q262 PolarHBondContact O-N 2.92Å; L259-Q262 PolarHBondContact O-N 2.85Å; R260-Q262 VanDerWaalsContact C-N 3.35Å; Q262-V264 VanDerWaalsContact C-N 3.28Å; Q262-V264 PolarHBondContact O-N 3.01Å; Q262-E265 PolarHBondContact O-N 3.25Å; Q262-E265 VanDerWaalsContact O-N 3.1Å; Q262-D266 PolarHBondContact NE2-OD1 3.19Å; Q262-D266 PolarHBondContact O-N 3.21Å
263	F	95	Very high	85.6	Confident	3 Å²	3	66.9 Å²	66.9	1%	0.013	34%	0.336	C	S	.	.	H	α-helix	trans	-57.6	-39.4	177.9	179.7	-91.5	0	0	0	112.8	I129 L134 M216 V217 V220 L259 R260 L267	I129-F263 HydrophobicContact CD1-CD2 3.81Å; I129-F263 HydrophobicContact CD1-CE2 3.88Å; I129-F263 HydrophobicContact CD1-CG 4.42Å; I129-F263 HydrophobicContact CG1-CD2 3.99Å; I129-F263 HydrophobicContact CG1-CE2 4.01Å; I129-F263 HydrophobicContact CG2-CD2 3.91Å; L134-F263 HydrophobicContact CB-CE2 4.16Å; L134-F263 HydrophobicContact CD1-CE2 3.9Å; L134-F263 HydrophobicContact CD1-CZ 4.25Å; L134-F263 HydrophobicContact CD2-CD2 3.8Å; L134-F263 HydrophobicContact CD2-CE2 3.69Å; L134-F263 HydrophobicContact CD2-CZ 4.44Å; L134-F263 HydrophobicContact CG-CE2 4.12Å; M216-F263 HydrophobicContact CB-CE2 4.4Å; M216-F263 HydrophobicContact CB-CZ 4.09Å; M216-F263 HydrophobicContact CE-CE2 4.07Å; V217-F263 HydrophobicContact CG2-CE1 4.33Å; V217-F263 HydrophobicContact CG2-CZ 4.19Å; V220-F263 HydrophobicContact CB-CD1 3.92Å; V220-F263 HydrophobicContact CB-CE1 3.94Å; V220-F263 HydrophobicContact CG1-CD1 3.63Å; V220-F263 HydrophobicContact CG1-CE1 4.15Å; V220-F263 HydrophobicContact CG1-CG 4.34Å; V220-F263 HydrophobicContact CG2-CD1 3.86Å; V220-F263 HydrophobicContact CG2-CE1 3.91Å; V220-F263 HydrophobicContact CG2-CG 4.21Å; V220-F263 HydrophobicContact CG2-CZ 4.33Å; L259-F263 WeakPolarHBondContact O-CB 3.26Å; L259-F263 PolarHBondContact O-N 3.24Å; R260-F263 PolarHBondContact O-N 3.15Å; F263-L267 HydrophobicContact CD1-CD1 3.81Å; F263-L267 HydrophobicContact CD1-CG 4.43Å; F263-L267 HydrophobicContact CE1-CD1 3.33Å; F263-L267 HydrophobicContact CE1-CG 4.13Å; F263-L267 HydrophobicContact CZ-CD1 3.92Å; F263-L267 HydrophobicContact CZ-CG 4.38Å; F263-L267 WeakPolarHBondContact O-CG 3.31Å; F263-L267 PolarHBondContact O-N 2.8Å; F263-L267 VanDerWaalsContact O-N 3.08Å
264	V	93.8	Very high	85.6	Confident	23 Å²	23	68.9 Å²	68.9	14%	0.139	35%	0.347	C	S	.	.	H	α-helix	trans	-68.5	-39	176.9	174.7	0	0	0	0	111.8	M224 R260 E261 Q262 A268 I313	M224-V264 HydrophobicContact CE-CG2 4.48Å; M224-V264 HydrophobicContact SD-CG2 3.82Å; R260-V264 VanDerWaalsContact O-CG2 3.32Å; R260-V264 WeakPolarHBondContact O-CG2 3.46Å; R260-V264 PolarHBondContact O-N 2.94Å; E261-V264 PolarHBondContact O-N 2.68Å; Q262-V264 VanDerWaalsContact C-N 3.28Å; Q262-V264 PolarHBondContact O-N 3.01Å; V264-A268 PolarHBondContact O-N 3.17Å; V264-I313 HydrophobicContact CG2-CD1 3.64Å; V264-I313 HydrophobicContact CG2-CG1 3.76Å
265	E	90.9	Very high	85	Confident	78 Å²	78	66.5 Å²	66.5	36%	0.364	34%	0.338	S	S	.	.	H	α-helix	trans	-67.4	-42.2	175.6	-168.4	60.5	-137.8	0	0	111.2	E261 Q262 L267 A268 M269 R593	E261-E265 PolarHBondContact O-N 3.01Å; E261-E265 VanDerWaalsContact O-N 3.07Å; Q262-E265 PolarHBondContact O-N 3.25Å; Q262-E265 VanDerWaalsContact O-N 3.1Å; E265-L267 VanDerWaalsContact C-N 3.31Å; E265-L267 PolarHBondContact O-N 2.99Å; E265-A268 CarbonylContact O-C 3.55Å; E265-A268 PolarHBondContact O-N 3Å; E265-M269 HydrophobicContact CG-CG 4.31Å; E265-M269 WeakPolarHBondContact O-CG 3.26Å; E265-M269 PolarHBondContact O-N 3.45Å; E265-R593 IonicContact OE1-CZ 2.72Å; E265-R593 IonicContact OE1-NH1 2.57Å; E265-R593 PolarHBondContact OE1-NH1 2.8Å; E265-R593 VanDerWaalsContact OE1-NH1 3.16Å; E265-R593 IonicContact OE1-NH2 3.84Å; E265-R593 PolarHBondContact OE1-NH2 2.84Å
266	D	92.4	Very high	84.6	Confident	76 Å²	76	66.2 Å²	66.2	41%	0.406	33%	0.332	S	S	.	.	H	α-helix	trans	-59.6	-41.5	177.5	-65.7	-18.9	0	0	0	111.4	L134 Q262 A268 M269	L134-D266 HydrophobicContact CD2-CB 4.02Å; Q262-D266 PolarHBondContact NE2-OD1 3.19Å; Q262-D266 PolarHBondContact O-N 3.21Å; D266-A268 VanDerWaalsContact C-N 3.28Å; D266-A268 PolarHBondContact O-N 3.29Å; D266-M269 PolarHBondContact O-N 3.25Å
267	L	93.3	Very high	84.6	Confident	4 Å²	4	64.5 Å²	64.5	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-65.2	-29.5	174.3	-77.6	175.3	0	0	0	114	L134 V217 F263 E265 L279 I313 T314	L134-L267 HydrophobicContact CD1-CD2 3.96Å; L134-L267 HydrophobicContact CD2-CD2 4.22Å; L134-L267 HydrophobicContact CD2-CG 4.24Å; V217-L267 HydrophobicContact CG2-CD1 4Å; V217-L267 HydrophobicContact CG2-CD2 4.45Å; F263-L267 HydrophobicContact CD1-CD1 3.81Å; F263-L267 HydrophobicContact CD1-CG 4.43Å; F263-L267 HydrophobicContact CE1-CD1 3.33Å; F263-L267 HydrophobicContact CE1-CG 4.13Å; F263-L267 HydrophobicContact CZ-CD1 3.92Å; F263-L267 HydrophobicContact CZ-CG 4.38Å; F263-L267 WeakPolarHBondContact O-CG 3.31Å; F263-L267 PolarHBondContact O-N 2.8Å; F263-L267 VanDerWaalsContact O-N 3.08Å; E265-L267 VanDerWaalsContact C-N 3.31Å; E265-L267 PolarHBondContact O-N 2.99Å; L267-L279 HydrophobicContact CD2-CD2 3.9Å; L267-I313 HydrophobicContact CD1-CG2 4.02Å; L267-T314 HydrophobicContact CB-CG2 3.9Å
268	A	89.2	Confident	84.8	Confident	12 Å²	12	64.4 Å²	64.4	10%	0.099	32%	0.323	C	S	.	.	H	α-helix	trans	-89.6	-14.6	-178.7	0	0	0	0	0	112.6	V264 E265 D266 T314 P590 R593	V264-A268 PolarHBondContact O-N 3.17Å; E265-A268 CarbonylContact O-C 3.55Å; E265-A268 PolarHBondContact O-N 3Å; D266-A268 VanDerWaalsContact C-N 3.28Å; D266-A268 PolarHBondContact O-N 3.29Å; A268-T314 HydrophobicContact CB-CG2 4.08Å; A268-P590 HydrophobicContact CB-CB 4.49Å; A268-R593 VanDerWaalsContact CB-NH1 3.28Å; A268-R593 PolarHBondContact O-NH1 3.31Å
269	M	87.7	Confident	85	Confident	66 Å²	66	59.3 Å²	59.3	33%	0.325	30%	0.3	S	S	.	.	S	Bend	trans	-78.3	151.7	177.3	-79.8	-75.9	95	0	0	112	E265 D266	E265-M269 HydrophobicContact CG-CG 4.31Å; E265-M269 WeakPolarHBondContact O-CG 3.26Å; E265-M269 PolarHBondContact O-N 3.45Å; D266-M269 PolarHBondContact O-N 3.25Å
270	P	85.5	Confident	85.2	Confident	45 Å²	45	58 Å²	58	29%	0.292	29%	0.294	S	S	.	.			trans	-62.2	142.2	169	-18.1	31.2	0	0	0	111.3	G275 L277	P270-G275 WeakPolarHBondContact CB-O 3.41Å; P270-L277 CarbonylContact C-O 3.54Å; P270-L277 VanDerWaalsContact CA-O 3.23Å; P270-L277 WeakPolarHBondContact CA-O 3.4Å
271	I	84.1	Confident	85.2	Confident	31 Å²	31	57.9 Å²	57.9	16%	0.159	30%	0.296	C	S	.	.	S	Bend	trans	-70	-39.5	-178.6	-58.2	169.2	0	0	0	110.1	I138 L142 L277 L279 V282	I138-I271 HydrophobicContact CG2-CD1 3.68Å; I138-I271 HydrophobicContact CG2-CG1 4.06Å; I138-I271 HydrophobicContact CG2-CG2 3.94Å; L142-I271 HydrophobicContact CD1-CD1 4.28Å; L142-I271 HydrophobicContact CD1-CG2 3.94Å; I271-L277 HydrophobicContact CD1-CG 4.43Å; I271-L277 PolarHBondContact N-O 3.09Å; I271-L279 HydrophobicContact CD1-CB 4.46Å; I271-V282 HydrophobicContact CD1-CG2 4.08Å
272	E	73.6	Confident	85.3	Confident	103 Å²	103	51.6 Å²	51.6	48%	0.481	27%	0.266	S	S	.	.	S	Bend	trans	-98.5	141.1	174.8	-68.3	179.9	-177.5	0	0	110.6	D274 G275	E272-D274 PolarHBondContact O-N 3.49Å; E272-G275 PolarHBondContact O-N 3.28Å
273	K	63.8	Low	85.5	Confident	214 Å²	214	46.6 Å²	46.6	93%	0.93	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.9	-176.5	-68.5	-177.2	179.7	174.9	0	113.9
274	D	57.1	Low	85.6	Confident	170 Å²	170	46.4 Å²	46.4	91%	0.909	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.6	1.1	-174.7	-62.7	-32.3	0	0	0	113.3	E272	E272-D274 PolarHBondContact O-N 3.49Å
275	G	67	Low	85.7	Confident	21 Å²	21	45.6 Å²	45.6	22%	0.216	24%	0.239	C	C	.	.	S	Bend	trans	-116.8	161.2	-173.9	0	0	0	0	0	114.3	P270 E272 L277	P270-G275 WeakPolarHBondContact CB-O 3.41Å; E272-G275 PolarHBondContact O-N 3.28Å; G275-L277 PolarHBondContact O-N 3.09Å
276	D	73.7	Confident	85.9	Confident	86 Å²	86	41.9 Å²	41.9	46%	0.46	22%	0.221	S	C	.	.			trans	-87.5	13.3	170.8	-76.4	-29.4	0	0	0	112.1	T278 R596 S597	D276-T278 PolarHBondContact O-N 3.26Å; D276-R596 IonicContact OD1-NE 3.42Å; D276-R596 IonicContact OD2-CZ 3.61Å; D276-R596 IonicContact OD2-NE 2.89Å; D276-R596 PolarHBondContact OD2-NE 3.41Å; D276-R596 IonicContact OD2-NH2 3.95Å; D276-R596 PolarHBondContact OD2-NH2 3.19Å; D276-S597 WeakPolarHBondContact O-CB 3.46Å
277	L	85.2	Confident	86.1	Confident	18 Å²	18	38.3 Å²	38.3	9%	0.094	20%	0.202	C	C	.	.			trans	-75.8	111.4	-173.7	-178.8	59.9	0	0	0	111.5	Y147 P270 I271 G275 A281 V282	Y147-L277 HydrophobicContact CD1-CD2 4.14Å; Y147-L277 HydrophobicContact CE1-CD1 4.37Å; Y147-L277 HydrophobicContact CE1-CD2 3.41Å; Y147-L277 VanDerWaalsContact CE1-CD2 3.41Å; Y147-L277 HydrophobicContact CE2-CD1 4.27Å; Y147-L277 HydrophobicContact CE2-CD2 4.46Å; Y147-L277 WeakPolarHBondContact OH-CD1 3.28Å; P270-L277 CarbonylContact C-O 3.54Å; P270-L277 VanDerWaalsContact CA-O 3.23Å; P270-L277 WeakPolarHBondContact CA-O 3.4Å; I271-L277 HydrophobicContact CD1-CG 4.43Å; I271-L277 PolarHBondContact N-O 3.09Å; G275-L277 PolarHBondContact O-N 3.09Å; L277-A281 HydrophobicContact CD1-CB 4.2Å; L277-V282 HydrophobicContact CD1-CG2 3.69Å; L277-V282 HydrophobicContact CD2-CG2 4.39Å; L277-V282 HydrophobicContact CG-CG2 4.15Å
278	T	90.6	Very high	86.1	Confident	6 Å²	6	40.5 Å²	40.5	4%	0.037	21%	0.212	C	C	.	.			trans	-106.1	157.7	174.5	59.6	0	0	0	0	111.1	D276 T280 A281 V282 S597	D276-T278 PolarHBondContact O-N 3.26Å; T278-T280 PolarHBondContact O-N 3.34Å; T278-T280 PolarHBondContact OG1-OG1 2.65Å; T278-A281 WeakPolarHBondContact O-CB 3.37Å; T278-A281 PolarHBondContact O-N 3Å; T278-A281 PolarHBondContact OG1-N 3.38Å; T278-V282 PolarHBondContact O-N 3.42Å; T278-V282 VanDerWaalsContact O-N 3.09Å; T278-S597 PolarHBondContact OG1-OG 2.8Å
279	L	94.1	Very high	86.4	Confident	4 Å²	4	41.2 Å²	41.2	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-54.4	-36.6	172.1	177.9	61.5	0	0	0	111.5	I138 L141 L267 I271 A281 V282 L283 V310	I138-L279 HydrophobicContact CD1-CD2 4.32Å; L141-L279 HydrophobicContact CD2-CD1 4.33Å; L267-L279 HydrophobicContact CD2-CD2 3.9Å; I271-L279 HydrophobicContact CD1-CB 4.46Å; L279-A281 VanDerWaalsContact C-N 3.35Å; L279-A281 PolarHBondContact O-N 3.41Å; L279-V282 WeakPolarHBondContact O-CB 3.19Å; L279-V282 PolarHBondContact O-N 2.89Å; L279-L283 HydrophobicContact CD1-CD1 4.4Å; L279-L283 HydrophobicContact CD1-CG 4.29Å; L279-L283 HydrophobicContact CG-CD1 4.1Å; L279-L283 HydrophobicContact CG-CG 4.44Å; L279-L283 VanDerWaalsContact O-CG 3.29Å; L279-L283 WeakPolarHBondContact O-CG 3.45Å; L279-L283 PolarHBondContact O-N 3.06Å; L279-V310 HydrophobicContact CD2-CG2 4.16Å
280	T	94.6	Very high	86.6	Confident	8 Å²	8	38.7 Å²	38.7	5%	0.049	20%	0.199	C	C	.	.	H	α-helix	trans	-61.6	-40.8	175.3	45.8	0	0	0	0	112.7	T278 L283 F284 L307 V310 L311 L594	T278-T280 PolarHBondContact O-N 3.34Å; T278-T280 PolarHBondContact OG1-OG1 2.65Å; T280-L283 PolarHBondContact O-N 3.07Å; T280-F284 WeakPolarHBondContact O-CD2 3.29Å; T280-F284 PolarHBondContact O-N 3.32Å; T280-L307 HydrophobicContact CG2-CD1 4.01Å; T280-V310 HydrophobicContact CG2-CB 4.46Å; T280-V310 HydrophobicContact CG2-CG1 3.62Å; T280-L311 HydrophobicContact CG2-CD2 3.71Å; T280-L311 HydrophobicContact CG2-CG 4.11Å; T280-L594 HydrophobicContact CG2-CD1 4.32Å; T280-L594 WeakPolarHBondContact OG1-CD1 3.38Å
281	A	92.3	Very high	86.9	Confident	10 Å²	10	37.1 Å²	37.1	8%	0.083	19%	0.189	C	C	.	.	H	α-helix	trans	-66.4	-39.4	176.8	0	0	0	0	0	111.6	L277 T278 L279 F284 G285	L277-A281 HydrophobicContact CD1-CB 4.2Å; T278-A281 WeakPolarHBondContact O-CB 3.37Å; T278-A281 PolarHBondContact O-N 3Å; T278-A281 PolarHBondContact OG1-N 3.38Å; L279-A281 VanDerWaalsContact C-N 3.35Å; L279-A281 PolarHBondContact O-N 3.41Å; A281-F284 PolarHBondContact O-N 3.21Å; A281-G285 PolarHBondContact O-N 3.43Å
282	V	94.5	Very high	87.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.6	-50.2	173.7	178.4	0	0	0	0	110.8	L142 I145 Y147 I271 L277 T278 L279 F284 G285 M286	L142-V282 HydrophobicContact CD2-CB 4.48Å; L142-V282 HydrophobicContact CD2-CG1 3.89Å; L142-V282 HydrophobicContact CD2-CG2 3.71Å; I145-V282 HydrophobicContact CD1-CG1 3.64Å; Y147-V282 HydrophobicContact CE2-CG2 4.26Å; I271-V282 HydrophobicContact CD1-CG2 4.08Å; L277-V282 HydrophobicContact CD1-CG2 3.69Å; L277-V282 HydrophobicContact CD2-CG2 4.39Å; L277-V282 HydrophobicContact CG-CG2 4.15Å; T278-V282 PolarHBondContact O-N 3.42Å; T278-V282 VanDerWaalsContact O-N 3.09Å; L279-V282 WeakPolarHBondContact O-CB 3.19Å; L279-V282 PolarHBondContact O-N 2.89Å; V282-F284 PolarHBondContact O-N 3.22Å; V282-G285 CarbonylContact O-C 3.5Å; V282-G285 WeakPolarHBondContact O-CA 3.33Å; V282-G285 PolarHBondContact O-N 3.08Å; V282-G285 VanDerWaalsContact O-N 3.07Å; V282-M286 WeakPolarHBondContact O-CG 3.38Å; V282-M286 PolarHBondContact O-N 3.08Å
283	L	97.5	Very high	87.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-39.1	-179.5	-64.7	171	0	0	0	112.4	L210 L279 T280 G285 M286 I287 V303 L306 L307	L210-L283 HydrophobicContact CD2-CD2 4.07Å; L279-L283 HydrophobicContact CD1-CD1 4.4Å; L279-L283 HydrophobicContact CD1-CG 4.29Å; L279-L283 HydrophobicContact CG-CD1 4.1Å; L279-L283 HydrophobicContact CG-CG 4.44Å; L279-L283 VanDerWaalsContact O-CG 3.29Å; L279-L283 WeakPolarHBondContact O-CG 3.45Å; L279-L283 PolarHBondContact O-N 3.06Å; T280-L283 PolarHBondContact O-N 3.07Å; L283-G285 VanDerWaalsContact C-N 3.32Å; L283-M286 HydrophobicContact CD2-SD 4.16Å; L283-M286 PolarHBondContact O-N 2.99Å; L283-I287 WeakPolarHBondContact O-CG1 3.43Å; L283-I287 PolarHBondContact O-N 3.08Å; L283-I287 VanDerWaalsContact O-N 3.09Å; L283-V303 HydrophobicContact CB-CG1 4.35Å; L283-V303 HydrophobicContact CD2-CG1 4.11Å; L283-L306 HydrophobicContact CD1-CB 4.46Å; L283-L306 HydrophobicContact CD1-CD2 4.03Å; L283-L306 HydrophobicContact CD1-CG 3.86Å; L283-L306 HydrophobicContact CD2-CD2 3.92Å; L283-L307 HydrophobicContact CB-CB 4.08Å; L283-L307 HydrophobicContact CB-CD1 4.06Å; L283-L307 HydrophobicContact CB-CD2 4.29Å; L283-L307 HydrophobicContact CB-CG 4.37Å; L283-L307 HydrophobicContact CD1-CB 3.92Å; L283-L307 HydrophobicContact CD1-CD1 4.23Å
284	F	96.9	Very high	88.9	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.3	-40.1	170.5	-83.6	-60.4	0	0	0	112.2	T280 A281 V282 I287 H288 L307 L311 M598 Y605 L609 L666 L670	T280-F284 WeakPolarHBondContact O-CD2 3.29Å; T280-F284 PolarHBondContact O-N 3.32Å; A281-F284 PolarHBondContact O-N 3.21Å; V282-F284 PolarHBondContact O-N 3.22Å; F284-I287 PolarHBondContact O-N 3.29Å; F284-H288 WeakPolarHBondContact O-CB 3.43Å; F284-H288 PolarHBondContact O-N 3.37Å; F284-L307 HydrophobicContact CD1-CD2 3.78Å; F284-L307 HydrophobicContact CD2-CD1 4.17Å; F284-L307 HydrophobicContact CD2-CD2 4.27Å; F284-L307 HydrophobicContact CE1-CD2 3.65Å; F284-L307 HydrophobicContact CE2-CD1 3.88Å; F284-L307 HydrophobicContact CE2-CD2 4.14Å; F284-L307 HydrophobicContact CE2-CG 4.5Å; F284-L307 HydrophobicContact CG-CD2 4.08Å; F284-L307 HydrophobicContact CZ-CD1 4.22Å; F284-L307 HydrophobicContact CZ-CD2 3.82Å; F284-L307 HydrophobicContact CZ-CG 4.37Å; F284-L311 HydrophobicContact CE2-CD1 4.45Å; F284-L311 HydrophobicContact CZ-CD1 4.27Å; F284-M598 HydrophobicContact CD1-CE 4.38Å; F284-M598 HydrophobicContact CD2-CE 3.86Å; F284-M598 HydrophobicContact CD2-CG 4.07Å; F284-M598 HydrophobicContact CD2-SD 4.01Å; F284-M598 HydrophobicContact CE1-CE 3.94Å; F284-M598 HydrophobicContact CE2-CE 3.38Å; F284-M598 HydrophobicContact CE2-CG 4.13Å; F284-M598 HydrophobicContact CE2-SD 3.45Å; F284-M598 WeakPolarHBondContact CE2-SD 3.32Å; F284-M598 HydrophobicContact CG-CE 4.37Å; F284-M598 HydrophobicContact CZ-CE 3.44Å; F284-M598 VanDerWaalsContact CZ-CE 3.44Å; F284-M598 HydrophobicContact CZ-SD 4.03Å; F284-Y605 HydrophobicContact CB-CD1 3.8Å; F284-Y605 HydrophobicContact CB-CD2 3.92Å; F284-Y605 HydrophobicContact CB-CE1 3.74Å; F284-Y605 HydrophobicContact CB-CE2 3.85Å; F284-Y605 HydrophobicContact CB-CG 3.89Å; F284-Y605 HydrophobicContact CD1-CD1 4.5Å; F284-Y605 HydrophobicContact CD1-CD2 4.35Å; F284-Y605 HydrophobicContact CD1-CG 4.04Å; F284-Y605 HydrophobicContact CG-CD1 4.48Å; F284-Y605 HydrophobicContact CG-CD2 4.08Å; F284-Y605 HydrophobicContact CG-CE2 4.39Å; F284-Y605 HydrophobicContact CG-CG 4.12Å; F284-L609 HydrophobicContact CE1-CD1 4.16Å; F284-L666 HydrophobicContact CE1-CD2 4.19Å; F284-L666 HydrophobicContact CZ-CD2 4.18Å; F284-L670 HydrophobicContact CZ-CD1 4.1Å
285	G	95.1	Very high	90.4	Very high	6 Å²	6	22.9 Å²	22.9	6%	0.062	14%	0.142	C	C	.	.	H	α-helix	trans	-61	-42.8	174	0	0	0	0	0	112.9	A281 V282 L283 I287 H288 R289	A281-G285 PolarHBondContact O-N 3.43Å; V282-G285 CarbonylContact O-C 3.5Å; V282-G285 WeakPolarHBondContact O-CA 3.33Å; V282-G285 PolarHBondContact O-N 3.08Å; V282-G285 VanDerWaalsContact O-N 3.07Å; L283-G285 VanDerWaalsContact C-N 3.32Å; G285-I287 PolarHBondContact O-N 3.14Å; G285-H288 PolarHBondContact O-N 2.95Å; G285-R289 WeakPolarHBondContact O-CG 3.47Å; G285-R289 PolarHBondContact O-N 3.06Å
286	M	95.8	Very high	91.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.3	-46.3	173.5	-65.9	-179.8	76.8	0	0	111.5	I145 W150 L210 V282 L283 H288 R289 F290 F298 V303	I145-M286 HydrophobicContact CG2-CE 4.06Å; W150-M286 HydrophobicContact CH2-CG 3.88Å; W150-M286 HydrophobicContact CZ2-CG 4.35Å; L210-M286 HydrophobicContact CD1-CE 4.43Å; V282-M286 WeakPolarHBondContact O-CG 3.38Å; V282-M286 PolarHBondContact O-N 3.08Å; L283-M286 HydrophobicContact CD2-SD 4.16Å; L283-M286 PolarHBondContact O-N 2.99Å; M286-H288 VanDerWaalsContact C-N 3.31Å; M286-H288 PolarHBondContact O-N 3.35Å; M286-R289 PolarHBondContact O-N 3.43Å; M286-F290 WeakPolarHBondContact O-CB 3.47Å; M286-F290 PolarHBondContact O-N 3.37Å; M286-F298 HydrophobicContact CB-CD2 3.8Å; M286-F298 HydrophobicContact CB-CE2 3.99Å; M286-F298 HydrophobicContact CE-CB 4.33Å; M286-F298 HydrophobicContact CE-CD1 3.97Å; M286-F298 HydrophobicContact CE-CD2 4.08Å; M286-F298 HydrophobicContact CE-CE1 4.24Å; M286-F298 HydrophobicContact CE-CE2 4.35Å; M286-F298 HydrophobicContact CE-CG 3.88Å; M286-F298 HydrophobicContact CE-CZ 4.43Å; M286-F298 HydrophobicContact CG-CD2 4.2Å; M286-F298 HydrophobicContact CG-CE2 4Å; M286-V303 HydrophobicContact CB-CG1 4.21Å; M286-V303 HydrophobicContact CE-CG2 3.79Å; M286-V303 HydrophobicContact SD-CG2 4.17Å
287	I	96.1	Very high	92	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-59.4	-43.2	176.7	-69.3	164.1	0	0	0	111	L283 F284 G285 C291 M300 V303 L304 L307 A608 L609 I612	L283-I287 WeakPolarHBondContact O-CG1 3.43Å; L283-I287 PolarHBondContact O-N 3.08Å; L283-I287 VanDerWaalsContact O-N 3.09Å; F284-I287 PolarHBondContact O-N 3.29Å; G285-I287 PolarHBondContact O-N 3.14Å; I287-C291 WeakPolarHBondContact O-CB 3.35Å; I287-C291 PolarHBondContact O-N 3.42Å; I287-C291 PolarHBondContact O-SG 2.89Å; I287-M300 HydrophobicContact CG1-SD 4.19Å; I287-V303 HydrophobicContact CD1-CG1 4.18Å; I287-V303 HydrophobicContact CG1-CG1 3.78Å; I287-L304 HydrophobicContact CD1-CD2 3.59Å; I287-L304 HydrophobicContact CD1-CG 4.42Å; I287-L304 HydrophobicContact CG1-CD2 4.19Å; I287-L307 HydrophobicContact CD1-CD2 3.44Å; I287-L307 VanDerWaalsContact CD1-CD2 3.44Å; I287-A608 HydrophobicContact CG2-CB 3.86Å; I287-L609 HydrophobicContact CD1-CD2 4.24Å; I287-L609 HydrophobicContact CG2-CD2 4.4Å; I287-I612 HydrophobicContact CG2-CD1 3.82Å
288	H	94.7	Very high	92.3	Very high	49 Å²	49	22.2 Å²	22.2	23%	0.227	13%	0.134	C	C	.	.	H	α-helix	trans	-65.6	-45.8	178.9	176.1	-109.8	0	0	0	112.7	F284 G285 M286 C291 S292 Y605	F284-H288 WeakPolarHBondContact O-CB 3.43Å; F284-H288 PolarHBondContact O-N 3.37Å; G285-H288 PolarHBondContact O-N 2.95Å; M286-H288 VanDerWaalsContact C-N 3.31Å; M286-H288 PolarHBondContact O-N 3.35Å; H288-C291 PolarHBondContact O-N 3.25Å; H288-S292 WeakPolarHBondContact O-CB 3.12Å; H288-S292 PolarHBondContact O-N 2.72Å; H288-S292 PolarHBondContact O-OG 3.34Å; H288-Y605 HydrophobicContact CB-CD1 4.05Å; H288-Y605 HydrophobicContact CB-CE1 4.05Å
289	R	94	Very high	92.4	Very high	27 Å²	27	22 Å²	22	10%	0.102	13%	0.133	C	C	.	.	H	α-helix	trans	-67	-38.5	179.3	-71.5	-176.6	64.2	141.4	-7.6	112	W150 G285 M286 S292 G293 I294 D295 F298	W150-R289 VanDerWaalsContact NE1-NH1 3.19Å; G285-R289 WeakPolarHBondContact O-CG 3.47Å; G285-R289 PolarHBondContact O-N 3.06Å; M286-R289 PolarHBondContact O-N 3.43Å; R289-S292 PolarHBondContact O-N 2.86Å; R289-G293 PolarHBondContact O-N 2.87Å; R289-I294 HydrophobicContact CB-CB 4.37Å; R289-I294 HydrophobicContact CG-CD1 4.43Å; R289-I294 PolarHBondContact O-N 2.56Å; R289-D295 HydrophobicContact CB-CB 4.44Å; R289-D295 IonicContact CZ-OD2 3.97Å; R289-D295 IonicContact NE-OD2 2.6Å; R289-D295 PolarHBondContact NE-OD2 3.17Å; R289-D295 IonicContact NH2-OD1 2.99Å; R289-D295 IonicContact NH2-OD2 3.94Å; R289-D295 PolarHBondContact NH2-OD2 3.2Å; R289-D295 PolarHBondContact O-N 3.45Å; R289-F298 HydrophobicContact CB-CE2 4.28Å
290	F	92.7	Very high	92.4	Very high	14 Å²	14	22 Å²	22	6%	0.061	13%	0.132	C	C	.	.	H	α-helix	trans	-60	-50.2	170.9	175.4	-95.3	0	0	0	111.9	M286 S292 G293 P296 F298 M300 I612 I627 I629	M286-F290 WeakPolarHBondContact O-CB 3.47Å; M286-F290 PolarHBondContact O-N 3.37Å; F290-S292 PolarHBondContact O-N 2.98Å; F290-G293 PolarHBondContact O-N 2.96Å; F290-P296 WeakPolarHBondContact CE2-O 3.16Å; F290-F298 HydrophobicContact CD2-CB 4.46Å; F290-M300 HydrophobicContact CB-CE 3.49Å; F290-M300 VanDerWaalsContact CB-CE 3.49Å; F290-M300 HydrophobicContact CB-CG 4.37Å; F290-M300 HydrophobicContact CB-SD 3.73Å; F290-M300 HydrophobicContact CD1-CE 4.24Å; F290-M300 HydrophobicContact CD1-CG 3.31Å; F290-M300 HydrophobicContact CD1-SD 3.53Å; F290-M300 VanDerWaalsContact CD1-SD 3.53Å; F290-M300 HydrophobicContact CD2-CE 3.93Å; F290-M300 HydrophobicContact CD2-CG 3.79Å; F290-M300 HydrophobicContact CD2-SD 4.25Å; F290-M300 HydrophobicContact CE1-CB 4.49Å; F290-M300 HydrophobicContact CE1-CG 3.32Å; F290-M300 HydrophobicContact CE1-SD 4.18Å; F290-M300 HydrophobicContact CE2-CG 3.8Å; F290-M300 HydrophobicContact CG-CE 3.63Å; F290-M300 HydrophobicContact CG-CG 3.55Å; F290-M300 HydrophobicContact CG-SD 3.57Å; F290-M300 VanDerWaalsContact CG-SD 3.57Å; F290-M300 HydrophobicContact CZ-CG 3.58Å; F290-I612 HydrophobicContact CD1-CD1 4.33Å; F290-I627 HydrophobicContact CD1-CG2 4.29Å; F290-I627 HydrophobicContact CE1-CG2 3.37Å; F290-I627 HydrophobicContact CZ-CG2 3.91Å; F290-I629 HydrophobicContact CE1-CG2 4.41Å
291	C	91.6	Very high	92.4	Very high	11 Å²	11	21.7 Å²	21.7	7%	0.074	13%	0.13	C	C	.	.	H	α-helix	trans	-67	-21.7	179.8	-72.9	0	0	0	0	114.3	I287 H288 G293 A608 I612	I287-C291 WeakPolarHBondContact O-CB 3.35Å; I287-C291 PolarHBondContact O-N 3.42Å; I287-C291 PolarHBondContact O-SG 2.89Å; H288-C291 PolarHBondContact O-N 3.25Å; C291-G293 VanDerWaalsContact C-N 3.32Å; C291-A608 HydrophobicContact CB-CB 3.87Å; C291-A608 PolarHBondContact SG-O 3.45Å; C291-I612 WeakPolarHBondContact SG-CG1 3.39Å
292	S	89.8	Confident	92.6	Very high	60 Å²	60	21.2 Å²	21.2	42%	0.42	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-6.9	174.8	-59	0	0	0	0	112.5	H288 R289 F290 I294	H288-S292 WeakPolarHBondContact O-CB 3.12Å; H288-S292 PolarHBondContact O-N 2.72Å; H288-S292 PolarHBondContact O-OG 3.34Å; R289-S292 PolarHBondContact O-N 2.86Å; F290-S292 PolarHBondContact O-N 2.98Å; S292-I294 VanDerWaalsContact C-N 3.26Å; S292-I294 PolarHBondContact O-N 2.99Å
293	G	86.6	Confident	92.8	Very high	47 Å²	47	21.2 Å²	21.2	49%	0.485	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	11	-177.8	0	0	0	0	0	114.4	R289 F290 C291	R289-G293 PolarHBondContact O-N 2.87Å; F290-G293 PolarHBondContact O-N 2.96Å; C291-G293 VanDerWaalsContact C-N 3.32Å
294	I	87.9	Confident	92.8	Very high	89 Å²	89	21.2 Å²	21.2	46%	0.456	13%	0.127	S	C	.	.	S	Bend	trans	-73.4	-48.9	178.7	-57.4	171.8	0	0	0	109.4	R289 S292 P296	R289-I294 HydrophobicContact CB-CB 4.37Å; R289-I294 HydrophobicContact CG-CD1 4.43Å; R289-I294 PolarHBondContact O-N 2.56Å; S292-I294 VanDerWaalsContact C-N 3.26Å; S292-I294 PolarHBondContact O-N 2.99Å; I294-P296 VanDerWaalsContact C-CD 3.45Å; I294-P296 WeakPolarHBondContact O-CD 3.37Å
295	D	88.5	Confident	92.9	Very high	23 Å²	23	21.2 Å²	21.2	12%	0.123	13%	0.127	C	C	.	.			trans	-124.8	74.4	179.9	-63.4	-68.9	0	0	0	111	R289 H297 F298	R289-D295 HydrophobicContact CB-CB 4.44Å; R289-D295 IonicContact CZ-OD2 3.97Å; R289-D295 IonicContact NE-OD2 2.6Å; R289-D295 PolarHBondContact NE-OD2 3.17Å; R289-D295 IonicContact NH2-OD1 2.99Å; R289-D295 IonicContact NH2-OD2 3.94Å; R289-D295 PolarHBondContact NH2-OD2 3.2Å; R289-D295 PolarHBondContact O-N 3.45Å; D295-H297 PolarHBondContact O-N 3.31Å; D295-H297 IonicContact OD1-CE1 3.99Å; D295-H297 PolarHBondContact OD1-CE1 3.13Å; D295-F298 HydrophobicContact CB-CD1 4.13Å; D295-F298 HydrophobicContact CB-CD2 3.68Å; D295-F298 HydrophobicContact CB-CE1 3.87Å; D295-F298 HydrophobicContact CB-CE2 3.39Å; D295-F298 HydrophobicContact CB-CG 4.05Å; D295-F298 HydrophobicContact CB-CZ 3.49Å; D295-F298 VanDerWaalsContact CB-CZ 3.49Å; D295-F298 PolarHBondContact O-N 2.85Å
296	P	86.8	Confident	93.1	Very high	50 Å²	50	21 Å²	21	33%	0.325	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-7.8	-177.4	29.9	-37.5	0	0	0	114	I198 F290 I294	I198-P296 HydrophobicContact CD1-CB 3.44Å; I198-P296 VanDerWaalsContact CD1-CB 3.44Å; I198-P296 HydrophobicContact CD1-CG 3.32Å; F290-P296 WeakPolarHBondContact CE2-O 3.16Å; I294-P296 VanDerWaalsContact C-CD 3.45Å; I294-P296 WeakPolarHBondContact O-CD 3.37Å
297	H	86.2	Confident	93.2	Very high	55 Å²	55	21 Å²	21	26%	0.255	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-6.9	179.9	65.4	-81.1	0	0	0	113.7	I198 S203 D295	I198-H297 HydrophobicContact CG2-CB 3.96Å; S203-H297 WeakPolarHBondContact CB-O 3.37Å; D295-H297 PolarHBondContact O-N 3.31Å; D295-H297 IonicContact OD1-CE1 3.99Å; D295-H297 PolarHBondContact OD1-CE1 3.13Å
298	F	92.8	Very high	93.3	Very high	6 Å²	6	21.1 Å²	21.1	3%	0.026	12%	0.124	C	C	.	.	S	Bend	trans	-66.8	130.9	179.5	-70.3	-16.3	0	0	0	112.2	I145 W150 L206 M286 R289 F290 D295 M300	I145-F298 HydrophobicContact CB-CE1 4.45Å; I145-F298 HydrophobicContact CB-CZ 4.3Å; I145-F298 HydrophobicContact CG2-CE1 4.16Å; I145-F298 HydrophobicContact CG2-CZ 4.35Å; W150-F298 HydrophobicContact CZ2-CE2 4.47Å; W150-F298 HydrophobicContact CZ2-CZ 4.42Å; L206-F298 HydrophobicContact CD1-CD1 3.6Å; L206-F298 HydrophobicContact CD1-CE1 3.82Å; M286-F298 HydrophobicContact CB-CD2 3.8Å; M286-F298 HydrophobicContact CB-CE2 3.99Å; M286-F298 HydrophobicContact CE-CB 4.33Å; M286-F298 HydrophobicContact CE-CD1 3.97Å; M286-F298 HydrophobicContact CE-CD2 4.08Å; M286-F298 HydrophobicContact CE-CE1 4.24Å; M286-F298 HydrophobicContact CE-CE2 4.35Å; M286-F298 HydrophobicContact CE-CG 3.88Å; M286-F298 HydrophobicContact CE-CZ 4.43Å; M286-F298 HydrophobicContact CG-CD2 4.2Å; M286-F298 HydrophobicContact CG-CE2 4Å; R289-F298 HydrophobicContact CB-CE2 4.28Å; F290-F298 HydrophobicContact CD2-CB 4.46Å; D295-F298 HydrophobicContact CB-CD1 4.13Å; D295-F298 HydrophobicContact CB-CD2 3.68Å; D295-F298 HydrophobicContact CB-CE1 3.87Å; D295-F298 HydrophobicContact CB-CE2 3.39Å; D295-F298 HydrophobicContact CB-CG 4.05Å; D295-F298 HydrophobicContact CB-CZ 3.49Å; D295-F298 VanDerWaalsContact CB-CZ 3.49Å; D295-F298 PolarHBondContact O-N 2.85Å; F298-M300 HydrophobicContact CB-CE 3.3Å; F298-M300 HydrophobicContact CD2-CE 4.43Å; F298-M300 HydrophobicContact CG-CE 4.38Å; F298-M300 PolarHBondContact O-N 3.04Å
299	P	93	Very high	93.4	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.013	11%	0.114	C	C	.	.			trans	-78.9	87	-175.8	32.6	-36.5	0	0	0	111.5	L206 R207 L210 K301 K302 V303 E632	L206-P299 HydrophobicContact CB-CG 4.42Å; R207-P299 HydrophobicContact CG-CB 3.5Å; R207-P299 HydrophobicContact CG-CG 3.69Å; L210-P299 HydrophobicContact CD1-CG 3.5Å; P299-K301 VanDerWaalsContact C-N 3.27Å; P299-K301 PolarHBondContact O-N 2.81Å; P299-K302 PolarHBondContact O-N 3.35Å; P299-K302 VanDerWaalsContact O-N 3.16Å; P299-V303 WeakPolarHBondContact O-CG2 3.3Å; P299-V303 PolarHBondContact O-N 3.27Å; P299-V303 VanDerWaalsContact O-N 3.1Å; P299-E632 VanDerWaalsContact C-OE2 3.26Å; P299-E632 VanDerWaalsContact CA-OE2 3.24Å; P299-E632 WeakPolarHBondContact CA-OE2 3.44Å; P299-E632 WeakPolarHBondContact CB-OE2 3.21Å
300	M	93.8	Very high	93.6	Very high	3 Å²	3	17.5 Å²	17.5	2%	0.015	11%	0.109	C	C	.	.	H	α-helix	trans	-58.6	-32	-169.8	-76.4	-57.7	102.2	0	0	114.6	I287 F290 F298 V303 L304 I612 E632	I287-M300 HydrophobicContact CG1-SD 4.19Å; F290-M300 HydrophobicContact CB-CE 3.49Å; F290-M300 VanDerWaalsContact CB-CE 3.49Å; F290-M300 HydrophobicContact CB-CG 4.37Å; F290-M300 HydrophobicContact CB-SD 3.73Å; F290-M300 HydrophobicContact CD1-CE 4.24Å; F290-M300 HydrophobicContact CD1-CG 3.31Å; F290-M300 HydrophobicContact CD1-SD 3.53Å; F290-M300 VanDerWaalsContact CD1-SD 3.53Å; F290-M300 HydrophobicContact CD2-CE 3.93Å; F290-M300 HydrophobicContact CD2-CG 3.79Å; F290-M300 HydrophobicContact CD2-SD 4.25Å; F290-M300 HydrophobicContact CE1-CB 4.49Å; F290-M300 HydrophobicContact CE1-CG 3.32Å; F290-M300 HydrophobicContact CE1-SD 4.18Å; F290-M300 HydrophobicContact CE2-CG 3.8Å; F290-M300 HydrophobicContact CG-CE 3.63Å; F290-M300 HydrophobicContact CG-CG 3.55Å; F290-M300 HydrophobicContact CG-SD 3.57Å; F290-M300 VanDerWaalsContact CG-SD 3.57Å; F290-M300 HydrophobicContact CZ-CG 3.58Å; F298-M300 HydrophobicContact CB-CE 3.3Å; F298-M300 HydrophobicContact CD2-CE 4.43Å; F298-M300 HydrophobicContact CG-CE 4.38Å; F298-M300 PolarHBondContact O-N 3.04Å; M300-V303 HydrophobicContact CE-CB 4.4Å; M300-V303 HydrophobicContact CE-CG2 4.19Å; M300-L304 VanDerWaalsContact O-CB 3.28Å; M300-L304 WeakPolarHBondContact O-CB 3.31Å; M300-L304 WeakPolarHBondContact O-CD1 3.42Å; M300-L304 WeakPolarHBondContact O-CG 3.22Å; M300-L304 PolarHBondContact O-N 2.82Å; M300-I612 HydrophobicContact CG-CD1 4.28Å; M300-I612 HydrophobicContact SD-CD1 3.91Å; M300-E632 PolarHBondContact N-OE2 3.36Å
301	K	95.2	Very high	93.7	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.009	11%	0.106	C	C	.	.	H	α-helix	trans	-60	-51.4	177.6	-176.1	-177.6	60.5	169.3	0	110.2	L38 Y39 S40 P299 L304 L305 E632 I658	L38-K301 WeakPolarHBondContact O-CE 3.45Å; L38-K301 PolarHBondContact O-NZ 2.95Å; Y39-K301 VanDerWaalsContact C-NZ 3.33Å; S40-K301 VanDerWaalsContact N-NZ 3.17Å; S40-K301 PolarHBondContact OG-NZ 2.99Å; P299-K301 VanDerWaalsContact C-N 3.27Å; P299-K301 PolarHBondContact O-N 2.81Å; K301-L304 PolarHBondContact O-N 2.66Å; K301-L305 HydrophobicContact CG-CD1 4.09Å; K301-L305 WeakPolarHBondContact O-CB 3.16Å; K301-L305 VanDerWaalsContact O-CG 3.3Å; K301-L305 WeakPolarHBondContact O-CG 3.43Å; K301-L305 PolarHBondContact O-N 3.45Å; K301-E632 WeakPolarHBondContact CB-OE1 3.23Å; K301-E632 VanDerWaalsContact CE-OE1 3.28Å; K301-E632 WeakPolarHBondContact CE-OE1 2.91Å; K301-E632 PolarHBondContact N-OE2 2.86Å; K301-I658 HydrophobicContact CD-CD1 4.44Å; K301-I658 HydrophobicContact CD-CG2 4.23Å; K301-I658 HydrophobicContact CG-CG2 4.01Å
302	K	96.5	Very high	93.9	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-68.4	-39.6	-177.8	-55.8	-166.2	-164.4	-78	0	111.6	L38 E43 R207 L210 S211 P299 L306	L38-K302 HydrophobicContact CD1-CB 4.34Å; L38-K302 HydrophobicContact CD1-CD 4.12Å; L38-K302 HydrophobicContact CD1-CG 3.96Å; L38-K302 PolarHBondContact O-NZ 2.75Å; E43-K302 VanDerWaalsContact CD-NZ 3.35Å; E43-K302 IonicContact OE1-NZ 2.91Å; E43-K302 PolarHBondContact OE1-NZ 2.87Å; E43-K302 VanDerWaalsContact OE2-CE 3.25Å; E43-K302 WeakPolarHBondContact OE2-CE 3.46Å; E43-K302 IonicContact OE2-NZ 3.3Å; E43-K302 PolarHBondContact OE2-NZ 3.39Å; R207-K302 HydrophobicContact CB-CD 4.1Å; R207-K302 HydrophobicContact CG-CD 4.08Å; L210-K302 HydrophobicContact CB-CB 4.05Å; L210-K302 HydrophobicContact CD1-CB 4.32Å; S211-K302 WeakPolarHBondContact OG-CD 2.88Å; P299-K302 PolarHBondContact O-N 3.35Å; P299-K302 VanDerWaalsContact O-N 3.16Å; K302-L306 VanDerWaalsContact O-CB 3.26Å; K302-L306 WeakPolarHBondContact O-CB 3.39Å; K302-L306 PolarHBondContact O-N 3.46Å
303	V	97.7	Very high	94.2	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.2	-47.4	175.2	175.6	0	0	0	0	111.6	L210 L283 M286 I287 P299 M300 L307	L210-V303 HydrophobicContact CD1-CG2 3.62Å; L210-V303 HydrophobicContact CD2-CG2 4.38Å; L283-V303 HydrophobicContact CB-CG1 4.35Å; L283-V303 HydrophobicContact CD2-CG1 4.11Å; M286-V303 HydrophobicContact CB-CG1 4.21Å; M286-V303 HydrophobicContact CE-CG2 3.79Å; M286-V303 HydrophobicContact SD-CG2 4.17Å; I287-V303 HydrophobicContact CD1-CG1 4.18Å; I287-V303 HydrophobicContact CG1-CG1 3.78Å; P299-V303 WeakPolarHBondContact O-CG2 3.3Å; P299-V303 PolarHBondContact O-N 3.27Å; P299-V303 VanDerWaalsContact O-N 3.1Å; M300-V303 HydrophobicContact CE-CB 4.4Å; M300-V303 HydrophobicContact CE-CG2 4.19Å; V303-L307 VanDerWaalsContact O-CB 3.26Å; V303-L307 WeakPolarHBondContact O-CB 3.22Å; V303-L307 PolarHBondContact O-N 3.48Å
304	L	98.2	Very high	94.5	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-68.6	-41.5	-178.5	-73.7	167.8	0	0	0	112.6	I287 M300 K301 W308 L609 I612 I659 A662 I663	I287-L304 HydrophobicContact CD1-CD2 3.59Å; I287-L304 HydrophobicContact CD1-CG 4.42Å; I287-L304 HydrophobicContact CG1-CD2 4.19Å; M300-L304 VanDerWaalsContact O-CB 3.28Å; M300-L304 WeakPolarHBondContact O-CB 3.31Å; M300-L304 WeakPolarHBondContact O-CD1 3.42Å; M300-L304 WeakPolarHBondContact O-CG 3.22Å; M300-L304 PolarHBondContact O-N 2.82Å; K301-L304 PolarHBondContact O-N 2.66Å; L304-W308 VanDerWaalsContact O-CB 3.31Å; L304-W308 WeakPolarHBondContact O-CB 3.3Å; L304-W308 PolarHBondContact O-N 2.85Å; L304-L609 HydrophobicContact CD2-CD2 3.86Å; L304-I612 HydrophobicContact CD1-CD1 4.44Å; L304-I612 HydrophobicContact CD1-CG2 4.1Å; L304-I659 HydrophobicContact CD1-CG1 4.43Å; L304-I659 HydrophobicContact CD1-CG2 4Å; L304-A662 HydrophobicContact CB-CB 4.06Å; L304-I663 HydrophobicContact CD1-CD1 4.01Å; L304-I663 HydrophobicContact CD1-CG1 3.96Å; L304-I663 HydrophobicContact CD2-CG1 3.93Å
305	L	98.1	Very high	94.8	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.005	5%	0.048	C	C	.	.	H	α-helix	trans	-61.3	-50.4	175.2	-78.9	179	0	0	0	110.7	Y214 K301 L307 W308 K309 I658 A662	Y214-L305 HydrophobicContact CD2-CB 3.96Å; Y214-L305 HydrophobicContact CE2-CB 3.59Å; Y214-L305 HydrophobicContact CE2-CG 4.49Å; K301-L305 HydrophobicContact CG-CD1 4.09Å; K301-L305 WeakPolarHBondContact O-CB 3.16Å; K301-L305 VanDerWaalsContact O-CG 3.3Å; K301-L305 WeakPolarHBondContact O-CG 3.43Å; K301-L305 PolarHBondContact O-N 3.45Å; L305-L307 PolarHBondContact O-N 3.39Å; L305-W308 HydrophobicContact CD2-CE3 4.17Å; L305-W308 HydrophobicContact CD2-CZ3 4.35Å; L305-W308 PolarHBondContact O-N 3.04Å; L305-K309 WeakPolarHBondContact O-CG 3.38Å; L305-K309 PolarHBondContact O-N 3.49Å; L305-I658 HydrophobicContact CD1-CG2 3.91Å; L305-I658 HydrophobicContact CD2-CG2 3.93Å; L305-I658 HydrophobicContact CG-CG2 4.11Å; L305-A662 HydrophobicContact CD2-CB 4.22Å
306	L	98.5	Very high	94.9	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-59	-50	177.4	178.2	61.1	0	0	0	111.6	L210 L213 Y214 V217 L283 K302 W308 K309 V310	L210-L306 HydrophobicContact CD2-CD2 3.71Å; L213-L306 HydrophobicContact CB-CD1 3.85Å; L213-L306 HydrophobicContact CB-CD2 3.74Å; L213-L306 HydrophobicContact CB-CG 4.48Å; L213-L306 HydrophobicContact CD1-CD2 3.94Å; Y214-L306 HydrophobicContact CD2-CB 4.41Å; V217-L306 HydrophobicContact CG2-CD1 4.09Å; L283-L306 HydrophobicContact CD1-CB 4.46Å; L283-L306 HydrophobicContact CD1-CD2 4.03Å; L283-L306 HydrophobicContact CD1-CG 3.86Å; L283-L306 HydrophobicContact CD2-CD2 3.92Å; K302-L306 VanDerWaalsContact O-CB 3.26Å; K302-L306 WeakPolarHBondContact O-CB 3.39Å; K302-L306 PolarHBondContact O-N 3.46Å; L306-W308 VanDerWaalsContact C-N 3.28Å; L306-W308 PolarHBondContact O-N 2.94Å; L306-K309 PolarHBondContact O-N 3.17Å; L306-K309 VanDerWaalsContact O-N 3.17Å; L306-V310 HydrophobicContact CD1-CG2 3.73Å; L306-V310 HydrophobicContact CG-CG2 4.13Å; L306-V310 WeakPolarHBondContact O-CB 3.41Å; L306-V310 VanDerWaalsContact O-CG2 3.27Å; L306-V310 WeakPolarHBondContact O-CG2 3.22Å; L306-V310 PolarHBondContact O-N 3.47Å
307	L	98.4	Very high	95	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-57.9	-43.6	179.4	177.3	55.4	0	0	0	111.7	T280 L283 F284 I287 V303 L305 L311 L666	T280-L307 HydrophobicContact CG2-CD1 4.01Å; L283-L307 HydrophobicContact CB-CB 4.08Å; L283-L307 HydrophobicContact CB-CD1 4.06Å; L283-L307 HydrophobicContact CB-CD2 4.29Å; L283-L307 HydrophobicContact CB-CG 4.37Å; L283-L307 HydrophobicContact CD1-CB 3.92Å; L283-L307 HydrophobicContact CD1-CD1 4.23Å; F284-L307 HydrophobicContact CD1-CD2 3.78Å; F284-L307 HydrophobicContact CD2-CD1 4.17Å; F284-L307 HydrophobicContact CD2-CD2 4.27Å; F284-L307 HydrophobicContact CE1-CD2 3.65Å; F284-L307 HydrophobicContact CE2-CD1 3.88Å; F284-L307 HydrophobicContact CE2-CD2 4.14Å; F284-L307 HydrophobicContact CE2-CG 4.5Å; F284-L307 HydrophobicContact CG-CD2 4.08Å; F284-L307 HydrophobicContact CZ-CD1 4.22Å; F284-L307 HydrophobicContact CZ-CD2 3.82Å; F284-L307 HydrophobicContact CZ-CG 4.37Å; I287-L307 HydrophobicContact CD1-CD2 3.44Å; I287-L307 VanDerWaalsContact CD1-CD2 3.44Å; V303-L307 VanDerWaalsContact O-CB 3.26Å; V303-L307 WeakPolarHBondContact O-CB 3.22Å; V303-L307 PolarHBondContact O-N 3.48Å; L305-L307 PolarHBondContact O-N 3.39Å; L307-L311 HydrophobicContact CD1-CD1 3.9Å; L307-L311 HydrophobicContact CD1-CG 4.05Å; L307-L311 HydrophobicContact CG-CD1 4.13Å; L307-L311 WeakPolarHBondContact O-CB 3.06Å; L307-L311 VanDerWaalsContact O-CG 3.24Å; L307-L311 WeakPolarHBondContact O-CG 3.38Å; L307-L311 PolarHBondContact O-N 3.17Å; L307-L666 HydrophobicContact CB-CD1 4.33Å; L307-L666 HydrophobicContact CD2-CD1 3.52Å; L307-L666 HydrophobicContact CG-CD1 3.62Å
308	W	97.9	Very high	95	Very high	4 Å²	4	6.1 Å²	6.1	2%	0.015	4%	0.036	C	C	.	.	H	α-helix	trans	-61.3	-47.9	176.6	172	32.7	0	0	0	112	D27 L304 L305 L306 L311 L312 K661 A662 A665 F750	D27-W308 WeakPolarHBondContact O-CZ2 3.4Å; L304-W308 VanDerWaalsContact O-CB 3.31Å; L304-W308 WeakPolarHBondContact O-CB 3.3Å; L304-W308 PolarHBondContact O-N 2.85Å; L305-W308 HydrophobicContact CD2-CE3 4.17Å; L305-W308 HydrophobicContact CD2-CZ3 4.35Å; L305-W308 PolarHBondContact O-N 3.04Å; L306-W308 VanDerWaalsContact C-N 3.28Å; L306-W308 PolarHBondContact O-N 2.94Å; W308-L311 PolarHBondContact O-N 2.92Å; W308-L312 WeakPolarHBondContact O-CB 3.39Å; W308-L312 PolarHBondContact O-N 2.99Å; W308-K661 HydrophobicContact CH2-CD 4.02Å; W308-K661 HydrophobicContact CH2-CG 4.12Å; W308-K661 HydrophobicContact CZ3-CD 4.1Å; W308-K661 HydrophobicContact CZ3-CG 4.14Å; W308-A662 HydrophobicContact CE3-CB 4.29Å; W308-A665 HydrophobicContact CD2-CB 3.89Å; W308-A665 HydrophobicContact CG-CB 4.21Å; W308-A665 HydrophobicContact CH2-CB 4.35Å; W308-A665 HydrophobicContact CZ2-CB 3.5Å; W308-A665 VanDerWaalsContact NE1-CB 3.29Å; W308-F750 HydrophobicContact CH2-CE1 4.28Å; W308-F750 HydrophobicContact CH2-CZ 4.32Å; W308-F750 HydrophobicContact CZ2-CE1 4.24Å; W308-F750 AromaticContact CZ2-CZ 3.95Å; W308-F750 HydrophobicContact CZ2-CZ 3.95Å
309	K	97.3	Very high	94.7	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-68.2	-39.5	-179.5	-60.7	-54.7	-173.1	177.8	0	112.7	E34 Y214 V217 E218 L305 L306 L311 L312 I313	E34-K309 IonicContact OE1-NZ 3.08Å; E34-K309 PolarHBondContact OE1-NZ 3.33Å; E34-K309 WeakPolarHBondContact OE2-CE 3.4Å; E34-K309 IonicContact OE2-NZ 3.16Å; E34-K309 PolarHBondContact OE2-NZ 2.84Å; Y214-K309 HydrophobicContact CD2-CG 4.18Å; Y214-K309 HydrophobicContact CE2-CB 4.42Å; Y214-K309 HydrophobicContact CE2-CD 4.47Å; Y214-K309 HydrophobicContact CE2-CG 3.45Å; Y214-K309 VanDerWaalsContact CE2-CG 3.45Å; Y214-K309 VanDerWaalsContact OH-CE 3.3Å; Y214-K309 WeakPolarHBondContact OH-CE 3.42Å; V217-K309 HydrophobicContact CG1-CB 3.76Å; E218-K309 WeakPolarHBondContact OE2-CD 3.28Å; E218-K309 WeakPolarHBondContact OE2-CE 3.24Å; E218-K309 IonicContact OE2-NZ 2.81Å; L305-K309 WeakPolarHBondContact O-CG 3.38Å; L305-K309 PolarHBondContact O-N 3.49Å; L306-K309 PolarHBondContact O-N 3.17Å; L306-K309 VanDerWaalsContact O-N 3.17Å; K309-L311 VanDerWaalsContact C-N 3.34Å; K309-L311 PolarHBondContact O-N 2.9Å; K309-L312 PolarHBondContact O-N 3.39Å; K309-L312 VanDerWaalsContact O-N 3.17Å; K309-I313 PolarHBondContact O-N 2.93Å
310	V	97.4	Very high	94.3	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-60	-45.2	174.5	172.7	0	0	0	0	110.3	V217 L279 T280 L306 L312 I313 T314	V217-V310 HydrophobicContact CG1-CG2 4.18Å; V217-V310 HydrophobicContact CG2-CG2 3.9Å; L279-V310 HydrophobicContact CD2-CG2 4.16Å; T280-V310 HydrophobicContact CG2-CB 4.46Å; T280-V310 HydrophobicContact CG2-CG1 3.62Å; L306-V310 HydrophobicContact CD1-CG2 3.73Å; L306-V310 HydrophobicContact CG-CG2 4.13Å; L306-V310 WeakPolarHBondContact O-CB 3.41Å; L306-V310 VanDerWaalsContact O-CG2 3.27Å; L306-V310 WeakPolarHBondContact O-CG2 3.22Å; L306-V310 PolarHBondContact O-N 3.47Å; V310-L312 VanDerWaalsContact C-N 3.35Å; V310-L312 PolarHBondContact O-N 3.32Å; V310-I313 WeakPolarHBondContact O-CG2 3.27Å; V310-I313 PolarHBondContact O-N 3.3Å; V310-T314 HydrophobicContact CG1-CG2 4.29Å; V310-T314 WeakPolarHBondContact O-CB 3.45Å; V310-T314 VanDerWaalsContact O-CG2 3.28Å; V310-T314 WeakPolarHBondContact O-CG2 3.3Å; V310-T314 PolarHBondContact O-N 3.49Å; V310-T314 PolarHBondContact O-OG1 3Å
311	L	96.6	Very high	94	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-66.1	-37.5	175.5	-70	172.6	0	0	0	112.4	T280 F284 L307 W308 K309 L315 L594 L666 L669 L670	T280-L311 HydrophobicContact CG2-CD2 3.71Å; T280-L311 HydrophobicContact CG2-CG 4.11Å; F284-L311 HydrophobicContact CE2-CD1 4.45Å; F284-L311 HydrophobicContact CZ-CD1 4.27Å; L307-L311 HydrophobicContact CD1-CD1 3.9Å; L307-L311 HydrophobicContact CD1-CG 4.05Å; L307-L311 HydrophobicContact CG-CD1 4.13Å; L307-L311 WeakPolarHBondContact O-CB 3.06Å; L307-L311 VanDerWaalsContact O-CG 3.24Å; L307-L311 WeakPolarHBondContact O-CG 3.38Å; L307-L311 PolarHBondContact O-N 3.17Å; W308-L311 PolarHBondContact O-N 2.92Å; K309-L311 VanDerWaalsContact C-N 3.34Å; K309-L311 PolarHBondContact O-N 2.9Å; L311-L315 HydrophobicContact CD2-CD1 4.28Å; L311-L315 WeakPolarHBondContact O-CB 3.34Å; L311-L315 VanDerWaalsContact O-CG 3.29Å; L311-L315 WeakPolarHBondContact O-CG 3.24Å; L311-L315 PolarHBondContact O-N 3.16Å; L311-L594 HydrophobicContact CD2-CD1 3.76Å; L311-L594 HydrophobicContact CD2-CD2 3.38Å; L311-L594 HydrophobicContact CD2-CG 4.22Å; L311-L666 HydrophobicContact CD1-CD1 4.41Å; L311-L666 HydrophobicContact CD1-CG 4.05Å; L311-L669 HydrophobicContact CB-CD2 3.55Å; L311-L670 HydrophobicContact CD1-CD2 4.1Å
312	L	95.5	Very high	93.7	Very high	7 Å²	7	14.7 Å²	14.7	4%	0.037	9%	0.088	C	C	.	.	H	α-helix	trans	-65.2	-40.3	178.8	-175.6	65.4	0	0	0	112.1	D27 T28 W308 K309 V310 G316 P317 L669	D27-L312 HydrophobicContact CB-CD1 4.35Å; T28-L312 HydrophobicContact CG2-CD2 3.3Å; W308-L312 WeakPolarHBondContact O-CB 3.39Å; W308-L312 PolarHBondContact O-N 2.99Å; K309-L312 PolarHBondContact O-N 3.39Å; K309-L312 VanDerWaalsContact O-N 3.17Å; V310-L312 VanDerWaalsContact C-N 3.35Å; V310-L312 PolarHBondContact O-N 3.32Å; L312-G316 CarbonylContact O-C 3.53Å; L312-G316 WeakPolarHBondContact O-CA 3.33Å; L312-G316 PolarHBondContact O-N 3.47Å; L312-P317 HydrophobicContact CD1-CB 4.46Å; L312-L669 HydrophobicContact CB-CD1 4.21Å; L312-L669 HydrophobicContact CD1-CD1 3.53Å; L312-L669 HydrophobicContact CG-CD1 4.49Å
313	I	95	Very high	93.4	Very high	14 Å²	14	18.6 Å²	18.6	7%	0.072	11%	0.111	C	C	.	.	H	α-helix	trans	-77.3	-43.1	-179.6	-157.8	179.5	0	0	0	111.9	V217 V220 R221 M224 V264 L267 K309 V310	V217-I313 HydrophobicContact CG1-CG2 4.11Å; V220-I313 HydrophobicContact CB-CD1 4.27Å; V220-I313 HydrophobicContact CG1-CD1 3.86Å; R221-I313 HydrophobicContact CB-CB 4.41Å; R221-I313 HydrophobicContact CB-CD1 3.84Å; R221-I313 HydrophobicContact CB-CG1 4.12Å; R221-I313 HydrophobicContact CG-CB 4.45Å; R221-I313 HydrophobicContact CG-CG1 4.34Å; M224-I313 HydrophobicContact SD-CD1 4.13Å; M224-I313 HydrophobicContact SD-CG1 4.03Å; V264-I313 HydrophobicContact CG2-CD1 3.64Å; V264-I313 HydrophobicContact CG2-CG1 3.76Å; L267-I313 HydrophobicContact CD1-CG2 4.02Å; K309-I313 PolarHBondContact O-N 2.93Å; V310-I313 WeakPolarHBondContact O-CG2 3.27Å; V310-I313 PolarHBondContact O-N 3.3Å
314	T	94.1	Very high	93	Very high	16 Å²	16	23 Å²	23	10%	0.098	13%	0.128	C	C	.	.	H	α-helix	trans	-73.3	-40.7	-177.8	55.3	0	0	0	0	112.5	L267 A268 V310	L267-T314 HydrophobicContact CB-CG2 3.9Å; A268-T314 HydrophobicContact CB-CG2 4.08Å; V310-T314 HydrophobicContact CG1-CG2 4.29Å; V310-T314 WeakPolarHBondContact O-CB 3.45Å; V310-T314 VanDerWaalsContact O-CG2 3.28Å; V310-T314 WeakPolarHBondContact O-CG2 3.3Å; V310-T314 PolarHBondContact O-N 3.49Å; V310-T314 PolarHBondContact O-OG1 3Å
315	L	93.2	Very high	92.7	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-87.7	-18.6	177.4	-49.8	-170.6	0	0	0	112.1	L311 R324 P590 V591 L594 L669 H673	L311-L315 HydrophobicContact CD2-CD1 4.28Å; L311-L315 WeakPolarHBondContact O-CB 3.34Å; L311-L315 VanDerWaalsContact O-CG 3.29Å; L311-L315 WeakPolarHBondContact O-CG 3.24Å; L311-L315 PolarHBondContact O-N 3.16Å; L315-R324 PolarHBondContact O-NH1 2.97Å; L315-R324 PolarHBondContact O-NH2 2.85Å; L315-P590 HydrophobicContact CD2-CB 4.23Å; L315-V591 HydrophobicContact CD2-CB 4.45Å; L315-V591 HydrophobicContact CD2-CG2 3.88Å; L315-L594 HydrophobicContact CD1-CD2 3.69Å; L315-L594 HydrophobicContact CD2-CD2 4.16Å; L315-L594 HydrophobicContact CG-CD2 4.37Å; L315-L669 HydrophobicContact CD1-CD2 3.8Å; L315-H673 WeakPolarHBondContact CB-NE2 3.43Å; L315-H673 HydrophobicContact CD1-CB 3.97Å; L315-H673 PolarHBondContact O-CE1 3.44Å
316	G	89.9	Confident	92.5	Very high	6 Å²	6	27.5 Å²	27.5	6%	0.062	15%	0.149	C	C	.	.			trans	84.8	162.2	-177.9	0	0	0	0	0	114.4	L312 H673	L312-G316 CarbonylContact O-C 3.53Å; L312-G316 WeakPolarHBondContact O-CA 3.33Å; L312-G316 PolarHBondContact O-N 3.47Å; G316-H673 PolarHBondContact O-CE1 3.43Å; G316-H673 PolarHBondContact O-NE2 3.23Å
317	P	89.6	Confident	92.2	Very high	43 Å²	43	32.7 Å²	32.7	28%	0.279	17%	0.173	S	C	.	.			trans	-68.9	157.3	-174.7	29.5	-36.3	0	0	0	112.7	L312 S319 N320	L312-P317 HydrophobicContact CD1-CB 4.46Å; P317-S319 PolarHBondContact O-N 2.66Å; P317-N320 HydrophobicContact CG-CB 4.28Å; P317-N320 PolarHBondContact O-N 2.96Å
318	L	86.9	Confident	91.8	Very high	23 Å²	23	33.6 Å²	33.6	12%	0.12	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-66.8	-24	179.4	-55.7	-174.8	0	0	0	112.2	D27 N320 L321 L668 L669 K672	D27-L318 WeakPolarHBondContact OD1-CB 3.45Å; D27-L318 WeakPolarHBondContact OD1-CD1 3.34Å; D27-L318 WeakPolarHBondContact OD1-CG 3.44Å; D27-L318 WeakPolarHBondContact OD2-CA 3.46Å; D27-L318 WeakPolarHBondContact OD2-CB 3.35Å; D27-L318 PolarHBondContact OD2-N 3.25Å; L318-N320 VanDerWaalsContact C-N 3.3Å; L318-N320 PolarHBondContact O-N 3.01Å; L318-L321 HydrophobicContact CB-CD1 4.04Å; L318-L321 HydrophobicContact CD2-CD1 3.55Å; L318-L321 HydrophobicContact CD2-CG 4.49Å; L318-L321 HydrophobicContact CG-CD1 4.41Å; L318-L321 VanDerWaalsContact O-CB 3.29Å; L318-L321 WeakPolarHBondContact O-CB 3.49Å; L318-L321 PolarHBondContact O-N 3.45Å; L318-L668 HydrophobicContact CD1-CD2 4.05Å; L318-L668 HydrophobicContact CD1-CG 4.33Å; L318-L669 HydrophobicContact CD2-CD1 4.34Å; L318-L669 HydrophobicContact CD2-CG 4.48Å; L318-K672 HydrophobicContact CD2-CB 4.15Å; L318-K672 HydrophobicContact CD2-CG 4.31Å
319	S	84.9	Confident	91.6	Very high	72 Å²	72	33.6 Å²	33.6	50%	0.503	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-59.5	-38.7	173	55.8	0	0	0	0	112.3	P317 L321	P317-S319 PolarHBondContact O-N 2.66Å; S319-L321 VanDerWaalsContact C-N 3.26Å; S319-L321 PolarHBondContact O-N 3.02Å
320	N	85.1	Confident	91.5	Very high	60 Å²	60	36.9 Å²	36.9	32%	0.321	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-77	-11	-179.1	-71.7	-10.8	0	0	0	113.2	P317 L318 L322 V323 R324	P317-N320 HydrophobicContact CG-CB 4.28Å; P317-N320 PolarHBondContact O-N 2.96Å; L318-N320 VanDerWaalsContact C-N 3.3Å; L318-N320 PolarHBondContact O-N 3.01Å; N320-L322 VanDerWaalsContact C-N 3.28Å; N320-L322 PolarHBondContact O-N 2.92Å; N320-V323 PolarHBondContact O-N 2.95Å; N320-R324 PolarHBondContact O-N 3.1Å
321	L	87.4	Confident	91.1	Very high	20 Å²	20	47.1 Å²	47.1	11%	0.105	25%	0.247	C	C	.	.	H	α-helix	trans	-62.8	-32.1	-178.1	-72.4	175.3	0	0	0	113.3	L318 S319 K325 K672 H673 L676	L318-L321 HydrophobicContact CB-CD1 4.04Å; L318-L321 HydrophobicContact CD2-CD1 3.55Å; L318-L321 HydrophobicContact CD2-CG 4.49Å; L318-L321 HydrophobicContact CG-CD1 4.41Å; L318-L321 VanDerWaalsContact O-CB 3.29Å; L318-L321 WeakPolarHBondContact O-CB 3.49Å; L318-L321 PolarHBondContact O-N 3.45Å; S319-L321 VanDerWaalsContact C-N 3.26Å; S319-L321 PolarHBondContact O-N 3.02Å; L321-K325 WeakPolarHBondContact O-CB 3.42Å; L321-K325 PolarHBondContact O-N 3.35Å; L321-K672 HydrophobicContact CD1-CB 3.76Å; L321-K672 HydrophobicContact CD1-CD 4.09Å; L321-K672 HydrophobicContact CD1-CG 4.23Å; L321-H673 VanDerWaalsContact CD2-CE1 3.48Å; L321-H673 WeakPolarHBondContact CD2-CE1 3.19Å; L321-H673 WeakPolarHBondContact CD2-ND1 3.29Å; L321-L676 HydrophobicContact CD2-CD2 3.68Å
322	L	89.5	Confident	90.6	Very high	41 Å²	41	50.2 Å²	50.2	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-66.9	-43.4	178.2	-179.5	60.9	0	0	0	111	N320 K325 N326 V337 D340	N320-L322 VanDerWaalsContact C-N 3.28Å; N320-L322 PolarHBondContact O-N 2.92Å; L322-K325 PolarHBondContact O-N 3.29Å; L322-N326 PolarHBondContact O-N 2.99Å; L322-V337 HydrophobicContact CD1-CB 4.25Å; L322-V337 HydrophobicContact CD1-CG1 4.39Å; L322-D340 HydrophobicContact CD2-CB 3.66Å
323	V	90.2	Very high	90.3	Very high	82 Å²	82	53.2 Å²	53.2	50%	0.497	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-52.6	177.5	178.7	0	0	0	0	109.8	N320 K325 N326 Q327	N320-V323 PolarHBondContact O-N 2.95Å; V323-K325 VanDerWaalsContact C-N 3.27Å; V323-K325 PolarHBondContact O-N 3.28Å; V323-N326 PolarHBondContact O-N 3.22Å; V323-Q327 WeakPolarHBondContact O-CG 3.26Å; V323-Q327 PolarHBondContact O-N 2.95Å
324	R	89.6	Confident	90.2	Very high	92 Å²	92	53.4 Å²	53.4	35%	0.347	29%	0.292	S	S	.	.	H	α-helix	trans	-60.2	-37.5	177.9	-67	-175.4	-178.8	-171.7	2.6	112.3	L315 N320 Q327 A328 L676	L315-R324 PolarHBondContact O-NH1 2.97Å; L315-R324 PolarHBondContact O-NH2 2.85Å; N320-R324 PolarHBondContact O-N 3.1Å; R324-Q327 PolarHBondContact O-N 2.81Å; R324-A328 WeakPolarHBondContact O-CB 3.45Å; R324-A328 PolarHBondContact O-N 3.41Å; R324-L676 HydrophobicContact CB-CD2 3.75Å
325	K	91.9	Very high	89.9	Confident	59 Å²	59	56.7 Å²	56.7	26%	0.257	31%	0.314	S	S	.	.	H	α-helix	trans	-63.3	-42.5	173.2	-176.4	-179	175.7	-169.9	0	112.4	L321 L322 V323 Q327 A328 R329 Y560 L676	L321-K325 WeakPolarHBondContact O-CB 3.42Å; L321-K325 PolarHBondContact O-N 3.35Å; L322-K325 PolarHBondContact O-N 3.29Å; V323-K325 VanDerWaalsContact C-N 3.27Å; V323-K325 PolarHBondContact O-N 3.28Å; K325-Q327 VanDerWaalsContact C-N 3.34Å; K325-A328 PolarHBondContact O-N 3.09Å; K325-R329 HydrophobicContact CG-CG 4.46Å; K325-R329 WeakPolarHBondContact O-CB 3.35Å; K325-R329 WeakPolarHBondContact O-CG 3.24Å; K325-R329 PolarHBondContact O-N 2.88Å; K325-Y560 PolarHBondContact NZ-OH 2.94Å; K325-L676 HydrophobicContact CB-CD1 3.77Å; K325-L676 HydrophobicContact CG-CD1 4.15Å
326	N	93.3	Very high	89.7	Confident	37 Å²	37	60.6 Å²	60.6	20%	0.198	34%	0.339	C	S	.	.	H	α-helix	trans	-68.6	-35.8	177.8	-75.2	-19.5	0	0	0	111.6	L322 V323 R329 A330 P336 V337	L322-N326 PolarHBondContact O-N 2.99Å; V323-N326 PolarHBondContact O-N 3.22Å; N326-R329 PolarHBondContact O-N 3.07Å; N326-A330 WeakPolarHBondContact O-CB 3.35Å; N326-A330 PolarHBondContact O-N 2.71Å; N326-P336 HydrophobicContact CB-CB 4.42Å; N326-V337 PolarHBondContact ND2-O 2.86Å; N326-V337 PolarHBondContact OD1-N 2.97Å
327	Q	92.2	Very high	89.6	Confident	108 Å²	108	61.2 Å²	61.2	51%	0.505	34%	0.342	S	S	.	.	H	α-helix	trans	-61.4	-48	170.6	-69	170.3	-12.9	0	0	111.6	V323 R324 K325 R329 A330 R331	V323-Q327 WeakPolarHBondContact O-CG 3.26Å; V323-Q327 PolarHBondContact O-N 2.95Å; R324-Q327 PolarHBondContact O-N 2.81Å; K325-Q327 VanDerWaalsContact C-N 3.34Å; Q327-R329 VanDerWaalsContact C-N 3.34Å; Q327-R329 PolarHBondContact O-N 2.97Å; Q327-A330 WeakPolarHBondContact O-CB 3.42Å; Q327-A330 PolarHBondContact O-N 3.4Å; Q327-R331 PolarHBondContact O-N 3.46Å
328	A	90.9	Very high	89.1	Confident	20 Å²	20	66 Å²	66	17%	0.165	36%	0.364	C	S	.	.	H	α-helix	trans	-61.3	-42.1	175.7	0	0	0	0	0	111.8	R324 K325 A330 R331 Y332 L563 L676	R324-A328 WeakPolarHBondContact O-CB 3.45Å; R324-A328 PolarHBondContact O-N 3.41Å; K325-A328 PolarHBondContact O-N 3.09Å; A328-A330 VanDerWaalsContact C-N 3.34Å; A328-A330 PolarHBondContact O-N 3.01Å; A328-R331 WeakPolarHBondContact O-CB 3.15Å; A328-R331 PolarHBondContact O-N 3.41Å; A328-Y332 WeakPolarHBondContact O-CD2 3.45Å; A328-Y332 PolarHBondContact O-N 3.35Å; A328-L563 HydrophobicContact CB-CD2 3.97Å; A328-L676 HydrophobicContact CB-CD1 4.48Å
329	R	94	Very high	88.8	Confident	4 Å²	4	67 Å²	67	2%	0.015	37%	0.368	C	S	.	.	H	α-helix	trans	-61.1	-40.7	175.7	-75.6	175.9	71.5	75.4	-2.1	112.5	K325 N326 Q327 R331 Y332 G333 L334 P335 I561	K325-R329 HydrophobicContact CG-CG 4.46Å; K325-R329 WeakPolarHBondContact O-CB 3.35Å; K325-R329 WeakPolarHBondContact O-CG 3.24Å; K325-R329 PolarHBondContact O-N 2.88Å; N326-R329 PolarHBondContact O-N 3.07Å; Q327-R329 VanDerWaalsContact C-N 3.34Å; Q327-R329 PolarHBondContact O-N 2.97Å; R329-R331 VanDerWaalsContact C-N 3.29Å; R329-R331 PolarHBondContact O-N 3.29Å; R329-Y332 CarbonylContact O-C 3.18Å; R329-Y332 PolarHBondContact O-N 3.46Å; R329-Y332 VanDerWaalsContact O-N 3.09Å; R329-G333 PolarHBondContact O-N 3.43Å; R329-L334 HydrophobicContact CB-CB 4Å; R329-L334 HydrophobicContact CG-CB 4.38Å; R329-L334 HydrophobicContact CG-CD1 4.41Å; R329-L334 WeakPolarHBondContact O-CB 3.44Å; R329-L334 PolarHBondContact O-N 3.21Å; R329-P335 PolarHBondContact NE-O 3.42Å; R329-P335 PolarHBondContact NH2-O 3.46Å; R329-I561 PolarHBondContact NH1-O 2.8Å
330	A	93.5	Very high	88.5	Confident	68 Å²	68	65 Å²	65	56%	0.562	35%	0.352	S	S	*	.	H	α-helix	trans	-61.2	-37.5	177.1	0	0	0	0	0	112	N326 Q327 A328 Y332 G333	N326-A330 WeakPolarHBondContact O-CB 3.35Å; N326-A330 PolarHBondContact O-N 2.71Å; Q327-A330 WeakPolarHBondContact O-CB 3.42Å; Q327-A330 PolarHBondContact O-N 3.4Å; A328-A330 VanDerWaalsContact C-N 3.34Å; A328-A330 PolarHBondContact O-N 3.01Å; A330-Y332 PolarHBondContact O-N 2.89Å; A330-G333 PolarHBondContact O-N 3.22Å
331	R	89	Confident	88.3	Confident	216 Å²	216	64 Å²	64	82%	0.815	35%	0.35	S	S	*	.	H	α-helix	trans	-61.7	-30	174.6	-64.1	176.5	-175.9	178	-0.3	113.2	Q327 A328 R329	Q327-R331 PolarHBondContact O-N 3.46Å; A328-R331 WeakPolarHBondContact O-CB 3.15Å; A328-R331 PolarHBondContact O-N 3.41Å; R329-R331 VanDerWaalsContact C-N 3.29Å; R329-R331 PolarHBondContact O-N 3.29Å
332	Y	87.2	Confident	87.9	Confident	65 Å²	65	64.6 Å²	64.6	26%	0.255	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	10.5	174	-71.8	-82.3	0	0	0	113.4	A328 R329 A330 L334 L563 M566	A328-Y332 WeakPolarHBondContact O-CD2 3.45Å; A328-Y332 PolarHBondContact O-N 3.35Å; R329-Y332 CarbonylContact O-C 3.18Å; R329-Y332 PolarHBondContact O-N 3.46Å; R329-Y332 VanDerWaalsContact O-N 3.09Å; A330-Y332 PolarHBondContact O-N 2.89Å; Y332-L334 PolarHBondContact O-N 2.92Å; Y332-L563 HydrophobicContact CD2-CD1 3.43Å; Y332-L563 VanDerWaalsContact CD2-CD1 3.43Å; Y332-L563 HydrophobicContact CE2-CD1 3.61Å; Y332-L563 HydrophobicContact CG-CD1 4.37Å; Y332-M566 HydrophobicContact CD1-CB 4.07Å; Y332-M566 HydrophobicContact CD1-CE 4.18Å; Y332-M566 HydrophobicContact CE1-CB 4.35Å; Y332-M566 HydrophobicContact CG-CB 4.43Å
333	G	89.7	Confident	87.2	Confident	69 Å²	69	68.1 Å²	68.1	71%	0.711	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	17.1	-177.7	0	0	0	0	0	114.5	R329 A330	R329-G333 PolarHBondContact O-N 3.43Å; A330-G333 PolarHBondContact O-N 3.22Å
334	L	91.6	Very high	86.5	Confident	19 Å²	19	65.1 Å²	65.1	10%	0.099	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-86.7	144.8	-178.9	-64.8	179.9	0	0	0	111.6	R329 Y332 I561 M566	R329-L334 HydrophobicContact CB-CB 4Å; R329-L334 HydrophobicContact CG-CB 4.38Å; R329-L334 HydrophobicContact CG-CD1 4.41Å; R329-L334 WeakPolarHBondContact O-CB 3.44Å; R329-L334 PolarHBondContact O-N 3.21Å; Y332-L334 PolarHBondContact O-N 2.92Å; L334-I561 HydrophobicContact CD2-CB 4.03Å; L334-I561 HydrophobicContact CD2-CD1 4.45Å; L334-I561 HydrophobicContact CD2-CG2 4.1Å; L334-M566 HydrophobicContact CD1-CG 3.78Å; L334-M566 HydrophobicContact CD2-CG 4.43Å; L334-M566 HydrophobicContact CD2-SD 4.42Å; L334-M566 HydrophobicContact CG-CG 4.38Å
335	P	89.2	Confident	85.9	Confident	85 Å²	85	61 Å²	61	55%	0.552	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-64.5	145.9	177.8	25.5	-33.9	0	0	0	111.6	R329	R329-P335 PolarHBondContact NE-O 3.42Å; R329-P335 PolarHBondContact NH2-O 3.46Å
336	P	89	Confident	85	Confident	83 Å²	83	63.6 Å²	63.6	54%	0.539	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-66	150.3	-179.6	28.2	-34.9	0	0	0	111.7	N326	N326-P336 HydrophobicContact CB-CB 4.42Å
337	V	86	Confident	84	Confident	20 Å²	20	69.7 Å²	69.7	12%	0.121	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-90.8	116.4	169.7	-177.8	0	0	0	0	107.9	L322 N326 Y560	L322-V337 HydrophobicContact CD1-CB 4.25Å; L322-V337 HydrophobicContact CD1-CG1 4.39Å; N326-V337 PolarHBondContact ND2-O 2.86Å; N326-V337 PolarHBondContact OD1-N 2.97Å; V337-Y560 HydrophobicContact CG2-CE2 3.95Å
338	L	80.1	Confident	83.3	Confident	142 Å²	142	66.2 Å²	66.2	74%	0.743	36%	0.36	S	S	*	.			trans	-83.1	-28.7	-177.5	-57.3	177.1	0	0	0	113.1
339	E	79.7	Confident	82.7	Confident	44 Å²	44	73.9 Å²	73.9	21%	0.206	38%	0.384	C	S	.	.			trans	-88.4	115.3	-173	-60.3	166.5	-156.7	0	0	111.2	K510 R828	E339-K510 WeakPolarHBondContact OE1-CB 3.39Å; E339-K510 WeakPolarHBondContact OE1-CG 3.11Å; E339-K510 PolarHBondContact OE1-N 3.29Å; E339-R828 IonicContact OE1-NH1 3.65Å; E339-R828 IonicContact OE1-NH2 3.81Å; E339-R828 IonicContact OE2-CZ 3.4Å; E339-R828 IonicContact OE2-NH1 3.42Å; E339-R828 PolarHBondContact OE2-NH1 3.27Å; E339-R828 IonicContact OE2-NH2 2.76Å
340	D	80.3	Confident	82.1	Confident	30 Å²	30	74.3 Å²	74.3	16%	0.16	39%	0.389	C	S	.	.			trans	-82.4	124.5	163.8	-171.9	-2.1	0	0	0	110.7	L322 V342 H343 V344	L322-D340 HydrophobicContact CD2-CB 3.66Å; D340-V342 VanDerWaalsContact C-N 3.28Å; D340-V342 PolarHBondContact O-N 3.34Å; D340-V342 PolarHBondContact OD1-N 2.86Å; D340-H343 HydrophobicContact CB-CB 4.13Å; D340-H343 PolarHBondContact O-N 2.89Å; D340-H343 IonicContact OD2-CE1 3.63Å; D340-H343 PolarHBondContact OD2-CE1 3.32Å; D340-H343 IonicContact OD2-CG 3.41Å; D340-H343 IonicContact OD2-ND1 3.64Å; D340-H343 PolarHBondContact OD2-ND1 2.75Å; D340-V344 WeakPolarHBondContact O-CB 3.26Å; D340-V344 WeakPolarHBondContact O-CG2 3.43Å; D340-V344 PolarHBondContact O-N 3.06Å
341	S	79.5	Confident	81.4	Confident	40 Å²	40	72 Å²	72	28%	0.28	37%	0.369	S	S	.	.	H	α-helix	trans	-54.1	-39.9	173.2	52.5	0	0	0	0	114	I345	S341-I345 WeakPolarHBondContact O-CB 3.46Å; S341-I345 WeakPolarHBondContact O-CD1 3.41Å; S341-I345 WeakPolarHBondContact O-CG1 3.36Å; S341-I345 PolarHBondContact O-N 3.38Å; S341-I345 VanDerWaalsContact O-N 3.08Å
342	V	78.9	Confident	80.6	Confident	32 Å²	32	66.2 Å²	66.2	19%	0.194	36%	0.362	C	S	.	.	H	α-helix	trans	-70.4	-50.2	-176.2	-179.6	0	0	0	0	110.3	D340 V344 I345 Q346 M792	D340-V342 VanDerWaalsContact C-N 3.28Å; D340-V342 PolarHBondContact O-N 3.34Å; D340-V342 PolarHBondContact OD1-N 2.86Å; V342-V344 VanDerWaalsContact C-N 3.35Å; V342-V344 PolarHBondContact O-N 3.13Å; V342-I345 WeakPolarHBondContact O-CB 3.38Å; V342-I345 PolarHBondContact O-N 3.22Å; V342-I345 VanDerWaalsContact O-N 3.13Å; V342-Q346 WeakPolarHBondContact O-CG 3.48Å; V342-Q346 PolarHBondContact O-N 3.27Å; V342-Q346 VanDerWaalsContact O-N 3.07Å; V342-M792 HydrophobicContact CB-CE 4.37Å; V342-M792 HydrophobicContact CG1-CE 4.05Å; V342-M792 HydrophobicContact CG2-CE 3.96Å
343	H	74.7	Confident	79.6	Confident	115 Å²	115	65.3 Å²	65.3	53%	0.532	36%	0.363	S	S	.	.	H	α-helix	trans	-60.9	-40.2	177.3	-69.4	87.5	0	0	0	113	D340 I345 Q346	D340-H343 HydrophobicContact CB-CB 4.13Å; D340-H343 PolarHBondContact O-N 2.89Å; D340-H343 IonicContact OD2-CE1 3.63Å; D340-H343 PolarHBondContact OD2-CE1 3.32Å; D340-H343 IonicContact OD2-CG 3.41Å; D340-H343 IonicContact OD2-ND1 3.64Å; D340-H343 PolarHBondContact OD2-ND1 2.75Å; H343-I345 VanDerWaalsContact C-N 3.32Å; H343-I345 PolarHBondContact O-N 3.23Å; H343-Q346 PolarHBondContact O-N 2.63Å
344	V	75.5	Confident	78.2	Confident	19 Å²	19	63.3 Å²	63.3	12%	0.115	34%	0.338	C	S	.	.	H	α-helix	trans	-65.3	-39.3	176.2	173.3	0	0	0	0	110.9	D340 V342 Q346 K347 P508 W509	D340-V344 WeakPolarHBondContact O-CB 3.26Å; D340-V344 WeakPolarHBondContact O-CG2 3.43Å; D340-V344 PolarHBondContact O-N 3.06Å; V342-V344 VanDerWaalsContact C-N 3.35Å; V342-V344 PolarHBondContact O-N 3.13Å; V344-Q346 PolarHBondContact O-N 3.38Å; V344-K347 PolarHBondContact O-N 3.22Å; V344-P508 HydrophobicContact CG1-CB 3.67Å; V344-P508 HydrophobicContact CG1-CG 3.49Å; V344-P508 VanDerWaalsContact CG1-CG 3.49Å; V344-W509 HydrophobicContact CB-CE3 4.4Å; V344-W509 HydrophobicContact CB-CH2 3.55Å; V344-W509 HydrophobicContact CB-CZ2 4.21Å; V344-W509 HydrophobicContact CB-CZ3 3.67Å; V344-W509 HydrophobicContact CG1-CD2 4.04Å; V344-W509 HydrophobicContact CG1-CE3 3.89Å; V344-W509 HydrophobicContact CG1-CH2 3.31Å; V344-W509 HydrophobicContact CG1-CZ2 3.47Å; V344-W509 VanDerWaalsContact CG1-CZ2 3.47Å; V344-W509 HydrophobicContact CG1-CZ3 3.54Å; V344-W509 HydrophobicContact CG2-CE3 4.48Å; V344-W509 HydrophobicContact CG2-CH2 4.38Å; V344-W509 HydrophobicContact CG2-CZ3 3.99Å
345	I	78.5	Confident	76.5	Confident	5 Å²	5	69.2 Å²	69.2	3%	0.026	37%	0.374	C	S	.	.	H	α-helix	trans	-64.5	-39	179.1	-73.1	163.4	0	0	0	112.1	S341 V342 H343 K347 V348 W509 M792 L795	S341-I345 WeakPolarHBondContact O-CB 3.46Å; S341-I345 WeakPolarHBondContact O-CD1 3.41Å; S341-I345 WeakPolarHBondContact O-CG1 3.36Å; S341-I345 PolarHBondContact O-N 3.38Å; S341-I345 VanDerWaalsContact O-N 3.08Å; V342-I345 WeakPolarHBondContact O-CB 3.38Å; V342-I345 PolarHBondContact O-N 3.22Å; V342-I345 VanDerWaalsContact O-N 3.13Å; H343-I345 VanDerWaalsContact C-N 3.32Å; H343-I345 PolarHBondContact O-N 3.23Å; I345-K347 PolarHBondContact O-N 3.49Å; I345-V348 PolarHBondContact O-N 3.09Å; I345-W509 HydrophobicContact CG1-CH2 4.48Å; I345-M792 HydrophobicContact CD1-CE 4.18Å; I345-M792 HydrophobicContact CD1-CG 4.3Å; I345-M792 HydrophobicContact CG2-CB 3.61Å; I345-M792 HydrophobicContact CG2-CG 3.95Å; I345-L795 HydrophobicContact CD1-CD2 3.54Å; I345-L795 HydrophobicContact CG1-CD2 3.36Å
346	Q	72.9	Confident	74.6	Confident	114 Å²	114	69.8 Å²	69.8	53%	0.533	37%	0.371	S	S	.	.	H	α-helix	trans	-60.1	-26.1	179.3	-73.7	171.6	-15.3	0	0	112.6	V342 H343 V344	V342-Q346 WeakPolarHBondContact O-CG 3.48Å; V342-Q346 PolarHBondContact O-N 3.27Å; V342-Q346 VanDerWaalsContact O-N 3.07Å; H343-Q346 PolarHBondContact O-N 2.63Å; V344-Q346 PolarHBondContact O-N 3.38Å
347	K	72.6	Confident	72.2	Confident	165 Å²	165	69.9 Å²	69.9	72%	0.717	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-14.1	176	-61.2	-178.3	-178.9	-175.3	0	113.6	V344 I345	V344-K347 PolarHBondContact O-N 3.22Å; I345-K347 PolarHBondContact O-N 3.49Å
348	V	76.3	Confident	70.1	Confident	36 Å²	36	75.4 Å²	75.4	22%	0.218	40%	0.4	C	S	.	.	S	Bend	trans	-90.4	124.5	-177.2	177.8	0	0	0	0	109.5	I345 P508 A791 K826	I345-V348 PolarHBondContact O-N 3.09Å; V348-P508 HydrophobicContact CG2-CG 4.23Å; V348-A791 WeakPolarHBondContact O-CB 3.41Å; V348-K826 HydrophobicContact CG1-CD 4.1Å; V348-K826 HydrophobicContact CG1-CG 4.28Å
349	R	79.4	Confident	68.4	Low	180 Å²	180	72.4 Å²	72.4	68%	0.679	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-70.2	148.8	174.3	-167.2	174.9	-177.7	139.5	8.1	111.9	D20 K826	D20-R349 IonicContact OD2-CZ 3.39Å; D20-R349 IonicContact OD2-NE 2.76Å; D20-R349 PolarHBondContact OD2-NE 3.37Å; D20-R349 VanDerWaalsContact OD2-NE 3.08Å; D20-R349 IonicContact OD2-NH2 2.66Å; D20-R349 PolarHBondContact OD2-NH2 3.26Å; R349-K826 PolarHBondContact O-NZ 2.84Å
350	A	80.8	Confident	66.5	Low	13 Å²	13	73.5 Å²	73.5	11%	0.107	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-60.9	149.1	168.8	0	0	0	0	0	111.8	R789 K826	A350-R789 HydrophobicContact CB-CB 4.32Å; A350-K826 VanDerWaalsContact C-NZ 3.25Å
351	S	77.6	Confident	64.9	Low	21 Å²	21	78.1 Å²	78.1	15%	0.147	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-86.5	144.3	176.5	-8.2	0	0	0	0	108.6	Q794 K826	S351-Q794 PolarHBondContact O-NE2 3.45Å; S351-Q794 PolarHBondContact OG-OE1 3.06Å; S351-K826 VanDerWaalsContact CA-NZ 3.31Å; S351-K826 VanDerWaalsContact CB-NZ 3.32Å; S351-K826 WeakPolarHBondContact OG-CE 3.43Å; S351-K826 PolarHBondContact OG-NZ 3.44Å
352	S	73.3	Confident	63.3	Low	94 Å²	94	80 Å²	80	66%	0.657	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-58.6	141.2	166.1	53.3	0	0	0	0	110
353	P	65.9	Low	61.4	Low	45 Å²	45	83.6 Å²	83.6	29%	0.292	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-54.3	147.7	176	-24.6	33.3	0	0	0	111.7	V355 R789	P353-V355 PolarHBondContact O-N 3.09Å; P353-R789 HydrophobicContact CG-CG 4.42Å
354	P	60.7	Low	59.9	Low	28 Å²	28	81.2 Å²	81.2	18%	0.182	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-59.6	128	172.3	-17	28.4	0	0	0	110	M356	P354-M356 PolarHBondContact O-N 2.89Å
355	V	55.5	Low	58.2	Low	142 Å²	142	88.8 Å²	88.8	86%	0.861	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-56.1	126	173.8	-178.6	0	0	0	0	108.8	P353 C357	P353-V355 PolarHBondContact O-N 3.09Å; V355-C357 PolarHBondContact O-N 3.1Å; V355-C357 VanDerWaalsContact O-N 3.1Å
356	M	48.6	Very low	56.6	Low	97 Å²	97	95 Å²	95	48%	0.478	50%	0.496	S	S	.	.			trans	-64.6	112.1	175.1	-69.8	-70.9	-76.1	0	0	108.4	P354 D360 R787	P354-M356 PolarHBondContact O-N 2.89Å; M356-D360 HydrophobicContact CE-CB 4.37Å; M356-R787 PolarHBondContact SD-NH2 3.48Å
357	C	39.9	Very low	55.2	Low	85 Å²	85	97 Å²	97	57%	0.574	51%	0.505	S	S	*	.			trans	-72.9	129.3	155	-166.8	0	0	0	0	106.4	V355 T359 D360	V355-C357 PolarHBondContact O-N 3.1Å; V355-C357 VanDerWaalsContact O-N 3.1Å; C357-T359 PolarHBondContact O-N 3.05Å; C357-D360 PolarHBondContact O-N 3.35Å
358	I	42.2	Very low	53.9	Low	136 Å²	136	99.2 Å²	99.2	70%	0.697	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-9.9	-178.8	-70.2	164.6	0	0	0	113.1	D360 Q361	I358-D360 VanDerWaalsContact C-N 3.34Å; I358-D360 PolarHBondContact O-N 3.43Å; I358-Q361 PolarHBondContact O-N 3.3Å
359	T	43.5	Very low	52.1	Low	79 Å²	79	103.3 Å²	103.3	49%	0.485	53%	0.53	S	S	.	.	H	α-helix	trans	-61	-25.8	178.5	50.8	0	0	0	0	116	C357 Q361 V362 L363	C357-T359 PolarHBondContact O-N 3.05Å; T359-Q361 VanDerWaalsContact C-N 3.28Å; T359-Q361 PolarHBondContact O-N 3.01Å; T359-V362 PolarHBondContact O-N 2.81Å; T359-V362 VanDerWaalsContact O-N 3.07Å; T359-L363 PolarHBondContact O-N 2.96Å; T359-L363 VanDerWaalsContact O-N 3.09Å
360	D	41	Very low	50	Low	67 Å²	67	101.9 Å²	101.9	36%	0.358	54%	0.536	S	S	.	.	H	α-helix	trans	-68.6	-27.8	177.8	-86.6	-23.7	0	0	0	112.3	M356 C357 I358 V362 S364 K783	M356-D360 HydrophobicContact CE-CB 4.37Å; C357-D360 PolarHBondContact O-N 3.35Å; I358-D360 VanDerWaalsContact C-N 3.34Å; I358-D360 PolarHBondContact O-N 3.43Å; D360-V362 VanDerWaalsContact C-N 3.29Å; D360-V362 PolarHBondContact O-N 3.15Å; D360-S364 PolarHBondContact O-N 3.36Å; D360-S364 VanDerWaalsContact O-N 3.16Å; D360-S364 PolarHBondContact O-OG 2.84Å; D360-K783 IonicContact OD2-NZ 3.24Å
361	Q	45.2	Very low	48	Very low	127 Å²	127	106.9 Å²	106.9	59%	0.593	57%	0.566	S	S	*	*	H	α-helix	trans	-68.6	-30.3	170.9	-73	-171.5	-4.7	0	0	112	I358 T359 S364 R365	I358-Q361 PolarHBondContact O-N 3.3Å; T359-Q361 VanDerWaalsContact C-N 3.28Å; T359-Q361 PolarHBondContact O-N 3.01Å; Q361-S364 PolarHBondContact O-OG 3.3Å; Q361-R365 WeakPolarHBondContact O-CB 3.31Å; Q361-R365 WeakPolarHBondContact O-CG 3.44Å; Q361-R365 PolarHBondContact O-N 3.31Å; Q361-R365 VanDerWaalsContact O-N 3.12Å
362	V	45.6	Very low	46	Very low	81 Å²	81	112.6 Å²	112.6	49%	0.491	59%	0.594	S	S	.	*	H	α-helix	trans	-74.5	-39.4	177.7	-176.7	0	0	0	0	111.2	T359 D360 R365 M366	T359-V362 PolarHBondContact O-N 2.81Å; T359-V362 VanDerWaalsContact O-N 3.07Å; D360-V362 VanDerWaalsContact C-N 3.29Å; D360-V362 PolarHBondContact O-N 3.15Å; V362-R365 PolarHBondContact O-N 3.27Å; V362-M366 PolarHBondContact O-N 3.3Å
363	L	39	Very low	44	Very low	107 Å²	107	115.3 Å²	115.3	56%	0.56	60%	0.602	S	S	*	*	H	α-helix	trans	-65.9	-39.4	176.4	-83.7	159.7	0	0	0	112.6	T359 M366 Q367	T359-L363 PolarHBondContact O-N 2.96Å; T359-L363 VanDerWaalsContact O-N 3.09Å; L363-M366 PolarHBondContact O-N 3.26Å; L363-Q367 PolarHBondContact O-N 2.58Å
364	S	42.9	Very low	42.3	Very low	65 Å²	65	120.5 Å²	120.5	46%	0.455	63%	0.627	S	S	.	*	H	α-helix	trans	-68.9	-32.7	174.4	61.6	0	0	0	0	113.1	D360 Q361	D360-S364 PolarHBondContact O-N 3.36Å; D360-S364 VanDerWaalsContact O-N 3.16Å; D360-S364 PolarHBondContact O-OG 2.84Å; Q361-S364 PolarHBondContact O-OG 3.3Å
365	R	41.6	Very low	41	Very low	178 Å²	178	126.5 Å²	126.5	67%	0.672	66%	0.656	S	S	*	*	H	α-helix	trans	-73.4	-35.6	173.2	-76.4	-176.5	-179.9	-172	0.8	113.1	Q361 V362 Q367 R368 N369	Q361-R365 WeakPolarHBondContact O-CB 3.31Å; Q361-R365 WeakPolarHBondContact O-CG 3.44Å; Q361-R365 PolarHBondContact O-N 3.31Å; Q361-R365 VanDerWaalsContact O-N 3.12Å; V362-R365 PolarHBondContact O-N 3.27Å; R365-Q367 PolarHBondContact O-N 3.19Å; R365-R368 PolarHBondContact O-N 3.47Å; R365-N369 PolarHBondContact O-N 3.34Å
366	M	43.6	Very low	39.7	Very low	135 Å²	135	126.3 Å²	126.3	67%	0.665	65%	0.65	S	S	*	*	H	α-helix	trans	-62.7	-30	175.6	-94	-175.2	164.7	0	0	112.8	V362 L363 R368	V362-M366 PolarHBondContact O-N 3.3Å; L363-M366 PolarHBondContact O-N 3.26Å; M366-R368 VanDerWaalsContact C-N 3.27Å; M366-R368 PolarHBondContact O-N 2.72Å
367	Q	45.1	Very low	38.9	Very low	155 Å²	155	129.4 Å²	129.4	72%	0.724	67%	0.668	S	S	*	*	H	α-helix	trans	-70	-21.4	173.7	-73.1	-176	-22	0	0	113.6	L363 R365	L363-Q367 PolarHBondContact O-N 2.58Å; R365-Q367 PolarHBondContact O-N 3.19Å
368	R	43.8	Very low	38.3	Very low	212 Å²	212	132.5 Å²	132.5	80%	0.8	68%	0.679	S	S	*	*	H	α-helix	trans	-89.4	-30	175.7	-82.3	-176.2	176.1	139.1	-1.3	113.8	R365 M366 N370	R365-R368 PolarHBondContact O-N 3.47Å; M366-R368 VanDerWaalsContact C-N 3.27Å; M366-R368 PolarHBondContact O-N 2.72Å; R368-N370 VanDerWaalsContact C-N 3.33Å; R368-N370 PolarHBondContact O-N 2.91Å
369	N	38.5	Very low	37.8	Very low	122 Å²	122	133.2 Å²	133.2	65%	0.652	68%	0.684	S	S	*	*	H	α-helix	trans	-83.7	-5.9	-175	-78.3	10.6	0	0	0	114.5	R365 T371	R365-N369 PolarHBondContact O-N 3.34Å; N369-T371 PolarHBondContact O-N 3.38Å
370	N	36	Very low	37	Very low	150 Å²	150	140.3 Å²	140.3	80%	0.802	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	5	-178.2	-132.6	25.9	0	0	0	114.6	R368	R368-N370 VanDerWaalsContact C-N 3.33Å; R368-N370 PolarHBondContact O-N 2.91Å
371	T	39	Very low	36.2	Very low	119 Å²	119	145.1 Å²	145.1	73%	0.73	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	-11.1	176.4	-45.5	0	0	0	0	113.6	N369	N369-T371 PolarHBondContact O-N 3.38Å
372	N	34.5	Very low	35.5	Very low	140 Å²	140	145 Å²	145	75%	0.749	73%	0.733	S	S	*	*	S	Bend	trans	-118.4	7.5	-170.2	-85.4	7.2	0	0	0	117.4
373	N	32.9	Very low	34.6	Very low	152 Å²	152	148.2 Å²	148.2	81%	0.813	75%	0.745	S	S	*	*			trans	-113.1	62.9	177.3	-75.1	-1.1	0	0	0	112.3
374	N	29.4	Very low	34.1	Very low	153 Å²	153	150.4 Å²	150.4	82%	0.818	76%	0.756	S	S	*	*			trans	-107.2	95.6	155	-101.6	-8.9	0	0	0	106.9
375	I	32.7	Very low	33.2	Very low	154 Å²	154	152.2 Å²	152.2	79%	0.79	77%	0.769	S	S	*	*	S	Bend	trans	-177.4	114.5	150	-88.1	143.3	0	0	0	106.7
376	N	29.3	Very low	32.6	Very low	138 Å²	138	152.5 Å²	152.5	74%	0.738	78%	0.778	S	S	*	*			trans	51.8	108.7	154.4	-60.4	-14.3	0	0	0	119.2
377	N	31	Very low	31.7	Very low	162 Å²	162	150.9 Å²	150.9	87%	0.866	78%	0.78	S	S	*	*				-171	114.6	109.3	-93.1	-21.4	0	0	0	112.4
378	N	27.9	Very low	30.9	Very low	151 Å²	151	151.4 Å²	151.4	81%	0.807	79%	0.788	S	S	*	*			trans	-65.9	122.6	157	-76.9	-31	0	0	0	108.8
379	N	31.2	Very low	30.1	Very low	150 Å²	150	150.3 Å²	150.3	80%	0.802	79%	0.792	S	S	*	*				159	104.8	126.2	-80.7	-23.4	0	0	0	112.4
380	R	26.6	Very low	29.5	Very low	228 Å²	228	149.5 Å²	149.5	86%	0.86	80%	0.795	S	S	*	*			trans	21.9	112	138.2	-72.4	178.3	170	179.5	-3.3	119.2
381	H	24.2	Very low	29.3	Very low	168 Å²	168	148.4 Å²	148.4	78%	0.778	80%	0.796	S	S	*	*				34.1	127.6	125.6	-63.8	-73.5	0	0	0	120.3
382	P	30.8	Very low	28.6	Very low	126 Å²	126	154.8 Å²	154.8	82%	0.818	81%	0.807	S	S	*	*			trans	-115	120.7	133.3	30	-16.8	0	0	0	110.6
383	I	26.4	Very low	28.3	Very low	147 Å²	147	157.1 Å²	157.1	75%	0.754	81%	0.813	S	S	*	*			trans	-76.9	118.1	171.4	-66.1	163.9	0	0	0	107.3
384	I	28.8	Very low	27.9	Very low	154 Å²	154	153.7 Å²	153.7	79%	0.79	81%	0.814	S	S	*	*			trans	-125.1	105.2	159.8	-67.5	-179.5	0	0	0	108
385	S	23.5	Very low	27.8	Very low	102 Å²	102	152.2 Å²	152.2	71%	0.713	82%	0.816	S	S	*	*			trans	-70.5	124.9	168	50.7	0	0	0	0	110.6
386	Q	28.9	Very low	27.5	Very low	185 Å²	185	153 Å²	153	86%	0.864	82%	0.82	S	S	*	*			trans	-131.2	120.5	151.3	-80.2	-169.6	-1.5	0	0	109.9
387	S	26.4	Very low	27.3	Very low	101 Å²	101	151 Å²	151	71%	0.706	82%	0.823	S	S	*	*			trans	-69.5	116.2	-177.2	46.8	0	0	0	0	112.2
388	N	27.7	Very low	27.1	Very low	166 Å²	166	147.1 Å²	147.1	89%	0.888	82%	0.822	S	S	*	*			trans	-95.7	102.4	159.5	-92.2	-15.2	0	0	0	109	S390	N388-S390 PolarHBondContact O-N 3.05Å
389	Q	25.7	Very low	27	Very low	189 Å²	189	143.5 Å²	143.5	88%	0.883	82%	0.82	S	S	*	*			trans	-68.5	119	172.3	-66.7	177.1	5.1	0	0	109
390	S	27.1	Very low	26.6	Very low	104 Å²	104	146.9 Å²	146.9	73%	0.727	82%	0.822	S	S	*	*			trans	-108.7	145	167.4	38.9	0	0	0	0	109.3	N388	N388-S390 PolarHBondContact O-N 3.05Å
391	P	31.3	Very low	26.6	Very low	127 Å²	127	144.8 Å²	144.8	83%	0.825	83%	0.827	S	S	*	*			trans	-75.3	134.2	-165.8	-11.1	27.6	0	0	0	111.9	Q393	P391-Q393 PolarHBondContact O-N 2.9Å
392	R	25.3	Very low	26.7	Very low	253 Å²	253	141.3 Å²	141.3	96%	0.955	83%	0.827	S	S	*	*			trans	-55.9	110.1	175.1	-68.9	174.5	170.5	-171.5	-3.3	111.1
393	Q	28	Very low	26.3	Very low	189 Å²	189	143.6 Å²	143.6	88%	0.883	83%	0.825	S	S	*	*			trans	-95.7	127	150.7	-84.3	-173.9	-23.6	0	0	108.2	P391 S395	P391-Q393 PolarHBondContact O-N 2.9Å; Q393-S395 PolarHBondContact O-N 3.31Å
394	G	24.8	Very low	26.2	Very low	80 Å²	80	145.5 Å²	145.5	83%	0.825	83%	0.83	S	S	*	*			trans	-60.4	120.3	-168.5	0	0	0	0	0	113.3
395	S	26.4	Very low	26.1	Very low	123 Å²	123	147.7 Å²	147.7	86%	0.86	84%	0.837	S	S	*	*			trans	-87.1	104.1	164.5	-174.4	0	0	0	0	108.1	Q393 A397	Q393-S395 PolarHBondContact O-N 3.31Å; S395-A397 PolarHBondContact O-N 3.36Å
396	L	26.6	Very low	26.1	Very low	169 Å²	169	151.3 Å²	151.3	89%	0.885	84%	0.843	S	S	*	*			trans	-82.7	107.3	168.9	-93.9	151.2	0	0	0	108.7
397	A	25.6	Very low	25.9	Very low	96 Å²	96	151.5 Å²	151.5	79%	0.793	84%	0.844	S	S	*	*			trans	44.6	88.6	144	0	0	0	0	0	118.2	S395	S395-A397 PolarHBondContact O-N 3.36Å
398	G	26.6	Very low	26	Very low	82 Å²	82	156.1 Å²	156.1	85%	0.845	85%	0.854	S	S	*	*			trans	-133	78.1	154.3	0	0	0	0	0	108.8
399	G	25	Very low	25.8	Very low	75 Å²	75	157.6 Å²	157.6	77%	0.773	86%	0.856	S	S	*	*			trans	-76.4	124.3	-176.4	0	0	0	0	0	113
400	R	23.9	Very low	26	Very low	220 Å²	220	157.6 Å²	157.6	83%	0.83	86%	0.856	S	S	*	*			trans	22.9	110.9	142.8	-71.9	-179.2	175.9	-114.8	0.3	118.2
401	L	25.5	Very low	25.8	Very low	185 Å²	185	161.7 Å²	161.7	97%	0.969	86%	0.863	S	S	*	*			trans	-154.1	77.3	136.3	-82	-178.6	0	0	0	108.9
402	A	25.6	Very low	25.6	Very low	95 Å²	95	164.7 Å²	164.7	79%	0.785	87%	0.866	S	S	*	*			trans	-166.6	77	166.1	0	0	0	0	0	110.2
403	F	23.3	Very low	25.7	Very low	174 Å²	174	158.5 Å²	158.5	76%	0.763	86%	0.862	S	S	*	*			trans	-142	102	164.3	-107.1	-83.8	0	0	0	106.2
404	E	24.7	Very low	25.6	Very low	187 Å²	187	156.4 Å²	156.4	87%	0.874	86%	0.861	S	S	*	*			trans	165.2	81.6	146.7	-95	176	169	0	0	109.5
405	Q	26.4	Very low	25.6	Very low	199 Å²	199	158.7 Å²	158.7	93%	0.93	86%	0.859	S	S	*	*			trans	-159.8	66.7	152.8	-108.3	173.2	36.1	0	0	107.7
406	Q	23.4	Very low	25.5	Very low	178 Å²	178	159.6 Å²	159.6	83%	0.832	86%	0.86	S	S	*	*			trans	-127	91.1	166.8	-86.7	-173.9	-5.3	0	0	108.1
407	Q	24.9	Very low	25.5	Very low	189 Å²	189	155.4 Å²	155.4	88%	0.883	85%	0.85	S	S	*	*			trans	-170.5	89	151	-109.2	172	73.7	0	0	109.3
408	Q	27.8	Very low	25.6	Very low	199 Å²	199	156.4 Å²	156.4	93%	0.93	85%	0.846	S	S	*	*			trans	176.2	78.7	145.3	-96.1	166.5	46.2	0	0	108.1
409	Q	25	Very low	25.5	Very low	197 Å²	197	158.1 Å²	158.1	92%	0.921	84%	0.84	S	S	*	*			trans	-118.6	99.1	162.9	-83.3	-177.7	12.3	0	0	107.9
410	Q	28.1	Very low	26	Very low	189 Å²	189	159.5 Å²	159.5	88%	0.883	83%	0.825	S	S	*	*			trans	-125.6	102.3	157.4	-82.6	-175.3	16.3	0	0	108.7
411	Q	23.5	Very low	26.1	Very low	189 Å²	189	154.9 Å²	154.9	88%	0.883	82%	0.823	S	S	*	*			trans	35.4	98.4	142.9	-62.2	173.7	21.8	0	0	117.6
412	Q	27.8	Very low	26.5	Very low	190 Å²	190	153.2 Å²	153.2	89%	0.888	81%	0.808	S	S	*	*			trans	-132	129.1	147.4	-76.6	-174.2	-7.8	0	0	110.5
413	S	26.7	Very low	26.5	Very low	123 Å²	123	153.7 Å²	153.7	86%	0.86	81%	0.806	S	S	*	*			trans	-63.7	126.2	-174.7	43	0	0	0	0	112.9	V415	S413-V415 PolarHBondContact O-N 2.86Å
414	V	25.6	Very low	26.6	Very low	145 Å²	145	150.3 Å²	150.3	88%	0.879	81%	0.81	S	S	*	*			trans	-81.5	89.7	-177.6	-178.2	0	0	0	0	110.6
415	V	24.6	Very low	26.6	Very low	128 Å²	128	148.6 Å²	148.6	78%	0.776	81%	0.807	S	S	*	*			trans	-153.1	98.2	155.3	-175.3	0	0	0	0	108.7	S413	S413-V415 PolarHBondContact O-N 2.86Å
416	T	26.1	Very low	26.6	Very low	143 Å²	143	144.6 Å²	144.6	88%	0.877	80%	0.801	S	S	*	*	S	Bend	trans	-176.5	153.9	135.5	9.5	0	0	0	0	111.7
417	A	25.5	Very low	26.6	Very low	81 Å²	81	140.5 Å²	140.5	67%	0.669	79%	0.792	S	S	*	*			trans	-39.6	135.3	-172	0	0	0	0	0	115.4	T419	A417-T419 PolarHBondContact O-N 3.05Å
418	V	28.3	Very low	26.5	Very low	117 Å²	117	141 Å²	141	71%	0.709	79%	0.791	S	S	*	*			trans	-71	85.2	167.6	-175.6	0	0	0	0	107.8	F420	V418-F420 HydrophobicContact CG1-CD1 4.34Å; V418-F420 HydrophobicContact CG1-CD2 4.07Å; V418-F420 HydrophobicContact CG1-CE1 3.98Å; V418-F420 HydrophobicContact CG1-CE2 3.69Å; V418-F420 HydrophobicContact CG1-CG 4.38Å; V418-F420 HydrophobicContact CG1-CZ 3.65Å
419	T	23.9	Very low	26.3	Very low	117 Å²	117	139.6 Å²	139.6	72%	0.718	79%	0.789	S	S	*	*			trans	-91.7	110.3	163	-48.6	0	0	0	0	106.1	A417 P421	A417-T419 PolarHBondContact O-N 3.05Å; T419-P421 WeakPolarHBondContact O-CD 3.48Å
420	F	35.2	Very low	26.3	Very low	104 Å²	104	135.9 Å²	135.9	46%	0.456	78%	0.782	S	S	.	*			trans	-69	114.3	-176.9	-71.2	-86.4	0	0	0	110.4	V418 F422	V418-F420 HydrophobicContact CG1-CD1 4.34Å; V418-F420 HydrophobicContact CG1-CD2 4.07Å; V418-F420 HydrophobicContact CG1-CE1 3.98Å; V418-F420 HydrophobicContact CG1-CE2 3.69Å; V418-F420 HydrophobicContact CG1-CG 4.38Å; V418-F420 HydrophobicContact CG1-CZ 3.65Å; F420-F422 HydrophobicContact CB-CD2 4.21Å; F420-F422 HydrophobicContact CB-CE2 3.86Å
421	P	26.8	Very low	26	Very low	124 Å²	124	134.4 Å²	134.4	81%	0.805	78%	0.779	S	S	*	*			trans	-84.9	117.5	170.2	14.2	3.9	0	0	0	108.4	T419	T419-P421 WeakPolarHBondContact O-CD 3.48Å
422	F	32.7	Very low	25.9	Very low	149 Å²	149	133 Å²	133	65%	0.654	78%	0.776	S	S	*	*			trans	-96.7	116.5	175	-81.2	-91	0	0	0	109.2	F420	F420-F422 HydrophobicContact CB-CD2 4.21Å; F420-F422 HydrophobicContact CB-CE2 3.86Å
423	S	26.8	Very low	25.6	Very low	105 Å²	105	132.4 Å²	132.4	73%	0.734	77%	0.773	S	S	*	*			trans	-118.4	119.6	163.4	-69.2	0	0	0	0	108.5
424	A	25.7	Very low	25.4	Very low	103 Å²	103	132.1 Å²	132.1	85%	0.851	77%	0.771	S	S	*	*			trans	-83.8	113.3	170	0	0	0	0	0	107.8
425	D	24.2	Very low	25.2	Very low	152 Å²	152	134.4 Å²	134.4	81%	0.813	77%	0.772	S	S	*	*			trans	-127.1	100.1	161.4	-151.6	-6.1	0	0	0	107.7
426	S	25.5	Very low	25.1	Very low	115 Å²	115	133.5 Å²	133.5	80%	0.804	77%	0.772	S	S	*	*			trans	-103	96.5	175.2	-72.2	0	0	0	0	107.4
427	S	23.1	Very low	25	Very low	91 Å²	91	135.6 Å²	135.6	64%	0.636	77%	0.771	S	S	*	*			trans	-164.7	142.4	150.6	57.9	0	0	0	0	112
428	K	24.6	Very low	24.9	Very low	199 Å²	199	136.9 Å²	136.9	87%	0.865	78%	0.775	S	S	*	*			trans	87.8	77.2	167.5	-55.5	-179	-178.7	178.7	0	116.9
429	L	22.8	Very low	24.6	Very low	171 Å²	171	137.9 Å²	137.9	90%	0.895	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-94.1	135.2	147	-78.2	162.8	0	0	0	109.2
430	P	24.1	Very low	24.7	Very low	118 Å²	118	141.7 Å²	141.7	77%	0.766	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-83.6	137.1	-178	15.8	-2.9	0	0	0	112.4	I432	P430-I432 PolarHBondContact O-N 3.23Å
431	I	21.5	Very low	24.1	Very low	158 Å²	158	145.7 Å²	145.7	81%	0.81	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-70.7	116.1	176	-61.5	166	0	0	0	109	Q433	I431-Q433 HydrophobicContact CG2-CG 4.46Å
432	I	22.9	Very low	23.9	Very low	160 Å²	160	148.8 Å²	148.8	82%	0.821	81%	0.813	S	S	*	*			trans	-97.5	109.2	167.6	-62.4	175	0	0	0	107.1	P430 S434	P430-I432 PolarHBondContact O-N 3.23Å; I432-S434 PolarHBondContact O-N 3.29Å
433	Q	21.7	Very low	23.5	Very low	177 Å²	177	148.4 Å²	148.4	83%	0.827	82%	0.823	S	S	*	*			trans	-69.7	124.4	173.1	-82	176.2	-23.9	0	0	110.4	I431	I431-Q433 HydrophobicContact CG2-CG 4.46Å
434	S	21.9	Very low	23.2	Very low	118 Å²	118	149.1 Å²	149.1	83%	0.825	82%	0.823	S	S	*	*			trans	-71.3	129.9	170.2	38	0	0	0	0	110.7	I432	I432-S434 PolarHBondContact O-N 3.29Å
435	Q	21.6	Very low	23.1	Very low	192 Å²	192	151 Å²	151	90%	0.897	82%	0.824	S	S	*	*			trans	-112.8	124.1	161	-77.1	-171.9	-6.9	0	0	109.5
436	S	22	Very low	23.1	Very low	110 Å²	110	149.6 Å²	149.6	77%	0.769	83%	0.826	S	S	*	*			trans	-72.1	139.9	173	48.9	0	0	0	0	112.5
437	Q	23.6	Very low	22.9	Very low	187 Å²	187	147 Å²	147	87%	0.874	82%	0.818	S	S	*	*			trans	-167.1	101.9	152.7	-104	163.9	28.6	0	0	107.1
438	S	23.8	Very low	23	Very low	107 Å²	107	152.7 Å²	152.7	75%	0.748	83%	0.831	S	S	*	*				88.6	105.2	92.7	64.8	0	0	0	0	113.5
439	T	22	Very low	23	Very low	138 Å²	138	151.1 Å²	151.1	85%	0.847	83%	0.832	S	S	*	*			trans	-28.9	132.9	157.9	4.9	0	0	0	0	116
440	E	25.8	Very low	23.1	Very low	197 Å²	197	149.4 Å²	149.4	92%	0.921	83%	0.829	S	S	*	*			trans	-146.3	151.9	146.1	-79.2	-160	163.6	0	0	111.2
441	E	23.6	Very low	23.3	Very low	189 Å²	189	149.8 Å²	149.8	88%	0.883	83%	0.831	S	S	*	*			trans	-88.9	154	-150.8	-68.4	173.8	137.1	0	0	116.4
442	F	22.3	Very low	23.6	Very low	188 Å²	188	152.5 Å²	152.5	83%	0.825	83%	0.832	S	S	*	*			trans	-14.5	129.7	151.5	-86.9	-102.4	0	0	0	118.8	T444	F442-T444 HydrophobicContact CD1-CG2 4.33Å
443	T	23	Very low	23.9	Very low	141 Å²	141	150.6 Å²	150.6	87%	0.865	83%	0.83	S	S	*	*			trans	-143.3	125	133.6	47.5	0	0	0	0	110.7
444	T	22.3	Very low	24.2	Very low	120 Å²	120	147.9 Å²	147.9	74%	0.736	83%	0.83	S	S	*	*			trans	-80.8	128	178	49	0	0	0	0	111.3	F442	F442-T444 HydrophobicContact CD1-CG2 4.33Å
445	T	23.3	Very low	24.4	Very low	143 Å²	143	147.1 Å²	147.1	88%	0.877	83%	0.825	S	S	*	*			trans	-133.3	123.8	159.5	56.3	0	0	0	0	110.5
446	S	23.3	Very low	24.8	Very low	122 Å²	122	143.9 Å²	143.9	85%	0.853	82%	0.82	S	S	*	*			trans	-83.3	143.3	-176.5	51.5	0	0	0	0	112.4
447	G	21.9	Very low	25.1	Very low	61 Å²	61	145.3 Å²	145.3	63%	0.629	82%	0.824	S	S	*	*			trans	95.7	106.9	140.8	0	0	0	0	0	116.6
448	F	25.7	Very low	25.4	Very low	211 Å²	211	141.8 Å²	141.8	93%	0.925	82%	0.82	S	S	*	*			trans	-151	97.6	140.7	-94.7	-73.7	0	0	0	108.7	T450	F448-T450 PolarHBondContact O-N 3.4Å
449	D	24.4	Very low	25.5	Very low	165 Å²	165	141.6 Å²	141.6	88%	0.882	82%	0.819	S	S	*	*			trans	-63.4	125.7	169.1	-74.4	-47.2	0	0	0	110
450	T	24.9	Very low	25.9	Very low	136 Å²	136	142.8 Å²	142.8	83%	0.834	82%	0.82	S	S	*	*			trans	-112.2	121	169.6	3.8	0	0	0	0	109.1	F448	F448-T450 PolarHBondContact O-N 3.4Å
451	P	27.8	Very low	26	Very low	125 Å²	125	139.3 Å²	139.3	81%	0.812	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77	136.6	-170.9	28.5	-31.8	0	0	0	112.4
452	R	27.2	Very low	26.4	Very low	215 Å²	215	138.3 Å²	138.3	81%	0.811	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-74.5	135.4	-178.6	-166.5	175.5	-167.3	151.6	1.6	111	S454	R452-S454 PolarHBondContact O-N 2.88Å
453	P	29.4	Very low	26.7	Very low	121 Å²	121	135.8 Å²	135.8	79%	0.786	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-67.1	126.9	173.8	-15.2	28.9	0	0	0	110.9
454	S	27.6	Very low	27.2	Very low	119 Å²	119	138 Å²	138	83%	0.832	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-49.9	123.4	178.5	44.7	0	0	0	0	114.2	R452	R452-S454 PolarHBondContact O-N 2.88Å
455	S	25.9	Very low	27.5	Very low	103 Å²	103	139.4 Å²	139.4	72%	0.72	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-81.1	148.1	152.6	-129.8	0	0	0	0	108.8	V457	S455-V457 PolarHBondContact O-N 3.46Å
456	P	30.6	Very low	27.9	Very low	123 Å²	123	140.2 Å²	140.2	80%	0.799	81%	0.809	S	S	*	*			trans	-75.7	112.8	-165.2	30.9	-31.2	0	0	0	109.9
457	V	29.7	Very low	28.2	Very low	140 Å²	140	137 Å²	137	85%	0.848	80%	0.795	S	S	*	*			trans	-93.9	125.4	170.4	177.4	0	0	0	0	107.8	S455 S459	S455-V457 PolarHBondContact O-N 3.46Å; V457-S459 PolarHBondContact O-N 3.31Å
458	S	29.1	Very low	28.5	Very low	113 Å²	113	140.2 Å²	140.2	79%	0.79	80%	0.803	S	S	*	*			trans	-50.1	126.2	-179.9	-52.6	0	0	0	0	112.1	D460	S458-D460 PolarHBondContact O-N 2.97Å
459	S	25.9	Very low	28.6	Very low	103 Å²	103	136.6 Å²	136.6	72%	0.72	79%	0.793	S	S	*	*			trans	-72.1	111.1	171.5	50.1	0	0	0	0	110	V457	V457-S459 PolarHBondContact O-N 3.31Å
460	D	29.9	Very low	28.6	Very low	164 Å²	164	135.4 Å²	135.4	88%	0.877	79%	0.786	S	S	*	*			trans	-139.3	80.5	154.7	-84.2	-37.6	0	0	0	108.2	S458	S458-D460 PolarHBondContact O-N 2.97Å
461	T	28.6	Very low	28.8	Very low	123 Å²	123	140.1 Å²	140.1	76%	0.755	79%	0.789	S	S	*	*			trans	-82	110.1	167.7	38.2	0	0	0	0	109.4
462	I	32.3	Very low	28.6	Very low	169 Å²	169	141.3 Å²	141.3	87%	0.867	79%	0.788	S	S	*	*			trans	-124.1	117.8	152.8	-63.5	-179.5	0	0	0	107.6
463	N	28.2	Very low	28.7	Very low	135 Å²	135	137.6 Å²	137.6	72%	0.722	79%	0.79	S	S	*	*			trans	-72.9	144	-178.5	-65.5	-46.3	0	0	0	112.4
464	H	33.4	Very low	28.3	Very low	187 Å²	187	136.5 Å²	136.5	87%	0.866	79%	0.785	S	S	*	*			trans	171.8	98.9	143.4	-97.9	-63	0	0	0	105.5
465	D	27.6	Very low	28.3	Very low	150 Å²	150	137.8 Å²	137.8	80%	0.802	78%	0.783	S	S	*	*				68.9	135.5	67.2	-148.3	19.2	0	0	0	114.7
466	D	33.3	Very low	28.1	Very low	160 Å²	160	139.9 Å²	139.9	86%	0.856	79%	0.785	S	S	*	*			trans	67.7	131.9	-171.7	-80.7	-25.6	0	0	0	117.1
467	G	28.5	Very low	27.8	Very low	55 Å²	55	140.9 Å²	140.9	57%	0.567	78%	0.783	S	S	*	*			cis	157.3	133.3	8.7	0	0	0	0	0	109.2
468	T	29.5	Very low	27.5	Very low	128 Å²	128	140.7 Å²	140.7	79%	0.785	78%	0.782	S	S	*	*			trans	69.6	115.7	151.3	61.3	0	0	0	0	122
469	N	27	Very low	27.2	Very low	135 Å²	135	140.9 Å²	140.9	72%	0.722	78%	0.783	S	S	*	*				76.4	118.2	123.4	-70.4	-13.7	0	0	0	122.2
470	N	25.4	Very low	27.4	Very low	139 Å²	139	141.5 Å²	141.5	74%	0.743	79%	0.788	S	S	*	*				56.3	110.7	128.3	-70.1	-12.7	0	0	0	118.2
471	R	27.5	Very low	27.1	Very low	235 Å²	235	140.5 Å²	140.5	89%	0.887	78%	0.782	S	S	*	*				172	142.9	89.6	-115	170.7	178.2	171.6	-1.9	110.6
472	D	23.6	Very low	27.2	Very low	150 Å²	150	143 Å²	143	80%	0.802	79%	0.79	S	S	*	*			trans	-46.8	136.6	162.7	-51.9	-66.7	0	0	0	112.1
473	T	29.2	Very low	26.8	Very low	138 Å²	138	141.7 Å²	141.7	85%	0.847	79%	0.785	S	S	*	*				-167.5	121.7	129.1	22.2	0	0	0	0	109.7
474	S	22.6	Very low	26.9	Very low	98 Å²	98	144.6 Å²	144.6	69%	0.685	79%	0.794	S	S	*	*			trans	-49.4	141.8	154.1	46.2	0	0	0	0	112.4
475	D	26.9	Very low	27.3	Very low	146 Å²	146	140.8 Å²	140.8	78%	0.781	79%	0.786	S	S	*	*			trans	164.7	102.1	137.1	-79.7	-17.1	0	0	0	107.8
476	L	22.1	Very low	27.1	Very low	147 Å²	147	140.6 Å²	140.6	77%	0.77	79%	0.785	S	S	*	*				53.7	116.4	95.2	-88.8	167.3	0	0	0	115.5
477	L	23.2	Very low	26.8	Very low	144 Å²	144	143.5 Å²	143.5	75%	0.754	79%	0.791	S	S	*	*			trans	74.1	117.3	152.4	-52.6	170.1	0	0	0	117
478	T	24.2	Very low	26.7	Very low	136 Å²	136	148.3 Å²	148.3	83%	0.834	80%	0.803	S	S	*	*				-179.4	138.1	99.1	27.7	0	0	0	0	112.2
479	S	22.7	Very low	26.5	Very low	116 Å²	116	149.6 Å²	149.6	81%	0.811	80%	0.8	S	S	*	*			trans	-55	140.6	167.7	47.1	0	0	0	0	114
480	S	29.2	Very low	26.5	Very low	116 Å²	116	151 Å²	151	81%	0.811	80%	0.802	S	S	*	*			trans	-139.8	113.7	158.4	54.9	0	0	0	0	111.1
481	N	23.5	Very low	26.6	Very low	143 Å²	143	153.4 Å²	153.4	77%	0.765	81%	0.809	S	S	*	*			trans	-38.9	155.9	165.3	-66.9	-50.7	0	0	0	114.3
482	L	30.9	Very low	26.8	Very low	176 Å²	176	148.4 Å²	148.4	92%	0.921	80%	0.804	S	S	*	*				-165.1	115.4	126.5	-98.2	154.4	0	0	0	111.3
483	N	23.9	Very low	27.1	Very low	141 Å²	141	148.9 Å²	148.9	75%	0.754	81%	0.805	S	S	*	*			trans	-69.4	148.8	169.1	-69.7	-39.7	0	0	0	111.8
484	Q	30.1	Very low	27	Very low	196 Å²	196	149.1 Å²	149.1	92%	0.916	80%	0.8	S	S	*	*				-168.4	133.9	125.6	-107	179.9	16.4	0	0	112.6
485	P	42	Very low	27.5	Very low	108 Å²	108	150.5 Å²	150.5	70%	0.701	81%	0.807	S	S	*	*			trans	-105.6	166.2	-178.3	39.7	-32.2	0	0	0	113.5
486	N	24.3	Very low	27.9	Very low	145 Å²	145	146.1 Å²	146.1	78%	0.775	80%	0.796	S	S	*	*			trans	124.8	107.7	156	-73.8	-17.4	0	0	0	112.7
487	F	27.3	Very low	28.4	Very low	221 Å²	221	145.2 Å²	145.2	97%	0.969	79%	0.792	S	S	*	*			trans	-156.9	118.6	132.5	-98.6	-70.2	0	0	0	110.2
488	N	25.1	Very low	29.1	Very low	156 Å²	156	143.6 Å²	143.6	83%	0.834	79%	0.792	S	S	*	*			trans	-83.4	140.2	177.8	-92.8	-26.2	0	0	0	111.6
489	H	26.4	Very low	29.6	Very low	155 Å²	155	143.5 Å²	143.5	72%	0.718	79%	0.787	S	S	*	*	S	Bend	trans	67.6	130.4	143.9	-102.8	46	0	0	0	122.5
490	H	26.5	Very low	30	Very low	164 Å²	164	144.3 Å²	144.3	76%	0.759	78%	0.781	S	S	*	*			trans	68.7	71.2	160.2	-63.4	-39.5	0	0	0	118.6	V492	H490-V492 PolarHBondContact O-N 2.98Å
491	Q	27.7	Very low	30.6	Very low	191 Å²	191	148.7 Å²	148.7	89%	0.893	78%	0.781	S	S	*	*			trans	-86.8	105.3	154.2	-80.4	-174.9	-13.4	0	0	110.4	I493	Q491-I493 PolarHBondContact O-N 3.12Å
492	V	31.8	Very low	31.3	Very low	130 Å²	130	148 Å²	148	79%	0.788	78%	0.775	S	S	*	*			trans	-44.5	118.9	156.3	175.9	0	0	0	0	108.5	H490 L494	H490-V492 PolarHBondContact O-N 2.98Å; V492-L494 PolarHBondContact O-N 3.24Å
493	I	29.7	Very low	31.8	Very low	160 Å²	160	146 Å²	146	82%	0.821	77%	0.765	S	S	*	*			trans	-65.8	99.4	-178.9	-61.3	170.6	0	0	0	108.1	Q491	Q491-I493 PolarHBondContact O-N 3.12Å
494	L	27.7	Very low	33.1	Very low	142 Å²	142	146.7 Å²	146.7	74%	0.743	76%	0.764	S	S	*	*			trans	-73.6	124.9	171.9	-154.1	77.6	0	0	0	108.5	V492 G496	V492-L494 PolarHBondContact O-N 3.24Å; L494-G496 PolarHBondContact O-N 3.18Å; L494-G496 VanDerWaalsContact O-N 3.09Å
495	P	33.5	Very low	34.5	Very low	127 Å²	127	147.1 Å²	147.1	83%	0.825	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	108	-175.6	29.1	-33.4	0	0	0	109.7
496	G	34.7	Very low	35.8	Very low	54 Å²	54	145.4 Å²	145.4	56%	0.557	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	171.4	-20	177.9	0	0	0	0	0	115.4	L494 S498	L494-G496 PolarHBondContact O-N 3.18Å; L494-G496 VanDerWaalsContact O-N 3.09Å; G496-S498 PolarHBondContact O-N 3.2Å
497	L	32	Very low	38.1	Very low	129 Å²	129	140.6 Å²	140.6	68%	0.675	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-82.1	-8.5	-176.3	-68	174.6	0	0	0	115.1	N499 L500	L497-N499 PolarHBondContact O-N 2.96Å; L497-N499 VanDerWaalsContact O-N 3.13Å; L497-L500 HydrophobicContact CD2-CD1 3.74Å; L497-L500 PolarHBondContact O-N 3.3Å
498	S	37.5	Very low	40.3	Very low	110 Å²	110	132.9 Å²	132.9	77%	0.769	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-67.7	-11.5	177.3	-48.3	0	0	0	0	114	G496	G496-S498 PolarHBondContact O-N 3.2Å
499	N	34.8	Very low	43	Very low	134 Å²	134	126.8 Å²	126.8	72%	0.717	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-88.6	-11.6	-179.5	-77.7	-12.8	0	0	0	114.5	L497 Y501	L497-N499 PolarHBondContact O-N 2.96Å; L497-N499 VanDerWaalsContact O-N 3.13Å; N499-Y501 VanDerWaalsContact C-N 3.29Å; N499-Y501 PolarHBondContact O-N 3.47Å
500	L	32	Very low	45.6	Very low	132 Å²	132	125.9 Å²	125.9	69%	0.691	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-7.8	-174.6	-84.9	162.6	0	0	0	115	L497	L497-L500 HydrophobicContact CD2-CD1 3.74Å; L497-L500 PolarHBondContact O-N 3.3Å
501	Y	40.6	Very low	48.4	Very low	208 Å²	208	120.4 Å²	120.4	82%	0.816	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	8.2	178.8	-76.3	-75.9	0	0	0	114.9	N499	N499-Y501 VanDerWaalsContact C-N 3.29Å; N499-Y501 PolarHBondContact O-N 3.47Å
502	M	39.9	Very low	51.4	Low	128 Å²	128	113 Å²	113	63%	0.631	60%	0.603	S	S	*	*			trans	-104.9	7.5	-174.1	-69.2	-69	115.6	0	0	115.1	E504	M502-E504 VanDerWaalsContact C-N 3.32Å; M502-E504 PolarHBondContact O-N 3Å
503	D	40.8	Very low	54.1	Low	135 Å²	135	106.9 Å²	106.9	72%	0.722	57%	0.565	S	S	*	*			trans	-88.6	14.8	-172.8	-146.1	14.8	0	0	0	115.3	K505	D503-K505 PolarHBondContact O-N 3.31Å; D503-K505 VanDerWaalsContact O-N 3.09Å
504	E	50.6	Low	56.9	Low	156 Å²	156	101 Å²	101	73%	0.729	53%	0.534	S	S	*	.			trans	-75.9	97.8	163.4	-84.6	-165.3	168.8	0	0	109.2	M502 S506	M502-E504 VanDerWaalsContact C-N 3.32Å; M502-E504 PolarHBondContact O-N 3Å; E504-S506 PolarHBondContact O-N 2.99Å
505	K	60	Low	59.8	Low	205 Å²	205	97.4 Å²	97.4	89%	0.891	51%	0.512	S	S	*	.			trans	-64.3	16.5	169.3	-65.2	-180	-177.8	170.9	0	113.7	D503	D503-K505 PolarHBondContact O-N 3.31Å; D503-K505 VanDerWaalsContact O-N 3.09Å
506	S	68.5	Low	62.3	Low	71 Å²	71	98.4 Å²	98.4	50%	0.497	50%	0.504	S	S	.	.	S	Bend	trans	-106.8	151	179	45.8	0	0	0	0	111.7	E504	E504-S506 PolarHBondContact O-N 2.99Å
507	L	72.7	Confident	64.9	Low	45 Å²	45	97.7 Å²	97.7	24%	0.236	49%	0.487	C	S	.	.			trans	-58.9	141.6	167.2	-74.9	171.8	0	0	0	109.5	W509 Q825 H829	L507-W509 PolarHBondContact O-N 3.41Å; L507-Q825 WeakPolarHBondContact CD2-O 3.34Å; L507-H829 WeakPolarHBondContact CD1-CD2 3.43Å
508	P	75	Confident	67.6	Low	59 Å²	59	91.5 Å²	91.5	38%	0.383	46%	0.455	S	S	.	.	S	Bend	trans	-72.9	12.1	176.8	33.5	-38.4	0	0	0	112.8	V344 V348	V344-P508 HydrophobicContact CG1-CB 3.67Å; V344-P508 HydrophobicContact CG1-CG 3.49Å; V344-P508 VanDerWaalsContact CG1-CG 3.49Å; V348-P508 HydrophobicContact CG2-CG 4.23Å
509	W	80.4	Confident	70.1	Confident	28 Å²	28	88.4 Å²	88.4	11%	0.106	43%	0.428	C	S	.	.	S	Bend	trans	-115.4	128.3	-175.6	-48.5	108.3	0	0	0	108.8	V344 I345 L507 L795 K826 R828	V344-W509 HydrophobicContact CB-CE3 4.4Å; V344-W509 HydrophobicContact CB-CH2 3.55Å; V344-W509 HydrophobicContact CB-CZ2 4.21Å; V344-W509 HydrophobicContact CB-CZ3 3.67Å; V344-W509 HydrophobicContact CG1-CD2 4.04Å; V344-W509 HydrophobicContact CG1-CE3 3.89Å; V344-W509 HydrophobicContact CG1-CH2 3.31Å; V344-W509 HydrophobicContact CG1-CZ2 3.47Å; V344-W509 VanDerWaalsContact CG1-CZ2 3.47Å; V344-W509 HydrophobicContact CG1-CZ3 3.54Å; V344-W509 HydrophobicContact CG2-CE3 4.48Å; V344-W509 HydrophobicContact CG2-CH2 4.38Å; V344-W509 HydrophobicContact CG2-CZ3 3.99Å; I345-W509 HydrophobicContact CG1-CH2 4.48Å; L507-W509 PolarHBondContact O-N 3.41Å; W509-L795 HydrophobicContact CZ2-CD2 4.14Å; W509-K826 PolarHBondContact NE1-O 3.23Å; W509-K826 VanDerWaalsContact NE1-O 3.13Å; W509-R828 HydrophobicContact CB-CB 3.81Å; W509-R828 HydrophobicContact CB-CG 3.66Å; W509-R828 HydrophobicContact CD2-CB 4.33Å; W509-R828 HydrophobicContact CG-CB 3.75Å; W509-R828 HydrophobicContact CG-CG 4.18Å
510	K	81.1	Confident	72.7	Confident	136 Å²	136	84.9 Å²	84.9	59%	0.591	42%	0.418	S	S	*	.			trans	-59.8	159.3	165.8	-69	-175.8	176.2	-170.1	0	110.3	E339 R828	E339-K510 WeakPolarHBondContact OE1-CB 3.39Å; E339-K510 WeakPolarHBondContact OE1-CG 3.11Å; E339-K510 PolarHBondContact OE1-N 3.29Å; K510-R828 PolarHBondContact O-NE 3.44Å; K510-R828 PolarHBondContact O-NH1 2.91Å; K510-R828 PolarHBondContact O-NH2 3.09Å
511	P	86.5	Confident	75.5	Confident	48 Å²	48	81.2 Å²	81.2	31%	0.312	40%	0.396	S	S	.	.			trans	-67.3	168.6	166.3	-24.5	34.9	0	0	0	111.9	R828 L831	P511-R828 PolarHBondContact O-NH2 2.99Å; P511-L831 HydrophobicContact CB-CD2 4.14Å; P511-L831 HydrophobicContact CB-CG 4.13Å; P511-L831 HydrophobicContact CG-CD2 4.48Å
512	K	89.5	Confident	77.9	Confident	37 Å²	37	71.3 Å²	71.3	16%	0.161	36%	0.357	C	S	.	.			trans	-139.3	145	170.7	-79.7	177.6	178	178.2	0	110.3	H558 Y560 R828 R830	K512-H558 CarbonylContact C-O 3.31Å; K512-H558 WeakPolarHBondContact CA-O 3.28Å; K512-Y560 HydrophobicContact CD-CD1 3.96Å; K512-Y560 HydrophobicContact CD-CD2 4.17Å; K512-Y560 HydrophobicContact CD-CG 3.76Å; K512-Y560 HydrophobicContact CG-CG 4.14Å; K512-R828 VanDerWaalsContact CE-CZ 3.46Å; K512-R828 VanDerWaalsContact CE-NH2 3.27Å; K512-R830 WeakPolarHBondContact O-CA 3.44Å; K512-R830 VanDerWaalsContact O-CB 3.23Å; K512-R830 WeakPolarHBondContact O-CB 3.22Å; K512-R830 WeakPolarHBondContact O-CG 2.96Å
513	V	89.9	Confident	80.4	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-128.2	135.9	171.6	-178.9	0	0	0	0	108.8	D517 L518 M555 H558 Y560 L831	V513-D517 HydrophobicContact CG1-CB 4.37Å; V513-L518 HydrophobicContact CG1-CB 4.45Å; V513-M555 HydrophobicContact CG1-CB 4.22Å; V513-M555 HydrophobicContact CG1-CG 4.41Å; V513-M555 HydrophobicContact CG2-CB 4.41Å; V513-M555 HydrophobicContact CG2-CG 4.37Å; V513-H558 HydrophobicContact CG2-CB 4.05Å; V513-H558 PolarHBondContact N-O 3.21Å; V513-Y560 PolarHBondContact O-N 3.24Å; V513-L831 HydrophobicContact CG2-CB 4.02Å; V513-L831 HydrophobicContact CG2-CD1 3.75Å; V513-L831 HydrophobicContact CG2-CG 4.09Å
514	K	87.4	Confident	82.7	Confident	36 Å²	36	63.5 Å²	63.5	16%	0.157	33%	0.325	C	S	.	.			trans	-86.4	154.3	171.7	-89.4	165.1	177.3	-173.6	0	110.2	K516 D517 L518 W765 R830	K514-K516 VanDerWaalsContact C-N 3.31Å; K514-K516 PolarHBondContact O-N 2.9Å; K514-D517 HydrophobicContact CB-CB 4.38Å; K514-D517 WeakPolarHBondContact CB-OD2 3.4Å; K514-D517 PolarHBondContact N-OD2 2.86Å; K514-D517 PolarHBondContact O-N 3.36Å; K514-D517 VanDerWaalsContact O-N 3.11Å; K514-L518 PolarHBondContact O-N 2.89Å; K514-L518 VanDerWaalsContact O-N 3.15Å; K514-W765 VanDerWaalsContact NZ-CD2 3.3Å; K514-R830 VanDerWaalsContact CG-NH1 3.32Å
515	K	88	Confident	84.7	Confident	68 Å²	68	56.7 Å²	56.7	30%	0.296	29%	0.293	S	S	.	.	H	α-helix	trans	-53.4	-47.9	171.1	-172.2	-176.9	174	-174.1	0	111.5	D517 L518 E519 L559 E569	K515-D517 VanDerWaalsContact C-N 3.3Å; K515-D517 PolarHBondContact O-N 3.09Å; K515-L518 WeakPolarHBondContact O-CB 3.16Å; K515-L518 PolarHBondContact O-N 3.38Å; K515-L518 VanDerWaalsContact O-N 3.13Å; K515-E519 WeakPolarHBondContact CE-OE1 3.47Å; K515-E519 WeakPolarHBondContact CG-OE1 3.49Å; K515-E519 WeakPolarHBondContact O-CG 3.36Å; K515-E519 PolarHBondContact O-N 3.43Å; K515-L559 HydrophobicContact CB-CD1 4.39Å; K515-E569 IonicContact NZ-OE1 3.34Å
516	K	86.9	Confident	86.3	Confident	147 Å²	147	47.2 Å²	47.2	64%	0.639	25%	0.252	S	S	*	.	H	α-helix	trans	-58.3	-36.7	176.4	-65	-170.9	177.4	-171.3	0	114	K514 E519 A520	K514-K516 VanDerWaalsContact C-N 3.31Å; K514-K516 PolarHBondContact O-N 2.9Å; K516-E519 PolarHBondContact O-N 2.99Å; K516-A520 VanDerWaalsContact O-CB 3.31Å; K516-A520 WeakPolarHBondContact O-CB 3.23Å; K516-A520 PolarHBondContact O-N 3.24Å
517	D	87.9	Confident	87.4	Confident	39 Å²	39	48.2 Å²	48.2	21%	0.209	25%	0.252	C	S	.	.	H	α-helix	trans	-69.3	-39.8	179.1	-55.3	-18.6	0	0	0	110.3	V513 K514 K515 F521 R830 T832	V513-D517 HydrophobicContact CG1-CB 4.37Å; K514-D517 HydrophobicContact CB-CB 4.38Å; K514-D517 WeakPolarHBondContact CB-OD2 3.4Å; K514-D517 PolarHBondContact N-OD2 2.86Å; K514-D517 PolarHBondContact O-N 3.36Å; K514-D517 VanDerWaalsContact O-N 3.11Å; K515-D517 VanDerWaalsContact C-N 3.3Å; K515-D517 PolarHBondContact O-N 3.09Å; D517-F521 WeakPolarHBondContact O-CB 3.26Å; D517-F521 PolarHBondContact O-N 3.38Å; D517-R830 IonicContact OD2-NH1 2.73Å; D517-R830 PolarHBondContact OD2-NH1 3.44Å; D517-T832 HydrophobicContact CB-CG2 4.09Å; D517-T832 PolarHBondContact OD2-OG1 3.4Å
518	L	89.4	Confident	88.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.2	-41.4	175.1	178	60.2	0	0	0	111.8	V513 K514 K515 F521 L522 I538 V552 M555 R556	V513-L518 HydrophobicContact CG1-CB 4.45Å; K514-L518 PolarHBondContact O-N 2.89Å; K514-L518 VanDerWaalsContact O-N 3.15Å; K515-L518 WeakPolarHBondContact O-CB 3.16Å; K515-L518 PolarHBondContact O-N 3.38Å; K515-L518 VanDerWaalsContact O-N 3.13Å; L518-F521 PolarHBondContact O-N 3.21Å; L518-L522 HydrophobicContact CD1-CD1 4.29Å; L518-L522 HydrophobicContact CD1-CG 4.33Å; L518-L522 HydrophobicContact CG-CD1 4.29Å; L518-L522 WeakPolarHBondContact O-CB 3.38Å; L518-L522 WeakPolarHBondContact O-CG 3.36Å; L518-L522 PolarHBondContact O-N 3.33Å; L518-I538 HydrophobicContact CD2-CB 4.34Å; L518-V552 HydrophobicContact CD1-CG1 4.31Å; L518-V552 HydrophobicContact CD1-CG2 4.45Å; L518-M555 HydrophobicContact CD1-CB 3.95Å; L518-M555 HydrophobicContact CD1-SD 3.8Å; L518-R556 HydrophobicContact CD2-CG 4.13Å
519	E	90.4	Very high	89.2	Confident	45 Å²	45	55.9 Å²	55.9	21%	0.21	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-44.7	174.7	-73.2	167.2	177.9	0	0	111.8	K515 K516 L522 T523 I538	K515-E519 WeakPolarHBondContact CE-OE1 3.47Å; K515-E519 WeakPolarHBondContact CG-OE1 3.49Å; K515-E519 WeakPolarHBondContact O-CG 3.36Å; K515-E519 PolarHBondContact O-N 3.43Å; K516-E519 PolarHBondContact O-N 2.99Å; E519-L522 PolarHBondContact O-N 2.89Å; E519-T523 VanDerWaalsContact O-CB 3.26Å; E519-T523 WeakPolarHBondContact O-CB 3.47Å; E519-T523 PolarHBondContact O-N 3.33Å; E519-T523 PolarHBondContact O-OG1 3.08Å; E519-I538 HydrophobicContact CG-CG2 3.46Å; E519-I538 VanDerWaalsContact CG-CG2 3.46Å
520	A	89.7	Confident	89.6	Confident	60 Å²	60	57.4 Å²	57.4	50%	0.496	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-42.3	176.2	0	0	0	0	0	111.4	K516 T523 S524	K516-A520 VanDerWaalsContact O-CB 3.31Å; K516-A520 WeakPolarHBondContact O-CB 3.23Å; K516-A520 PolarHBondContact O-N 3.24Å; A520-T523 PolarHBondContact O-N 2.97Å; A520-S524 WeakPolarHBondContact O-CB 3.39Å; A520-S524 PolarHBondContact O-N 3.48Å; A520-S524 PolarHBondContact O-OG 3.23Å
521	F	90.2	Very high	90	Very high	55 Å²	55	53.6 Å²	53.6	24%	0.241	29%	0.286	C	S	.	.	H	α-helix	trans	-59.5	-54.1	174.8	175.6	-102.9	0	0	0	111.4	D517 L518 T523 S524 V525 I548 A551 V552 M555	D517-F521 WeakPolarHBondContact O-CB 3.26Å; D517-F521 PolarHBondContact O-N 3.38Å; L518-F521 PolarHBondContact O-N 3.21Å; F521-T523 VanDerWaalsContact C-N 3.31Å; F521-T523 PolarHBondContact O-N 3.32Å; F521-S524 PolarHBondContact O-N 2.72Å; F521-S524 PolarHBondContact O-OG 2.85Å; F521-V525 HydrophobicContact CD2-CG2 4.34Å; F521-V525 HydrophobicContact CE1-CG2 4.19Å; F521-V525 HydrophobicContact CE2-CG2 3.96Å; F521-V525 HydrophobicContact CZ-CG2 3.89Å; F521-V525 WeakPolarHBondContact O-CB 3.3Å; F521-V525 WeakPolarHBondContact O-CG2 2.99Å; F521-V525 PolarHBondContact O-N 2.83Å; F521-I548 HydrophobicContact CE1-CG2 4.08Å; F521-I548 HydrophobicContact CZ-CG2 4.36Å; F521-A551 HydrophobicContact CE1-CB 4.34Å; F521-A551 HydrophobicContact CZ-CB 4.09Å; F521-V552 HydrophobicContact CD1-CG2 4.34Å; F521-V552 HydrophobicContact CE1-CG2 3.96Å; F521-M555 HydrophobicContact CB-CE 4.5Å; F521-M555 HydrophobicContact CB-SD 4.38Å; F521-M555 HydrophobicContact CD1-CE 3.55Å; F521-M555 HydrophobicContact CD1-SD 3.96Å; F521-M555 HydrophobicContact CD2-CE 3.86Å; F521-M555 HydrophobicContact CE1-CE 3.57Å; F521-M555 HydrophobicContact CE1-SD 4.46Å; F521-M555 HydrophobicContact CE2-CE 3.88Å; F521-M555 HydrophobicContact CG-CE 3.69Å; F521-M555 HydrophobicContact CG-SD 4.12Å; F521-M555 HydrophobicContact CZ-CE 3.73Å
522	L	91.6	Very high	90	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.5	-40.1	178.6	-77.1	173.9	0	0	0	112.3	L518 E519 V525 R526 I538 L541 L544 V552	L518-L522 HydrophobicContact CD1-CD1 4.29Å; L518-L522 HydrophobicContact CD1-CG 4.33Å; L518-L522 HydrophobicContact CG-CD1 4.29Å; L518-L522 WeakPolarHBondContact O-CB 3.38Å; L518-L522 WeakPolarHBondContact O-CG 3.36Å; L518-L522 PolarHBondContact O-N 3.33Å; E519-L522 PolarHBondContact O-N 2.89Å; L522-V525 PolarHBondContact O-N 3.47Å; L522-R526 VanDerWaalsContact O-CB 3.31Å; L522-R526 WeakPolarHBondContact O-CB 3.29Å; L522-R526 WeakPolarHBondContact O-CG 3.21Å; L522-R526 PolarHBondContact O-N 2.94Å; L522-I538 HydrophobicContact CD1-CB 4.3Å; L522-L541 HydrophobicContact CD2-CD2 3.7Å; L522-L544 HydrophobicContact CD2-CD1 4.3Å; L522-V552 HydrophobicContact CD2-CG2 3.65Å; L522-V552 HydrophobicContact CG-CG2 4.39Å
523	T	91	Very high	89.8	Confident	32 Å²	32	59.4 Å²	59.4	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-61.3	-49	176.4	-64.2	0	0	0	0	111.1	E519 A520 F521 V525 R526 L527 H533	E519-T523 VanDerWaalsContact O-CB 3.26Å; E519-T523 WeakPolarHBondContact O-CB 3.47Å; E519-T523 PolarHBondContact O-N 3.33Å; E519-T523 PolarHBondContact O-OG1 3.08Å; A520-T523 PolarHBondContact O-N 2.97Å; F521-T523 VanDerWaalsContact C-N 3.31Å; F521-T523 PolarHBondContact O-N 3.32Å; T523-V525 VanDerWaalsContact C-N 3.26Å; T523-V525 PolarHBondContact O-N 3.38Å; T523-R526 PolarHBondContact O-N 3.35Å; T523-L527 HydrophobicContact CG2-CD1 3.91Å; T523-L527 WeakPolarHBondContact O-CB 2.89Å; T523-L527 VanDerWaalsContact O-CG 3.28Å; T523-L527 WeakPolarHBondContact O-CG 3.35Å; T523-L527 PolarHBondContact O-N 3.02Å; T523-H533 VanDerWaalsContact CG2-ND1 3.26Å; T523-H533 WeakPolarHBondContact CG2-ND1 3.37Å; T523-H533 PolarHBondContact OG1-CE1 3.02Å; T523-H533 PolarHBondContact OG1-ND1 3.23Å
524	S	90.7	Very high	89.5	Confident	67 Å²	67	61.5 Å²	61.5	47%	0.469	32%	0.32	S	S	.	.	H	α-helix	trans	-60.7	-38.2	179	73.8	0	0	0	0	112.3	A520 F521 K528	A520-S524 WeakPolarHBondContact O-CB 3.39Å; A520-S524 PolarHBondContact O-N 3.48Å; A520-S524 PolarHBondContact O-OG 3.23Å; F521-S524 PolarHBondContact O-N 2.72Å; F521-S524 PolarHBondContact O-OG 2.85Å; S524-K528 WeakPolarHBondContact O-CB 3.48Å; S524-K528 PolarHBondContact O-N 3.31Å; S524-K528 VanDerWaalsContact O-N 3.12Å
525	V	92	Very high	89.3	Confident	12 Å²	12	63.6 Å²	63.6	7%	0.073	34%	0.338	C	S	.	.	H	α-helix	trans	-73.8	-46.1	-179.6	160.8	0	0	0	0	111.6	F521 L522 T523 L527 K528 F529 L544 I548	F521-V525 HydrophobicContact CD2-CG2 4.34Å; F521-V525 HydrophobicContact CE1-CG2 4.19Å; F521-V525 HydrophobicContact CE2-CG2 3.96Å; F521-V525 HydrophobicContact CZ-CG2 3.89Å; F521-V525 WeakPolarHBondContact O-CB 3.3Å; F521-V525 WeakPolarHBondContact O-CG2 2.99Å; F521-V525 PolarHBondContact O-N 2.83Å; L522-V525 PolarHBondContact O-N 3.47Å; T523-V525 VanDerWaalsContact C-N 3.26Å; T523-V525 PolarHBondContact O-N 3.38Å; V525-L527 VanDerWaalsContact C-N 3.33Å; V525-L527 PolarHBondContact O-N 2.77Å; V525-K528 WeakPolarHBondContact O-CB 3.28Å; V525-K528 PolarHBondContact O-N 3.41Å; V525-F529 HydrophobicContact CG1-CD2 3.93Å; V525-F529 HydrophobicContact CG1-CE2 4.37Å; V525-F529 WeakPolarHBondContact O-CD2 3.13Å; V525-F529 PolarHBondContact O-N 2.94Å; V525-L544 HydrophobicContact CG1-CD1 3.93Å; V525-L544 HydrophobicContact CG1-CD2 3.55Å; V525-L544 HydrophobicContact CG1-CG 4.3Å; V525-I548 HydrophobicContact CB-CD1 4.37Å; V525-I548 HydrophobicContact CG1-CD1 3.28Å; V525-I548 HydrophobicContact CG1-CG1 4.41Å; V525-I548 HydrophobicContact CG1-CG2 3.76Å; V525-I548 HydrophobicContact CG2-CD1 4.2Å
526	R	92.9	Very high	88.9	Confident	7 Å²	7	67.6 Å²	67.6	3%	0.026	36%	0.362	C	S	.	.	H	α-helix	trans	-61.7	-42.3	177.3	-73.5	169.9	176.7	162.7	-3.8	111.2	L522 T523 K528 I530 G531 F532 V534 D537 S540 L544	L522-R526 VanDerWaalsContact O-CB 3.31Å; L522-R526 WeakPolarHBondContact O-CB 3.29Å; L522-R526 WeakPolarHBondContact O-CG 3.21Å; L522-R526 PolarHBondContact O-N 2.94Å; T523-R526 PolarHBondContact O-N 3.35Å; R526-K528 VanDerWaalsContact C-N 3.28Å; R526-K528 PolarHBondContact O-N 3.25Å; R526-I530 HydrophobicContact CG-CD1 4.23Å; R526-I530 CarbonylContact O-C 3.52Å; R526-I530 WeakPolarHBondContact O-CA 3.46Å; R526-I530 WeakPolarHBondContact O-CB 3.08Å; R526-I530 PolarHBondContact O-N 2.77Å; R526-G531 PolarHBondContact O-N 3Å; R526-F532 WeakPolarHBondContact CB-O 3.38Å; R526-V534 PolarHBondContact NH1-O 3.34Å; R526-D537 IonicContact CZ-OD2 2.86Å; R526-D537 PolarHBondContact NH1-O 2.94Å; R526-D537 IonicContact NH1-OD2 3.63Å; R526-D537 PolarHBondContact NH2-O 2.58Å; R526-D537 IonicContact NH2-OD1 3.71Å; R526-D537 IonicContact NH2-OD2 3.77Å; R526-D537 PolarHBondContact NH2-OD2 3.08Å; R526-S540 PolarHBondContact NH2-O 2.94Å; R526-L544 HydrophobicContact CG-CD1 4.39Å; R526-L544 HydrophobicContact CG-CD2 4.48Å
527	L	91.6	Very high	88.8	Confident	92 Å²	92	62 Å²	62	48%	0.482	34%	0.34	S	S	.	.	H	α-helix	trans	-61.2	-37.2	173	-72.8	171.1	0	0	0	112.2	T523 V525 G531 H533	T523-L527 HydrophobicContact CG2-CD1 3.91Å; T523-L527 WeakPolarHBondContact O-CB 2.89Å; T523-L527 VanDerWaalsContact O-CG 3.28Å; T523-L527 WeakPolarHBondContact O-CG 3.35Å; T523-L527 PolarHBondContact O-N 3.02Å; V525-L527 VanDerWaalsContact C-N 3.33Å; V525-L527 PolarHBondContact O-N 2.77Å; L527-G531 WeakPolarHBondContact O-CA 3.35Å; L527-G531 PolarHBondContact O-N 3.12Å; L527-H533 HydrophobicContact CD2-CB 4.46Å
528	K	92.8	Very high	88.7	Confident	163 Å²	163	61.9 Å²	61.9	71%	0.709	34%	0.338	S	S	*	.	H	α-helix	trans	-72.7	-43.3	179.6	-177.9	179.3	176.8	-177.3	0	113.7	S524 V525 R526	S524-K528 WeakPolarHBondContact O-CB 3.48Å; S524-K528 PolarHBondContact O-N 3.31Å; S524-K528 VanDerWaalsContact O-N 3.12Å; V525-K528 WeakPolarHBondContact O-CB 3.28Å; V525-K528 PolarHBondContact O-N 3.41Å; R526-K528 VanDerWaalsContact C-N 3.28Å; R526-K528 PolarHBondContact O-N 3.25Å
529	F	92.5	Very high	88.6	Confident	101 Å²	101	66.6 Å²	66.6	44%	0.443	37%	0.367	S	S	.	.	H	α-helix	trans	-99.1	-31.1	-171.3	-73	-82.2	0	0	0	113.8	V525 L544 P545 I548	V525-F529 HydrophobicContact CG1-CD2 3.93Å; V525-F529 HydrophobicContact CG1-CE2 4.37Å; V525-F529 WeakPolarHBondContact O-CD2 3.13Å; V525-F529 PolarHBondContact O-N 2.94Å; F529-L544 HydrophobicContact CB-CD2 4.03Å; F529-P545 HydrophobicContact CD1-CG 3.79Å; F529-P545 HydrophobicContact CE1-CG 3.56Å; F529-P545 HydrophobicContact CG-CG 4.41Å; F529-P545 HydrophobicContact CZ-CG 3.99Å; F529-I548 HydrophobicContact CD2-CD1 3.75Å; F529-I548 HydrophobicContact CE2-CD1 3.38Å; F529-I548 HydrophobicContact CZ-CD1 4.03Å
530	I	90.2	Very high	88.5	Confident	61 Å²	61	67.6 Å²	67.6	31%	0.313	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-26.2	-173.6	-31.4	177.3	0	0	0	111.9	R526 F532 A542 L544	R526-I530 HydrophobicContact CG-CD1 4.23Å; R526-I530 CarbonylContact O-C 3.52Å; R526-I530 WeakPolarHBondContact O-CA 3.46Å; R526-I530 WeakPolarHBondContact O-CB 3.08Å; R526-I530 PolarHBondContact O-N 2.77Å; I530-F532 HydrophobicContact CB-CD1 4.14Å; I530-F532 HydrophobicContact CB-CE1 3.88Å; I530-F532 HydrophobicContact CB-CZ 4.27Å; I530-F532 HydrophobicContact CD1-CZ 4.32Å; I530-F532 HydrophobicContact CG2-CD1 3.69Å; I530-F532 HydrophobicContact CG2-CE1 3.06Å; I530-F532 HydrophobicContact CG2-CZ 3.62Å; I530-A542 VanDerWaalsContact CD1-O 3.32Å; I530-A542 WeakPolarHBondContact CD1-O 3.45Å; I530-L544 HydrophobicContact CD1-CD2 3.76Å; I530-L544 HydrophobicContact CD1-CG 4.24Å; I530-L544 HydrophobicContact CG1-CD2 3.9Å
531	G	89.2	Confident	88.4	Confident	55 Å²	55	66.3 Å²	66.3	57%	0.567	36%	0.363	S	S	*	.	S	Bend	trans	88	3.5	174.9	0	0	0	0	0	115.6	R526 L527	R526-G531 PolarHBondContact O-N 3Å; L527-G531 WeakPolarHBondContact O-CA 3.35Å; L527-G531 PolarHBondContact O-N 3.12Å
532	F	85.8	Confident	88.3	Confident	108 Å²	108	67.7 Å²	67.7	47%	0.474	39%	0.385	S	S	.	.			trans	-126.9	155.8	177.1	60.9	-101.8	0	0	0	113.2	R526 I530 V534	R526-F532 WeakPolarHBondContact CB-O 3.38Å; I530-F532 HydrophobicContact CB-CD1 4.14Å; I530-F532 HydrophobicContact CB-CE1 3.88Å; I530-F532 HydrophobicContact CB-CZ 4.27Å; I530-F532 HydrophobicContact CD1-CZ 4.32Å; I530-F532 HydrophobicContact CG2-CD1 3.69Å; I530-F532 HydrophobicContact CG2-CE1 3.06Å; I530-F532 HydrophobicContact CG2-CZ 3.62Å; F532-V534 HydrophobicContact CD2-CG2 3.57Å; F532-V534 HydrophobicContact CE2-CG2 3.39Å
533	H	84.8	Confident	88.1	Confident	99 Å²	99	71 Å²	71	46%	0.458	42%	0.419	S	S	.	.			trans	-99.4	130.7	173.5	175.2	61	0	0	0	109.8	T523 L527	T523-H533 VanDerWaalsContact CG2-ND1 3.26Å; T523-H533 WeakPolarHBondContact CG2-ND1 3.37Å; T523-H533 PolarHBondContact OG1-CE1 3.02Å; T523-H533 PolarHBondContact OG1-ND1 3.23Å; L527-H533 HydrophobicContact CD2-CB 4.46Å
534	V	84.4	Confident	88.2	Confident	45 Å²	45	70 Å²	70	27%	0.273	41%	0.413	S	S	.	.			trans	-111.4	104.7	170.2	-171.7	0	0	0	0	107.4	R526 F532 D537	R526-V534 PolarHBondContact NH1-O 3.34Å; F532-V534 HydrophobicContact CD2-CG2 3.57Å; F532-V534 HydrophobicContact CE2-CG2 3.39Å; V534-D537 HydrophobicContact CB-CB 4.36Å; V534-D537 HydrophobicContact CG1-CB 3.64Å
535	P	82.4	Confident	88.3	Confident	80 Å²	80	69.2 Å²	69.2	52%	0.519	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	146.7	-179.8	26.3	-32	0	0	0	111.1	D537	P535-D537 PolarHBondContact O-N 2.84Å
536	N	79.4	Confident	88.4	Confident	151 Å²	151	74.1 Å²	74.1	81%	0.807	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	10.1	174.6	-58.2	-23.4	0	0	0	116.9
537	D	85.9	Confident	88.5	Confident	31 Å²	31	78.2 Å²	78.2	17%	0.166	46%	0.455	C	S	.	.			trans	-102.6	112.8	177	175.6	27.6	0	0	0	111.6	R526 V534 P535 V539 S540	R526-D537 IonicContact CZ-OD2 2.86Å; R526-D537 PolarHBondContact NH1-O 2.94Å; R526-D537 IonicContact NH1-OD2 3.63Å; R526-D537 PolarHBondContact NH2-O 2.58Å; R526-D537 IonicContact NH2-OD1 3.71Å; R526-D537 IonicContact NH2-OD2 3.77Å; R526-D537 PolarHBondContact NH2-OD2 3.08Å; V534-D537 HydrophobicContact CB-CB 4.36Å; V534-D537 HydrophobicContact CG1-CB 3.64Å; P535-D537 PolarHBondContact O-N 2.84Å; D537-V539 PolarHBondContact OD1-N 3.09Å; D537-S540 VanDerWaalsContact CG-OG 3.29Å; D537-S540 PolarHBondContact OD1-N 2.83Å; D537-S540 PolarHBondContact OD1-OG 3.23Å; D537-S540 WeakPolarHBondContact OD2-CB 3.48Å; D537-S540 PolarHBondContact OD2-N 2.97Å; D537-S540 PolarHBondContact OD2-OG 3.35Å
538	I	85.4	Confident	88.6	Confident	36 Å²	36	74.6 Å²	74.6	19%	0.185	44%	0.436	C	S	.	.	S	Bend	trans	-105.8	1.5	173.5	60.5	171	0	0	0	113.1	L518 E519 L522 R556	L518-I538 HydrophobicContact CD2-CB 4.34Å; E519-I538 HydrophobicContact CG-CG2 3.46Å; E519-I538 VanDerWaalsContact CG-CG2 3.46Å; L522-I538 HydrophobicContact CD1-CB 4.3Å; I538-R556 PolarHBondContact O-NH2 3.06Å
539	V	86.7	Confident	88.6	Confident	99 Å²	99	69.2 Å²	69.2	60%	0.6	41%	0.413	S	S	*	.	S	Bend	trans	-101.3	-48.1	-170.6	-175	0	0	0	0	111.4	D537 L541 R556	D537-V539 PolarHBondContact OD1-N 3.09Å; V539-L541 PolarHBondContact O-N 3.41Å; V539-R556 PolarHBondContact O-NH2 2.94Å
540	S	88.4	Confident	88.6	Confident	65 Å²	65	68.6 Å²	68.6	46%	0.455	41%	0.412	S	S	.	.			trans	-73.6	125.8	-170.2	-38.2	0	0	0	0	112.3	R526 D537	R526-S540 PolarHBondContact NH2-O 2.94Å; D537-S540 VanDerWaalsContact CG-OG 3.29Å; D537-S540 PolarHBondContact OD1-N 2.83Å; D537-S540 PolarHBondContact OD1-OG 3.23Å; D537-S540 WeakPolarHBondContact OD2-CB 3.48Å; D537-S540 PolarHBondContact OD2-N 2.97Å; D537-S540 PolarHBondContact OD2-OG 3.35Å
541	L	88.9	Confident	88.7	Confident	33 Å²	33	67.1 Å²	67.1	17%	0.173	41%	0.409	C	S	.	.			trans	-118	10.8	179	-57.7	176.3	0	0	0	112.9	L522 V539 G543 L544 H549 V552	L522-L541 HydrophobicContact CD2-CD2 3.7Å; V539-L541 PolarHBondContact O-N 3.41Å; L541-G543 PolarHBondContact O-N 3.47Å; L541-L544 HydrophobicContact CD2-CD1 4.1Å; L541-L544 WeakPolarHBondContact O-CB 3.44Å; L541-L544 PolarHBondContact O-N 3.02Å; L541-L544 VanDerWaalsContact O-N 3.12Å; L541-H549 HydrophobicContact CD1-CB 4.42Å; L541-H549 PolarHBondContact O-NE2 3.07Å; L541-H549 VanDerWaalsContact O-NE2 3.14Å; L541-V552 HydrophobicContact CD1-CB 4.27Å; L541-V552 HydrophobicContact CD1-CG1 4.13Å; L541-V552 HydrophobicContact CD2-CB 4.24Å; L541-V552 HydrophobicContact CD2-CG1 4.07Å; L541-V552 HydrophobicContact CD2-CG2 3.87Å
542	A	86.8	Confident	88.9	Confident	85 Å²	85	64.5 Å²	64.5	70%	0.702	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	134.3	-178.4	0	0	0	0	0	111.7	I530 L544	I530-A542 VanDerWaalsContact CD1-O 3.32Å; I530-A542 WeakPolarHBondContact CD1-O 3.45Å; A542-L544 VanDerWaalsContact C-N 3.26Å; A542-L544 PolarHBondContact O-N 2.72Å
543	G	89.2	Confident	89.2	Confident	69 Å²	69	66.6 Å²	66.6	71%	0.711	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	0.1	-179.7	0	0	0	0	0	115.3	L541	L541-G543 PolarHBondContact O-N 3.47Å
544	L	92	Very high	89.5	Confident	12 Å²	12	64.5 Å²	64.5	6%	0.063	38%	0.381	C	S	.	.			trans	-92.5	144.6	177.7	-58.8	179.6	0	0	0	111.3	L522 V525 R526 F529 I530 L541 A542 I548 H549	L522-L544 HydrophobicContact CD2-CD1 4.3Å; V525-L544 HydrophobicContact CG1-CD1 3.93Å; V525-L544 HydrophobicContact CG1-CD2 3.55Å; V525-L544 HydrophobicContact CG1-CG 4.3Å; R526-L544 HydrophobicContact CG-CD1 4.39Å; R526-L544 HydrophobicContact CG-CD2 4.48Å; F529-L544 HydrophobicContact CB-CD2 4.03Å; I530-L544 HydrophobicContact CD1-CD2 3.76Å; I530-L544 HydrophobicContact CD1-CG 4.24Å; I530-L544 HydrophobicContact CG1-CD2 3.9Å; L541-L544 HydrophobicContact CD2-CD1 4.1Å; L541-L544 WeakPolarHBondContact O-CB 3.44Å; L541-L544 PolarHBondContact O-N 3.02Å; L541-L544 VanDerWaalsContact O-N 3.12Å; A542-L544 VanDerWaalsContact C-N 3.26Å; A542-L544 PolarHBondContact O-N 2.72Å; L544-I548 HydrophobicContact CB-CB 4.37Å; L544-I548 HydrophobicContact CB-CG2 4.32Å; L544-I548 HydrophobicContact CD1-CG2 4.12Å; L544-H549 PolarHBondContact O-NE2 2.76Å; L544-H549 VanDerWaalsContact O-NE2 3.16Å
545	P	93.8	Very high	89.8	Confident	49 Å²	49	63.3 Å²	63.3	32%	0.318	37%	0.372	S	S	.	.			trans	-62.7	150.4	174.6	-24.7	32.9	0	0	0	113.6	F529 P547 I548 H549	F529-P545 HydrophobicContact CD1-CG 3.79Å; F529-P545 HydrophobicContact CE1-CG 3.56Å; F529-P545 HydrophobicContact CG-CG 4.41Å; F529-P545 HydrophobicContact CZ-CG 3.99Å; P545-P547 VanDerWaalsContact C-CD 3.46Å; P545-I548 HydrophobicContact CB-CG1 4.47Å; P545-I548 HydrophobicContact CG-CD1 4.32Å; P545-I548 WeakPolarHBondContact O-CA 3.12Å; P545-I548 VanDerWaalsContact O-CB 3.23Å; P545-I548 WeakPolarHBondContact O-CB 3.08Å; P545-I548 PolarHBondContact O-N 2.65Å; P545-H549 PolarHBondContact O-N 3.45Å
546	E	94	Very high	90.1	Very high	116 Å²	116	63.9 Å²	63.9	54%	0.542	36%	0.364	S	S	.	.	H	α-helix	trans	-54.7	-37.6	-178.6	-169.2	57.5	-151.6	0	0	115.4	I548 H549 E550	E546-I548 PolarHBondContact O-N 3.04Å; E546-I548 VanDerWaalsContact O-N 3.11Å; E546-H549 WeakPolarHBondContact O-CA 3.26Å; E546-H549 VanDerWaalsContact O-CB 3.28Å; E546-H549 WeakPolarHBondContact O-CB 3.31Å; E546-H549 PolarHBondContact O-N 3.37Å; E546-H549 IonicContact OE2-CE1 2.63Å; E546-H549 IonicContact OE2-CG 2.75Å; E546-H549 IonicContact OE2-ND1 3.09Å; E546-H549 PolarHBondContact OE2-ND1 3.22Å; E546-E550 PolarHBondContact O-N 2.98Å
547	P	94.8	Very high	90.6	Very high	92 Å²	92	64 Å²	64	60%	0.597	36%	0.36	S	S	*	.	H	α-helix	trans	-58.5	-27.1	173.9	-27.1	36.2	0	0	0	113.9	P545 A551	P545-P547 VanDerWaalsContact C-CD 3.46Å; P547-A551 WeakPolarHBondContact O-CB 3.48Å; P547-A551 PolarHBondContact O-N 2.87Å
548	I	92.4	Very high	90.8	Very high	16 Å²	16	64.6 Å²	64.6	8%	0.082	36%	0.362	C	S	.	.	H	α-helix	trans	-75.9	-37.7	175.5	-53.5	-168.2	0	0	0	109.9	F521 V525 F529 L544 P545 E546 E550 A551 V552	F521-I548 HydrophobicContact CE1-CG2 4.08Å; F521-I548 HydrophobicContact CZ-CG2 4.36Å; V525-I548 HydrophobicContact CB-CD1 4.37Å; V525-I548 HydrophobicContact CG1-CD1 3.28Å; V525-I548 HydrophobicContact CG1-CG1 4.41Å; V525-I548 HydrophobicContact CG1-CG2 3.76Å; V525-I548 HydrophobicContact CG2-CD1 4.2Å; F529-I548 HydrophobicContact CD2-CD1 3.75Å; F529-I548 HydrophobicContact CE2-CD1 3.38Å; F529-I548 HydrophobicContact CZ-CD1 4.03Å; L544-I548 HydrophobicContact CB-CB 4.37Å; L544-I548 HydrophobicContact CB-CG2 4.32Å; L544-I548 HydrophobicContact CD1-CG2 4.12Å; P545-I548 HydrophobicContact CB-CG1 4.47Å; P545-I548 HydrophobicContact CG-CD1 4.32Å; P545-I548 WeakPolarHBondContact O-CA 3.12Å; P545-I548 VanDerWaalsContact O-CB 3.23Å; P545-I548 WeakPolarHBondContact O-CB 3.08Å; P545-I548 PolarHBondContact O-N 2.65Å; E546-I548 PolarHBondContact O-N 3.04Å; E546-I548 VanDerWaalsContact O-N 3.11Å; I548-E550 VanDerWaalsContact C-N 3.3Å; I548-E550 PolarHBondContact O-N 3.37Å; I548-A551 PolarHBondContact O-N 3.07Å; I548-V552 HydrophobicContact CG2-CG2 4.26Å; I548-V552 WeakPolarHBondContact O-CB 3.35Å; I548-V552 VanDerWaalsContact O-CG2 3.25Å; I548-V552 WeakPolarHBondContact O-CG2 3.46Å; I548-V552 PolarHBondContact O-N 2.83Å
549	H	93.5	Very high	91	Very high	50 Å²	50	65.4 Å²	65.4	23%	0.231	37%	0.366	C	S	.	.	H	α-helix	trans	-59.5	-45.5	173.3	-61.8	-179	0	0	0	110.8	L541 L544 P545 E546 V552 R553	L541-H549 HydrophobicContact CD1-CB 4.42Å; L541-H549 PolarHBondContact O-NE2 3.07Å; L541-H549 VanDerWaalsContact O-NE2 3.14Å; L544-H549 PolarHBondContact O-NE2 2.76Å; L544-H549 VanDerWaalsContact O-NE2 3.16Å; P545-H549 PolarHBondContact O-N 3.45Å; E546-H549 WeakPolarHBondContact O-CA 3.26Å; E546-H549 VanDerWaalsContact O-CB 3.28Å; E546-H549 WeakPolarHBondContact O-CB 3.31Å; E546-H549 PolarHBondContact O-N 3.37Å; E546-H549 IonicContact OE2-CE1 2.63Å; E546-H549 IonicContact OE2-CG 2.75Å; E546-H549 IonicContact OE2-ND1 3.09Å; E546-H549 PolarHBondContact OE2-ND1 3.22Å; H549-V552 PolarHBondContact O-N 2.84Å; H549-R553 WeakPolarHBondContact O-CB 3.44Å; H549-R553 PolarHBondContact O-N 2.6Å
550	E	93.3	Very high	91.2	Very high	88 Å²	88	62.5 Å²	62.5	41%	0.411	35%	0.345	S	S	.	.	H	α-helix	trans	-58.4	-49.4	173.5	-177.1	179.2	-170.6	0	0	111.4	E546 I548 V552 R553 V554	E546-E550 PolarHBondContact O-N 2.98Å; I548-E550 VanDerWaalsContact C-N 3.3Å; I548-E550 PolarHBondContact O-N 3.37Å; E550-V552 PolarHBondContact O-N 3.39Å; E550-R553 WeakPolarHBondContact O-CB 3.47Å; E550-R553 PolarHBondContact O-N 3.33Å; E550-V554 WeakPolarHBondContact O-CG2 3.19Å; E550-V554 PolarHBondContact O-N 2.99Å
551	A	92	Very high	91.2	Very high	31 Å²	31	61.7 Å²	61.7	26%	0.256	34%	0.335	S	S	.	.	H	α-helix	trans	-59.7	-44.6	179.3	0	0	0	0	0	112.4	F521 P547 I548 V554 M555	F521-A551 HydrophobicContact CE1-CB 4.34Å; F521-A551 HydrophobicContact CZ-CB 4.09Å; P547-A551 WeakPolarHBondContact O-CB 3.48Å; P547-A551 PolarHBondContact O-N 2.87Å; I548-A551 PolarHBondContact O-N 3.07Å; A551-V554 PolarHBondContact O-N 2.67Å; A551-M555 HydrophobicContact CB-CE 4.14Å; A551-M555 VanDerWaalsContact O-CG 3.3Å; A551-M555 WeakPolarHBondContact O-CG 3.38Å; A551-M555 PolarHBondContact O-N 3.45Å
552	V	92.3	Very high	91.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-64.8	-41.2	177.4	172.2	0	0	0	0	110.9	L518 F521 L522 L541 I548 H549 E550 V554 M555 R556	L518-V552 HydrophobicContact CD1-CG1 4.31Å; L518-V552 HydrophobicContact CD1-CG2 4.45Å; F521-V552 HydrophobicContact CD1-CG2 4.34Å; F521-V552 HydrophobicContact CE1-CG2 3.96Å; L522-V552 HydrophobicContact CD2-CG2 3.65Å; L522-V552 HydrophobicContact CG-CG2 4.39Å; L541-V552 HydrophobicContact CD1-CB 4.27Å; L541-V552 HydrophobicContact CD1-CG1 4.13Å; L541-V552 HydrophobicContact CD2-CB 4.24Å; L541-V552 HydrophobicContact CD2-CG1 4.07Å; L541-V552 HydrophobicContact CD2-CG2 3.87Å; I548-V552 HydrophobicContact CG2-CG2 4.26Å; I548-V552 WeakPolarHBondContact O-CB 3.35Å; I548-V552 VanDerWaalsContact O-CG2 3.25Å; I548-V552 WeakPolarHBondContact O-CG2 3.46Å; I548-V552 PolarHBondContact O-N 2.83Å; H549-V552 PolarHBondContact O-N 2.84Å; E550-V552 PolarHBondContact O-N 3.39Å; V552-V554 PolarHBondContact O-N 3.47Å; V552-M555 PolarHBondContact O-N 3.28Å; V552-R556 HydrophobicContact CG1-CG 4.24Å; V552-R556 WeakPolarHBondContact O-CB 3.39Å; V552-R556 VanDerWaalsContact O-CG 3.31Å; V552-R556 WeakPolarHBondContact O-CG 3.22Å; V552-R556 PolarHBondContact O-N 3.4Å
553	R	92.5	Very high	91.6	Very high	152 Å²	152	58 Å²	58	57%	0.574	31%	0.305	S	S	*	.	H	α-helix	trans	-57.6	-48.4	175.7	-177.1	175.7	64.7	-150.6	-1.3	111.2	H549 E550 M555 R556 E557	H549-R553 WeakPolarHBondContact O-CB 3.44Å; H549-R553 PolarHBondContact O-N 2.6Å; E550-R553 WeakPolarHBondContact O-CB 3.47Å; E550-R553 PolarHBondContact O-N 3.33Å; R553-M555 PolarHBondContact O-N 3.27Å; R553-R556 PolarHBondContact O-N 2.84Å; R553-E557 PolarHBondContact O-N 3.5Å; R553-E557 VanDerWaalsContact O-N 3.07Å
554	V	91.4	Very high	91.8	Very high	54 Å²	54	55.3 Å²	55.3	33%	0.327	28%	0.278	S	S	.	.	H	α-helix	trans	-63.9	-41	177.6	175.1	0	0	0	0	111.8	E550 A551 V552 E557 H558 L831	E550-V554 WeakPolarHBondContact O-CG2 3.19Å; E550-V554 PolarHBondContact O-N 2.99Å; A551-V554 PolarHBondContact O-N 2.67Å; V552-V554 PolarHBondContact O-N 3.47Å; V554-E557 PolarHBondContact O-N 3.36Å; V554-H558 PolarHBondContact O-N 3.24Å; V554-H558 PolarHBondContact O-ND1 3.33Å; V554-L831 HydrophobicContact CG1-CD1 3.97Å
555	M	90.4	Very high	91.8	Very high	20 Å²	20	56.9 Å²	56.9	10%	0.099	29%	0.285	C	S	.	.	H	α-helix	trans	-64.6	-39	176.9	-73.9	-174.8	-139.4	0	0	112.5	V513 L518 F521 A551 V552 R553 H558 L559	V513-M555 HydrophobicContact CG1-CB 4.22Å; V513-M555 HydrophobicContact CG1-CG 4.41Å; V513-M555 HydrophobicContact CG2-CB 4.41Å; V513-M555 HydrophobicContact CG2-CG 4.37Å; L518-M555 HydrophobicContact CD1-CB 3.95Å; L518-M555 HydrophobicContact CD1-SD 3.8Å; F521-M555 HydrophobicContact CB-CE 4.5Å; F521-M555 HydrophobicContact CB-SD 4.38Å; F521-M555 HydrophobicContact CD1-CE 3.55Å; F521-M555 HydrophobicContact CD1-SD 3.96Å; F521-M555 HydrophobicContact CD2-CE 3.86Å; F521-M555 HydrophobicContact CE1-CE 3.57Å; F521-M555 HydrophobicContact CE1-SD 4.46Å; F521-M555 HydrophobicContact CE2-CE 3.88Å; F521-M555 HydrophobicContact CG-CE 3.69Å; F521-M555 HydrophobicContact CG-SD 4.12Å; F521-M555 HydrophobicContact CZ-CE 3.73Å; A551-M555 HydrophobicContact CB-CE 4.14Å; A551-M555 VanDerWaalsContact O-CG 3.3Å; A551-M555 WeakPolarHBondContact O-CG 3.38Å; A551-M555 PolarHBondContact O-N 3.45Å; V552-M555 PolarHBondContact O-N 3.28Å; R553-M555 PolarHBondContact O-N 3.27Å; M555-H558 CarbonylContact O-C 3.49Å; M555-H558 PolarHBondContact O-N 3.26Å; M555-L559 PolarHBondContact O-N 3.28Å; M555-L559 VanDerWaalsContact O-N 3.07Å
556	R	90	Very high	91.7	Very high	93 Å²	93	56.8 Å²	56.8	35%	0.351	28%	0.281	S	S	.	.	H	α-helix	trans	-65.1	-41.1	176.3	-75.6	179.9	-174.5	169.3	11.6	111.9	L518 I538 V539 V552 R553 H558 L559	L518-R556 HydrophobicContact CD2-CG 4.13Å; I538-R556 PolarHBondContact O-NH2 3.06Å; V539-R556 PolarHBondContact O-NH2 2.94Å; V552-R556 HydrophobicContact CG1-CG 4.24Å; V552-R556 WeakPolarHBondContact O-CB 3.39Å; V552-R556 VanDerWaalsContact O-CG 3.31Å; V552-R556 WeakPolarHBondContact O-CG 3.22Å; V552-R556 PolarHBondContact O-N 3.4Å; R553-R556 PolarHBondContact O-N 2.84Å; R556-H558 PolarHBondContact O-N 2.97Å; R556-L559 WeakPolarHBondContact O-CB 3.43Å; R556-L559 PolarHBondContact O-N 3.01Å; R556-L559 VanDerWaalsContact O-N 3.11Å
557	E	89.2	Confident	91.7	Very high	152 Å²	152	51.5 Å²	51.5	71%	0.71	26%	0.256	S	S	*	.	H	α-helix	trans	-59.6	-34.2	176	-171.2	-176.4	174.3	0	0	112.2	R553 V554	R553-E557 PolarHBondContact O-N 3.5Å; R553-E557 VanDerWaalsContact O-N 3.07Å; V554-E557 PolarHBondContact O-N 3.36Å
558	H	89.1	Confident	91.6	Very high	45 Å²	45	49.9 Å²	49.9	21%	0.208	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	12.6	179.3	-63.5	86.5	0	0	0	113.6	K512 V513 V554 M555 R556 Y560 L831	K512-H558 CarbonylContact C-O 3.31Å; K512-H558 WeakPolarHBondContact CA-O 3.28Å; V513-H558 HydrophobicContact CG2-CB 4.05Å; V513-H558 PolarHBondContact N-O 3.21Å; V554-H558 PolarHBondContact O-N 3.24Å; V554-H558 PolarHBondContact O-ND1 3.33Å; M555-H558 CarbonylContact O-C 3.49Å; M555-H558 PolarHBondContact O-N 3.26Å; R556-H558 PolarHBondContact O-N 2.97Å; H558-Y560 PolarHBondContact O-N 3.21Å; H558-L831 HydrophobicContact CB-CD1 4.26Å
559	L	90	Very high	91.5	Very high	53 Å²	53	53 Å²	53	28%	0.277	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-66	121.8	-178.4	-175	66.2	0	0	0	110.1	K515 M555 R556 I561	K515-L559 HydrophobicContact CB-CD1 4.39Å; M555-L559 PolarHBondContact O-N 3.28Å; M555-L559 VanDerWaalsContact O-N 3.07Å; R556-L559 WeakPolarHBondContact O-CB 3.43Å; R556-L559 PolarHBondContact O-N 3.01Å; R556-L559 VanDerWaalsContact O-N 3.11Å; L559-I561 HydrophobicContact CG-CG1 4.42Å
560	Y	90.5	Very high	91.3	Very high	38 Å²	38	55.1 Å²	55.1	15%	0.149	26%	0.262	C	S	.	.			trans	-120.7	108.8	176.1	173.9	-94.1	0	0	0	109.5	K325 V337 K512 V513 H558	K325-Y560 PolarHBondContact NZ-OH 2.94Å; V337-Y560 HydrophobicContact CG2-CE2 3.95Å; K512-Y560 HydrophobicContact CD-CD1 3.96Å; K512-Y560 HydrophobicContact CD-CD2 4.17Å; K512-Y560 HydrophobicContact CD-CG 3.76Å; K512-Y560 HydrophobicContact CG-CG 4.14Å; V513-Y560 PolarHBondContact O-N 3.24Å; H558-Y560 PolarHBondContact O-N 3.21Å
561	I	90.1	Very high	91.2	Very high	48 Å²	48	51.9 Å²	51.9	25%	0.246	25%	0.247	C	C	.	.			trans	-90.8	123.1	169.6	-56.4	170.9	0	0	0	107.9	R329 L334 L559 M566	R329-I561 PolarHBondContact NH1-O 2.8Å; L334-I561 HydrophobicContact CD2-CB 4.03Å; L334-I561 HydrophobicContact CD2-CD1 4.45Å; L334-I561 HydrophobicContact CD2-CG2 4.1Å; L559-I561 HydrophobicContact CG-CG1 4.42Å; I561-M566 HydrophobicContact CG2-CG 4.11Å; I561-M566 HydrophobicContact CG2-SD 3.96Å
562	S	91.4	Very high	91.2	Very high	29 Å²	29	53.8 Å²	53.8	20%	0.203	25%	0.253	C	S	.	.			trans	-81.8	150.5	178.4	70.8	0	0	0	0	111.5	G564 E565 M566	S562-G564 PolarHBondContact O-N 2.71Å; S562-E565 WeakPolarHBondContact CB-OE2 3.5Å; S562-E565 PolarHBondContact N-OE2 3.38Å; S562-E565 PolarHBondContact O-N 3.29Å; S562-E565 VanDerWaalsContact O-N 3.11Å; S562-E565 VanDerWaalsContact OG-CG 3.23Å; S562-E565 WeakPolarHBondContact OG-CG 3.3Å; S562-E565 PolarHBondContact OG-N 3.05Å; S562-E565 PolarHBondContact OG-OE2 3.48Å; S562-M566 PolarHBondContact O-N 3.09Å
563	L	92.3	Very high	91	Very high	10 Å²	10	58.5 Å²	58.5	5%	0.052	28%	0.275	C	S	.	.	H	α-helix	trans	-57.4	-40	175.7	-177	65	0	0	0	111.6	A328 Y332 E565 M566 Q567 L676	A328-L563 HydrophobicContact CB-CD2 3.97Å; Y332-L563 HydrophobicContact CD2-CD1 3.43Å; Y332-L563 VanDerWaalsContact CD2-CD1 3.43Å; Y332-L563 HydrophobicContact CE2-CD1 3.61Å; Y332-L563 HydrophobicContact CG-CD1 4.37Å; L563-E565 VanDerWaalsContact C-N 3.31Å; L563-E565 PolarHBondContact O-N 2.8Å; L563-M566 WeakPolarHBondContact O-CB 3.45Å; L563-M566 PolarHBondContact O-N 3.03Å; L563-Q567 WeakPolarHBondContact O-CG 3.29Å; L563-Q567 PolarHBondContact O-N 3.34Å; L563-L676 HydrophobicContact CD2-CD1 4.09Å
564	G	93.4	Very high	90.8	Very high	13 Å²	13	51.7 Å²	51.7	13%	0.134	25%	0.249	C	C	.	.	H	α-helix	trans	-65.9	-29	177.7	0	0	0	0	0	113.9	S562 Q567 I568	S562-G564 PolarHBondContact O-N 2.71Å; G564-Q567 PolarHBondContact O-N 3.12Å; G564-I568 WeakPolarHBondContact O-CD1 3.46Å; G564-I568 VanDerWaalsContact O-CG1 3.22Å; G564-I568 WeakPolarHBondContact O-CG1 3.35Å; G564-I568 PolarHBondContact O-N 3.26Å
565	E	91.5	Very high	90.4	Very high	46 Å²	46	52.3 Å²	52.3	22%	0.215	26%	0.26	C	S	.	.	H	α-helix	trans	-68.5	-40.7	173.6	-77.7	157.4	160.7	0	0	111	S562 L563 Q567 I568 E569	S562-E565 WeakPolarHBondContact CB-OE2 3.5Å; S562-E565 PolarHBondContact N-OE2 3.38Å; S562-E565 PolarHBondContact O-N 3.29Å; S562-E565 VanDerWaalsContact O-N 3.11Å; S562-E565 VanDerWaalsContact OG-CG 3.23Å; S562-E565 WeakPolarHBondContact OG-CG 3.3Å; S562-E565 PolarHBondContact OG-N 3.05Å; S562-E565 PolarHBondContact OG-OE2 3.48Å; L563-E565 VanDerWaalsContact C-N 3.31Å; L563-E565 PolarHBondContact O-N 2.8Å; E565-Q567 VanDerWaalsContact C-N 3.34Å; E565-Q567 PolarHBondContact O-N 3.16Å; E565-I568 PolarHBondContact O-N 3.16Å; E565-E569 WeakPolarHBondContact O-CB 3.4Å; E565-E569 PolarHBondContact O-N 3.27Å
566	M	91.6	Very high	90.3	Very high	46 Å²	46	58.3 Å²	58.3	23%	0.227	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-40.6	173.9	-66.1	-59	-58.7	0	0	112.2	Y332 L334 I561 S562 L563 E569 R570	Y332-M566 HydrophobicContact CD1-CB 4.07Å; Y332-M566 HydrophobicContact CD1-CE 4.18Å; Y332-M566 HydrophobicContact CE1-CB 4.35Å; Y332-M566 HydrophobicContact CG-CB 4.43Å; L334-M566 HydrophobicContact CD1-CG 3.78Å; L334-M566 HydrophobicContact CD2-CG 4.43Å; L334-M566 HydrophobicContact CD2-SD 4.42Å; L334-M566 HydrophobicContact CG-CG 4.38Å; I561-M566 HydrophobicContact CG2-CG 4.11Å; I561-M566 HydrophobicContact CG2-SD 3.96Å; S562-M566 PolarHBondContact O-N 3.09Å; L563-M566 WeakPolarHBondContact O-CB 3.45Å; L563-M566 PolarHBondContact O-N 3.03Å; M566-E569 PolarHBondContact O-N 3.25Å; M566-R570 PolarHBondContact O-N 3.37Å
567	Q	93.5	Very high	90	Very high	6 Å²	6	57.8 Å²	57.8	3%	0.028	29%	0.292	C	S	.	.	H	α-helix	trans	-63.8	-45.9	177.1	-73.4	174	-26.7	0	0	111.3	L563 G564 E565 E569 R570 E571 N677 I679	L563-Q567 WeakPolarHBondContact O-CG 3.29Å; L563-Q567 PolarHBondContact O-N 3.34Å; G564-Q567 PolarHBondContact O-N 3.12Å; E565-Q567 VanDerWaalsContact C-N 3.34Å; E565-Q567 PolarHBondContact O-N 3.16Å; Q567-E569 VanDerWaalsContact C-N 3.34Å; Q567-E569 PolarHBondContact O-N 3.23Å; Q567-R570 PolarHBondContact O-N 2.72Å; Q567-E571 VanDerWaalsContact O-CG 3.31Å; Q567-E571 WeakPolarHBondContact O-CG 3.38Å; Q567-E571 PolarHBondContact O-N 3.5Å; Q567-N677 PolarHBondContact NE2-O 3.44Å; Q567-I679 HydrophobicContact CB-CG2 3.84Å
568	I	93.2	Very high	89.4	Confident	57 Å²	57	53.2 Å²	53.2	29%	0.292	28%	0.276	S	S	.	.	H	α-helix	trans	-62	-41.9	175.9	-69.5	161.2	0	0	0	111.5	G564 E565 E571 N572 I679 Y680	G564-I568 WeakPolarHBondContact O-CD1 3.46Å; G564-I568 VanDerWaalsContact O-CG1 3.22Å; G564-I568 WeakPolarHBondContact O-CG1 3.35Å; G564-I568 PolarHBondContact O-N 3.26Å; E565-I568 PolarHBondContact O-N 3.16Å; I568-E571 PolarHBondContact O-N 2.88Å; I568-N572 PolarHBondContact O-N 3.25Å; I568-N572 PolarHBondContact O-ND2 3.14Å; I568-I679 HydrophobicContact CD1-CG1 4.49Å; I568-I679 HydrophobicContact CD1-CG2 4.27Å; I568-I679 HydrophobicContact CG1-CG2 3.8Å; I568-Y680 HydrophobicContact CG1-CE1 4.06Å
569	E	91.1	Very high	88.8	Confident	82 Å²	82	56.6 Å²	56.6	38%	0.383	30%	0.295	S	S	.	.	H	α-helix	trans	-61.8	-45.1	178.8	-168.7	162.9	-153.6	0	0	111	K515 E565 M566 Q567 E571 N572 E573	K515-E569 IonicContact NZ-OE1 3.34Å; E565-E569 WeakPolarHBondContact O-CB 3.4Å; E565-E569 PolarHBondContact O-N 3.27Å; M566-E569 PolarHBondContact O-N 3.25Å; Q567-E569 VanDerWaalsContact C-N 3.34Å; Q567-E569 PolarHBondContact O-N 3.23Å; E569-E571 PolarHBondContact O-N 2.86Å; E569-N572 WeakPolarHBondContact O-CB 3.31Å; E569-N572 PolarHBondContact O-N 2.76Å; E569-E573 WeakPolarHBondContact O-CG 3.33Å; E569-E573 PolarHBondContact O-N 3.03Å
570	R	89.5	Confident	88.2	Confident	95 Å²	95	58.7 Å²	58.7	36%	0.358	31%	0.314	S	S	.	.	H	α-helix	trans	-59.6	-44	173.6	177.2	168.2	-70.8	-164.3	-2	112.8	M566 Q567 N572 E573 I574 E584	M566-R570 PolarHBondContact O-N 3.37Å; Q567-R570 PolarHBondContact O-N 2.72Å; R570-N572 VanDerWaalsContact C-N 3.27Å; R570-N572 PolarHBondContact O-N 3.37Å; R570-E573 WeakPolarHBondContact O-CB 3.5Å; R570-E573 PolarHBondContact O-N 3.16Å; R570-E573 VanDerWaalsContact O-N 3.13Å; R570-I574 HydrophobicContact CG-CD1 4.01Å; R570-I574 HydrophobicContact CG-CG1 4.49Å; R570-I574 WeakPolarHBondContact O-CG1 3.39Å; R570-I574 PolarHBondContact O-N 2.92Å; R570-E584 IonicContact CZ-OE1 3.36Å; R570-E584 IonicContact NE-OE1 3.1Å; R570-E584 IonicContact NH1-OE1 2.71Å; R570-E584 PolarHBondContact NH1-OE1 3.43Å
571	E	91	Very high	87.3	Confident	19 Å²	19	61 Å²	61	9%	0.089	33%	0.327	C	S	.	.	H	α-helix	trans	-62.4	-36.2	177.5	-71	-63.6	147.6	0	0	112.3	Q567 I568 E569 I574 A575 H678 Y680 F862 R865	Q567-E571 VanDerWaalsContact O-CG 3.31Å; Q567-E571 WeakPolarHBondContact O-CG 3.38Å; Q567-E571 PolarHBondContact O-N 3.5Å; I568-E571 PolarHBondContact O-N 2.88Å; E569-E571 PolarHBondContact O-N 2.86Å; E571-I574 PolarHBondContact O-N 3.06Å; E571-A575 WeakPolarHBondContact O-CB 3.36Å; E571-A575 PolarHBondContact O-N 3.39Å; E571-H678 IonicContact OE1-CE1 2.72Å; E571-H678 IonicContact OE1-NE2 3.6Å; E571-Y680 HydrophobicContact CB-CE2 3.77Å; E571-Y680 HydrophobicContact CG-CD2 4.01Å; E571-Y680 HydrophobicContact CG-CE2 3.67Å; E571-F862 HydrophobicContact CG-CD2 4.48Å; E571-F862 WeakPolarHBondContact OE1-CD2 3.43Å; E571-R865 IonicContact OE1-NH2 2.8Å; E571-R865 PolarHBondContact OE1-NH2 3.08Å; E571-R865 IonicContact OE2-CZ 3.1Å; E571-R865 IonicContact OE2-NH2 3.53Å; E571-R865 PolarHBondContact OE2-NH2 3.1Å
572	N	90.6	Very high	86	Confident	72 Å²	72	62.3 Å²	62.3	39%	0.385	34%	0.337	S	S	.	.	H	α-helix	trans	-67.9	-37.2	173.9	-63.6	-30.9	0	0	0	112	I568 E569 R570 A575 Q576	I568-N572 PolarHBondContact O-N 3.25Å; I568-N572 PolarHBondContact O-ND2 3.14Å; E569-N572 WeakPolarHBondContact O-CB 3.31Å; E569-N572 PolarHBondContact O-N 2.76Å; R570-N572 VanDerWaalsContact C-N 3.27Å; R570-N572 PolarHBondContact O-N 3.37Å; N572-A575 PolarHBondContact O-N 2.93Å; N572-Q576 VanDerWaalsContact O-CG 3.3Å; N572-Q576 WeakPolarHBondContact O-CG 3.48Å; N572-Q576 PolarHBondContact O-N 3.26Å
573	E	89.7	Confident	84.6	Confident	99 Å²	99	64.4 Å²	64.4	46%	0.463	36%	0.364	S	S	.	.	H	α-helix	trans	-64.5	-41.2	175.3	-69.6	169.7	179	0	0	111.9	E569 R570 Q576 N577	E569-E573 WeakPolarHBondContact O-CG 3.33Å; E569-E573 PolarHBondContact O-N 3.03Å; R570-E573 WeakPolarHBondContact O-CB 3.5Å; R570-E573 PolarHBondContact O-N 3.16Å; R570-E573 VanDerWaalsContact O-N 3.13Å; E573-Q576 PolarHBondContact O-N 3.48Å; E573-N577 PolarHBondContact O-N 2.9Å; E573-N577 PolarHBondContact O-ND2 2.91Å
574	I	86.7	Confident	83.4	Confident	8 Å²	8	68.2 Å²	68.2	4%	0.041	38%	0.381	C	S	.	.	H	α-helix	trans	-64.4	-45.4	175.4	-64.4	166.8	0	0	0	110.2	R570 E571 Q576 N577 P578 M581	R570-I574 HydrophobicContact CG-CD1 4.01Å; R570-I574 HydrophobicContact CG-CG1 4.49Å; R570-I574 WeakPolarHBondContact O-CG1 3.39Å; R570-I574 PolarHBondContact O-N 2.92Å; E571-I574 PolarHBondContact O-N 3.06Å; I574-Q576 PolarHBondContact O-N 3.49Å; I574-N577 CarbonylContact O-C 3.51Å; I574-N577 VanDerWaalsContact O-C 3.24Å; I574-N577 PolarHBondContact O-N 2.95Å; I574-N577 VanDerWaalsContact O-N 3.13Å; I574-P578 WeakPolarHBondContact O-CA 3.48Å; I574-P578 VanDerWaalsContact O-N 3.15Å; I574-M581 HydrophobicContact CB-CB 4.44Å; I574-M581 HydrophobicContact CG1-CB 4.03Å; I574-M581 HydrophobicContact CG1-CG 4.4Å; I574-M581 HydrophobicContact CG2-CB 4.29Å
575	A	84.5	Confident	82.3	Confident	67 Å²	67	72.7 Å²	72.7	55%	0.554	41%	0.41	S	S	*	.	H	α-helix	trans	-62.1	-31.8	177.2	0	0	0	0	0	112.7	E571 N572	E571-A575 WeakPolarHBondContact O-CB 3.36Å; E571-A575 PolarHBondContact O-N 3.39Å; N572-A575 PolarHBondContact O-N 2.93Å
576	Q	86.7	Confident	81.7	Confident	147 Å²	147	73.8 Å²	73.8	69%	0.687	42%	0.417	S	S	*	.	H	α-helix	trans	-74.6	-33.6	174.2	-74.1	175.8	17.4	0	0	112.8	N572 E573 I574 P578	N572-Q576 VanDerWaalsContact O-CG 3.3Å; N572-Q576 WeakPolarHBondContact O-CG 3.48Å; N572-Q576 PolarHBondContact O-N 3.26Å; E573-Q576 PolarHBondContact O-N 3.48Å; I574-Q576 PolarHBondContact O-N 3.49Å; Q576-P578 VanDerWaalsContact C-CD 3.48Å; Q576-P578 WeakPolarHBondContact O-CD 3.38Å
577	N	85.3	Confident	81.3	Confident	82 Å²	82	75.1 Å²	75.1	44%	0.439	43%	0.429	S	S	.	.			trans	-128.3	61.3	-173.2	-54.1	-72.7	0	0	0	112.2	E573 I574 L579 S580 M581	E573-N577 PolarHBondContact O-N 2.9Å; E573-N577 PolarHBondContact O-ND2 2.91Å; I574-N577 CarbonylContact O-C 3.51Å; I574-N577 VanDerWaalsContact O-C 3.24Å; I574-N577 PolarHBondContact O-N 2.95Å; I574-N577 VanDerWaalsContact O-N 3.13Å; N577-L579 VanDerWaalsContact C-N 3.33Å; N577-L579 PolarHBondContact O-N 2.99Å; N577-S580 PolarHBondContact O-N 2.56Å; N577-M581 HydrophobicContact CB-CG 4.44Å; N577-M581 PolarHBondContact O-N 2.71Å
578	P	76	Confident	80.8	Confident	56 Å²	56	80.5 Å²	80.5	36%	0.364	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-41.6	-170.2	22.3	-33.2	0	0	0	112.3	I574 Q576 S580 M581 V582	I574-P578 WeakPolarHBondContact O-CA 3.48Å; I574-P578 VanDerWaalsContact O-N 3.15Å; Q576-P578 VanDerWaalsContact C-CD 3.48Å; Q576-P578 WeakPolarHBondContact O-CD 3.38Å; P578-S580 PolarHBondContact O-N 3.38Å; P578-M581 PolarHBondContact O-N 3.25Å; P578-V582 WeakPolarHBondContact O-CG2 3.35Å; P578-V582 PolarHBondContact O-N 2.92Å
579	L	77.2	Confident	80.6	Confident	115 Å²	115	79.9 Å²	79.9	60%	0.602	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-33.4	-176.6	-61.9	178.3	0	0	0	114	N577 F872	N577-L579 VanDerWaalsContact C-N 3.33Å; N577-L579 PolarHBondContact O-N 2.99Å; L579-F872 HydrophobicContact CD2-CE2 4.05Å; L579-F872 HydrophobicContact CD2-CZ 3.57Å
580	S	76.9	Confident	80.6	Confident	97 Å²	97	78.2 Å²	78.2	68%	0.678	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-20.9	-177.3	-61.3	0	0	0	0	112.7	N577 P578	N577-S580 PolarHBondContact O-N 2.56Å; P578-S580 PolarHBondContact O-N 3.38Å
581	M	72.2	Confident	80.8	Confident	86 Å²	86	74.2 Å²	74.2	42%	0.424	44%	0.439	S	S	.	.	S	Bend	trans	-111.2	10.4	-171.6	-60.2	-76.3	88.5	0	0	113.8	I574 N577 P578 G583	I574-M581 HydrophobicContact CB-CB 4.44Å; I574-M581 HydrophobicContact CG1-CB 4.03Å; I574-M581 HydrophobicContact CG1-CG 4.4Å; I574-M581 HydrophobicContact CG2-CB 4.29Å; N577-M581 HydrophobicContact CB-CG 4.44Å; N577-M581 PolarHBondContact O-N 2.71Å; P578-M581 PolarHBondContact O-N 3.25Å; M581-G583 PolarHBondContact O-N 3.44Å
582	V	61.9	Low	80.8	Confident	76 Å²	76	74 Å²	74	46%	0.461	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-24.7	-178	-178.1	0	0	0	0	113.7	P578 W871 F872	P578-V582 WeakPolarHBondContact O-CG2 3.35Å; P578-V582 PolarHBondContact O-N 2.92Å; V582-W871 HydrophobicContact CG1-CH2 4.43Å; V582-W871 HydrophobicContact CG1-CZ2 4.01Å; V582-W871 HydrophobicContact CG2-CH2 4.26Å; V582-F872 HydrophobicContact CG2-CE2 4.12Å
583	G	61.3	Low	80.8	Confident	74 Å²	74	72.5 Å²	72.5	76%	0.763	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	17.7	-164	0	0	0	0	0	118.2	M581 S585	M581-G583 PolarHBondContact O-N 3.44Å; G583-S585 PolarHBondContact O-N 3.24Å; G583-S585 VanDerWaalsContact O-N 3.09Å
584	E	67	Low	81	Confident	90 Å²	90	68 Å²	68	42%	0.421	41%	0.407	S	S	.	.			trans	-68.6	110.7	176.1	-78.3	-160.1	156.2	0	0	110.7	R570 I586	R570-E584 IonicContact CZ-OE1 3.36Å; R570-E584 IonicContact NE-OE1 3.1Å; R570-E584 IonicContact NH1-OE1 2.71Å; R570-E584 PolarHBondContact NH1-OE1 3.43Å; E584-I586 PolarHBondContact O-N 2.89Å
585	S	71.2	Confident	81.3	Confident	106 Å²	106	67.7 Å²	67.7	74%	0.741	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-63.9	120.8	172.4	62.6	0	0	0	0	109.7	G583	G583-S585 PolarHBondContact O-N 3.24Å; G583-S585 VanDerWaalsContact O-N 3.09Å
586	I	79.7	Confident	81.6	Confident	69 Å²	69	70.2 Å²	70.2	35%	0.354	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-63.3	122.4	175.4	-61.1	174	0	0	0	108.4	E584 N588 E592 H866	E584-I586 PolarHBondContact O-N 2.89Å; I586-N588 PolarHBondContact O-N 3.48Å; I586-E592 HydrophobicContact CG2-CG 3.49Å; I586-E592 VanDerWaalsContact CG2-CG 3.49Å; I586-E592 WeakPolarHBondContact CG2-OE1 3.47Å; I586-H866 HydrophobicContact CD1-CB 4.38Å; I586-H866 WeakPolarHBondContact CD1-O 3.35Å
587	P	81.6	Confident	81.7	Confident	75 Å²	75	64 Å²	64	49%	0.487	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-68	122.6	-177.7	27.8	-33.8	0	0	0	110	T589	P587-T589 HydrophobicContact CB-CG2 4.2Å; P587-T589 PolarHBondContact O-N 2.91Å
588	N	83.2	Confident	82	Confident	118 Å²	118	60.1 Å²	60.1	63%	0.631	35%	0.352	S	S	*	.			trans	-73.2	76.5	178.5	-173.6	5.6	0	0	0	111.3	I586 R593	I586-N588 PolarHBondContact O-N 3.48Å; N588-R593 WeakPolarHBondContact OD1-CD 3.17Å; N588-R593 WeakPolarHBondContact OD1-CG 3.48Å; N588-R593 PolarHBondContact OD1-NE 3.38Å
589	T	90.1	Very high	82.8	Confident	45 Å²	45	59.5 Å²	59.5	28%	0.276	34%	0.343	S	S	.	.			trans	-103.3	154.6	175.4	70.7	0	0	0	0	110.7	P587 V591 E592 R593	P587-T589 HydrophobicContact CB-CG2 4.2Å; P587-T589 PolarHBondContact O-N 2.91Å; T589-V591 PolarHBondContact O-N 3.49Å; T589-E592 WeakPolarHBondContact O-CB 3.32Å; T589-E592 PolarHBondContact O-N 3.28Å; T589-E592 WeakPolarHBondContact OG1-CB 3.43Å; T589-E592 PolarHBondContact OG1-N 3.42Å; T589-R593 PolarHBondContact O-N 2.99Å
590	P	90.3	Very high	83.4	Confident	46 Å²	46	58.5 Å²	58.5	30%	0.299	34%	0.343	S	S	.	.	H	α-helix	trans	-55.8	-35.1	176.1	-27.4	35.1	0	0	0	113.6	A268 L315 E592 L594	A268-P590 HydrophobicContact CB-CB 4.49Å; L315-P590 HydrophobicContact CD2-CB 4.23Å; P590-E592 VanDerWaalsContact C-N 3.34Å; P590-L594 WeakPolarHBondContact O-CB 3.45Å; P590-L594 PolarHBondContact O-N 3.44Å
591	V	93	Very high	84.1	Confident	12 Å²	12	57.1 Å²	57.1	7%	0.073	33%	0.328	C	S	.	.	H	α-helix	trans	-66.3	-38.9	177.3	-177.4	0	0	0	0	111.2	L315 T589 Y595 H673 F674 N677	L315-V591 HydrophobicContact CD2-CB 4.45Å; L315-V591 HydrophobicContact CD2-CG2 3.88Å; T589-V591 PolarHBondContact O-N 3.49Å; V591-Y595 PolarHBondContact O-N 3.12Å; V591-H673 HydrophobicContact CG1-CB 4.26Å; V591-H673 HydrophobicContact CG2-CB 4.19Å; V591-F674 HydrophobicContact CG1-CD1 3.69Å; V591-F674 HydrophobicContact CG1-CE1 3.99Å; V591-N677 HydrophobicContact CB-CB 4.39Å; V591-N677 HydrophobicContact CG1-CB 3.72Å
592	E	92.6	Very high	85.2	Confident	14 Å²	14	53 Å²	53	7%	0.065	31%	0.308	C	S	.	.	H	α-helix	trans	-71.4	-44.3	179.8	-166.5	65.1	-163.8	0	0	111.6	I586 T589 P590 L594 Y595 R596 N677 Q681 Y867	I586-E592 HydrophobicContact CG2-CG 3.49Å; I586-E592 VanDerWaalsContact CG2-CG 3.49Å; I586-E592 WeakPolarHBondContact CG2-OE1 3.47Å; T589-E592 WeakPolarHBondContact O-CB 3.32Å; T589-E592 PolarHBondContact O-N 3.28Å; T589-E592 WeakPolarHBondContact OG1-CB 3.43Å; T589-E592 PolarHBondContact OG1-N 3.42Å; P590-E592 VanDerWaalsContact C-N 3.34Å; E592-L594 VanDerWaalsContact C-N 3.29Å; E592-L594 PolarHBondContact O-N 3.06Å; E592-Y595 PolarHBondContact O-N 3.01Å; E592-R596 WeakPolarHBondContact O-CB 3.43Å; E592-R596 PolarHBondContact O-N 3.39Å; E592-N677 PolarHBondContact OE2-ND2 3.17Å; E592-Q681 PolarHBondContact OE2-NE2 3.3Å; E592-Y867 VanDerWaalsContact OE1-CE1 3.26Å; E592-Y867 WeakPolarHBondContact OE1-CE1 3.5Å; E592-Y867 PolarHBondContact OE1-OH 3.4Å
593	R	90.1	Very high	86.8	Confident	40 Å²	40	50.2 Å²	50.2	15%	0.151	29%	0.291	C	S	.	.	H	α-helix	trans	-56	-46.1	172	-67.5	-175.4	-123.2	150.9	-8.5	111.1	E265 A268 N588 T589 R596 S597	E265-R593 IonicContact OE1-CZ 2.72Å; E265-R593 IonicContact OE1-NH1 2.57Å; E265-R593 PolarHBondContact OE1-NH1 2.8Å; E265-R593 VanDerWaalsContact OE1-NH1 3.16Å; E265-R593 IonicContact OE1-NH2 3.84Å; E265-R593 PolarHBondContact OE1-NH2 2.84Å; A268-R593 VanDerWaalsContact CB-NH1 3.28Å; A268-R593 PolarHBondContact O-NH1 3.31Å; N588-R593 WeakPolarHBondContact OD1-CD 3.17Å; N588-R593 WeakPolarHBondContact OD1-CG 3.48Å; N588-R593 PolarHBondContact OD1-NE 3.38Å; T589-R593 PolarHBondContact O-N 2.99Å; R593-R596 PolarHBondContact O-N 3.24Å; R593-S597 WeakPolarHBondContact O-CB 3.41Å; R593-S597 PolarHBondContact O-N 3.03Å; R593-S597 PolarHBondContact O-OG 3.02Å
594	L	93	Very high	88.5	Confident	6 Å²	6	50.1 Å²	50.1	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-59.5	-51	176	176.6	67.7	0	0	0	111.3	T280 L311 L315 P590 E592 R596 S597 M598 L670 F674	T280-L594 HydrophobicContact CG2-CD1 4.32Å; T280-L594 WeakPolarHBondContact OG1-CD1 3.38Å; L311-L594 HydrophobicContact CD2-CD1 3.76Å; L311-L594 HydrophobicContact CD2-CD2 3.38Å; L311-L594 HydrophobicContact CD2-CG 4.22Å; L315-L594 HydrophobicContact CD1-CD2 3.69Å; L315-L594 HydrophobicContact CD2-CD2 4.16Å; L315-L594 HydrophobicContact CG-CD2 4.37Å; P590-L594 WeakPolarHBondContact O-CB 3.45Å; P590-L594 PolarHBondContact O-N 3.44Å; E592-L594 VanDerWaalsContact C-N 3.29Å; E592-L594 PolarHBondContact O-N 3.06Å; L594-R596 VanDerWaalsContact C-N 3.33Å; L594-R596 PolarHBondContact O-N 3.49Å; L594-S597 PolarHBondContact O-N 3.22Å; L594-S597 PolarHBondContact O-OG 2.8Å; L594-M598 HydrophobicContact CD1-CG 4.01Å; L594-M598 HydrophobicContact CD1-SD 3.6Å; L594-M598 HydrophobicContact CD2-SD 4.33Å; L594-M598 HydrophobicContact CG-CG 4.42Å; L594-M598 HydrophobicContact CG-SD 3.75Å; L594-M598 WeakPolarHBondContact O-CB 3.34Å; L594-M598 VanDerWaalsContact O-CG 3.31Å; L594-M598 WeakPolarHBondContact O-CG 3.5Å; L594-M598 PolarHBondContact O-N 2.82Å; L594-L670 HydrophobicContact CD2-CD2 3.92Å; L594-F674 HydrophobicContact CD2-CE1 4.21Å; L594-F674 HydrophobicContact CD2-CZ 4.09Å; L594-F674 HydrophobicContact CG-CE1 4.49Å; L594-F674 HydrophobicContact CG-CZ 4.31Å
595	Y	94.1	Very high	89.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.1	-44.4	-178	-171.9	-88.7	0	0	0	111.3	V591 E592 M598 Y599 L602 F674 Q681 Y684 N863 Y867	V591-Y595 PolarHBondContact O-N 3.12Å; E592-Y595 PolarHBondContact O-N 3.01Å; Y595-M598 PolarHBondContact O-N 2.9Å; Y595-Y599 HydrophobicContact CE1-CD2 4Å; Y595-Y599 WeakPolarHBondContact O-CA 3.39Å; Y595-Y599 VanDerWaalsContact O-CB 3.31Å; Y595-Y599 WeakPolarHBondContact O-CB 3.26Å; Y595-Y599 PolarHBondContact O-N 3.36Å; Y595-L602 HydrophobicContact CD2-CD1 4.39Å; Y595-L602 HydrophobicContact CE2-CD1 4.13Å; Y595-F674 AromaticContact CD2-CD1 3.94Å; Y595-F674 HydrophobicContact CD2-CD1 3.94Å; Y595-F674 HydrophobicContact CD2-CD2 4.24Å; Y595-F674 AromaticContact CD2-CE1 3.79Å; Y595-F674 HydrophobicContact CD2-CE1 3.79Å; Y595-F674 HydrophobicContact CD2-CE2 4.07Å; Y595-F674 HydrophobicContact CD2-CG 4.19Å; Y595-F674 AromaticContact CD2-CZ 3.85Å; Y595-F674 HydrophobicContact CD2-CZ 3.85Å; Y595-F674 HydrophobicContact CG-CE1 4.26Å; Y595-Q681 HydrophobicContact CD1-CG 4.07Å; Y595-Q681 HydrophobicContact CD2-CB 3.8Å; Y595-Q681 HydrophobicContact CD2-CG 3.78Å; Y595-Q681 HydrophobicContact CE1-CG 3.95Å; Y595-Q681 HydrophobicContact CE2-CB 3.5Å; Y595-Q681 VanDerWaalsContact CE2-CB 3.5Å; Y595-Q681 HydrophobicContact CE2-CG 3.65Å; Y595-Q681 HydrophobicContact CG-CB 4.48Å; Y595-Q681 HydrophobicContact CG-CG 3.97Å; Y595-Y684 HydrophobicContact CE2-CD1 4.44Å; Y595-Y684 WeakPolarHBondContact OH-CD1 3.14Å; Y595-N863 PolarHBondContact OH-ND2 3.26Å; Y595-N863 PolarHBondContact OH-OD1 3.26Å; Y595-Y867 HydrophobicContact CD1-CD1 4.41Å; Y595-Y867 HydrophobicContact CD1-CD2 4.41Å; Y595-Y867 AromaticContact CD1-CE1 3.68Å; Y595-Y867 HydrophobicContact CD1-CE1 3.68Å; Y595-Y867 AromaticContact CD1-CE2 3.75Å; Y595-Y867 HydrophobicContact CD1-CE2 3.75Å; Y595-Y867 AromaticContact CD1-CZ 3.32Å; Y595-Y867 WeakPolarHBondContact CD1-OH 3.4Å; Y595-Y867 AromaticContact CE1-CD2 3.93Å; Y595-Y867 HydrophobicContact CE1-CD2 3.93Å; Y595-Y867 HydrophobicContact CE1-CE1 4.14Å; Y595-Y867 AromaticContact CE1-CE2 3.32Å; Y595-Y867 HydrophobicContact CE1-CE2 3.32Å; Y595-Y867 AromaticContact CE1-CZ 3.44Å; Y595-Y867 VanDerWaalsContact CE1-CZ 3.44Å
596	R	90.9	Very high	91.2	Very high	121 Å²	121	41.4 Å²	41.4	46%	0.457	22%	0.218	S	C	.	.	H	α-helix	trans	-59	-48.4	175.8	-178.6	175	172.5	144.1	2.6	112.1	D276 E592 R593 L594 M598 Y599 Y867	D276-R596 IonicContact OD1-NE 3.42Å; D276-R596 IonicContact OD2-CZ 3.61Å; D276-R596 IonicContact OD2-NE 2.89Å; D276-R596 PolarHBondContact OD2-NE 3.41Å; D276-R596 IonicContact OD2-NH2 3.95Å; D276-R596 PolarHBondContact OD2-NH2 3.19Å; E592-R596 WeakPolarHBondContact O-CB 3.43Å; E592-R596 PolarHBondContact O-N 3.39Å; R593-R596 PolarHBondContact O-N 3.24Å; L594-R596 VanDerWaalsContact C-N 3.33Å; L594-R596 PolarHBondContact O-N 3.49Å; R596-M598 VanDerWaalsContact C-N 3.27Å; R596-M598 PolarHBondContact O-N 3.08Å; R596-Y599 PolarHBondContact O-N 2.84Å; R596-Y867 HydrophobicContact CB-CD1 4.25Å; R596-Y867 HydrophobicContact CB-CE1 4.46Å; R596-Y867 HydrophobicContact CG-CD1 4.42Å
597	S	89.1	Confident	92	Very high	17 Å²	17	41.1 Å²	41.1	12%	0.119	22%	0.217	C	C	.	.	H	α-helix	trans	-64.7	-31.7	179.1	70.5	0	0	0	0	112.8	D276 T278 R593 L594	D276-S597 WeakPolarHBondContact O-CB 3.46Å; T278-S597 PolarHBondContact OG1-OG 2.8Å; R593-S597 WeakPolarHBondContact O-CB 3.41Å; R593-S597 PolarHBondContact O-N 3.03Å; R593-S597 PolarHBondContact O-OG 3.02Å; L594-S597 PolarHBondContact O-N 3.22Å; L594-S597 PolarHBondContact O-OG 2.8Å
598	M	91.4	Very high	92.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-82.8	-28.4	178.6	-68.1	178.1	69.3	0	0	113.3	F284 L594 Y595 R596 P600 L601 L602 Y605 M606 L670 F674	F284-M598 HydrophobicContact CD1-CE 4.38Å; F284-M598 HydrophobicContact CD2-CE 3.86Å; F284-M598 HydrophobicContact CD2-CG 4.07Å; F284-M598 HydrophobicContact CD2-SD 4.01Å; F284-M598 HydrophobicContact CE1-CE 3.94Å; F284-M598 HydrophobicContact CE2-CE 3.38Å; F284-M598 HydrophobicContact CE2-CG 4.13Å; F284-M598 HydrophobicContact CE2-SD 3.45Å; F284-M598 WeakPolarHBondContact CE2-SD 3.32Å; F284-M598 HydrophobicContact CG-CE 4.37Å; F284-M598 HydrophobicContact CZ-CE 3.44Å; F284-M598 VanDerWaalsContact CZ-CE 3.44Å; F284-M598 HydrophobicContact CZ-SD 4.03Å; L594-M598 HydrophobicContact CD1-CG 4.01Å; L594-M598 HydrophobicContact CD1-SD 3.6Å; L594-M598 HydrophobicContact CD2-SD 4.33Å; L594-M598 HydrophobicContact CG-CG 4.42Å; L594-M598 HydrophobicContact CG-SD 3.75Å; L594-M598 WeakPolarHBondContact O-CB 3.34Å; L594-M598 VanDerWaalsContact O-CG 3.31Å; L594-M598 WeakPolarHBondContact O-CG 3.5Å; L594-M598 PolarHBondContact O-N 2.82Å; Y595-M598 PolarHBondContact O-N 2.9Å; R596-M598 VanDerWaalsContact C-N 3.27Å; R596-M598 PolarHBondContact O-N 3.08Å; M598-P600 VanDerWaalsContact C-CD 3.44Å; M598-L601 CarbonylContact O-C 3.56Å; M598-L601 PolarHBondContact O-N 3.37Å; M598-L602 HydrophobicContact CB-CD1 4.18Å; M598-L602 HydrophobicContact CE-CD1 4.44Å; M598-L602 WeakPolarHBondContact O-CA 3.41Å; M598-L602 WeakPolarHBondContact O-CB 3.35Å; M598-L602 PolarHBondContact O-N 3.11Å; M598-Y605 HydrophobicContact CB-CD2 4.4Å; M598-Y605 HydrophobicContact CB-CE2 4.41Å; M598-Y605 HydrophobicContact CE-CD2 4.17Å; M598-M606 HydrophobicContact CE-CE 4Å; M598-L670 HydrophobicContact CE-CD1 4.19Å; M598-L670 HydrophobicContact SD-CD2 4.32Å; M598-F674 HydrophobicContact SD-CZ 4.26Å
599	Y	91.9	Very high	93.3	Very high	42 Å²	42	32.1 Å²	32.1	17%	0.165	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-48.5	-46.8	-165.2	173.5	-110.5	0	0	0	114.5	Y595 R596 L601 L602 Y684 N863 Y867 T868	Y595-Y599 HydrophobicContact CE1-CD2 4Å; Y595-Y599 WeakPolarHBondContact O-CA 3.39Å; Y595-Y599 VanDerWaalsContact O-CB 3.31Å; Y595-Y599 WeakPolarHBondContact O-CB 3.26Å; Y595-Y599 PolarHBondContact O-N 3.36Å; R596-Y599 PolarHBondContact O-N 2.84Å; Y599-L601 VanDerWaalsContact C-N 3.28Å; Y599-L601 PolarHBondContact O-N 3Å; Y599-L602 PolarHBondContact O-N 3.37Å; Y599-Y684 AromaticContact CD2-CE1 3.95Å; Y599-Y684 HydrophobicContact CD2-CE1 3.95Å; Y599-Y684 AromaticContact CE2-CE1 3.99Å; Y599-Y684 HydrophobicContact CE2-CE1 3.99Å; Y599-Y684 AromaticContact CE2-CZ 3.84Å; Y599-N863 HydrophobicContact CE2-CB 3.66Å; Y599-Y867 HydrophobicContact CD1-CG 4.34Å; Y599-Y867 HydrophobicContact CD2-CD2 4.41Å; Y599-Y867 HydrophobicContact CE2-CD2 4.49Å; Y599-Y867 HydrophobicContact CG-CD2 4.48Å; Y599-Y867 HydrophobicContact CG-CG 4.42Å; Y599-T868 HydrophobicContact CE1-CG2 4.42Å
600	P	90	Very high	93.6	Very high	95 Å²	95	30.3 Å²	30.3	62%	0.617	15%	0.153	S	C	*	.	G	3₁₀ helix	trans	-60.7	-31.7	-178.1	-24.6	35.2	0	0	0	114.7	M598	M598-P600 VanDerWaalsContact C-CD 3.44Å
601	L	92.5	Very high	93.8	Very high	67 Å²	67	32.9 Å²	32.9	35%	0.351	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-121.2	12.1	-174.8	-68.6	176.1	0	0	0	113.2	M598 Y599 P603 Q604 Y605	M598-L601 CarbonylContact O-C 3.56Å; M598-L601 PolarHBondContact O-N 3.37Å; Y599-L601 VanDerWaalsContact C-N 3.28Å; Y599-L601 PolarHBondContact O-N 3Å; L601-P603 VanDerWaalsContact C-CD 3.47Å; L601-Q604 HydrophobicContact CD2-CG 4.4Å; L601-Q604 WeakPolarHBondContact O-CB 3.49Å; L601-Q604 PolarHBondContact O-N 3.48Å; L601-Q604 VanDerWaalsContact O-N 3.09Å; L601-Q604 PolarHBondContact O-OE1 2.99Å; L601-Q604 VanDerWaalsContact O-OE1 3.08Å; L601-Y605 HydrophobicContact CB-CD1 4.4Å; L601-Y605 HydrophobicContact CB-CD2 4.24Å; L601-Y605 HydrophobicContact CB-CE1 3.83Å; L601-Y605 HydrophobicContact CB-CE2 3.64Å; L601-Y605 VanDerWaalsContact CB-CZ 3.43Å; L601-Y605 HydrophobicContact CD1-CE1 4.32Å; L601-Y605 WeakPolarHBondContact CD1-OH 3.09Å; L601-Y605 WeakPolarHBondContact O-CD2 3.31Å; L601-Y605 VanDerWaalsContact O-CG 3.25Å; L601-Y605 PolarHBondContact O-N 3.32Å
602	L	94.7	Very high	93.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56.2	-43.5	-176	-171	141.8	0	0	0	113	Y595 M598 Y599 Q604 Y605 M606 Y684 V685 Y688	Y595-L602 HydrophobicContact CD2-CD1 4.39Å; Y595-L602 HydrophobicContact CE2-CD1 4.13Å; M598-L602 HydrophobicContact CB-CD1 4.18Å; M598-L602 HydrophobicContact CE-CD1 4.44Å; M598-L602 WeakPolarHBondContact O-CA 3.41Å; M598-L602 WeakPolarHBondContact O-CB 3.35Å; M598-L602 PolarHBondContact O-N 3.11Å; Y599-L602 PolarHBondContact O-N 3.37Å; L602-Q604 VanDerWaalsContact C-N 3.32Å; L602-Q604 PolarHBondContact O-N 3.2Å; L602-Y605 PolarHBondContact O-N 2.84Å; L602-M606 HydrophobicContact CD2-CG 4.14Å; L602-M606 WeakPolarHBondContact O-CG 3.4Å; L602-M606 PolarHBondContact O-N 3.49Å; L602-Y684 HydrophobicContact CB-CE1 4.32Å; L602-Y684 HydrophobicContact CD1-CD1 4.48Å; L602-Y684 HydrophobicContact CD2-CD1 3.76Å; L602-Y684 HydrophobicContact CD2-CE1 3.85Å; L602-Y684 HydrophobicContact CG-CE1 4.49Å; L602-V685 HydrophobicContact CD1-CG2 3.9Å; L602-V685 HydrophobicContact CD2-CB 4.47Å; L602-V685 HydrophobicContact CD2-CG2 3.88Å; L602-V685 HydrophobicContact CG-CG2 4.44Å; L602-Y688 HydrophobicContact CD2-CD2 4.31Å
603	P	95.6	Very high	94	Very high	18 Å²	18	31.9 Å²	31.9	12%	0.117	15%	0.154	C	C	.	.	H	α-helix	trans	-57.8	-44	175.7	-25.7	36.3	0	0	0	112.8	L601 M606 I607 Y688	L601-P603 VanDerWaalsContact C-CD 3.47Å; P603-M606 PolarHBondContact O-N 3.29Å; P603-I607 VanDerWaalsContact O-CG1 3.31Å; P603-I607 WeakPolarHBondContact O-CG1 3.38Å; P603-I607 PolarHBondContact O-N 2.92Å; P603-Y688 HydrophobicContact CB-CD1 3.66Å; P603-Y688 HydrophobicContact CB-CD2 4.45Å; P603-Y688 HydrophobicContact CB-CE1 3.6Å; P603-Y688 HydrophobicContact CB-CE2 4.42Å; P603-Y688 HydrophobicContact CB-CG 4.09Å; P603-Y688 HydrophobicContact CG-CD1 4Å; P603-Y688 HydrophobicContact CG-CD2 4.08Å; P603-Y688 HydrophobicContact CG-CE1 3.59Å; P603-Y688 HydrophobicContact CG-CE2 3.71Å; P603-Y688 HydrophobicContact CG-CG 4.22Å; P603-Y688 VanDerWaalsContact CG-CZ 3.42Å
604	Q	96	Very high	94.2	Very high	71 Å²	71	32.9 Å²	32.9	33%	0.332	16%	0.162	S	C	.	.	H	α-helix	trans	-67.2	-42.1	-178.7	-64	81.1	-9.1	0	0	110.6	L601 L602 M606 I607 A608	L601-Q604 HydrophobicContact CD2-CG 4.4Å; L601-Q604 WeakPolarHBondContact O-CB 3.49Å; L601-Q604 PolarHBondContact O-N 3.48Å; L601-Q604 VanDerWaalsContact O-N 3.09Å; L601-Q604 PolarHBondContact O-OE1 2.99Å; L601-Q604 VanDerWaalsContact O-OE1 3.08Å; L602-Q604 VanDerWaalsContact C-N 3.32Å; L602-Q604 PolarHBondContact O-N 3.2Å; Q604-M606 PolarHBondContact O-N 3.09Å; Q604-I607 PolarHBondContact O-N 3.43Å; Q604-A608 WeakPolarHBondContact O-CB 3.36Å; Q604-A608 PolarHBondContact O-N 3.14Å
605	Y	97.1	Very high	94.2	Very high	13 Å²	13	32.7 Å²	32.7	5%	0.051	16%	0.162	C	C	.	.	H	α-helix	trans	-60.7	-44.1	174.6	-60.1	-29.4	0	0	0	111.9	F284 H288 M598 L601 L602 I607 A608 L609	F284-Y605 HydrophobicContact CB-CD1 3.8Å; F284-Y605 HydrophobicContact CB-CD2 3.92Å; F284-Y605 HydrophobicContact CB-CE1 3.74Å; F284-Y605 HydrophobicContact CB-CE2 3.85Å; F284-Y605 HydrophobicContact CB-CG 3.89Å; F284-Y605 HydrophobicContact CD1-CD1 4.5Å; F284-Y605 HydrophobicContact CD1-CD2 4.35Å; F284-Y605 HydrophobicContact CD1-CG 4.04Å; F284-Y605 HydrophobicContact CG-CD1 4.48Å; F284-Y605 HydrophobicContact CG-CD2 4.08Å; F284-Y605 HydrophobicContact CG-CE2 4.39Å; F284-Y605 HydrophobicContact CG-CG 4.12Å; H288-Y605 HydrophobicContact CB-CD1 4.05Å; H288-Y605 HydrophobicContact CB-CE1 4.05Å; M598-Y605 HydrophobicContact CB-CD2 4.4Å; M598-Y605 HydrophobicContact CB-CE2 4.41Å; M598-Y605 HydrophobicContact CE-CD2 4.17Å; L601-Y605 HydrophobicContact CB-CD1 4.4Å; L601-Y605 HydrophobicContact CB-CD2 4.24Å; L601-Y605 HydrophobicContact CB-CE1 3.83Å; L601-Y605 HydrophobicContact CB-CE2 3.64Å; L601-Y605 VanDerWaalsContact CB-CZ 3.43Å; L601-Y605 HydrophobicContact CD1-CE1 4.32Å; L601-Y605 WeakPolarHBondContact CD1-OH 3.09Å; L601-Y605 WeakPolarHBondContact O-CD2 3.31Å; L601-Y605 VanDerWaalsContact O-CG 3.25Å; L601-Y605 PolarHBondContact O-N 3.32Å; L602-Y605 PolarHBondContact O-N 2.84Å; Y605-I607 PolarHBondContact O-N 3.23Å; Y605-A608 PolarHBondContact O-N 3.01Å; Y605-L609 WeakPolarHBondContact O-CG 3.36Å; Y605-L609 PolarHBondContact O-N 3.04Å
606	M	97.7	Very high	94.1	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-63.4	-42.3	177.5	-67.6	-51.3	102.7	0	0	111.8	M598 L602 P603 Q604 L609 L610 L667 L670 V685 L689	M598-M606 HydrophobicContact CE-CE 4Å; L602-M606 HydrophobicContact CD2-CG 4.14Å; L602-M606 WeakPolarHBondContact O-CG 3.4Å; L602-M606 PolarHBondContact O-N 3.49Å; P603-M606 PolarHBondContact O-N 3.29Å; Q604-M606 PolarHBondContact O-N 3.09Å; M606-L609 HydrophobicContact CE-CD1 3.94Å; M606-L609 HydrophobicContact SD-CD1 4.45Å; M606-L610 VanDerWaalsContact O-CG 3.28Å; M606-L610 WeakPolarHBondContact O-CG 2.94Å; M606-L610 PolarHBondContact O-N 2.95Å; M606-L667 HydrophobicContact SD-CD2 4Å; M606-L670 HydrophobicContact CE-CD1 3.83Å; M606-V685 HydrophobicContact CG-CG1 4.2Å; M606-V685 HydrophobicContact SD-CG1 3.65Å; M606-L689 HydrophobicContact CB-CD2 4.07Å; M606-L689 HydrophobicContact CG-CD2 4.31Å; M606-L689 HydrophobicContact SD-CD2 4.02Å; M606-L689 HydrophobicContact SD-CG 4.36Å
607	I	96.1	Very high	94.1	Very high	63 Å²	63	27 Å²	27	32%	0.323	14%	0.141	S	C	.	.	H	α-helix	trans	-64.3	-44	176.4	-67.9	163.6	0	0	0	110.9	P603 Q604 Y605 L610 K611 A692	P603-I607 VanDerWaalsContact O-CG1 3.31Å; P603-I607 WeakPolarHBondContact O-CG1 3.38Å; P603-I607 PolarHBondContact O-N 2.92Å; Q604-I607 PolarHBondContact O-N 3.43Å; Y605-I607 PolarHBondContact O-N 3.23Å; I607-L610 PolarHBondContact O-N 3.01Å; I607-K611 HydrophobicContact CG2-CD 4.22Å; I607-K611 HydrophobicContact CG2-CG 4.33Å; I607-K611 WeakPolarHBondContact O-CG 3.4Å; I607-K611 PolarHBondContact O-N 3.18Å; I607-A692 HydrophobicContact CG1-CB 3.7Å
608	A	95.8	Very high	94	Very high	3 Å²	3	29.1 Å²	29.1	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-60.5	-47.7	179.9	0	0	0	0	0	111.6	I287 C291 Q604 Y605 L610 K611 I612	I287-A608 HydrophobicContact CG2-CB 3.86Å; C291-A608 HydrophobicContact CB-CB 3.87Å; C291-A608 PolarHBondContact SG-O 3.45Å; Q604-A608 WeakPolarHBondContact O-CB 3.36Å; Q604-A608 PolarHBondContact O-N 3.14Å; Y605-A608 PolarHBondContact O-N 3.01Å; A608-L610 VanDerWaalsContact C-N 3.31Å; A608-L610 PolarHBondContact O-N 3.33Å; A608-K611 WeakPolarHBondContact O-CB 3.22Å; A608-K611 PolarHBondContact O-N 3.39Å; A608-K611 VanDerWaalsContact O-N 3.17Å; A608-I612 WeakPolarHBondContact O-CG1 3.25Å; A608-I612 PolarHBondContact O-N 3.48Å
609	L	97.5	Very high	93.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.9	-43.2	174.7	-70.5	171.8	0	0	0	112.5	F284 I287 L304 Y605 M606 I612 L613 I663 L666 L667	F284-L609 HydrophobicContact CE1-CD1 4.16Å; I287-L609 HydrophobicContact CD1-CD2 4.24Å; I287-L609 HydrophobicContact CG2-CD2 4.4Å; L304-L609 HydrophobicContact CD2-CD2 3.86Å; Y605-L609 WeakPolarHBondContact O-CG 3.36Å; Y605-L609 PolarHBondContact O-N 3.04Å; M606-L609 HydrophobicContact CE-CD1 3.94Å; M606-L609 HydrophobicContact SD-CD1 4.45Å; L609-I612 PolarHBondContact O-N 3.22Å; L609-L613 WeakPolarHBondContact O-CB 3.22Å; L609-L613 PolarHBondContact O-N 3.35Å; L609-I663 HydrophobicContact CB-CG2 4.3Å; L609-I663 HydrophobicContact CD2-CG1 4.47Å; L609-L666 HydrophobicContact CD1-CD2 3.49Å; L609-L666 VanDerWaalsContact CD1-CD2 3.49Å; L609-L666 HydrophobicContact CD2-CD1 4.28Å; L609-L666 HydrophobicContact CD2-CD2 4.24Å; L609-L667 HydrophobicContact CD1-CD2 3.71Å; L609-L667 HydrophobicContact CD1-CG 4.43Å
610	L	96.7	Very high	93	Very high	8 Å²	8	29.8 Å²	29.8	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-70.4	-33.2	179.4	-66	174.3	0	0	0	112.7	M606 I607 A608 L613 L614 L667 L689 A692 C694 L697	M606-L610 VanDerWaalsContact O-CG 3.28Å; M606-L610 WeakPolarHBondContact O-CG 2.94Å; M606-L610 PolarHBondContact O-N 2.95Å; I607-L610 PolarHBondContact O-N 3.01Å; A608-L610 VanDerWaalsContact C-N 3.31Å; A608-L610 PolarHBondContact O-N 3.33Å; L610-L613 HydrophobicContact CD2-CD2 4.32Å; L610-L613 PolarHBondContact O-N 3.45Å; L610-L614 WeakPolarHBondContact O-CB 3.3Å; L610-L614 PolarHBondContact O-N 3.33Å; L610-L667 HydrophobicContact CD2-CD1 4.14Å; L610-L689 HydrophobicContact CD1-CD2 3.82Å; L610-L689 HydrophobicContact CD2-CD2 4.2Å; L610-L689 HydrophobicContact CG-CD2 4.11Å; L610-A692 HydrophobicContact CD1-CB 3.58Å; L610-C694 HydrophobicContact CD1-CB 3.84Å; L610-C694 HydrophobicContact CD2-CB 3.95Å; L610-L697 HydrophobicContact CB-CD2 4.17Å; L610-L697 HydrophobicContact CD2-CD2 3.98Å
611	K	94.3	Very high	91.8	Very high	100 Å²	100	35.5 Å²	35.5	44%	0.435	17%	0.173	S	C	.	.	H	α-helix	trans	-62.9	-45.9	172.7	-79	-179.3	173.3	-176.6	0	111.2	I607 A608 L614 A615 I627	I607-K611 HydrophobicContact CG2-CD 4.22Å; I607-K611 HydrophobicContact CG2-CG 4.33Å; I607-K611 WeakPolarHBondContact O-CG 3.4Å; I607-K611 PolarHBondContact O-N 3.18Å; A608-K611 WeakPolarHBondContact O-CB 3.22Å; A608-K611 PolarHBondContact O-N 3.39Å; A608-K611 VanDerWaalsContact O-N 3.17Å; K611-L614 PolarHBondContact O-N 3.41Å; K611-A615 PolarHBondContact O-N 3.01Å; K611-I627 HydrophobicContact CB-CD1 3.72Å; K611-I627 HydrophobicContact CD-CD1 4.19Å; K611-I627 HydrophobicContact CG-CD1 4.43Å
612	I	94.7	Very high	90	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.9	-42.9	175.6	-58.2	177.3	0	0	0	110.4	I287 F290 C291 M300 L304 A608 L609 L614 A615 A616 I629 I659 I663	I287-I612 HydrophobicContact CG2-CD1 3.82Å; F290-I612 HydrophobicContact CD1-CD1 4.33Å; C291-I612 WeakPolarHBondContact SG-CG1 3.39Å; M300-I612 HydrophobicContact CG-CD1 4.28Å; M300-I612 HydrophobicContact SD-CD1 3.91Å; L304-I612 HydrophobicContact CD1-CD1 4.44Å; L304-I612 HydrophobicContact CD1-CG2 4.1Å; A608-I612 WeakPolarHBondContact O-CG1 3.25Å; A608-I612 PolarHBondContact O-N 3.48Å; L609-I612 PolarHBondContact O-N 3.22Å; I612-L614 VanDerWaalsContact C-N 3.27Å; I612-L614 PolarHBondContact O-N 3.02Å; I612-A615 PolarHBondContact O-N 3.33Å; I612-A615 VanDerWaalsContact O-N 3.11Å; I612-A616 WeakPolarHBondContact O-CB 3.35Å; I612-A616 PolarHBondContact O-N 3.03Å; I612-I629 HydrophobicContact CG2-CG2 4.12Å; I612-I659 HydrophobicContact CG2-CG2 3.68Å; I612-I663 HydrophobicContact CB-CD1 3.78Å; I612-I663 HydrophobicContact CG2-CD1 3.62Å
613	L	95.6	Very high	88	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-59.3	-39	176.6	-177	60.9	0	0	0	112.3	L609 L610 A616 S617 V660 I663 L697 L755	L609-L613 WeakPolarHBondContact O-CB 3.22Å; L609-L613 PolarHBondContact O-N 3.35Å; L610-L613 HydrophobicContact CD2-CD2 4.32Å; L610-L613 PolarHBondContact O-N 3.45Å; L613-A616 PolarHBondContact O-N 3.17Å; L613-S617 PolarHBondContact O-N 3.36Å; L613-V660 HydrophobicContact CD1-CB 4.4Å; L613-V660 HydrophobicContact CD1-CG1 4.08Å; L613-V660 HydrophobicContact CD1-CG2 4.16Å; L613-I663 HydrophobicContact CB-CD1 4.14Å; L613-I663 HydrophobicContact CB-CG2 4.13Å; L613-I663 HydrophobicContact CD1-CG2 4.44Å; L613-I663 HydrophobicContact CD2-CG2 4.36Å; L613-L697 HydrophobicContact CB-CD2 4.25Å; L613-L697 HydrophobicContact CD2-CD2 3.92Å; L613-L697 HydrophobicContact CG-CD2 4.14Å; L613-L755 HydrophobicContact CD2-CD2 4.12Å
614	L	94.2	Very high	86.1	Confident	61 Å²	61	47.7 Å²	47.7	32%	0.319	24%	0.235	S	C	.	.	H	α-helix	trans	-65.1	-44	174.4	174.9	62.4	0	0	0	111.5	L610 K611 I612 A616 S617 S620 L697	L610-L614 WeakPolarHBondContact O-CB 3.3Å; L610-L614 PolarHBondContact O-N 3.33Å; K611-L614 PolarHBondContact O-N 3.41Å; I612-L614 VanDerWaalsContact C-N 3.27Å; I612-L614 PolarHBondContact O-N 3.02Å; L614-A616 VanDerWaalsContact C-N 3.32Å; L614-S617 WeakPolarHBondContact O-CB 3.35Å; L614-S617 PolarHBondContact O-N 3.48Å; L614-S620 VanDerWaalsContact O-CB 3.28Å; L614-S620 WeakPolarHBondContact O-CB 3.5Å; L614-L697 HydrophobicContact CB-CD1 3.8Å; L614-L697 HydrophobicContact CB-CD2 4.43Å; L614-L697 HydrophobicContact CD1-CD1 3.63Å; L614-L697 HydrophobicContact CG-CD1 4.27Å
615	A	91.9	Very high	84.1	Confident	3 Å²	3	52 Å²	52	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-66.1	-33.2	177.7	0	0	0	0	0	112.7	K611 I612 S620 I629 R656	K611-A615 PolarHBondContact O-N 3.01Å; I612-A615 PolarHBondContact O-N 3.33Å; I612-A615 VanDerWaalsContact O-N 3.11Å; A615-S620 PolarHBondContact O-OG 3.45Å; A615-I629 HydrophobicContact CB-CD1 4.33Å; A615-I629 HydrophobicContact CB-CG2 4.04Å; A615-R656 PolarHBondContact O-NH1 2.97Å
616	A	92.9	Very high	82.5	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.008	29%	0.289	C	S	.	.	H	α-helix	trans	-82.9	-16.2	177.7	0	0	0	0	0	113.5	I612 L613 L614 I629 I659 V660	I612-A616 WeakPolarHBondContact O-CB 3.35Å; I612-A616 PolarHBondContact O-N 3.03Å; L613-A616 PolarHBondContact O-N 3.17Å; L614-A616 VanDerWaalsContact C-N 3.32Å; A616-I629 HydrophobicContact CB-CD1 3.79Å; A616-I659 HydrophobicContact CB-CB 4.09Å; A616-I659 HydrophobicContact CB-CG2 3.57Å; A616-V660 HydrophobicContact CB-CG2 3.82Å
617	S	90.7	Very high	81.5	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.007	29%	0.293	C	S	.	.	S	Bend	trans	-58.2	134	-179.4	-177.4	0	0	0	0	111.3	L613 L614 T619 S620	L613-S617 PolarHBondContact O-N 3.36Å; L614-S617 WeakPolarHBondContact O-CB 3.35Å; L614-S617 PolarHBondContact O-N 3.48Å; S617-T619 PolarHBondContact O-N 3.29Å; S617-T619 PolarHBondContact OG-N 3.49Å; S617-T619 PolarHBondContact OG-OG1 3.16Å; S617-S620 VanDerWaalsContact O-CB 3.32Å; S617-S620 WeakPolarHBondContact O-CB 3.12Å; S617-S620 PolarHBondContact O-N 3.23Å; S617-S620 PolarHBondContact O-OG 3.08Å
618	P	85.8	Confident	80.7	Confident	60 Å²	60	58.9 Å²	58.9	39%	0.39	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.5	176.8	25.3	-36.2	0	0	0	113.3	F701 Q704 Y709	P618-F701 HydrophobicContact CG-CE2 4.36Å; P618-Q704 VanDerWaalsContact CG-NE2 3.29Å; P618-Y709 HydrophobicContact CB-CD2 4.46Å; P618-Y709 HydrophobicContact CB-CE2 4.39Å; P618-Y709 HydrophobicContact CG-CD2 4.06Å; P618-Y709 HydrophobicContact CG-CE2 3.87Å
619	T	82.7	Confident	80.1	Confident	38 Å²	38	59.1 Å²	59.1	23%	0.233	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-6.6	176.8	67.1	0	0	0	0	113.9	S617 R621 Q704	S617-T619 PolarHBondContact O-N 3.29Å; S617-T619 PolarHBondContact OG-N 3.49Å; S617-T619 PolarHBondContact OG-OG1 3.16Å; T619-R621 PolarHBondContact O-N 3.49Å; T619-Q704 HydrophobicContact CG2-CB 3.98Å; T619-Q704 HydrophobicContact CG2-CG 4.41Å
620	S	79.6	Confident	79.3	Confident	18 Å²	18	60.5 Å²	60.5	13%	0.126	31%	0.31	C	S	.	.	S	Bend	trans	-72.2	128.5	176.2	67.7	0	0	0	0	109.3	L614 A615 S617	L614-S620 VanDerWaalsContact O-CB 3.28Å; L614-S620 WeakPolarHBondContact O-CB 3.5Å; A615-S620 PolarHBondContact O-OG 3.45Å; S617-S620 VanDerWaalsContact O-CB 3.32Å; S617-S620 WeakPolarHBondContact O-CB 3.12Å; S617-S620 PolarHBondContact O-N 3.23Å; S617-S620 PolarHBondContact O-OG 3.08Å
621	R	65.6	Low	78.2	Confident	216 Å²	216	60.6 Å²	60.6	82%	0.815	31%	0.312	S	S	*	.			trans	-73.7	137.1	166.5	-65.8	-177.3	178.8	-176.9	-1.8	106	T619 K623 T624	T619-R621 PolarHBondContact O-N 3.49Å; R621-K623 PolarHBondContact O-N 3.47Å; R621-T624 PolarHBondContact O-N 3.25Å
622	T	55.8	Low	77.3	Confident	125 Å²	125	56.3 Å²	56.3	77%	0.767	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.8	-12.7	179.2	43.7	0	0	0	0	115.5	T624	T622-T624 VanDerWaalsContact C-N 3.28Å; T622-T624 PolarHBondContact O-N 3.36Å
623	K	50.7	Low	76.1	Confident	168 Å²	168	56.4 Å²	56.4	73%	0.73	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	22.6	174.5	-55.1	-166	176.8	-165.7	0	115.8	R621 E625	R621-K623 PolarHBondContact O-N 3.47Å; K623-E625 PolarHBondContact O-N 2.87Å
624	T	57	Low	74.8	Confident	47 Å²	47	59.1 Å²	59.1	29%	0.288	31%	0.311	S	S	.	.			trans	-73.6	70.6	162	48.6	0	0	0	0	108.1	R621 T622 S626 I627	R621-T624 PolarHBondContact O-N 3.25Å; T622-T624 VanDerWaalsContact C-N 3.28Å; T622-T624 PolarHBondContact O-N 3.36Å; T624-S626 PolarHBondContact O-N 3.31Å; T624-I627 PolarHBondContact O-N 2.92Å
625	E	52.9	Low	73.5	Confident	163 Å²	163	58.4 Å²	58.4	76%	0.762	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-19.1	-169.5	-74.1	172.4	-174.8	0	0	114	K623	K623-E625 PolarHBondContact O-N 2.87Å
626	S	65	Low	72	Confident	108 Å²	108	66.1 Å²	66.1	76%	0.755	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-22.1	-176.4	55.7	0	0	0	0	115	T624	T624-S626 PolarHBondContact O-N 3.31Å
627	I	76.2	Confident	70.5	Confident	15 Å²	15	71.4 Å²	71.4	8%	0.077	38%	0.378	C	S	.	.			trans	-138.9	107.5	-173.3	-54.6	179	0	0	0	110.4	F290 K611 T624 I629	F290-I627 HydrophobicContact CD1-CG2 4.29Å; F290-I627 HydrophobicContact CE1-CG2 3.37Å; F290-I627 HydrophobicContact CZ-CG2 3.91Å; K611-I627 HydrophobicContact CB-CD1 3.72Å; K611-I627 HydrophobicContact CD-CD1 4.19Å; K611-I627 HydrophobicContact CG-CD1 4.43Å; T624-I627 PolarHBondContact O-N 2.92Å; I627-I629 HydrophobicContact CG2-CG2 3.9Å; I627-I629 PolarHBondContact O-N 3.4Å
628	N	79.4	Confident	69.4	Low	98 Å²	98	78.9 Å²	78.9	52%	0.524	41%	0.414	S	S	.	.			trans	-93.9	89.1	175.2	-172.6	6.4	0	0	0	110.9	L630 A631	N628-L630 PolarHBondContact O-N 3.01Å; N628-L630 PolarHBondContact OD1-N 3.35Å; N628-L630 VanDerWaalsContact OD1-N 3.11Å; N628-A631 HydrophobicContact CB-CB 4.5Å; N628-A631 PolarHBondContact OD1-N 3.03Å
629	I	82.8	Confident	68.3	Low	8 Å²	8	77.9 Å²	77.9	4%	0.041	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-16.2	175.6	63.2	173.7	0	0	0	113.2	F290 I612 A615 A616 I627 H655 R656 I659	F290-I629 HydrophobicContact CE1-CG2 4.41Å; I612-I629 HydrophobicContact CG2-CG2 4.12Å; A615-I629 HydrophobicContact CB-CD1 4.33Å; A615-I629 HydrophobicContact CB-CG2 4.04Å; A616-I629 HydrophobicContact CB-CD1 3.79Å; I627-I629 HydrophobicContact CG2-CG2 3.9Å; I627-I629 PolarHBondContact O-N 3.4Å; I629-H655 PolarHBondContact O-NE2 3.07Å; I629-H655 VanDerWaalsContact O-NE2 3.12Å; I629-R656 HydrophobicContact CD1-CG 4.33Å; I629-I659 HydrophobicContact CB-CD1 4.26Å; I629-I659 HydrophobicContact CD1-CD1 4.31Å
630	L	80	Confident	67.5	Low	28 Å²	28	82.1 Å²	82.1	15%	0.147	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	3.6	-176.7	-62	-178.5	0	0	0	113.1	N628 E632 M633 T634 R656	N628-L630 PolarHBondContact O-N 3.01Å; N628-L630 PolarHBondContact OD1-N 3.35Å; N628-L630 VanDerWaalsContact OD1-N 3.11Å; L630-E632 PolarHBondContact O-N 3.49Å; L630-M633 HydrophobicContact CD2-SD 4.11Å; L630-M633 PolarHBondContact O-N 2.98Å; L630-T634 PolarHBondContact O-N 3.32Å; L630-R656 VanDerWaalsContact CD1-NH2 3.3Å
631	A	74.5	Confident	67.2	Low	10 Å²	10	85.8 Å²	85.8	8%	0.083	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-59.1	-29.2	179.4	0	0	0	0	0	112.6	N628 M633 T634	N628-A631 HydrophobicContact CB-CB 4.5Å; N628-A631 PolarHBondContact OD1-N 3.03Å; A631-M633 PolarHBondContact O-N 3.13Å; A631-T634 PolarHBondContact O-OG1 3.37Å
632	E	75.3	Confident	67.7	Low	10 Å²	10	78 Å²	78	5%	0.047	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-76.6	-0.3	175.8	65.6	168.3	-131.1	0	0	114.4	M200 P299 M300 K301 L630 H655	M200-E632 WeakPolarHBondContact CG-O 3.28Å; P299-E632 VanDerWaalsContact C-OE2 3.26Å; P299-E632 VanDerWaalsContact CA-OE2 3.24Å; P299-E632 WeakPolarHBondContact CA-OE2 3.44Å; P299-E632 WeakPolarHBondContact CB-OE2 3.21Å; M300-E632 PolarHBondContact N-OE2 3.36Å; K301-E632 WeakPolarHBondContact CB-OE1 3.23Å; K301-E632 VanDerWaalsContact CE-OE1 3.28Å; K301-E632 WeakPolarHBondContact CE-OE1 2.91Å; K301-E632 PolarHBondContact N-OE2 2.86Å; L630-E632 PolarHBondContact O-N 3.49Å; E632-H655 VanDerWaalsContact CD-CE1 3.48Å; E632-H655 IonicContact OE1-CE1 2.82Å; E632-H655 PolarHBondContact OE1-CE1 3.45Å; E632-H655 IonicContact OE1-ND1 2.96Å; E632-H655 PolarHBondContact OE1-ND1 3.49Å
633	M	69.1	Low	68.7	Low	2 Å²	2	74.8 Å²	74.8	1%	0.01	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-117.3	-8.4	179	-55.8	-168.7	73.5	0	0	113.4	L630 A631 P635 D651 H655	L630-M633 HydrophobicContact CD2-SD 4.11Å; L630-M633 PolarHBondContact O-N 2.98Å; A631-M633 PolarHBondContact O-N 3.13Å; M633-P635 WeakPolarHBondContact O-CD 3.41Å; M633-D651 VanDerWaalsContact CE-C 3.44Å; M633-D651 HydrophobicContact CE-CB 3.5Å; M633-D651 WeakPolarHBondContact CE-O 3.43Å; M633-D651 WeakPolarHBondContact CE-OD2 3.42Å; M633-H655 HydrophobicContact CE-CB 4.1Å; M633-H655 HydrophobicContact SD-CB 3.28Å; M633-H655 WeakPolarHBondContact SD-CB 3.31Å
634	T	69.2	Low	70.1	Confident	62 Å²	62	70.9 Å²	70.9	38%	0.38	40%	0.404	S	S	.	.			trans	-69.5	111.9	-178.5	42.7	0	0	0	0	110	L630 A631	L630-T634 PolarHBondContact O-N 3.32Å; A631-T634 PolarHBondContact O-OG1 3.37Å
635	P	66.2	Low	71.3	Confident	45 Å²	45	74.9 Å²	74.9	29%	0.292	42%	0.419	S	S	.	.			trans	-68.4	156.9	179.8	29.5	-34.2	0	0	0	111.2	M633 T637 L648	M633-P635 WeakPolarHBondContact O-CD 3.41Å; P635-T637 VanDerWaalsContact C-N 3.3Å; P635-T637 WeakPolarHBondContact CG-O 3.38Å; P635-T637 PolarHBondContact O-N 3.01Å; P635-L648 HydrophobicContact CG-CD2 4.33Å
636	E	60.6	Low	72.8	Confident	165 Å²	165	70.7 Å²	70.7	77%	0.771	41%	0.405	S	S	*	.	S	Bend	trans	-63.3	-37.8	178.9	-64.1	-170.9	166.7	0	0	112.1
637	T	61.6	Low	73.7	Confident	113 Å²	113	67.2 Å²	67.2	69%	0.693	38%	0.377	S	S	*	.	S	Bend	trans	-111.4	131	175.9	51.3	0	0	0	0	109.4	P635	P635-T637 VanDerWaalsContact C-N 3.3Å; P635-T637 WeakPolarHBondContact CG-O 3.38Å; P635-T637 PolarHBondContact O-N 3.01Å
638	M	67.7	Low	74.2	Confident	157 Å²	157	68.2 Å²	68.2	77%	0.773	38%	0.383	S	S	*	.			trans	-59.8	137.5	171.9	-65.4	-64.4	-76.4	0	0	109	T640	M638-T640 PolarHBondContact O-N 3.18Å
639	P	62.5	Low	74.5	Confident	40 Å²	40	67.2 Å²	67.2	26%	0.26	38%	0.377	S	S	.	.			trans	-56	128.1	-178.5	21.1	-31.4	0	0	0	109.9	E644 E645 L648	P639-E644 WeakPolarHBondContact CA-OE2 3.23Å; P639-E644 HydrophobicContact CB-CB 3.54Å; P639-E645 HydrophobicContact CG-CB 4.41Å; P639-L648 HydrophobicContact CG-CD2 4.21Å
640	T	66	Low	74.7	Confident	126 Å²	126	67.7 Å²	67.7	77%	0.773	38%	0.382	S	S	*	.			trans	-89.2	-28.2	179.5	30.5	0	0	0	0	111.9	M638 E644	M638-T640 PolarHBondContact O-N 3.18Å; T640-E644 PolarHBondContact N-OE2 3.43Å; T640-E644 VanDerWaalsContact N-OE2 3.15Å
641	D	73	Confident	75.2	Confident	96 Å²	96	66.4 Å²	66.4	51%	0.513	38%	0.375	S	S	.	.	S	Bend	trans	-105.7	143.1	-175.6	-68.3	-15	0	0	0	111.2	T643 E644 E645	D641-T643 PolarHBondContact O-N 3.31Å; D641-T643 VanDerWaalsContact O-N 3.16Å; D641-E644 HydrophobicContact CB-CG 4.28Å; D641-E644 PolarHBondContact O-N 3.38Å; D641-E644 VanDerWaalsContact O-N 3.12Å; D641-E645 PolarHBondContact O-N 3.44Å
642	G	77.1	Confident	75.9	Confident	52 Å²	52	67.6 Å²	67.6	54%	0.536	38%	0.38	S	S	.	.	H	α-helix	trans	-61.9	-24.5	-179.7	0	0	0	0	0	113.6	T646	G642-T646 WeakPolarHBondContact O-CG2 3.12Å; G642-T646 PolarHBondContact O-N 2.92Å
643	T	76.7	Confident	76.6	Confident	57 Å²	57	71.2 Å²	71.2	35%	0.35	40%	0.395	S	S	.	.	H	α-helix	trans	-67.5	-47.1	173.5	46	0	0	0	0	111.5	D641 E645 T646 I647 I734	D641-T643 PolarHBondContact O-N 3.31Å; D641-T643 VanDerWaalsContact O-N 3.16Å; T643-E645 VanDerWaalsContact C-N 3.28Å; T643-E645 PolarHBondContact O-N 2.88Å; T643-T646 PolarHBondContact O-N 3.36Å; T643-T646 VanDerWaalsContact O-N 3.16Å; T643-T646 PolarHBondContact O-OG1 3.46Å; T643-I647 WeakPolarHBondContact O-CG1 3.36Å; T643-I647 PolarHBondContact O-N 3.02Å; T643-I734 HydrophobicContact CG2-CD1 4.15Å; T643-I734 HydrophobicContact CG2-CG1 3.99Å
644	E	79.4	Confident	77.7	Confident	86 Å²	86	71.1 Å²	71.1	40%	0.402	40%	0.395	S	S	.	.	H	α-helix	trans	-60.7	-39	177.4	-62.9	-179	151	0	0	111.5	P639 T640 D641 T646 I647 L648	P639-E644 WeakPolarHBondContact CA-OE2 3.23Å; P639-E644 HydrophobicContact CB-CB 3.54Å; T640-E644 PolarHBondContact N-OE2 3.43Å; T640-E644 VanDerWaalsContact N-OE2 3.15Å; D641-E644 HydrophobicContact CB-CG 4.28Å; D641-E644 PolarHBondContact O-N 3.38Å; D641-E644 VanDerWaalsContact O-N 3.12Å; E644-T646 PolarHBondContact O-N 2.87Å; E644-I647 PolarHBondContact O-N 3.32Å; E644-L648 WeakPolarHBondContact O-CB 3.44Å; E644-L648 PolarHBondContact O-N 3.43Å
645	E	82.2	Confident	78.9	Confident	132 Å²	132	68.2 Å²	68.2	62%	0.617	38%	0.377	S	S	*	.	H	α-helix	trans	-61.4	-43.3	175.6	-171.7	179.5	-178.2	0	0	111.8	P639 D641 T643 L648 D649	P639-E645 HydrophobicContact CG-CB 4.41Å; D641-E645 PolarHBondContact O-N 3.44Å; T643-E645 VanDerWaalsContact C-N 3.28Å; T643-E645 PolarHBondContact O-N 2.88Å; E645-L648 PolarHBondContact O-N 3.13Å; E645-D649 PolarHBondContact O-N 3.29Å
646	T	83.5	Confident	80.2	Confident	74 Å²	74	68.4 Å²	68.4	45%	0.454	37%	0.372	S	S	.	.	H	α-helix	trans	-68	-35.5	177.8	59.8	0	0	0	0	113.3	G642 T643 E644 S650	G642-T646 WeakPolarHBondContact O-CG2 3.12Å; G642-T646 PolarHBondContact O-N 2.92Å; T643-T646 PolarHBondContact O-N 3.36Å; T643-T646 VanDerWaalsContact O-N 3.16Å; T643-T646 PolarHBondContact O-OG1 3.46Å; E644-T646 PolarHBondContact O-N 2.87Å; T646-S650 WeakPolarHBondContact O-CB 3.42Å; T646-S650 PolarHBondContact O-N 3.17Å; T646-S650 PolarHBondContact O-OG 3.13Å
647	I	85.1	Confident	81.8	Confident	35 Å²	35	61 Å²	61	18%	0.179	34%	0.337	C	S	.	.	H	α-helix	trans	-65.2	-46.7	174.8	-67.6	167.5	0	0	0	109.4	Y41 T643 E644 D649 S650 D651 L716 L719 L732	Y41-I647 HydrophobicContact CD2-CG2 4.19Å; T643-I647 WeakPolarHBondContact O-CG1 3.36Å; T643-I647 PolarHBondContact O-N 3.02Å; E644-I647 PolarHBondContact O-N 3.32Å; I647-D649 PolarHBondContact O-N 2.97Å; I647-S650 PolarHBondContact O-N 3.09Å; I647-D651 PolarHBondContact O-N 3.48Å; I647-L716 HydrophobicContact CG1-CD1 4.31Å; I647-L716 HydrophobicContact CG2-CD1 4.27Å; I647-L719 HydrophobicContact CD1-CD1 4.29Å; I647-L719 HydrophobicContact CG1-CD1 4.34Å; I647-L719 HydrophobicContact CG2-CD1 3.75Å; I647-L732 HydrophobicContact CD1-CD1 4.46Å
648	L	85.9	Confident	83.5	Confident	36 Å²	36	55.6 Å²	55.6	19%	0.188	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-43	178.9	-178.1	61.9	0	0	0	112.3	P635 P639 E644 E645 S650 D651 N652	P635-L648 HydrophobicContact CG-CD2 4.33Å; P639-L648 HydrophobicContact CG-CD2 4.21Å; E644-L648 WeakPolarHBondContact O-CB 3.44Å; E644-L648 PolarHBondContact O-N 3.43Å; E645-L648 PolarHBondContact O-N 3.13Å; L648-S650 VanDerWaalsContact C-N 3.35Å; L648-D651 PolarHBondContact O-N 3.44Å; L648-N652 WeakPolarHBondContact O-CB 3.38Å; L648-N652 PolarHBondContact O-N 3.32Å; L648-N652 PolarHBondContact O-ND2 3.48Å
649	D	86.5	Confident	84.8	Confident	78 Å²	78	48.2 Å²	48.2	42%	0.417	27%	0.268	S	S	.	.	H	α-helix	trans	-63.7	-40.3	175.8	-179.9	58.3	0	0	0	112.1	E645 I647 N652 K653	E645-D649 PolarHBondContact O-N 3.29Å; I647-D649 PolarHBondContact O-N 2.97Å; D649-N652 PolarHBondContact O-N 2.97Å; D649-K653 WeakPolarHBondContact O-CG 3.48Å; D649-K653 PolarHBondContact O-N 2.77Å; D649-K653 VanDerWaalsContact O-N 3.14Å; D649-K653 IonicContact OD1-NZ 3.87Å; D649-K653 VanDerWaalsContact OD2-CE 3.29Å; D649-K653 WeakPolarHBondContact OD2-CE 3.28Å; D649-K653 IonicContact OD2-NZ 3.96Å; D649-K653 PolarHBondContact OD2-NZ 3.08Å
650	S	86.7	Confident	86.5	Confident	18 Å²	18	46.4 Å²	46.4	13%	0.126	26%	0.256	C	S	.	.	H	α-helix	trans	-64.6	-44.9	176.4	-59.3	0	0	0	0	111.5	T646 I647 L648 K653 R654	T646-S650 WeakPolarHBondContact O-CB 3.42Å; T646-S650 PolarHBondContact O-N 3.17Å; T646-S650 PolarHBondContact O-OG 3.13Å; I647-S650 PolarHBondContact O-N 3.09Å; L648-S650 VanDerWaalsContact C-N 3.35Å; S650-K653 PolarHBondContact O-N 3.39Å; S650-R654 WeakPolarHBondContact O-CB 3.48Å; S650-R654 PolarHBondContact O-N 3.31Å
651	D	89.5	Confident	87.9	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-68	-37.7	178.7	-156.3	19.7	0	0	0	111.4	Y41 M633 I647 L648 K653 R654 H655	Y41-D651 HydrophobicContact CD2-CB 3.63Å; Y41-D651 VanDerWaalsContact CD2-CG 3.41Å; Y41-D651 HydrophobicContact CE2-CB 4.04Å; Y41-D651 HydrophobicContact CG-CB 4.47Å; Y41-D651 PolarHBondContact N-OD2 3.5Å; M633-D651 VanDerWaalsContact CE-C 3.44Å; M633-D651 HydrophobicContact CE-CB 3.5Å; M633-D651 WeakPolarHBondContact CE-O 3.43Å; M633-D651 WeakPolarHBondContact CE-OD2 3.42Å; I647-D651 PolarHBondContact O-N 3.48Å; L648-D651 PolarHBondContact O-N 3.44Å; D651-K653 VanDerWaalsContact C-N 3.27Å; D651-K653 PolarHBondContact O-N 2.66Å; D651-R654 WeakPolarHBondContact O-CB 3.44Å; D651-R654 PolarHBondContact O-N 3.16Å; D651-R654 VanDerWaalsContact O-N 3.16Å; D651-R654 IonicContact OD1-NH1 2.76Å; D651-R654 PolarHBondContact OD1-NH1 3.35Å; D651-H655 VanDerWaalsContact O-CB 3.3Å; D651-H655 WeakPolarHBondContact O-CB 3.47Å; D651-H655 PolarHBondContact O-N 3.29Å
652	N	89.6	Confident	89.1	Confident	34 Å²	34	35.8 Å²	35.8	18%	0.182	19%	0.194	C	C	.	.	H	α-helix	trans	-58.4	-39.8	173.1	-79.9	-38.3	0	0	0	112.4	L648 D649 R656	L648-N652 WeakPolarHBondContact O-CB 3.38Å; L648-N652 PolarHBondContact O-N 3.32Å; L648-N652 PolarHBondContact O-ND2 3.48Å; D649-N652 PolarHBondContact O-N 2.97Å; N652-R656 WeakPolarHBondContact O-CG 3.47Å; N652-R656 PolarHBondContact O-N 2.96Å
653	K	90.7	Very high	90.1	Very high	86 Å²	86	33.3 Å²	33.3	37%	0.374	17%	0.169	S	C	.	.	H	α-helix	trans	-68.3	-47.6	174.1	-69.3	165.5	-177.6	159.6	0	110.6	D649 S650 D651 H655 R656 E657 N714	D649-K653 WeakPolarHBondContact O-CG 3.48Å; D649-K653 PolarHBondContact O-N 2.77Å; D649-K653 VanDerWaalsContact O-N 3.14Å; D649-K653 IonicContact OD1-NZ 3.87Å; D649-K653 VanDerWaalsContact OD2-CE 3.29Å; D649-K653 WeakPolarHBondContact OD2-CE 3.28Å; D649-K653 IonicContact OD2-NZ 3.96Å; D649-K653 PolarHBondContact OD2-NZ 3.08Å; S650-K653 PolarHBondContact O-N 3.39Å; D651-K653 VanDerWaalsContact C-N 3.27Å; D651-K653 PolarHBondContact O-N 2.66Å; K653-H655 VanDerWaalsContact C-N 3.33Å; K653-H655 PolarHBondContact O-N 3.18Å; K653-R656 WeakPolarHBondContact O-CB 3.32Å; K653-R656 PolarHBondContact O-N 2.79Å; K653-E657 WeakPolarHBondContact O-CG 3.35Å; K653-E657 PolarHBondContact O-N 3.4Å; K653-N714 HydrophobicContact CB-CB 4.03Å; K653-N714 VanDerWaalsContact CB-CG 3.5Å; K653-N714 VanDerWaalsContact CD-OD1 3.29Å; K653-N714 WeakPolarHBondContact CD-OD1 3.09Å
654	R	92.5	Very high	91.2	Very high	1 Å²	1	30.6 Å²	30.6	0%	0.004	15%	0.152	C	C	.	.	H	α-helix	trans	-51.2	-50.7	175.6	-173.7	175.3	168.1	-96.5	-0.5	111.7	A36 Y39 Y41 S650 D651 R656 E657 I658 N714 E720 R747	A36-R654 PolarHBondContact O-NH2 2.82Å; Y39-R654 PolarHBondContact O-NH1 3.28Å; Y41-R654 VanDerWaalsContact OH-CD 3.23Å; Y41-R654 WeakPolarHBondContact OH-CD 3.43Å; Y41-R654 PolarHBondContact OH-NE 3.15Å; S650-R654 WeakPolarHBondContact O-CB 3.48Å; S650-R654 PolarHBondContact O-N 3.31Å; D651-R654 WeakPolarHBondContact O-CB 3.44Å; D651-R654 PolarHBondContact O-N 3.16Å; D651-R654 VanDerWaalsContact O-N 3.16Å; D651-R654 IonicContact OD1-NH1 2.76Å; D651-R654 PolarHBondContact OD1-NH1 3.35Å; R654-R656 PolarHBondContact O-N 3.06Å; R654-E657 WeakPolarHBondContact O-CB 3.3Å; R654-E657 PolarHBondContact O-N 3.31Å; R654-E657 VanDerWaalsContact O-N 3.12Å; R654-I658 HydrophobicContact CG-CD1 4.02Å; R654-I658 WeakPolarHBondContact O-CG1 3.33Å; R654-I658 PolarHBondContact O-N 3.48Å; R654-N714 HydrophobicContact CB-CB 4.42Å; R654-N714 WeakPolarHBondContact CB-O 3.12Å; R654-E720 IonicContact CZ-OE1 3.47Å; R654-E720 VanDerWaalsContact CZ-OE1 3.24Å; R654-E720 IonicContact CZ-OE2 3.73Å; R654-E720 IonicContact NE-OE1 2.79Å; R654-E720 PolarHBondContact NE-OE1 2.9Å; R654-E720 IonicContact NE-OE2 3.86Å; R654-E720 VanDerWaalsContact NH2-CD 3.3Å; R654-E720 IonicContact NH2-OE1 3.53Å; R654-E720 PolarHBondContact NH2-OE1 3.48Å; R654-E720 IonicContact NH2-OE2 2.62Å; R654-E720 PolarHBondContact NH2-OE2 3.03Å; R654-R747 VanDerWaalsContact CG-NH1 3.35Å
655	H	93.3	Very high	92	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-58	-45.1	179	173.3	104.5	0	0	0	112.4	I629 E632 M633 D651 K653 E657 I658 I659	I629-H655 PolarHBondContact O-NE2 3.07Å; I629-H655 VanDerWaalsContact O-NE2 3.12Å; E632-H655 VanDerWaalsContact CD-CE1 3.48Å; E632-H655 IonicContact OE1-CE1 2.82Å; E632-H655 PolarHBondContact OE1-CE1 3.45Å; E632-H655 IonicContact OE1-ND1 2.96Å; E632-H655 PolarHBondContact OE1-ND1 3.49Å; M633-H655 HydrophobicContact CE-CB 4.1Å; M633-H655 HydrophobicContact SD-CB 3.28Å; M633-H655 WeakPolarHBondContact SD-CB 3.31Å; D651-H655 VanDerWaalsContact O-CB 3.3Å; D651-H655 WeakPolarHBondContact O-CB 3.47Å; D651-H655 PolarHBondContact O-N 3.29Å; K653-H655 VanDerWaalsContact C-N 3.33Å; K653-H655 PolarHBondContact O-N 3.18Å; H655-E657 VanDerWaalsContact C-N 3.34Å; H655-E657 PolarHBondContact O-N 2.98Å; H655-I658 PolarHBondContact O-N 3.07Å; H655-I659 WeakPolarHBondContact NE2-CD1 3.31Å; H655-I659 PolarHBondContact O-N 3.49Å
656	R	93.9	Very high	92.8	Very high	49 Å²	49	20.5 Å²	20.5	19%	0.185	11%	0.106	C	C	.	.	H	α-helix	trans	-61.1	-42.5	175.4	-71.3	170	-178.6	-80.9	-4.6	111.8	A615 I629 L630 N652 K653 R654 I658 I659 V660	A615-R656 PolarHBondContact O-NH1 2.97Å; I629-R656 HydrophobicContact CD1-CG 4.33Å; L630-R656 VanDerWaalsContact CD1-NH2 3.3Å; N652-R656 WeakPolarHBondContact O-CG 3.47Å; N652-R656 PolarHBondContact O-N 2.96Å; K653-R656 WeakPolarHBondContact O-CB 3.32Å; K653-R656 PolarHBondContact O-N 2.79Å; R654-R656 PolarHBondContact O-N 3.06Å; R656-I658 VanDerWaalsContact C-N 3.34Å; R656-I658 PolarHBondContact O-N 3.09Å; R656-I659 PolarHBondContact O-N 3.08Å; R656-V660 VanDerWaalsContact O-CG2 3.25Å; R656-V660 WeakPolarHBondContact O-CG2 3.4Å; R656-V660 PolarHBondContact O-N 3.13Å
657	E	94.8	Very high	93.5	Very high	8 Å²	8	17.1 Å²	17.1	4%	0.037	9%	0.085	C	C	.	.	H	α-helix	trans	-61.2	-42	177.1	-62.6	177.6	166.4	0	0	111.8	K653 R654 H655 V660 K661 S712 N714 C745 R747 N748	K653-E657 WeakPolarHBondContact O-CG 3.35Å; K653-E657 PolarHBondContact O-N 3.4Å; R654-E657 WeakPolarHBondContact O-CB 3.3Å; R654-E657 PolarHBondContact O-N 3.31Å; R654-E657 VanDerWaalsContact O-N 3.12Å; H655-E657 VanDerWaalsContact C-N 3.34Å; H655-E657 PolarHBondContact O-N 2.98Å; E657-V660 PolarHBondContact O-N 3.04Å; E657-K661 WeakPolarHBondContact O-CB 3.38Å; E657-K661 PolarHBondContact O-N 2.9Å; E657-S712 PolarHBondContact OE1-OG 3.41Å; E657-N714 PolarHBondContact OE1-ND2 3.3Å; E657-C745 PolarHBondContact OE2-SG 3.41Å; E657-C745 VanDerWaalsContact OE2-SG 3.37Å; E657-R747 HydrophobicContact CB-CB 4.24Å; E657-R747 IonicContact OE2-CZ 3.81Å; E657-R747 VanDerWaalsContact OE2-CZ 3.3Å; E657-R747 IonicContact OE2-NE 3.29Å; E657-R747 PolarHBondContact OE2-NE 3.4Å; E657-R747 IonicContact OE2-NH2 3.49Å; E657-R747 PolarHBondContact OE2-NH2 2.76Å; E657-N748 WeakPolarHBondContact CB-OD1 3.32Å; E657-N748 VanDerWaalsContact CD-ND2 3.34Å; E657-N748 WeakPolarHBondContact CG-OD1 3.38Å; E657-N748 PolarHBondContact OE1-ND2 3.27Å
658	I	96.2	Very high	94.1	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-64.1	-44.9	177.6	-65.6	165.1	0	0	0	111	E37 K301 L305 R654 H655 R656 V660 K661 A662	E37-I658 HydrophobicContact CB-CD1 3.97Å; E37-I658 HydrophobicContact CB-CG1 4.36Å; E37-I658 HydrophobicContact CG-CD1 3.97Å; E37-I658 HydrophobicContact CG-CG1 4.11Å; K301-I658 HydrophobicContact CD-CD1 4.44Å; K301-I658 HydrophobicContact CD-CG2 4.23Å; K301-I658 HydrophobicContact CG-CG2 4.01Å; L305-I658 HydrophobicContact CD1-CG2 3.91Å; L305-I658 HydrophobicContact CD2-CG2 3.93Å; L305-I658 HydrophobicContact CG-CG2 4.11Å; R654-I658 HydrophobicContact CG-CD1 4.02Å; R654-I658 WeakPolarHBondContact O-CG1 3.33Å; R654-I658 PolarHBondContact O-N 3.48Å; H655-I658 PolarHBondContact O-N 3.07Å; R656-I658 VanDerWaalsContact C-N 3.34Å; R656-I658 PolarHBondContact O-N 3.09Å; I658-V660 PolarHBondContact O-N 2.97Å; I658-K661 WeakPolarHBondContact O-CB 3.36Å; I658-K661 PolarHBondContact O-N 2.85Å; I658-A662 PolarHBondContact O-N 3.26Å
659	I	96.2	Very high	94.6	Very high	2 Å²	2	13.9 Å²	13.9	1%	0.01	7%	0.068	C	C	.	.	H	α-helix	trans	-61.6	-45.8	176.7	-73	-176.7	0	0	0	111.3	L304 I612 A616 I629 H655 R656 K661 A662 I663	L304-I659 HydrophobicContact CD1-CG1 4.43Å; L304-I659 HydrophobicContact CD1-CG2 4Å; I612-I659 HydrophobicContact CG2-CG2 3.68Å; A616-I659 HydrophobicContact CB-CB 4.09Å; A616-I659 HydrophobicContact CB-CG2 3.57Å; I629-I659 HydrophobicContact CB-CD1 4.26Å; I629-I659 HydrophobicContact CD1-CD1 4.31Å; H655-I659 WeakPolarHBondContact NE2-CD1 3.31Å; H655-I659 PolarHBondContact O-N 3.49Å; R656-I659 PolarHBondContact O-N 3.08Å; I659-K661 VanDerWaalsContact C-N 3.3Å; I659-K661 PolarHBondContact O-N 2.85Å; I659-A662 PolarHBondContact O-N 3.03Å; I659-I663 HydrophobicContact CG2-CD1 3.64Å; I659-I663 HydrophobicContact CG2-CG1 4.41Å; I659-I663 WeakPolarHBondContact O-CG1 3.45Å; I659-I663 PolarHBondContact O-N 2.62Å
660	V	97.1	Very high	95.2	Very high	1 Å²	1	10.2 Å²	10.2	1%	0.006	5%	0.049	C	C	.	.	H	α-helix	trans	-61.9	-41.3	177.5	175.7	0	0	0	0	110.4	L613 A616 R656 E657 I658 S664 F701	L613-V660 HydrophobicContact CD1-CB 4.4Å; L613-V660 HydrophobicContact CD1-CG1 4.08Å; L613-V660 HydrophobicContact CD1-CG2 4.16Å; A616-V660 HydrophobicContact CB-CG2 3.82Å; R656-V660 VanDerWaalsContact O-CG2 3.25Å; R656-V660 WeakPolarHBondContact O-CG2 3.4Å; R656-V660 PolarHBondContact O-N 3.13Å; E657-V660 PolarHBondContact O-N 3.04Å; I658-V660 PolarHBondContact O-N 2.97Å; V660-S664 WeakPolarHBondContact O-CB 3.32Å; V660-S664 PolarHBondContact O-N 2.6Å; V660-S664 PolarHBondContact O-OG 3.23Å; V660-S664 VanDerWaalsContact O-OG 3.08Å; V660-F701 HydrophobicContact CG1-CE2 3.69Å; V660-F701 HydrophobicContact CG1-CZ 3.84Å; V660-F701 HydrophobicContact CG2-CE2 4.21Å
661	K	96.8	Very high	95.7	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-54.9	-57.3	173.5	174.4	175.5	73.7	149.9	0	110.6	E34 E37 W308 E657 I658 I659 I663 S664 A665 W746 R747 F750 S751	E34-K661 IonicContact OE1-NZ 3.72Å; E34-K661 PolarHBondContact OE1-NZ 3.03Å; E34-K661 IonicContact OE2-NZ 3.72Å; E34-K661 PolarHBondContact OE2-NZ 3.37Å; E37-K661 VanDerWaalsContact CD-NZ 3.26Å; E37-K661 IonicContact OE1-NZ 3.19Å; E37-K661 PolarHBondContact OE1-NZ 2.98Å; E37-K661 WeakPolarHBondContact OE2-CE 3.37Å; E37-K661 IonicContact OE2-NZ 3.9Å; E37-K661 PolarHBondContact OE2-NZ 2.83Å; W308-K661 HydrophobicContact CH2-CD 4.02Å; W308-K661 HydrophobicContact CH2-CG 4.12Å; W308-K661 HydrophobicContact CZ3-CD 4.1Å; W308-K661 HydrophobicContact CZ3-CG 4.14Å; E657-K661 WeakPolarHBondContact O-CB 3.38Å; E657-K661 PolarHBondContact O-N 2.9Å; I658-K661 WeakPolarHBondContact O-CB 3.36Å; I658-K661 PolarHBondContact O-N 2.85Å; I659-K661 VanDerWaalsContact C-N 3.3Å; I659-K661 PolarHBondContact O-N 2.85Å; K661-I663 PolarHBondContact O-N 3Å; K661-S664 PolarHBondContact O-N 2.89Å; K661-S664 PolarHBondContact O-OG 2.94Å; K661-A665 WeakPolarHBondContact O-CB 3.44Å; K661-A665 PolarHBondContact O-N 3.47Å; K661-W746 HydrophobicContact CD-CE3 4.32Å; K661-W746 HydrophobicContact CD-CZ3 3.66Å; K661-R747 HydrophobicContact CD-CG 4.29Å; K661-F750 HydrophobicContact CD-CD1 4.14Å; K661-F750 HydrophobicContact CD-CE1 4.25Å; K661-F750 HydrophobicContact CG-CD1 3.65Å; K661-F750 HydrophobicContact CG-CE1 3.65Å; K661-S751 WeakPolarHBondContact CA-OG 3.5Å; K661-S751 PolarHBondContact N-OG 3.23Å
662	A	98	Very high	96.1	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-59.4	-49.6	-175.6	0	0	0	0	0	112.2	L304 L305 W308 I658 I659 S664 A665 L666	L304-A662 HydrophobicContact CB-CB 4.06Å; L305-A662 HydrophobicContact CD2-CB 4.22Å; W308-A662 HydrophobicContact CE3-CB 4.29Å; I658-A662 PolarHBondContact O-N 3.26Å; I659-A662 PolarHBondContact O-N 3.03Å; A662-S664 PolarHBondContact O-N 2.96Å; A662-A665 PolarHBondContact O-N 2.73Å; A662-L666 VanDerWaalsContact O-CB 3.26Å; A662-L666 WeakPolarHBondContact O-CB 3.35Å; A662-L666 PolarHBondContact O-N 3.43Å
663	I	98.1	Very high	96.4	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-65.4	-42.5	-178.4	-64.1	168.5	0	0	0	111.3	L304 L609 I612 L613 I659 K661 A665 L666 L667	L304-I663 HydrophobicContact CD1-CD1 4.01Å; L304-I663 HydrophobicContact CD1-CG1 3.96Å; L304-I663 HydrophobicContact CD2-CG1 3.93Å; L609-I663 HydrophobicContact CB-CG2 4.3Å; L609-I663 HydrophobicContact CD2-CG1 4.47Å; I612-I663 HydrophobicContact CB-CD1 3.78Å; I612-I663 HydrophobicContact CG2-CD1 3.62Å; L613-I663 HydrophobicContact CB-CD1 4.14Å; L613-I663 HydrophobicContact CB-CG2 4.13Å; L613-I663 HydrophobicContact CD1-CG2 4.44Å; L613-I663 HydrophobicContact CD2-CG2 4.36Å; I659-I663 HydrophobicContact CG2-CD1 3.64Å; I659-I663 HydrophobicContact CG2-CG1 4.41Å; I659-I663 WeakPolarHBondContact O-CG1 3.45Å; I659-I663 PolarHBondContact O-N 2.62Å; K661-I663 PolarHBondContact O-N 3Å; I663-A665 VanDerWaalsContact C-N 3.29Å; I663-A665 PolarHBondContact O-N 3.42Å; I663-L666 PolarHBondContact O-N 2.83Å; I663-L667 HydrophobicContact CG2-CD1 3.9Å; I663-L667 HydrophobicContact CG2-CG 4.19Å; I663-L667 WeakPolarHBondContact O-CB 3.45Å; I663-L667 WeakPolarHBondContact O-CG 3.43Å; I663-L667 PolarHBondContact O-N 3.37Å
664	S	98.2	Very high	96.7	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-63.8	-37.1	179.5	75	0	0	0	0	111.9	V660 K661 A662 L668 N754 I758	V660-S664 WeakPolarHBondContact O-CB 3.32Å; V660-S664 PolarHBondContact O-N 2.6Å; V660-S664 PolarHBondContact O-OG 3.23Å; V660-S664 VanDerWaalsContact O-OG 3.08Å; K661-S664 PolarHBondContact O-N 2.89Å; K661-S664 PolarHBondContact O-OG 2.94Å; A662-S664 PolarHBondContact O-N 2.96Å; S664-L668 VanDerWaalsContact O-CB 3.28Å; S664-L668 WeakPolarHBondContact O-CB 3.47Å; S664-L668 PolarHBondContact O-N 3.38Å; S664-N754 PolarHBondContact OG-ND2 2.75Å; S664-I758 WeakPolarHBondContact O-CD1 3.31Å
665	A	98	Very high	96.9	Very high	6 Å²	6	10.1 Å²	10.1	5%	0.05	5%	0.045	C	C	.	.	H	α-helix	trans	-71.2	-46.2	176.4	0	0	0	0	0	111.7	W308 K661 A662 I663 L667 L668 L669 F750	W308-A665 HydrophobicContact CD2-CB 3.89Å; W308-A665 HydrophobicContact CG-CB 4.21Å; W308-A665 HydrophobicContact CH2-CB 4.35Å; W308-A665 HydrophobicContact CZ2-CB 3.5Å; W308-A665 VanDerWaalsContact NE1-CB 3.29Å; K661-A665 WeakPolarHBondContact O-CB 3.44Å; K661-A665 PolarHBondContact O-N 3.47Å; A662-A665 PolarHBondContact O-N 2.73Å; I663-A665 VanDerWaalsContact C-N 3.29Å; I663-A665 PolarHBondContact O-N 3.42Å; A665-L667 PolarHBondContact O-N 3.25Å; A665-L668 PolarHBondContact O-N 3.42Å; A665-L669 VanDerWaalsContact O-CB 3.23Å; A665-L669 WeakPolarHBondContact O-CB 3.43Å; A665-L669 PolarHBondContact O-N 2.89Å; A665-F750 HydrophobicContact CB-CE1 3.83Å; A665-F750 HydrophobicContact CB-CZ 3.87Å
666	L	97.8	Very high	97	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-56.9	-51.9	178.2	-175.2	160	0	0	0	111.2	F284 L307 L311 L609 A662 I663 L668 L669 L670	F284-L666 HydrophobicContact CE1-CD2 4.19Å; F284-L666 HydrophobicContact CZ-CD2 4.18Å; L307-L666 HydrophobicContact CB-CD1 4.33Å; L307-L666 HydrophobicContact CD2-CD1 3.52Å; L307-L666 HydrophobicContact CG-CD1 3.62Å; L311-L666 HydrophobicContact CD1-CD1 4.41Å; L311-L666 HydrophobicContact CD1-CG 4.05Å; L609-L666 HydrophobicContact CD1-CD2 3.49Å; L609-L666 VanDerWaalsContact CD1-CD2 3.49Å; L609-L666 HydrophobicContact CD2-CD1 4.28Å; L609-L666 HydrophobicContact CD2-CD2 4.24Å; A662-L666 VanDerWaalsContact O-CB 3.26Å; A662-L666 WeakPolarHBondContact O-CB 3.35Å; A662-L666 PolarHBondContact O-N 3.43Å; I663-L666 PolarHBondContact O-N 2.83Å; L666-L668 VanDerWaalsContact C-N 3.32Å; L666-L668 PolarHBondContact O-N 3.33Å; L666-L669 PolarHBondContact O-N 2.89Å; L666-L670 HydrophobicContact CD2-CD1 3.6Å; L666-L670 HydrophobicContact CD2-CG 4.16Å; L666-L670 WeakPolarHBondContact O-CG 3.35Å; L666-L670 PolarHBondContact O-N 3.34Å
667	L	98.3	Very high	97	Very high	2 Å²	2	11.2 Å²	11.2	1%	0.01	5%	0.054	C	C	.	.	H	α-helix	trans	-60.4	-42.3	178.4	-72.6	178	0	0	0	112.1	M606 L609 L610 I663 A665 L669 L671 L689 I758	M606-L667 HydrophobicContact SD-CD2 4Å; L609-L667 HydrophobicContact CD1-CD2 3.71Å; L609-L667 HydrophobicContact CD1-CG 4.43Å; L610-L667 HydrophobicContact CD2-CD1 4.14Å; I663-L667 HydrophobicContact CG2-CD1 3.9Å; I663-L667 HydrophobicContact CG2-CG 4.19Å; I663-L667 WeakPolarHBondContact O-CB 3.45Å; I663-L667 WeakPolarHBondContact O-CG 3.43Å; I663-L667 PolarHBondContact O-N 3.37Å; A665-L667 PolarHBondContact O-N 3.25Å; L667-L669 VanDerWaalsContact C-N 3.34Å; L667-L671 WeakPolarHBondContact O-CB 3.35Å; L667-L671 VanDerWaalsContact O-CG 3.23Å; L667-L671 WeakPolarHBondContact O-CG 3.4Å; L667-L671 PolarHBondContact O-N 2.74Å; L667-L671 VanDerWaalsContact O-N 3.09Å; L667-L689 HydrophobicContact CD2-CD1 4.44Å; L667-L689 HydrophobicContact CD2-CD2 3.9Å; L667-I758 HydrophobicContact CB-CD1 3.69Å; L667-I758 HydrophobicContact CB-CG1 4.5Å; L667-I758 HydrophobicContact CD1-CD1 4.48Å
668	L	98	Very high	97	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.005	6%	0.057	C	C	.	.	H	α-helix	trans	-64.6	-41	178.2	178.2	62.8	0	0	0	111.5	L318 S664 A665 L666 K672 N754 R757 I758 M761	L318-L668 HydrophobicContact CD1-CD2 4.05Å; L318-L668 HydrophobicContact CD1-CG 4.33Å; S664-L668 VanDerWaalsContact O-CB 3.28Å; S664-L668 WeakPolarHBondContact O-CB 3.47Å; S664-L668 PolarHBondContact O-N 3.38Å; A665-L668 PolarHBondContact O-N 3.42Å; L666-L668 VanDerWaalsContact C-N 3.32Å; L666-L668 PolarHBondContact O-N 3.33Å; L668-K672 HydrophobicContact CD1-CG 4.11Å; L668-K672 HydrophobicContact CG-CG 4.43Å; L668-K672 VanDerWaalsContact O-CB 3.31Å; L668-K672 WeakPolarHBondContact O-CB 3.41Å; L668-K672 WeakPolarHBondContact O-CG 3.25Å; L668-K672 PolarHBondContact O-N 2.85Å; L668-N754 HydrophobicContact CD2-CB 4.17Å; L668-N754 VanDerWaalsContact CD2-OD1 3.31Å; L668-N754 WeakPolarHBondContact CD2-OD1 3.15Å; L668-R757 HydrophobicContact CD1-CB 3.81Å; L668-R757 HydrophobicContact CD2-CB 4.41Å; L668-I758 HydrophobicContact CB-CD1 4.23Å; L668-I758 HydrophobicContact CB-CG1 4.05Å; L668-I758 HydrophobicContact CD1-CG1 4.3Å; L668-M761 HydrophobicContact CD1-SD 3.91Å
669	L	97.4	Very high	97.1	Very high	3 Å²	3	12.5 Å²	12.5	2%	0.016	6%	0.06	C	C	.	.	H	α-helix	trans	-66.6	-47.8	-178.4	-169.8	128.7	0	0	0	111.1	L311 L312 L315 L318 A665 L666 L667 L671 K672 H673	L311-L669 HydrophobicContact CB-CD2 3.55Å; L312-L669 HydrophobicContact CB-CD1 4.21Å; L312-L669 HydrophobicContact CD1-CD1 3.53Å; L312-L669 HydrophobicContact CG-CD1 4.49Å; L315-L669 HydrophobicContact CD1-CD2 3.8Å; L318-L669 HydrophobicContact CD2-CD1 4.34Å; L318-L669 HydrophobicContact CD2-CG 4.48Å; A665-L669 VanDerWaalsContact O-CB 3.23Å; A665-L669 WeakPolarHBondContact O-CB 3.43Å; A665-L669 PolarHBondContact O-N 2.89Å; L666-L669 PolarHBondContact O-N 2.89Å; L667-L669 VanDerWaalsContact C-N 3.34Å; L669-L671 PolarHBondContact O-N 3.08Å; L669-K672 PolarHBondContact O-N 3Å; L669-H673 PolarHBondContact O-CD2 3.02Å; L669-H673 PolarHBondContact O-N 3.5Å
670	L	97.7	Very high	97.1	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-56	-52	173.2	-68.1	-179.8	0	0	0	111.6	F284 L311 L594 M598 M606 L666 K672 H673 F674	F284-L670 HydrophobicContact CZ-CD1 4.1Å; L311-L670 HydrophobicContact CD1-CD2 4.1Å; L594-L670 HydrophobicContact CD2-CD2 3.92Å; M598-L670 HydrophobicContact CE-CD1 4.19Å; M598-L670 HydrophobicContact SD-CD2 4.32Å; M606-L670 HydrophobicContact CE-CD1 3.83Å; L666-L670 HydrophobicContact CD2-CD1 3.6Å; L666-L670 HydrophobicContact CD2-CG 4.16Å; L666-L670 WeakPolarHBondContact O-CG 3.35Å; L666-L670 PolarHBondContact O-N 3.34Å; L670-K672 PolarHBondContact O-N 3.33Å; L670-H673 PolarHBondContact O-N 3.42Å; L670-F674 HydrophobicContact CB-CD2 4.22Å; L670-F674 HydrophobicContact CB-CE2 4.02Å; L670-F674 HydrophobicContact CD2-CE2 3.93Å; L670-F674 HydrophobicContact CD2-CZ 3.97Å; L670-F674 HydrophobicContact CG-CE2 4.44Å; L670-F674 VanDerWaalsContact O-CB 3.32Å; L670-F674 WeakPolarHBondContact O-CB 3.37Å; L670-F674 VanDerWaalsContact O-CD2 3.29Å; L670-F674 WeakPolarHBondContact O-CD2 3.47Å; L670-F674 VanDerWaalsContact O-CG 3.3Å; L670-F674 WeakPolarHBondContact O-CG 3.49Å; L670-F674 PolarHBondContact O-N 3.27Å
671	L	98.3	Very high	97.1	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-61.9	-32.4	-179	-71.6	171.5	0	0	0	112.7	L667 L669 K675 F682 V685 L689 I758 M761 L762	L667-L671 WeakPolarHBondContact O-CB 3.35Å; L667-L671 VanDerWaalsContact O-CG 3.23Å; L667-L671 WeakPolarHBondContact O-CG 3.4Å; L667-L671 PolarHBondContact O-N 2.74Å; L667-L671 VanDerWaalsContact O-N 3.09Å; L669-L671 PolarHBondContact O-N 3.08Å; L671-K675 WeakPolarHBondContact O-CB 3.18Å; L671-K675 PolarHBondContact O-N 3.17Å; L671-F682 HydrophobicContact CB-CD2 4.24Å; L671-F682 HydrophobicContact CB-CE2 4.28Å; L671-F682 HydrophobicContact CD2-CD2 3.8Å; L671-F682 HydrophobicContact CD2-CE2 3.79Å; L671-F682 WeakPolarHBondContact O-CD2 3.45Å; L671-V685 HydrophobicContact CD2-CB 4.24Å; L671-V685 HydrophobicContact CD2-CG1 3.91Å; L671-L689 HydrophobicContact CD1-CD1 4Å; L671-L689 HydrophobicContact CD2-CD1 4.06Å; L671-L689 HydrophobicContact CG-CD1 4.3Å; L671-I758 HydrophobicContact CD1-CB 4.48Å; L671-I758 HydrophobicContact CD1-CG1 4.25Å; L671-I758 HydrophobicContact CD1-CG2 3.92Å; L671-M761 HydrophobicContact CB-CE 3.71Å; L671-M761 HydrophobicContact CB-SD 4.48Å; L671-M761 WeakPolarHBondContact O-CE 3.18Å; L671-L762 HydrophobicContact CD1-CD2 4.38Å
672	K	97	Very high	97.2	Very high	55 Å²	55	12.7 Å²	12.7	24%	0.239	6%	0.061	C	C	.	.	H	α-helix	trans	-76	-47.7	-179.3	-78.2	-79.3	-172.4	155.9	0	112	L318 L321 L668 L669 L670 K675 L676 M761	L318-K672 HydrophobicContact CD2-CB 4.15Å; L318-K672 HydrophobicContact CD2-CG 4.31Å; L321-K672 HydrophobicContact CD1-CB 3.76Å; L321-K672 HydrophobicContact CD1-CD 4.09Å; L321-K672 HydrophobicContact CD1-CG 4.23Å; L668-K672 HydrophobicContact CD1-CG 4.11Å; L668-K672 HydrophobicContact CG-CG 4.43Å; L668-K672 VanDerWaalsContact O-CB 3.31Å; L668-K672 WeakPolarHBondContact O-CB 3.41Å; L668-K672 WeakPolarHBondContact O-CG 3.25Å; L668-K672 PolarHBondContact O-N 2.85Å; L669-K672 PolarHBondContact O-N 3Å; L670-K672 PolarHBondContact O-N 3.33Å; K672-K675 PolarHBondContact O-N 3.32Å; K672-L676 PolarHBondContact O-N 2.91Å; K672-L676 VanDerWaalsContact O-N 3.14Å; K672-M761 HydrophobicContact CD-CE 4.01Å; K672-M761 HydrophobicContact CD-SD 4.03Å; K672-M761 HydrophobicContact CG-CE 4.09Å; K672-M761 HydrophobicContact CG-SD 4.15Å
673	H	96.7	Very high	97.2	Very high	3 Å²	3	13.1 Å²	13.1	1%	0.014	6%	0.063	C	C	.	.	H	α-helix	trans	-70.7	-44.5	-179.1	-76.9	-64.2	0	0	0	111.7	L315 G316 L321 V591 L669 L670 K675 L676 N677	L315-H673 WeakPolarHBondContact CB-NE2 3.43Å; L315-H673 HydrophobicContact CD1-CB 3.97Å; L315-H673 PolarHBondContact O-CE1 3.44Å; G316-H673 PolarHBondContact O-CE1 3.43Å; G316-H673 PolarHBondContact O-NE2 3.23Å; L321-H673 VanDerWaalsContact CD2-CE1 3.48Å; L321-H673 WeakPolarHBondContact CD2-CE1 3.19Å; L321-H673 WeakPolarHBondContact CD2-ND1 3.29Å; V591-H673 HydrophobicContact CG1-CB 4.26Å; V591-H673 HydrophobicContact CG2-CB 4.19Å; L669-H673 PolarHBondContact O-CD2 3.02Å; L669-H673 PolarHBondContact O-N 3.5Å; L670-H673 PolarHBondContact O-N 3.42Å; H673-K675 VanDerWaalsContact C-N 3.29Å; H673-K675 PolarHBondContact O-N 2.85Å; H673-L676 PolarHBondContact O-N 3.11Å; H673-L676 VanDerWaalsContact O-N 3.08Å; H673-N677 WeakPolarHBondContact O-CB 3.42Å; H673-N677 PolarHBondContact O-N 3.36Å
674	F	97.2	Very high	97.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-61.7	-37.9	174.6	-64.8	-29.5	0	0	0	111.9	V591 L594 Y595 M598 L670 L676 N677 H678 Q681 F682 V685	V591-F674 HydrophobicContact CG1-CD1 3.69Å; V591-F674 HydrophobicContact CG1-CE1 3.99Å; L594-F674 HydrophobicContact CD2-CE1 4.21Å; L594-F674 HydrophobicContact CD2-CZ 4.09Å; L594-F674 HydrophobicContact CG-CE1 4.49Å; L594-F674 HydrophobicContact CG-CZ 4.31Å; Y595-F674 AromaticContact CD2-CD1 3.94Å; Y595-F674 HydrophobicContact CD2-CD1 3.94Å; Y595-F674 HydrophobicContact CD2-CD2 4.24Å; Y595-F674 AromaticContact CD2-CE1 3.79Å; Y595-F674 HydrophobicContact CD2-CE1 3.79Å; Y595-F674 HydrophobicContact CD2-CE2 4.07Å; Y595-F674 HydrophobicContact CD2-CG 4.19Å; Y595-F674 AromaticContact CD2-CZ 3.85Å; Y595-F674 HydrophobicContact CD2-CZ 3.85Å; Y595-F674 HydrophobicContact CG-CE1 4.26Å; M598-F674 HydrophobicContact SD-CZ 4.26Å; L670-F674 HydrophobicContact CB-CD2 4.22Å; L670-F674 HydrophobicContact CB-CE2 4.02Å; L670-F674 HydrophobicContact CD2-CE2 3.93Å; L670-F674 HydrophobicContact CD2-CZ 3.97Å; L670-F674 HydrophobicContact CG-CE2 4.44Å; L670-F674 VanDerWaalsContact O-CB 3.32Å; L670-F674 WeakPolarHBondContact O-CB 3.37Å; L670-F674 VanDerWaalsContact O-CD2 3.29Å; L670-F674 WeakPolarHBondContact O-CD2 3.47Å; L670-F674 VanDerWaalsContact O-CG 3.3Å; L670-F674 WeakPolarHBondContact O-CG 3.49Å; L670-F674 PolarHBondContact O-N 3.27Å; F674-L676 VanDerWaalsContact C-N 3.28Å; F674-L676 PolarHBondContact O-N 2.76Å; F674-N677 PolarHBondContact O-N 3.11Å; F674-H678 CarbonylContact O-C 3.49Å; F674-H678 VanDerWaalsContact O-C 3.31Å; F674-H678 PolarHBondContact O-N 2.85Å; F674-Q681 HydrophobicContact CB-CB 3.96Å; F674-Q681 HydrophobicContact CG-CB 4.39Å; F674-F682 HydrophobicContact CB-CB 4.49Å; F674-V685 HydrophobicContact CD2-CG2 3.59Å; F674-V685 HydrophobicContact CE2-CG2 3.86Å
675	K	96.8	Very high	97.1	Very high	81 Å²	81	14 Å²	14	35%	0.352	7%	0.066	S	C	.	.	H	α-helix	trans	-66.1	-31.8	176.2	-172.7	176.4	-165.8	109.4	0	113.3	L671 K672 H673 I679 F682 M761	L671-K675 WeakPolarHBondContact O-CB 3.18Å; L671-K675 PolarHBondContact O-N 3.17Å; K672-K675 PolarHBondContact O-N 3.32Å; H673-K675 VanDerWaalsContact C-N 3.29Å; H673-K675 PolarHBondContact O-N 2.85Å; K675-I679 HydrophobicContact CG-CD1 4.28Å; K675-F682 HydrophobicContact CB-CB 3.69Å; K675-F682 HydrophobicContact CB-CD2 3.87Å; K675-F682 HydrophobicContact CB-CG 3.77Å; K675-F682 HydrophobicContact CD-CD1 4.47Å; K675-F682 HydrophobicContact CD-CD2 4.28Å; K675-F682 HydrophobicContact CD-CE2 4.43Å; K675-F682 HydrophobicContact CD-CG 4.31Å; K675-F682 HydrophobicContact CG-CB 4.23Å; K675-F682 HydrophobicContact CG-CD1 4.36Å; K675-F682 HydrophobicContact CG-CD2 4.35Å; K675-F682 HydrophobicContact CG-CG 4.03Å; K675-M761 HydrophobicContact CD-CE 4.2Å
676	L	94.5	Very high	97.1	Very high	31 Å²	31	13.7 Å²	13.7	16%	0.162	6%	0.064	C	C	.	.	H	α-helix	trans	-75.7	-40.8	177.4	176	59.7	0	0	0	110.9	L321 R324 K325 A328 L563 K672 H673 F674	L321-L676 HydrophobicContact CD2-CD2 3.68Å; R324-L676 HydrophobicContact CB-CD2 3.75Å; K325-L676 HydrophobicContact CB-CD1 3.77Å; K325-L676 HydrophobicContact CG-CD1 4.15Å; A328-L676 HydrophobicContact CB-CD1 4.48Å; L563-L676 HydrophobicContact CD2-CD1 4.09Å; K672-L676 PolarHBondContact O-N 2.91Å; K672-L676 VanDerWaalsContact O-N 3.14Å; H673-L676 PolarHBondContact O-N 3.11Å; H673-L676 VanDerWaalsContact O-N 3.08Å; F674-L676 VanDerWaalsContact C-N 3.28Å; F674-L676 PolarHBondContact O-N 2.76Å
677	N	94.4	Very high	97.1	Very high	42 Å²	42	14.3 Å²	14.3	23%	0.225	7%	0.067	C	C	.	.	H	α-helix	trans	-69.5	-60.9	178.5	-168.8	56.8	0	0	0	111.1	Q567 V591 E592 H673 F674 Q681	Q567-N677 PolarHBondContact NE2-O 3.44Å; V591-N677 HydrophobicContact CB-CB 4.39Å; V591-N677 HydrophobicContact CG1-CB 3.72Å; E592-N677 PolarHBondContact OE2-ND2 3.17Å; H673-N677 WeakPolarHBondContact O-CB 3.42Å; H673-N677 PolarHBondContact O-N 3.36Å; F674-N677 PolarHBondContact O-N 3.11Å; N677-Q681 VanDerWaalsContact ND2-CD 3.33Å; N677-Q681 PolarHBondContact ND2-NE2 3.26Å; N677-Q681 VanDerWaalsContact ND2-NE2 3.12Å; N677-Q681 PolarHBondContact ND2-OE1 3.49Å
678	H	95.2	Very high	97	Very high	20 Å²	20	16.3 Å²	16.3	9%	0.093	7%	0.074	C	C	.	.			trans	-149.3	131.6	174	-160.3	-103.1	0	0	0	113.7	E571 F674 Y680 Q681 F682 F862	E571-H678 IonicContact OE1-CE1 2.72Å; E571-H678 IonicContact OE1-NE2 3.6Å; F674-H678 CarbonylContact O-C 3.49Å; F674-H678 VanDerWaalsContact O-C 3.31Å; F674-H678 PolarHBondContact O-N 2.85Å; H678-Y680 AromaticContact CE1-CD2 3.57Å; H678-Y680 AromaticContact CE1-CG 3.97Å; H678-Y680 PolarHBondContact ND1-N 3.24Å; H678-Y680 PolarHBondContact O-N 2.89Å; H678-Y680 VanDerWaalsContact O-N 3.16Å; H678-Q681 HydrophobicContact CB-CB 4.43Å; H678-Q681 HydrophobicContact CB-CG 4Å; H678-Q681 WeakPolarHBondContact O-CB 3.47Å; H678-Q681 PolarHBondContact O-N 3.48Å; H678-Q681 VanDerWaalsContact O-N 3.08Å; H678-F682 PolarHBondContact O-N 2.83Å; H678-F862 HydrophobicContact CB-CZ 4.15Å; H678-F862 AromaticContact CE1-CD2 3.62Å; H678-F862 AromaticContact CE1-CE2 3.4Å; H678-F862 WeakPolarHBondContact CE1-CE2 3.21Å; H678-F862 AromaticContact CE1-CZ 3.88Å; H678-F862 AromaticContact CG-CE2 3.86Å; H678-F862 AromaticContact CG-CZ 3.71Å; H678-F862 AromaticContact ND1-CD2 3.84Å; H678-F862 AromaticContact ND1-CE1 3.76Å; H678-F862 AromaticContact ND1-CE2 3.33Å; H678-F862 VanDerWaalsContact ND1-CE2 3.33Å; H678-F862 WeakPolarHBondContact ND1-CE2 3.33Å; H678-F862 AromaticContact ND1-CZ 3.3Å; H678-F862 VanDerWaalsContact ND1-CZ 3.3Å; H678-F862 WeakPolarHBondContact ND1-CZ 3.33Å; H678-F862 AromaticContact NE2-CE2 3.97Å
679	I	96.9	Very high	97	Very high	16 Å²	16	16.2 Å²	16.2	8%	0.082	7%	0.074	C	C	.	.	H	α-helix	trans	-56.9	-34.5	-178.8	-172	61.7	0	0	0	113.5	Q567 I568 K675 F682 E683	Q567-I679 HydrophobicContact CB-CG2 3.84Å; I568-I679 HydrophobicContact CD1-CG1 4.49Å; I568-I679 HydrophobicContact CD1-CG2 4.27Å; I568-I679 HydrophobicContact CG1-CG2 3.8Å; K675-I679 HydrophobicContact CG-CD1 4.28Å; I679-F682 HydrophobicContact CD1-CD1 3.82Å; I679-F682 HydrophobicContact CD1-CE1 4.47Å; I679-F682 WeakPolarHBondContact O-CB 3.35Å; I679-F682 PolarHBondContact O-N 2.99Å; I679-E683 HydrophobicContact CG1-CG 4.46Å; I679-E683 WeakPolarHBondContact O-CG 3.41Å; I679-E683 PolarHBondContact O-N 3.24Å
680	Y	97.2	Very high	97	Very high	5 Å²	5	17.3 Å²	17.3	2%	0.02	8%	0.081	C	C	.	.	H	α-helix	trans	-74.2	-30	177.6	-67.3	-35.4	0	0	0	113.9	I568 E571 H678 F682 E683 Y684 L855 N858 V859 F862	I568-Y680 HydrophobicContact CG1-CE1 4.06Å; E571-Y680 HydrophobicContact CB-CE2 3.77Å; E571-Y680 HydrophobicContact CG-CD2 4.01Å; E571-Y680 HydrophobicContact CG-CE2 3.67Å; H678-Y680 AromaticContact CE1-CD2 3.57Å; H678-Y680 AromaticContact CE1-CG 3.97Å; H678-Y680 PolarHBondContact ND1-N 3.24Å; H678-Y680 PolarHBondContact O-N 2.89Å; H678-Y680 VanDerWaalsContact O-N 3.16Å; Y680-F682 VanDerWaalsContact C-N 3.32Å; Y680-F682 PolarHBondContact O-N 3.47Å; Y680-E683 PolarHBondContact O-N 2.95Å; Y680-Y684 WeakPolarHBondContact O-CB 3.08Å; Y680-Y684 PolarHBondContact O-N 2.84Å; Y680-L855 HydrophobicContact CE1-CD1 4.23Å; Y680-N858 HydrophobicContact CE1-CB 4.1Å; Y680-N858 HydrophobicContact CE2-CB 4.35Å; Y680-V859 HydrophobicContact CD1-CG2 3.62Å; Y680-V859 HydrophobicContact CE1-CG2 4.39Å; Y680-V859 HydrophobicContact CG-CG2 4.05Å; Y680-F862 HydrophobicContact CD2-CB 3.67Å; Y680-F862 HydrophobicContact CD2-CD1 4.49Å; Y680-F862 HydrophobicContact CD2-CD2 4.21Å; Y680-F862 AromaticContact CD2-CG 3.87Å; Y680-F862 HydrophobicContact CD2-CG 3.87Å; Y680-F862 HydrophobicContact CE2-CB 4.44Å; Y680-F862 HydrophobicContact CG-CB 4.36Å; Y680-F862 HydrophobicContact CG-CG 4.41Å
681	Q	97.5	Very high	96.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.9	-43.6	168.8	-68	173.6	-20.6	0	0	110.5	E592 Y595 F674 N677 H678 Y684 V685 F862 Y867	E592-Q681 PolarHBondContact OE2-NE2 3.3Å; Y595-Q681 HydrophobicContact CD1-CG 4.07Å; Y595-Q681 HydrophobicContact CD2-CB 3.8Å; Y595-Q681 HydrophobicContact CD2-CG 3.78Å; Y595-Q681 HydrophobicContact CE1-CG 3.95Å; Y595-Q681 HydrophobicContact CE2-CB 3.5Å; Y595-Q681 VanDerWaalsContact CE2-CB 3.5Å; Y595-Q681 HydrophobicContact CE2-CG 3.65Å; Y595-Q681 HydrophobicContact CG-CB 4.48Å; Y595-Q681 HydrophobicContact CG-CG 3.97Å; F674-Q681 HydrophobicContact CB-CB 3.96Å; F674-Q681 HydrophobicContact CG-CB 4.39Å; N677-Q681 VanDerWaalsContact ND2-CD 3.33Å; N677-Q681 PolarHBondContact ND2-NE2 3.26Å; N677-Q681 VanDerWaalsContact ND2-NE2 3.12Å; N677-Q681 PolarHBondContact ND2-OE1 3.49Å; H678-Q681 HydrophobicContact CB-CB 4.43Å; H678-Q681 HydrophobicContact CB-CG 4Å; H678-Q681 WeakPolarHBondContact O-CB 3.47Å; H678-Q681 PolarHBondContact O-N 3.48Å; H678-Q681 VanDerWaalsContact O-N 3.08Å; Q681-Y684 PolarHBondContact O-N 2.95Å; Q681-V685 WeakPolarHBondContact O-CG2 2.99Å; Q681-V685 PolarHBondContact O-N 3.38Å; Q681-F862 HydrophobicContact CG-CE1 3.94Å; Q681-F862 HydrophobicContact CG-CZ 4.31Å; Q681-Y867 PolarHBondContact NE2-OH 2.98Å
682	F	98	Very high	96.7	Very high	1 Å²	1	24.8 Å²	24.8	0%	0.004	12%	0.118	C	C	.	.	H	α-helix	trans	-62.1	-45.7	173.9	159.8	-95.3	0	0	0	112.6	L671 F674 K675 H678 I679 Y680 Y684 V685 S686 M761	L671-F682 HydrophobicContact CB-CD2 4.24Å; L671-F682 HydrophobicContact CB-CE2 4.28Å; L671-F682 HydrophobicContact CD2-CD2 3.8Å; L671-F682 HydrophobicContact CD2-CE2 3.79Å; L671-F682 WeakPolarHBondContact O-CD2 3.45Å; F674-F682 HydrophobicContact CB-CB 4.49Å; K675-F682 HydrophobicContact CB-CB 3.69Å; K675-F682 HydrophobicContact CB-CD2 3.87Å; K675-F682 HydrophobicContact CB-CG 3.77Å; K675-F682 HydrophobicContact CD-CD1 4.47Å; K675-F682 HydrophobicContact CD-CD2 4.28Å; K675-F682 HydrophobicContact CD-CE2 4.43Å; K675-F682 HydrophobicContact CD-CG 4.31Å; K675-F682 HydrophobicContact CG-CB 4.23Å; K675-F682 HydrophobicContact CG-CD1 4.36Å; K675-F682 HydrophobicContact CG-CD2 4.35Å; K675-F682 HydrophobicContact CG-CG 4.03Å; H678-F682 PolarHBondContact O-N 2.83Å; I679-F682 HydrophobicContact CD1-CD1 3.82Å; I679-F682 HydrophobicContact CD1-CE1 4.47Å; I679-F682 WeakPolarHBondContact O-CB 3.35Å; I679-F682 PolarHBondContact O-N 2.99Å; Y680-F682 VanDerWaalsContact C-N 3.32Å; Y680-F682 PolarHBondContact O-N 3.47Å; F682-Y684 VanDerWaalsContact C-N 3.32Å; F682-Y684 PolarHBondContact O-N 2.79Å; F682-V685 PolarHBondContact O-N 3.44Å; F682-S686 WeakPolarHBondContact O-CB 3.45Å; F682-S686 PolarHBondContact O-N 3.28Å; F682-M761 HydrophobicContact CD2-CE 4.33Å; F682-M761 HydrophobicContact CE2-CB 4.31Å; F682-M761 HydrophobicContact CE2-CE 3.9Å; F682-M761 HydrophobicContact CZ-CB 4.49Å
683	E	97.6	Very high	96.6	Very high	10 Å²	10	27 Å²	27	5%	0.047	13%	0.132	C	C	.	.	H	α-helix	trans	-66.9	-34.6	-179.1	-69.9	-68	178.3	0	0	111.9	I679 Y680 S686 Q687 K766 R769 L855 V859	I679-E683 HydrophobicContact CG1-CG 4.46Å; I679-E683 WeakPolarHBondContact O-CG 3.41Å; I679-E683 PolarHBondContact O-N 3.24Å; Y680-E683 PolarHBondContact O-N 2.95Å; E683-S686 PolarHBondContact O-N 3.19Å; E683-Q687 WeakPolarHBondContact O-CB 3.46Å; E683-Q687 WeakPolarHBondContact O-CG 3.42Å; E683-Q687 PolarHBondContact O-N 3.18Å; E683-K766 VanDerWaalsContact CD-NZ 3.28Å; E683-K766 WeakPolarHBondContact OE1-CE 3.36Å; E683-K766 IonicContact OE1-NZ 2.86Å; E683-K766 PolarHBondContact OE1-NZ 2.8Å; E683-K766 IonicContact OE2-NZ 3.2Å; E683-K766 PolarHBondContact OE2-NZ 3.09Å; E683-R769 IonicContact OE2-CZ 2.75Å; E683-R769 IonicContact OE2-NH1 3.05Å; E683-R769 PolarHBondContact OE2-NH1 3.16Å; E683-R769 IonicContact OE2-NH2 2.82Å; E683-R769 PolarHBondContact OE2-NH2 3.35Å; E683-L855 HydrophobicContact CB-CD1 4.37Å; E683-L855 HydrophobicContact CB-CD2 4.43Å; E683-L855 HydrophobicContact CG-CD1 4.14Å; E683-L855 HydrophobicContact CG-CD2 4.3Å; E683-V859 HydrophobicContact CB-CG2 3.88Å
684	Y	97.5	Very high	96.7	Very high	16 Å²	16	26.9 Å²	26.9	6%	0.063	13%	0.132	C	C	.	.	H	α-helix	trans	-57.4	-57.2	173.5	-167.2	-116.4	0	0	0	111	Y595 Y599 L602 Y680 Q681 F682 S686 Q687 Y688 V859 N863	Y595-Y684 HydrophobicContact CE2-CD1 4.44Å; Y595-Y684 WeakPolarHBondContact OH-CD1 3.14Å; Y599-Y684 AromaticContact CD2-CE1 3.95Å; Y599-Y684 HydrophobicContact CD2-CE1 3.95Å; Y599-Y684 AromaticContact CE2-CE1 3.99Å; Y599-Y684 HydrophobicContact CE2-CE1 3.99Å; Y599-Y684 AromaticContact CE2-CZ 3.84Å; L602-Y684 HydrophobicContact CB-CE1 4.32Å; L602-Y684 HydrophobicContact CD1-CD1 4.48Å; L602-Y684 HydrophobicContact CD2-CD1 3.76Å; L602-Y684 HydrophobicContact CD2-CE1 3.85Å; L602-Y684 HydrophobicContact CG-CE1 4.49Å; Y680-Y684 WeakPolarHBondContact O-CB 3.08Å; Y680-Y684 PolarHBondContact O-N 2.84Å; Q681-Y684 PolarHBondContact O-N 2.95Å; F682-Y684 VanDerWaalsContact C-N 3.32Å; F682-Y684 PolarHBondContact O-N 2.79Å; Y684-S686 VanDerWaalsContact C-N 3.31Å; Y684-S686 PolarHBondContact O-N 3.37Å; Y684-Q687 PolarHBondContact O-N 3.01Å; Y684-Y688 HydrophobicContact CD1-CD2 4.4Å; Y684-Y688 HydrophobicContact CD1-CE2 4.24Å; Y684-Y688 HydrophobicContact CD2-CD2 4.43Å; Y684-Y688 AromaticContact CD2-CE2 3.83Å; Y684-Y688 HydrophobicContact CD2-CE2 3.83Å; Y684-Y688 HydrophobicContact CE1-CD2 4.3Å; Y684-Y688 AromaticContact CE1-CE2 3.83Å; Y684-Y688 HydrophobicContact CE1-CE2 3.83Å; Y684-Y688 HydrophobicContact CE2-CD2 4.41Å; Y684-Y688 AromaticContact CE2-CE2 3.46Å; Y684-Y688 HydrophobicContact CE2-CE2 3.46Å; Y684-Y688 VanDerWaalsContact CE2-CE2 3.46Å; Y684-Y688 HydrophobicContact CG-CD2 4.45Å; Y684-Y688 HydrophobicContact CG-CE2 4.23Å; Y684-Y688 AromaticContact CZ-CE2 3.42Å; Y684-Y688 VanDerWaalsContact CZ-CE2 3.42Å; Y684-Y688 VanDerWaalsContact O-CD2 3.25Å; Y684-Y688 WeakPolarHBondContact O-CD2 3.42Å; Y684-Y688 PolarHBondContact O-N 3.34Å; Y684-V859 HydrophobicContact CD2-CG1 3.47Å; Y684-V859 VanDerWaalsContact CD2-CG1 3.47Å; Y684-V859 HydrophobicContact CG-CG1 3.95Å; Y684-N863 WeakPolarHBondContact CD2-ND2 3.37Å; Y684-N863 WeakPolarHBondContact CE2-ND2 3.45Å
685	V	98.1	Very high	96.7	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.006	13%	0.132	C	C	.	.	H	α-helix	trans	-59.3	-43.8	176.7	-177.8	0	0	0	0	111.1	L602 M606 L671 F674 Q681 F682 Q687 Y688 L689	L602-V685 HydrophobicContact CD1-CG2 3.9Å; L602-V685 HydrophobicContact CD2-CB 4.47Å; L602-V685 HydrophobicContact CD2-CG2 3.88Å; L602-V685 HydrophobicContact CG-CG2 4.44Å; M606-V685 HydrophobicContact CG-CG1 4.2Å; M606-V685 HydrophobicContact SD-CG1 3.65Å; L671-V685 HydrophobicContact CD2-CB 4.24Å; L671-V685 HydrophobicContact CD2-CG1 3.91Å; F674-V685 HydrophobicContact CD2-CG2 3.59Å; F674-V685 HydrophobicContact CE2-CG2 3.86Å; Q681-V685 WeakPolarHBondContact O-CG2 2.99Å; Q681-V685 PolarHBondContact O-N 3.38Å; F682-V685 PolarHBondContact O-N 3.44Å; V685-Q687 PolarHBondContact O-N 3.07Å; V685-Y688 PolarHBondContact O-N 2.98Å; V685-L689 HydrophobicContact CG1-CD1 4.14Å; V685-L689 HydrophobicContact CG1-CG 4.44Å; V685-L689 WeakPolarHBondContact O-CG 3.29Å; V685-L689 PolarHBondContact O-N 3.36Å
686	S	98	Very high	96.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.2	-41	-179.4	-176.7	0	0	0	0	112.7	F682 E683 Y684 V690 L762 R769	F682-S686 WeakPolarHBondContact O-CB 3.45Å; F682-S686 PolarHBondContact O-N 3.28Å; E683-S686 PolarHBondContact O-N 3.19Å; Y684-S686 VanDerWaalsContact C-N 3.31Å; Y684-S686 PolarHBondContact O-N 3.37Å; S686-V690 VanDerWaalsContact O-CG2 3.29Å; S686-V690 WeakPolarHBondContact O-CG2 3.29Å; S686-V690 PolarHBondContact O-N 3.47Å; S686-V690 VanDerWaalsContact O-N 3.09Å; S686-L762 WeakPolarHBondContact OG-CD2 3.5Å; S686-R769 PolarHBondContact OG-NH1 2.81Å
687	Q	96	Very high	96.8	Very high	13 Å²	13	23.9 Å²	23.9	6%	0.061	12%	0.121	C	C	.	.	H	α-helix	trans	-67	-42.5	178.6	-79.9	-172.5	-24.9	0	0	111.1	E683 Y684 V685 V690 F691 E852	E683-Q687 WeakPolarHBondContact O-CB 3.46Å; E683-Q687 WeakPolarHBondContact O-CG 3.42Å; E683-Q687 PolarHBondContact O-N 3.18Å; Y684-Q687 PolarHBondContact O-N 3.01Å; V685-Q687 PolarHBondContact O-N 3.07Å; Q687-V690 PolarHBondContact O-N 3.13Å; Q687-F691 WeakPolarHBondContact O-CB 3.38Å; Q687-F691 PolarHBondContact O-N 2.87Å; Q687-E852 PolarHBondContact NE2-O 2.8Å; Q687-E852 PolarHBondContact NE2-OE2 2.8Å; Q687-E852 VanDerWaalsContact NE2-OE2 3.09Å
688	Y	97.1	Very high	96.9	Very high	44 Å²	44	22 Å²	22	17%	0.173	11%	0.111	C	C	.	.	H	α-helix	trans	-65.1	-38.5	175.7	-77.8	-67.3	0	0	0	113	L602 P603 Y684 V685 V690 F691 A692	L602-Y688 HydrophobicContact CD2-CD2 4.31Å; P603-Y688 HydrophobicContact CB-CD1 3.66Å; P603-Y688 HydrophobicContact CB-CD2 4.45Å; P603-Y688 HydrophobicContact CB-CE1 3.6Å; P603-Y688 HydrophobicContact CB-CE2 4.42Å; P603-Y688 HydrophobicContact CB-CG 4.09Å; P603-Y688 HydrophobicContact CG-CD1 4Å; P603-Y688 HydrophobicContact CG-CD2 4.08Å; P603-Y688 HydrophobicContact CG-CE1 3.59Å; P603-Y688 HydrophobicContact CG-CE2 3.71Å; P603-Y688 HydrophobicContact CG-CG 4.22Å; P603-Y688 VanDerWaalsContact CG-CZ 3.42Å; Y684-Y688 HydrophobicContact CD1-CD2 4.4Å; Y684-Y688 HydrophobicContact CD1-CE2 4.24Å; Y684-Y688 HydrophobicContact CD2-CD2 4.43Å; Y684-Y688 AromaticContact CD2-CE2 3.83Å; Y684-Y688 HydrophobicContact CD2-CE2 3.83Å; Y684-Y688 HydrophobicContact CE1-CD2 4.3Å; Y684-Y688 AromaticContact CE1-CE2 3.83Å; Y684-Y688 HydrophobicContact CE1-CE2 3.83Å; Y684-Y688 HydrophobicContact CE2-CD2 4.41Å; Y684-Y688 AromaticContact CE2-CE2 3.46Å; Y684-Y688 HydrophobicContact CE2-CE2 3.46Å; Y684-Y688 VanDerWaalsContact CE2-CE2 3.46Å; Y684-Y688 HydrophobicContact CG-CD2 4.45Å; Y684-Y688 HydrophobicContact CG-CE2 4.23Å; Y684-Y688 AromaticContact CZ-CE2 3.42Å; Y684-Y688 VanDerWaalsContact CZ-CE2 3.42Å; Y684-Y688 VanDerWaalsContact O-CD2 3.25Å; Y684-Y688 WeakPolarHBondContact O-CD2 3.42Å; Y684-Y688 PolarHBondContact O-N 3.34Å; V685-Y688 PolarHBondContact O-N 2.98Å; Y688-V690 VanDerWaalsContact C-N 3.34Å; Y688-V690 PolarHBondContact O-N 3.05Å; Y688-F691 PolarHBondContact O-N 3.44Å; Y688-A692 WeakPolarHBondContact O-CB 3.5Å; Y688-A692 PolarHBondContact O-N 3.1Å
689	L	98.3	Very high	97	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.4	-43.4	173.5	-71.9	173.9	0	0	0	111.6	M606 L610 L667 L671 V685 A692 N693 C694 L762	M606-L689 HydrophobicContact CB-CD2 4.07Å; M606-L689 HydrophobicContact CG-CD2 4.31Å; M606-L689 HydrophobicContact SD-CD2 4.02Å; M606-L689 HydrophobicContact SD-CG 4.36Å; L610-L689 HydrophobicContact CD1-CD2 3.82Å; L610-L689 HydrophobicContact CD2-CD2 4.2Å; L610-L689 HydrophobicContact CG-CD2 4.11Å; L667-L689 HydrophobicContact CD2-CD1 4.44Å; L667-L689 HydrophobicContact CD2-CD2 3.9Å; L671-L689 HydrophobicContact CD1-CD1 4Å; L671-L689 HydrophobicContact CD2-CD1 4.06Å; L671-L689 HydrophobicContact CG-CD1 4.3Å; V685-L689 HydrophobicContact CG1-CD1 4.14Å; V685-L689 HydrophobicContact CG1-CG 4.44Å; V685-L689 WeakPolarHBondContact O-CG 3.29Å; V685-L689 PolarHBondContact O-N 3.36Å; L689-A692 PolarHBondContact O-N 3.37Å; L689-N693 PolarHBondContact O-N 3.02Å; L689-C694 HydrophobicContact CB-CB 3.97Å; L689-C694 WeakPolarHBondContact O-CB 3.44Å; L689-C694 PolarHBondContact O-N 3.36Å; L689-L762 HydrophobicContact CB-CD1 4.47Å; L689-L762 HydrophobicContact CB-CD2 4.29Å; L689-L762 HydrophobicContact CD1-CD2 4.16Å
690	V	96.5	Very high	96.9	Very high	26 Å²	26	25.3 Å²	25.3	16%	0.158	13%	0.125	C	C	.	.	H	α-helix	trans	-65	-45.3	177.4	173.3	0	0	0	0	111	S686 Q687 Y688 A692 N693 I695 L762 R769 L772	S686-V690 VanDerWaalsContact O-CG2 3.29Å; S686-V690 WeakPolarHBondContact O-CG2 3.29Å; S686-V690 PolarHBondContact O-N 3.47Å; S686-V690 VanDerWaalsContact O-N 3.09Å; Q687-V690 PolarHBondContact O-N 3.13Å; Y688-V690 VanDerWaalsContact C-N 3.34Å; Y688-V690 PolarHBondContact O-N 3.05Å; V690-A692 VanDerWaalsContact C-N 3.34Å; V690-A692 PolarHBondContact O-N 3.33Å; V690-N693 PolarHBondContact O-N 3.34Å; V690-N693 VanDerWaalsContact O-N 3.14Å; V690-I695 HydrophobicContact CG1-CD1 4.3Å; V690-I695 HydrophobicContact CG2-CD1 4.04Å; V690-I695 HydrophobicContact CG2-CG1 4.44Å; V690-L762 HydrophobicContact CG2-CB 4.38Å; V690-L762 HydrophobicContact CG2-CD1 4.36Å; V690-R769 HydrophobicContact CG2-CG 4.43Å; V690-L772 HydrophobicContact CG1-CD2 4.32Å
691	F	94.5	Very high	96.8	Very high	133 Å²	133	25.3 Å²	25.3	58%	0.583	13%	0.125	S	C	*	.	H	α-helix	trans	-60.5	-41.7	176.6	176.2	-99.9	0	0	0	112.2	Q687 Y688 N693	Q687-F691 WeakPolarHBondContact O-CB 3.38Å; Q687-F691 PolarHBondContact O-N 2.87Å; Y688-F691 PolarHBondContact O-N 3.44Å; F691-N693 PolarHBondContact O-N 3.05Å
692	A	96	Very high	96.7	Very high	23 Å²	23	25.4 Å²	25.4	19%	0.19	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	19.6	176.3	0	0	0	0	0	113.7	I607 L610 Y688 L689 V690 C694	I607-A692 HydrophobicContact CG1-CB 3.7Å; L610-A692 HydrophobicContact CD1-CB 3.58Å; Y688-A692 WeakPolarHBondContact O-CB 3.5Å; Y688-A692 PolarHBondContact O-N 3.1Å; L689-A692 PolarHBondContact O-N 3.37Å; V690-A692 VanDerWaalsContact C-N 3.34Å; V690-A692 PolarHBondContact O-N 3.33Å; A692-C694 VanDerWaalsContact C-N 3.33Å; A692-C694 PolarHBondContact O-N 3.36Å
693	N	95.6	Very high	96.5	Very high	101 Å²	101	29.5 Å²	29.5	54%	0.54	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	31.3	174.7	-67.6	-51.3	0	0	0	114.9	L689 V690 F691 I695 P696 L697	L689-N693 PolarHBondContact O-N 3.02Å; V690-N693 PolarHBondContact O-N 3.34Å; V690-N693 VanDerWaalsContact O-N 3.14Å; F691-N693 PolarHBondContact O-N 3.05Å; N693-I695 VanDerWaalsContact C-N 3.35Å; N693-I695 PolarHBondContact O-N 3.18Å; N693-P696 HydrophobicContact CB-CG 3.77Å; N693-P696 VanDerWaalsContact O-CD 3.27Å; N693-P696 WeakPolarHBondContact O-CD 3.22Å; N693-P696 VanDerWaalsContact O-CG 3.29Å; N693-P696 WeakPolarHBondContact O-CG 3.36Å; N693-L697 VanDerWaalsContact O-CB 3.31Å; N693-L697 WeakPolarHBondContact O-CB 3.49Å; N693-L697 PolarHBondContact O-N 3.12Å; N693-L697 VanDerWaalsContact O-N 3.08Å
694	C	97.8	Very high	96.2	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.007	15%	0.153	C	C	.	.	H	α-helix	trans	-60.1	-41.6	175.7	-176.5	0	0	0	0	112.7	L610 L689 A692 L697 I698 L762	L610-C694 HydrophobicContact CD1-CB 3.84Å; L610-C694 HydrophobicContact CD2-CB 3.95Å; L689-C694 HydrophobicContact CB-CB 3.97Å; L689-C694 WeakPolarHBondContact O-CB 3.44Å; L689-C694 PolarHBondContact O-N 3.36Å; A692-C694 VanDerWaalsContact C-N 3.33Å; A692-C694 PolarHBondContact O-N 3.36Å; C694-L697 WeakPolarHBondContact O-CB 3.48Å; C694-L697 PolarHBondContact O-N 2.85Å; C694-I698 WeakPolarHBondContact O-CG1 3.36Å; C694-I698 PolarHBondContact O-N 3.08Å; C694-L762 HydrophobicContact CB-CD1 4.37Å
695	I	97.2	Very high	95.9	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-57.9	-58.9	179.2	-66.9	178.3	0	0	0	111.6	V690 N693 L697 I698 L699 L759 L762 T763 R769 L773 F776	V690-I695 HydrophobicContact CG1-CD1 4.3Å; V690-I695 HydrophobicContact CG2-CD1 4.04Å; V690-I695 HydrophobicContact CG2-CG1 4.44Å; N693-I695 VanDerWaalsContact C-N 3.35Å; N693-I695 PolarHBondContact O-N 3.18Å; I695-L697 VanDerWaalsContact C-N 3.26Å; I695-L697 PolarHBondContact O-N 2.86Å; I695-I698 PolarHBondContact O-N 2.99Å; I695-L699 HydrophobicContact CG2-CD1 4.16Å; I695-L699 WeakPolarHBondContact O-CG 3.31Å; I695-L699 PolarHBondContact O-N 3.34Å; I695-L759 HydrophobicContact CB-CD1 4.29Å; I695-L759 HydrophobicContact CG1-CD1 3.91Å; I695-L759 HydrophobicContact CG2-CD1 4.13Å; I695-L762 HydrophobicContact CG1-CD1 4.35Å; I695-T763 HydrophobicContact CD1-CG2 4.08Å; I695-R769 HydrophobicContact CD1-CB 4.41Å; I695-L773 HydrophobicContact CG2-CD2 3.76Å; I695-F776 HydrophobicContact CG2-CD2 4.31Å
696	P	96.4	Very high	95.7	Very high	30 Å²	30	34.6 Å²	34.6	20%	0.195	17%	0.172	C	C	.	.	H	α-helix	trans	-64	-30.7	178.7	24.7	-34.4	0	0	0	112.7	N693 L699 K700 F776	N693-P696 HydrophobicContact CB-CG 3.77Å; N693-P696 VanDerWaalsContact O-CD 3.27Å; N693-P696 WeakPolarHBondContact O-CD 3.22Å; N693-P696 VanDerWaalsContact O-CG 3.29Å; N693-P696 WeakPolarHBondContact O-CG 3.36Å; P696-L699 PolarHBondContact O-N 3.13Å; P696-K700 WeakPolarHBondContact O-CB 3.27Å; P696-K700 PolarHBondContact O-N 3.48Å; P696-F776 HydrophobicContact CB-CD1 4.28Å; P696-F776 HydrophobicContact CB-CD2 4.48Å; P696-F776 HydrophobicContact CB-CE1 3.97Å; P696-F776 HydrophobicContact CB-CE2 4.18Å; P696-F776 HydrophobicContact CB-CZ 3.93Å; P696-F776 HydrophobicContact CG-CE1 4.47Å; P696-F776 HydrophobicContact CG-CE2 4.17Å; P696-F776 HydrophobicContact CG-CZ 3.97Å
697	L	96.1	Very high	95.3	Very high	19 Å²	19	37.2 Å²	37.2	10%	0.099	19%	0.188	C	C	.	.	H	α-helix	trans	-60.7	-49.8	173.5	175.5	60.3	0	0	0	112	L610 L613 L614 N693 C694 I695 L699 K700 F701	L610-L697 HydrophobicContact CB-CD2 4.17Å; L610-L697 HydrophobicContact CD2-CD2 3.98Å; L613-L697 HydrophobicContact CB-CD2 4.25Å; L613-L697 HydrophobicContact CD2-CD2 3.92Å; L613-L697 HydrophobicContact CG-CD2 4.14Å; L614-L697 HydrophobicContact CB-CD1 3.8Å; L614-L697 HydrophobicContact CB-CD2 4.43Å; L614-L697 HydrophobicContact CD1-CD1 3.63Å; L614-L697 HydrophobicContact CG-CD1 4.27Å; N693-L697 VanDerWaalsContact O-CB 3.31Å; N693-L697 WeakPolarHBondContact O-CB 3.49Å; N693-L697 PolarHBondContact O-N 3.12Å; N693-L697 VanDerWaalsContact O-N 3.08Å; C694-L697 WeakPolarHBondContact O-CB 3.48Å; C694-L697 PolarHBondContact O-N 2.85Å; I695-L697 VanDerWaalsContact C-N 3.26Å; I695-L697 PolarHBondContact O-N 2.86Å; L697-L699 VanDerWaalsContact C-N 3.32Å; L697-L699 PolarHBondContact O-N 3.33Å; L697-K700 WeakPolarHBondContact O-CB 3.32Å; L697-K700 PolarHBondContact O-N 3.08Å; L697-F701 PolarHBondContact O-N 3.29Å
698	I	97.7	Very high	95	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-61.9	-42.5	177.2	-67.4	172.9	0	0	0	110.2	C694 I695 K700 F701 F702 L755 I758 L759	C694-I698 WeakPolarHBondContact O-CG1 3.36Å; C694-I698 PolarHBondContact O-N 3.08Å; I695-I698 PolarHBondContact O-N 2.99Å; I698-K700 VanDerWaalsContact C-N 3.33Å; I698-K700 PolarHBondContact O-N 3.35Å; I698-F701 WeakPolarHBondContact O-CB 3.42Å; I698-F701 PolarHBondContact O-N 3.15Å; I698-F702 HydrophobicContact CG2-CD2 3.81Å; I698-F702 HydrophobicContact CG2-CE2 3.86Å; I698-F702 VanDerWaalsContact O-CD2 3.32Å; I698-F702 WeakPolarHBondContact O-CD2 3.39Å; I698-F702 PolarHBondContact O-N 2.9Å; I698-L755 HydrophobicContact CD1-CD2 4.42Å; I698-L755 HydrophobicContact CG1-CD2 4.2Å; I698-L755 HydrophobicContact CG2-CB 4.14Å; I698-I758 HydrophobicContact CD1-CB 4.47Å; I698-I758 HydrophobicContact CD1-CG2 4.1Å; I698-L759 HydrophobicContact CD1-CB 4.32Å; I698-L759 HydrophobicContact CG2-CB 4.41Å; I698-L759 HydrophobicContact CG2-CD2 3.99Å
699	L	96.4	Very high	94.8	Very high	7 Å²	7	41.3 Å²	41.3	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-40	177.2	-66.6	178.6	0	0	0	112.3	I695 P696 L697 F701 F702 N703 L759 L773 F776 S778 I781	I695-L699 HydrophobicContact CG2-CD1 4.16Å; I695-L699 WeakPolarHBondContact O-CG 3.31Å; I695-L699 PolarHBondContact O-N 3.34Å; P696-L699 PolarHBondContact O-N 3.13Å; L697-L699 VanDerWaalsContact C-N 3.32Å; L697-L699 PolarHBondContact O-N 3.33Å; L699-F701 VanDerWaalsContact C-N 3.35Å; L699-F702 PolarHBondContact O-N 3.13Å; L699-N703 WeakPolarHBondContact O-CB 3.49Å; L699-N703 PolarHBondContact O-N 3.35Å; L699-L759 HydrophobicContact CD2-CD2 4.13Å; L699-L773 HydrophobicContact CD1-CD2 4.19Å; L699-L773 HydrophobicContact CD2-CD2 4.41Å; L699-F776 HydrophobicContact CD1-CB 3.64Å; L699-F776 HydrophobicContact CD1-CG 4.38Å; L699-S778 VanDerWaalsContact CD2-CB 3.49Å; L699-I781 HydrophobicContact CB-CD1 4.29Å
700	K	94.6	Very high	94.5	Very high	100 Å²	100	41.4 Å²	41.4	44%	0.435	21%	0.212	S	C	.	.	H	α-helix	trans	-62.5	-42.6	173.8	-174.7	-177.7	175.7	-174.2	0	111.1	P696 L697 I698 F702 N703	P696-K700 WeakPolarHBondContact O-CB 3.27Å; P696-K700 PolarHBondContact O-N 3.48Å; L697-K700 WeakPolarHBondContact O-CB 3.32Å; L697-K700 PolarHBondContact O-N 3.08Å; I698-K700 VanDerWaalsContact C-N 3.33Å; I698-K700 PolarHBondContact O-N 3.35Å; K700-F702 VanDerWaalsContact C-N 3.33Å; K700-F702 PolarHBondContact O-N 2.91Å; K700-N703 PolarHBondContact O-N 2.97Å
701	F	95.5	Very high	94.1	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-57.7	-43.2	175.1	-176.8	-80.8	0	0	0	112.1	P618 V660 L697 I698 L699 N703 Q704 Y709 L755	P618-F701 HydrophobicContact CG-CE2 4.36Å; V660-F701 HydrophobicContact CG1-CE2 3.69Å; V660-F701 HydrophobicContact CG1-CZ 3.84Å; V660-F701 HydrophobicContact CG2-CE2 4.21Å; L697-F701 PolarHBondContact O-N 3.29Å; I698-F701 WeakPolarHBondContact O-CB 3.42Å; I698-F701 PolarHBondContact O-N 3.15Å; L699-F701 VanDerWaalsContact C-N 3.35Å; F701-N703 VanDerWaalsContact C-N 3.3Å; F701-N703 PolarHBondContact O-N 3.48Å; F701-Q704 WeakPolarHBondContact O-CG 3.44Å; F701-Q704 PolarHBondContact O-NE2 3.34Å; F701-Y709 AromaticContact CE1-CE1 3.87Å; F701-Y709 HydrophobicContact CE1-CE1 3.87Å; F701-Y709 AromaticContact CZ-CE1 3.6Å; F701-Y709 HydrophobicContact CZ-CE1 3.6Å; F701-Y709 AromaticContact CZ-CZ 3.68Å; F701-Y709 WeakPolarHBondContact CZ-OH 3.41Å; F701-L755 HydrophobicContact CD1-CD1 3.66Å; F701-L755 HydrophobicContact CD2-CD1 4.21Å; F701-L755 HydrophobicContact CE1-CD1 3.72Å; F701-L755 HydrophobicContact CE2-CD1 4.26Å; F701-L755 HydrophobicContact CG-CD1 3.93Å; F701-L755 HydrophobicContact CZ-CD1 4.02Å
702	F	96.4	Very high	93.8	Very high	3 Å²	3	38.3 Å²	38.3	1%	0.013	21%	0.205	C	C	.	.	H	α-helix	trans	-77.2	-12.6	176	-81	-77.7	0	0	0	114.2	I698 L699 K700 Q704 I706 C752 L755 L756 I781 A785	I698-F702 HydrophobicContact CG2-CD2 3.81Å; I698-F702 HydrophobicContact CG2-CE2 3.86Å; I698-F702 VanDerWaalsContact O-CD2 3.32Å; I698-F702 WeakPolarHBondContact O-CD2 3.39Å; I698-F702 PolarHBondContact O-N 2.9Å; L699-F702 PolarHBondContact O-N 3.13Å; K700-F702 VanDerWaalsContact C-N 3.33Å; K700-F702 PolarHBondContact O-N 2.91Å; F702-Q704 PolarHBondContact O-N 3.32Å; F702-I706 HydrophobicContact CD1-CD1 3.7Å; F702-I706 HydrophobicContact CD1-CG1 4.04Å; F702-I706 HydrophobicContact CE1-CD1 3.89Å; F702-I706 HydrophobicContact CE1-CG1 4.2Å; F702-C752 HydrophobicContact CE1-CB 4.04Å; F702-C752 HydrophobicContact CZ-CB 3.94Å; F702-C752 WeakPolarHBondContact CZ-O 3.44Å; F702-L755 HydrophobicContact CE2-CB 4.02Å; F702-L756 HydrophobicContact CE1-CD1 4.19Å; F702-L756 HydrophobicContact CE1-CD2 4.45Å; F702-L756 HydrophobicContact CE1-CG 4.22Å; F702-L756 HydrophobicContact CE2-CD2 3.99Å; F702-L756 HydrophobicContact CE2-CG 3.88Å; F702-L756 HydrophobicContact CZ-CD1 3.89Å; F702-L756 HydrophobicContact CZ-CD2 3.95Å; F702-L756 HydrophobicContact CZ-CG 3.51Å; F702-I781 HydrophobicContact CB-CG2 3.62Å; F702-A785 HydrophobicContact CD1-CB 4.29Å
703	N	93.3	Very high	93.2	Very high	86 Å²	86	43 Å²	43	46%	0.46	22%	0.221	S	C	.	.	S	Bend	trans	-82.4	50.5	-179.6	-166.3	33.8	0	0	0	112.6	L699 K700 F701 I781 R784	L699-N703 WeakPolarHBondContact O-CB 3.49Å; L699-N703 PolarHBondContact O-N 3.35Å; K700-N703 PolarHBondContact O-N 2.97Å; F701-N703 VanDerWaalsContact C-N 3.3Å; F701-N703 PolarHBondContact O-N 3.48Å; N703-I781 HydrophobicContact CB-CD1 4.14Å; N703-I781 HydrophobicContact CB-CG1 4.33Å; N703-I781 HydrophobicContact CB-CG2 4.36Å; N703-R784 PolarHBondContact OD1-NH1 3.38Å
704	Q	92.1	Very high	92.8	Very high	35 Å²	35	39.1 Å²	39.1	16%	0.164	20%	0.2	C	C	.	.	S	Bend	trans	-137	179.3	174.1	63.3	-177.9	-6.2	0	0	109.7	P618 T619 F701 F702 I706	P618-Q704 VanDerWaalsContact CG-NE2 3.29Å; T619-Q704 HydrophobicContact CG2-CB 3.98Å; T619-Q704 HydrophobicContact CG2-CG 4.41Å; F701-Q704 WeakPolarHBondContact O-CG 3.44Å; F701-Q704 PolarHBondContact O-NE2 3.34Å; F702-Q704 PolarHBondContact O-N 3.32Å; Q704-I706 PolarHBondContact O-N 3.2Å
705	E	91.2	Very high	92.3	Very high	97 Å²	97	42 Å²	42	45%	0.453	22%	0.217	S	C	.	.			trans	-72.5	81.3	170	-72.9	-58.7	151.1	0	0	109.9	T707 L708 Y709	E705-T707 PolarHBondContact O-N 3.43Å; E705-L708 HydrophobicContact CB-CB 4.28Å; E705-L708 HydrophobicContact CB-CD1 3.93Å; E705-L708 HydrophobicContact CB-CG 4.19Å; E705-L708 HydrophobicContact CG-CD1 4.44Å; E705-L708 PolarHBondContact O-N 3.06Å; E705-Y709 PolarHBondContact O-N 2.76Å; E705-Y709 VanDerWaalsContact O-N 3.09Å
706	I	92.1	Very high	91.8	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-61.7	-28.1	-172.4	-164.5	70.4	0	0	0	113.3	F702 Q704 Y709 I710 V788	F702-I706 HydrophobicContact CD1-CD1 3.7Å; F702-I706 HydrophobicContact CD1-CG1 4.04Å; F702-I706 HydrophobicContact CE1-CD1 3.89Å; F702-I706 HydrophobicContact CE1-CG1 4.2Å; Q704-I706 PolarHBondContact O-N 3.2Å; I706-Y709 HydrophobicContact CD1-CD1 3.94Å; I706-Y709 PolarHBondContact O-N 3.38Å; I706-I710 HydrophobicContact CG1-CD1 4.25Å; I706-I710 WeakPolarHBondContact O-CG1 3.28Å; I706-I710 PolarHBondContact O-N 3.05Å; I706-V788 HydrophobicContact CG2-CG2 3.91Å
707	T	90.3	Very high	91.1	Very high	56 Å²	56	43.6 Å²	43.6	34%	0.344	23%	0.229	S	C	.	.	H	α-helix	trans	-62.7	-47.3	173.3	-55.8	0	0	0	0	110.7	E705 Y709 I710 T711	E705-T707 PolarHBondContact O-N 3.43Å; T707-Y709 VanDerWaalsContact C-N 3.33Å; T707-Y709 PolarHBondContact O-N 3.09Å; T707-I710 PolarHBondContact O-N 2.68Å; T707-T711 WeakPolarHBondContact O-CG2 3.23Å; T707-T711 PolarHBondContact O-N 3.19Å; T707-T711 VanDerWaalsContact O-N 3.13Å; T707-T711 PolarHBondContact O-OG1 3.02Å
708	L	90.2	Very high	90.3	Very high	119 Å²	119	44.9 Å²	44.9	62%	0.623	24%	0.239	S	C	*	.	H	α-helix	trans	-66.1	-37	177.8	-65.7	178	0	0	0	112	E705 I710 T711 S712	E705-L708 HydrophobicContact CB-CB 4.28Å; E705-L708 HydrophobicContact CB-CD1 3.93Å; E705-L708 HydrophobicContact CB-CG 4.19Å; E705-L708 HydrophobicContact CG-CD1 4.44Å; E705-L708 PolarHBondContact O-N 3.06Å; L708-I710 VanDerWaalsContact C-N 3.32Å; L708-I710 PolarHBondContact O-N 3.36Å; L708-T711 CarbonylContact O-C 3.55Å; L708-T711 PolarHBondContact O-N 3.05Å; L708-T711 PolarHBondContact O-OG1 3.47Å; L708-S712 PolarHBondContact O-N 3.35Å
709	Y	92.2	Very high	89.7	Confident	23 Å²	23	45.6 Å²	45.6	9%	0.09	24%	0.243	C	C	.	.	H	α-helix	trans	-63.1	-38.2	176	177.2	-111.1	0	0	0	112.3	P618 F701 E705 I706 T707 S712 N748	P618-Y709 HydrophobicContact CB-CD2 4.46Å; P618-Y709 HydrophobicContact CB-CE2 4.39Å; P618-Y709 HydrophobicContact CG-CD2 4.06Å; P618-Y709 HydrophobicContact CG-CE2 3.87Å; F701-Y709 AromaticContact CE1-CE1 3.87Å; F701-Y709 HydrophobicContact CE1-CE1 3.87Å; F701-Y709 AromaticContact CZ-CE1 3.6Å; F701-Y709 HydrophobicContact CZ-CE1 3.6Å; F701-Y709 AromaticContact CZ-CZ 3.68Å; F701-Y709 WeakPolarHBondContact CZ-OH 3.41Å; E705-Y709 PolarHBondContact O-N 2.76Å; E705-Y709 VanDerWaalsContact O-N 3.09Å; I706-Y709 HydrophobicContact CD1-CD1 3.94Å; I706-Y709 PolarHBondContact O-N 3.38Å; T707-Y709 VanDerWaalsContact C-N 3.33Å; T707-Y709 PolarHBondContact O-N 3.09Å; Y709-S712 PolarHBondContact O-OG 3.07Å; Y709-N748 HydrophobicContact CD1-CB 4.08Å; Y709-N748 HydrophobicContact CE1-CB 3.62Å; Y709-N748 HydrophobicContact CE2-CB 4.39Å; Y709-N748 WeakPolarHBondContact CE2-ND2 3.47Å; Y709-N748 VanDerWaalsContact CZ-OD1 3.29Å; Y709-N748 PolarHBondContact O-ND2 3.05Å; Y709-N748 PolarHBondContact OH-OD1 3.17Å
710	I	91.6	Very high	89.3	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-75.2	-29.2	178.7	-70.8	173.4	0	0	0	111.7	I706 T707 L708 C744 C745 M749 V788 L793	I706-I710 HydrophobicContact CG1-CD1 4.25Å; I706-I710 WeakPolarHBondContact O-CG1 3.28Å; I706-I710 PolarHBondContact O-N 3.05Å; T707-I710 PolarHBondContact O-N 2.68Å; L708-I710 VanDerWaalsContact C-N 3.32Å; L708-I710 PolarHBondContact O-N 3.36Å; I710-C744 HydrophobicContact CG2-CB 3.64Å; I710-C744 CarbonylContact O-C 3.47Å; I710-C744 WeakPolarHBondContact O-CA 3.25Å; I710-C744 WeakPolarHBondContact O-CB 3.3Å; I710-C745 PolarHBondContact O-N 3.44Å; I710-M749 HydrophobicContact CD1-CE 4.31Å; I710-M749 HydrophobicContact CD1-SD 4.16Å; I710-M749 HydrophobicContact CG2-CB 4.48Å; I710-M749 HydrophobicContact CG2-CE 3.64Å; I710-M749 HydrophobicContact CG2-SD 4.46Å; I710-V788 HydrophobicContact CD1-CB 4.19Å; I710-V788 HydrophobicContact CD1-CG1 3.6Å; I710-V788 HydrophobicContact CD1-CG2 3.61Å; I710-L793 HydrophobicContact CD1-CD1 3.98Å
711	T	89	Confident	89.2	Confident	66 Å²	66	42.3 Å²	42.3	41%	0.405	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	10.7	178.5	62.5	0	0	0	0	113.2	T707 L708	T707-T711 WeakPolarHBondContact O-CG2 3.23Å; T707-T711 PolarHBondContact O-N 3.19Å; T707-T711 VanDerWaalsContact O-N 3.13Å; T707-T711 PolarHBondContact O-OG1 3.02Å; L708-T711 CarbonylContact O-C 3.55Å; L708-T711 PolarHBondContact O-N 3.05Å; L708-T711 PolarHBondContact O-OG1 3.47Å
712	S	88.1	Confident	88.9	Confident	27 Å²	27	42.4 Å²	42.4	19%	0.189	23%	0.229	C	C	.	.			trans	-65.1	144.2	176.8	60.3	0	0	0	0	110.5	E657 L708 Y709 C745 N748	E657-S712 PolarHBondContact OE1-OG 3.41Å; L708-S712 PolarHBondContact O-N 3.35Å; Y709-S712 PolarHBondContact O-OG 3.07Å; S712-C745 WeakPolarHBondContact O-CB 3.3Å; S712-N748 PolarHBondContact OG-ND2 2.98Å
713	K	84	Confident	88.4	Confident	122 Å²	122	43.9 Å²	43.9	53%	0.53	24%	0.242	S	C	.	.			trans	-120.8	103.5	176.4	-61.7	-174.1	-174.3	-178.6	0	107.8	D740	K713-D740 WeakPolarHBondContact CE-O 3.36Å; K713-D740 PolarHBondContact NZ-O 3.32Å
714	N	87.4	Confident	88.1	Confident	19 Å²	19	41.5 Å²	41.5	10%	0.102	23%	0.227	C	C	.	.			trans	-126.4	16.5	-180	-59.4	-52.8	0	0	0	111.1	K653 R654 E657	K653-N714 HydrophobicContact CB-CB 4.03Å; K653-N714 VanDerWaalsContact CB-CG 3.5Å; K653-N714 VanDerWaalsContact CD-OD1 3.29Å; K653-N714 WeakPolarHBondContact CD-OD1 3.09Å; R654-N714 HydrophobicContact CB-CB 4.42Å; R654-N714 WeakPolarHBondContact CB-O 3.12Å; E657-N714 PolarHBondContact OE1-ND2 3.3Å
715	T	86.9	Confident	87.9	Confident	61 Å²	61	41.3 Å²	41.3	37%	0.374	23%	0.227	S	C	.	.			trans	-104.3	132.2	175.3	-63.4	0	0	0	0	107.5	E720 R747	T715-E720 HydrophobicContact CG2-CG 4.19Å; T715-E720 WeakPolarHBondContact CG2-OE1 3.37Å; T715-R747 PolarHBondContact OG1-NH2 3.11Å; T715-R747 VanDerWaalsContact OG1-NH2 3.09Å
716	L	85.8	Confident	87.6	Confident	9 Å²	9	37.8 Å²	37.8	5%	0.047	21%	0.211	C	C	.	.			trans	-116.3	90	-178.3	-61.2	-179.6	0	0	0	107.1	Y41 I647 C718 L719 E720 V737	Y41-L716 HydrophobicContact CD2-CD1 4.29Å; Y41-L716 HydrophobicContact CE2-CB 3.98Å; Y41-L716 HydrophobicContact CE2-CD1 3.8Å; Y41-L716 HydrophobicContact CE2-CG 3.99Å; Y41-L716 PolarHBondContact OH-N 3.28Å; I647-L716 HydrophobicContact CG1-CD1 4.31Å; I647-L716 HydrophobicContact CG2-CD1 4.27Å; L716-C718 PolarHBondContact O-N 3.32Å; L716-C718 VanDerWaalsContact O-N 3.09Å; L716-L719 HydrophobicContact CB-CB 4.22Å; L716-L719 HydrophobicContact CB-CD1 4.2Å; L716-L719 HydrophobicContact CB-CG 4.38Å; L716-L719 HydrophobicContact CD1-CD1 3.77Å; L716-L719 PolarHBondContact O-N 3.3Å; L716-E720 PolarHBondContact O-N 2.83Å; L716-V737 HydrophobicContact CD2-CB 4.19Å; L716-V737 HydrophobicContact CD2-CG1 3.71Å; L716-V737 HydrophobicContact CD2-CG2 4.05Å
717	S	81.2	Confident	86.9	Confident	57 Å²	57	40.9 Å²	40.9	40%	0.399	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-55.2	-33.2	-168.2	-50.8	0	0	0	0	113.5	L719 E720 D740	S717-L719 VanDerWaalsContact C-N 3.28Å; S717-L719 PolarHBondContact O-N 3.07Å; S717-E720 PolarHBondContact O-N 2.84Å; S717-D740 PolarHBondContact OG-OD2 3.28Å
718	C	80.2	Confident	85.8	Confident	45 Å²	45	47.3 Å²	47.3	30%	0.304	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-72.3	-14.2	176.4	61	0	0	0	0	115.1	L716 R724	L716-C718 PolarHBondContact O-N 3.32Å; L716-C718 VanDerWaalsContact O-N 3.09Å; C718-R724 VanDerWaalsContact O-CD 3.3Å; C718-R724 WeakPolarHBondContact O-CD 3.43Å
719	L	84.7	Confident	84.6	Confident	16 Å²	16	47.2 Å²	47.2	8%	0.084	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-106	-4.6	178	-66.2	-178.6	0	0	0	112.8	Y41 I647 L716 S717 R724 L732	Y41-L719 HydrophobicContact CD1-CB 3.71Å; Y41-L719 WeakPolarHBondContact CD1-O 3.43Å; Y41-L719 HydrophobicContact CD2-CB 4.42Å; Y41-L719 HydrophobicContact CD2-CD1 4.05Å; Y41-L719 HydrophobicContact CE1-CB 3.8Å; Y41-L719 HydrophobicContact CE2-CD1 4.45Å; Y41-L719 HydrophobicContact CG-CB 4.05Å; Y41-L719 HydrophobicContact CG-CD1 4.2Å; I647-L719 HydrophobicContact CD1-CD1 4.29Å; I647-L719 HydrophobicContact CG1-CD1 4.34Å; I647-L719 HydrophobicContact CG2-CD1 3.75Å; L716-L719 HydrophobicContact CB-CB 4.22Å; L716-L719 HydrophobicContact CB-CD1 4.2Å; L716-L719 HydrophobicContact CB-CG 4.38Å; L716-L719 HydrophobicContact CD1-CD1 3.77Å; L716-L719 PolarHBondContact O-N 3.3Å; S717-L719 VanDerWaalsContact C-N 3.28Å; S717-L719 PolarHBondContact O-N 3.07Å; L719-R724 HydrophobicContact CD2-CG 4.47Å; L719-L732 HydrophobicContact CD2-CD2 3.79Å; L719-L732 HydrophobicContact CG-CD2 4.31Å
720	E	88.9	Confident	83.2	Confident	25 Å²	25	52.6 Å²	52.6	12%	0.117	29%	0.292	C	S	.	.	S	Bend	trans	-71.8	145.3	179	-69.5	-71.1	173.1	0	0	110.9	A36 Y41 R654 T715 L716 S717 A723 R724	A36-E720 HydrophobicContact CB-CB 4.42Å; A36-E720 WeakPolarHBondContact CB-OE2 3.37Å; Y41-E720 HydrophobicContact CE1-CG 4.47Å; Y41-E720 PolarHBondContact OH-OE1 2.94Å; Y41-E720 VanDerWaalsContact OH-OE1 3.1Å; R654-E720 IonicContact CZ-OE1 3.47Å; R654-E720 VanDerWaalsContact CZ-OE1 3.24Å; R654-E720 IonicContact CZ-OE2 3.73Å; R654-E720 IonicContact NE-OE1 2.79Å; R654-E720 PolarHBondContact NE-OE1 2.9Å; R654-E720 IonicContact NE-OE2 3.86Å; R654-E720 VanDerWaalsContact NH2-CD 3.3Å; R654-E720 IonicContact NH2-OE1 3.53Å; R654-E720 PolarHBondContact NH2-OE1 3.48Å; R654-E720 IonicContact NH2-OE2 2.62Å; R654-E720 PolarHBondContact NH2-OE2 3.03Å; T715-E720 HydrophobicContact CG2-CG 4.19Å; T715-E720 WeakPolarHBondContact CG2-OE1 3.37Å; L716-E720 PolarHBondContact O-N 2.83Å; S717-E720 PolarHBondContact O-N 2.84Å; E720-A723 PolarHBondContact O-N 2.67Å; E720-A723 VanDerWaalsContact O-N 3.13Å; E720-R724 PolarHBondContact O-N 3.06Å
721	F	91.5	Very high	81.8	Confident	14 Å²	14	56.7 Å²	56.7	6%	0.061	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	137.3	170.6	173.3	-89.5	0	0	0	109.5	I35 A36 Y39 F47 Q105 F108 L725	I35-F721 HydrophobicContact CG2-CD1 3.86Å; I35-F721 HydrophobicContact CG2-CE1 3.73Å; A36-F721 VanDerWaalsContact CB-O 3.26Å; A36-F721 WeakPolarHBondContact CB-O 3.22Å; Y39-F721 HydrophobicContact CD2-CB 4.09Å; Y39-F721 HydrophobicContact CD2-CD1 4.19Å; Y39-F721 HydrophobicContact CD2-CG 4.08Å; Y39-F721 HydrophobicContact CE2-CD1 4.02Å; Y39-F721 HydrophobicContact CE2-CE1 4.34Å; Y39-F721 HydrophobicContact CE2-CG 4.21Å; F47-F721 HydrophobicContact CD1-CD2 4.01Å; F47-F721 HydrophobicContact CD1-CE2 4.01Å; F47-F721 AromaticContact CE1-CD2 3.28Å; F47-F721 HydrophobicContact CE1-CD2 3.28Å; F47-F721 AromaticContact CE1-CE2 3.56Å; F47-F721 HydrophobicContact CE1-CE2 3.56Å; F47-F721 HydrophobicContact CE1-CG 4.09Å; F47-F721 HydrophobicContact CZ-CB 4.31Å; F47-F721 AromaticContact CZ-CD2 3.71Å; F47-F721 HydrophobicContact CZ-CD2 3.71Å; F47-F721 HydrophobicContact CZ-CE2 4.42Å; F47-F721 HydrophobicContact CZ-CG 4.21Å; Q105-F721 HydrophobicContact CB-CE2 4.41Å; Q105-F721 HydrophobicContact CB-CZ 3.94Å; Q105-F721 HydrophobicContact CG-CE2 4.48Å; Q105-F721 HydrophobicContact CG-CZ 4.1Å; F108-F721 HydrophobicContact CD1-CE2 4.09Å; F108-F721 HydrophobicContact CE1-CE2 4.45Å; F721-L725 HydrophobicContact CD2-CD1 3.67Å; F721-L725 HydrophobicContact CE2-CD1 3.87Å
722	P	90.1	Very high	80.6	Confident	5 Å²	5	57.8 Å²	57.8	3%	0.032	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	cis	-92.6	-6.7	2.7	38.4	-38.4	0	0	0	114.5	E114 Q117 R724 L725 I726	E114-P722 HydrophobicContact CB-CG 4.21Å; E114-P722 HydrophobicContact CG-CG 4.08Å; Q117-P722 HydrophobicContact CG-CB 4.16Å; Q117-P722 HydrophobicContact CG-CG 4.49Å; P722-R724 PolarHBondContact O-N 3.49Å; P722-L725 PolarHBondContact O-N 3.45Å; P722-I726 HydrophobicContact CB-CD1 3.84Å; P722-I726 HydrophobicContact CB-CG1 4.44Å; P722-I726 HydrophobicContact CG-CD1 4.19Å; P722-I726 PolarHBondContact O-N 3.03Å
723	A	86.6	Confident	79.5	Confident	34 Å²	34	59.2 Å²	59.2	28%	0.281	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-48.5	-38.6	-174	0	0	0	0	0	113.5	E114 E720 L725	E114-A723 WeakPolarHBondContact OE1-CA 3.36Å; E114-A723 VanDerWaalsContact OE1-CB 3.26Å; E114-A723 WeakPolarHBondContact OE1-CB 3.48Å; E720-A723 PolarHBondContact O-N 2.67Å; E720-A723 VanDerWaalsContact O-N 3.13Å; A723-L725 PolarHBondContact O-N 2.95Å
724	R	87	Confident	78.4	Confident	37 Å²	37	58.2 Å²	58.2	14%	0.14	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-63.2	-24.4	178.8	-177.5	53.8	-173.2	165.8	-0	114.7	E44 C718 L719 E720 P722 Q729	E44-R724 IonicContact OE1-CZ 3.89Å; E44-R724 IonicContact OE1-NE 3.02Å; E44-R724 PolarHBondContact OE1-NE 3.43Å; E44-R724 IonicContact OE1-NH2 3.31Å; E44-R724 PolarHBondContact OE1-NH2 2.82Å; E44-R724 IonicContact OE2-NE 3.43Å; C718-R724 VanDerWaalsContact O-CD 3.3Å; C718-R724 WeakPolarHBondContact O-CD 3.43Å; L719-R724 HydrophobicContact CD2-CG 4.47Å; E720-R724 PolarHBondContact O-N 3.06Å; P722-R724 PolarHBondContact O-N 3.49Å; R724-Q729 VanDerWaalsContact CZ-CD 3.46Å
725	L	87.2	Confident	77.1	Confident	31 Å²	31	63.9 Å²	63.9	16%	0.162	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-107.6	-12.7	-170	-59.1	174.3	0	0	0	113.6	F47 F108 F721 P722 A723	F47-L725 HydrophobicContact CB-CD1 3.77Å; F47-L725 HydrophobicContact CB-CD2 4.27Å; F47-L725 HydrophobicContact CD1-CD1 3.56Å; F47-L725 HydrophobicContact CD2-CD1 4.1Å; F47-L725 HydrophobicContact CE1-CD1 4.07Å; F47-L725 HydrophobicContact CG-CD1 3.55Å; F108-L725 HydrophobicContact CD1-CD1 4.39Å; F108-L725 HydrophobicContact CD2-CB 3.81Å; F108-L725 HydrophobicContact CD2-CD1 4.07Å; F108-L725 HydrophobicContact CE1-CD1 4.13Å; F108-L725 HydrophobicContact CE2-CB 4.05Å; F108-L725 HydrophobicContact CE2-CD1 3.81Å; F108-L725 HydrophobicContact CE2-CG 4.41Å; F108-L725 HydrophobicContact CG-CB 4.48Å; F108-L725 HydrophobicContact CG-CD1 4.38Å; F108-L725 HydrophobicContact CZ-CD1 3.86Å; F721-L725 HydrophobicContact CD2-CD1 3.67Å; F721-L725 HydrophobicContact CE2-CD1 3.87Å; P722-L725 PolarHBondContact O-N 3.45Å; A723-L725 PolarHBondContact O-N 2.95Å
726	I	85.7	Confident	75.8	Confident	23 Å²	23	64.3 Å²	64.3	12%	0.118	37%	0.367	C	S	.	.	S	Bend	trans	-108.2	129.8	-176.6	-60.8	177.3	0	0	0	108.8	F108 C111 E112 E114 Q117 P722	F108-I726 HydrophobicContact CB-CD1 4.29Å; F108-I726 HydrophobicContact CB-CG1 4.18Å; C111-I726 HydrophobicContact CB-CD1 4.34Å; E112-I726 WeakPolarHBondContact O-CG2 3.41Å; E114-I726 HydrophobicContact CG-CD1 4.36Å; Q117-I726 HydrophobicContact CB-CD1 3.69Å; Q117-I726 HydrophobicContact CG-CD1 4.08Å; P722-I726 HydrophobicContact CB-CD1 3.84Å; P722-I726 HydrophobicContact CB-CG1 4.44Å; P722-I726 HydrophobicContact CG-CD1 4.19Å; P722-I726 PolarHBondContact O-N 3.03Å
727	G	76.3	Confident	74.3	Confident	67 Å²	67	66.4 Å²	66.4	69%	0.691	38%	0.38	S	S	*	.	S	Bend	trans	88.4	-163.9	178.2	0	0	0	0	0	115.2
728	E	67.1	Low	73.2	Confident	191 Å²	191	70.8 Å²	70.8	89%	0.893	39%	0.392	S	S	*	.			trans	-75.7	127.3	178.3	-72.5	-169.8	171.2	0	0	111	E730	E728-E730 PolarHBondContact O-N 2.9Å
729	Q	66.2	Low	71.8	Confident	117 Å²	117	71 Å²	71	55%	0.547	40%	0.402	S	S	.	.			trans	-77.5	94.2	-178.3	-160	171	56.1	0	0	110	E44 R724	E44-Q729 PolarHBondContact OE1-NE2 3.2Å; R724-Q729 VanDerWaalsContact CZ-CD 3.46Å
730	E	62.3	Low	70.5	Confident	136 Å²	136	74 Å²	74	64%	0.636	42%	0.418	S	S	*	.			trans	-59.7	142	176.7	-66.3	-174.6	157.5	0	0	111.1	E728 L732 M736	E728-E730 PolarHBondContact O-N 2.9Å; E730-L732 PolarHBondContact O-N 2.89Å; E730-M736 HydrophobicContact CB-CE 4.04Å; E730-M736 WeakPolarHBondContact OE2-CE 2.95Å
731	A	62.5	Low	68.8	Low	88 Å²	88	85 Å²	85	73%	0.727	46%	0.459	S	S	*	.			trans	-65.8	126	177.5	0	0	0	0	0	110.2	S733	A731-S733 PolarHBondContact O-N 3.25Å
732	L	64.1	Low	67.5	Low	89 Å²	89	88.6 Å²	88.6	47%	0.466	48%	0.482	S	S	.	.			trans	-56.6	112.8	179.5	-73.4	159	0	0	0	110.3	I647 L719 E730	I647-L732 HydrophobicContact CD1-CD1 4.46Å; L719-L732 HydrophobicContact CD2-CD2 3.79Å; L719-L732 HydrophobicContact CG-CD2 4.31Å; E730-L732 PolarHBondContact O-N 2.89Å
733	S	63.7	Low	66.4	Low	57 Å²	57	91.1 Å²	91.1	40%	0.399	50%	0.499	S	S	.	.			trans	-113.7	145.5	171.5	70	0	0	0	0	110.2	A731 D735 M736	A731-S733 PolarHBondContact O-N 3.25Å; S733-D735 PolarHBondContact O-N 2.7Å; S733-M736 PolarHBondContact O-N 3.24Å
734	I	60.2	Low	66.3	Low	102 Å²	102	90 Å²	90	52%	0.523	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-60.2	-29.4	-179.9	-65.6	169.4	0	0	0	111.2	T643 M736 V737 F738	T643-I734 HydrophobicContact CG2-CD1 4.15Å; T643-I734 HydrophobicContact CG2-CG1 3.99Å; I734-M736 VanDerWaalsContact C-N 3.3Å; I734-M736 PolarHBondContact O-N 3.44Å; I734-V737 WeakPolarHBondContact O-CB 3.37Å; I734-V737 WeakPolarHBondContact O-CG2 3.25Å; I734-V737 PolarHBondContact O-N 3.31Å; I734-F738 HydrophobicContact CG2-CE2 4.18Å
735	D	61.9	Low	66.5	Low	138 Å²	138	88.9 Å²	88.9	74%	0.738	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-67.8	-27.2	-177.8	-70.3	-21.8	0	0	0	113.2	S733 V737 F738	S733-D735 PolarHBondContact O-N 2.7Å; D735-V737 PolarHBondContact O-N 2.93Å; D735-F738 PolarHBondContact O-N 3.29Å
736	M	57.9	Low	66.7	Low	70 Å²	70	89.5 Å²	89.5	35%	0.345	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-64.3	-21.4	176.6	-74.1	170.1	156.3	0	0	113.3	E730 S733 I734 F738	E730-M736 HydrophobicContact CB-CE 4.04Å; E730-M736 WeakPolarHBondContact OE2-CE 2.95Å; S733-M736 PolarHBondContact O-N 3.24Å; I734-M736 VanDerWaalsContact C-N 3.3Å; I734-M736 PolarHBondContact O-N 3.44Å; M736-F738 PolarHBondContact O-N 3.35Å
737	V	56.2	Low	67.1	Low	52 Å²	52	88.9 Å²	88.9	32%	0.315	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-68.1	-20.4	-179.9	177.9	0	0	0	0	112	L716 I734 D735	L716-V737 HydrophobicContact CD2-CB 4.19Å; L716-V737 HydrophobicContact CD2-CG1 3.71Å; L716-V737 HydrophobicContact CD2-CG2 4.05Å; I734-V737 WeakPolarHBondContact O-CB 3.37Å; I734-V737 WeakPolarHBondContact O-CG2 3.25Å; I734-V737 PolarHBondContact O-N 3.31Å; D735-V737 PolarHBondContact O-N 2.93Å
738	F	56.6	Low	68	Low	149 Å²	149	85.7 Å²	85.7	65%	0.654	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-109.1	5.3	-167	-63.4	-75	0	0	0	115.4	I734 D735 M736 D740	I734-F738 HydrophobicContact CG2-CE2 4.18Å; D735-F738 PolarHBondContact O-N 3.29Å; M736-F738 PolarHBondContact O-N 3.35Å; F738-D740 PolarHBondContact O-N 3.08Å
739	G	51.3	Low	69.3	Low	49 Å²	49	76.6 Å²	76.6	51%	0.505	41%	0.408	S	S	.	.			trans	-74.9	-23	-163.5	0	0	0	0	0	118.8
740	D	57	Low	70.8	Confident	80 Å²	80	71.2 Å²	71.2	43%	0.428	38%	0.383	S	S	.	.			trans	-90.1	126.5	-165.3	-76.9	-21.2	0	0	0	114.5	K713 S717 F738 V742	K713-D740 WeakPolarHBondContact CE-O 3.36Å; K713-D740 PolarHBondContact NZ-O 3.32Å; S717-D740 PolarHBondContact OG-OD2 3.28Å; F738-D740 PolarHBondContact O-N 3.08Å; D740-V742 HydrophobicContact CB-CG2 4.14Å; D740-V742 PolarHBondContact O-N 2.75Å; D740-V742 VanDerWaalsContact O-N 3.08Å
741	W	53.3	Low	72.4	Confident	256 Å²	256	64.7 Å²	64.7	97%	0.97	35%	0.352	S	S	*	.			trans	-79.4	29.4	174.9	-58.1	90.1	0	0	0	113.4	S743	W741-S743 PolarHBondContact O-N 3.19Å
742	V	63.8	Low	74.1	Confident	90 Å²	90	60.5 Å²	60.5	55%	0.545	32%	0.318	S	S	.	.			trans	-73.2	127.2	179.9	-176.7	0	0	0	0	109.9	D740 C744	D740-V742 HydrophobicContact CB-CG2 4.14Å; D740-V742 PolarHBondContact O-N 2.75Å; D740-V742 VanDerWaalsContact O-N 3.08Å; V742-C744 VanDerWaalsContact C-N 3.29Å; V742-C744 WeakPolarHBondContact CG1-O 3.15Å; V742-C744 PolarHBondContact O-N 3.13Å
743	S	67.9	Low	75.6	Confident	57 Å²	57	56.3 Å²	56.3	40%	0.399	30%	0.296	S	S	.	.	S	Bend	trans	-69.6	-21.9	-176.2	58.4	0	0	0	0	114.4	W741	W741-S743 PolarHBondContact O-N 3.19Å
744	C	84.7	Confident	77.3	Confident	10 Å²	10	53.6 Å²	53.6	7%	0.068	28%	0.277	C	S	.	.	S	Bend	trans	-160.2	151.5	178.5	61.8	0	0	0	0	112.9	V21 I710 V742 W746	V21-C744 HydrophobicContact CG1-CB 3.72Å; V21-C744 WeakPolarHBondContact CG1-SG 3.48Å; I710-C744 HydrophobicContact CG2-CB 3.64Å; I710-C744 CarbonylContact O-C 3.47Å; I710-C744 WeakPolarHBondContact O-CA 3.25Å; I710-C744 WeakPolarHBondContact O-CB 3.3Å; V742-C744 VanDerWaalsContact C-N 3.29Å; V742-C744 WeakPolarHBondContact CG1-O 3.15Å; V742-C744 PolarHBondContact O-N 3.13Å; C744-W746 PolarHBondContact O-N 3.49Å
745	C	90.1	Very high	79.1	Confident	15 Å²	15	48.8 Å²	48.8	10%	0.101	25%	0.252	C	S	.	.			trans	-68.6	116	165.5	174.5	0	0	0	0	110.1	E657 I710 S712 R747 N748 M749	E657-C745 PolarHBondContact OE2-SG 3.41Å; E657-C745 VanDerWaalsContact OE2-SG 3.37Å; I710-C745 PolarHBondContact O-N 3.44Å; S712-C745 WeakPolarHBondContact O-CB 3.3Å; C745-R747 PolarHBondContact O-N 3.1Å; C745-N748 HydrophobicContact CB-CB 4.11Å; C745-N748 PolarHBondContact O-N 2.86Å; C745-M749 PolarHBondContact O-N 3.46Å; C745-M749 VanDerWaalsContact O-N 3.07Å
746	W	91.8	Very high	80.8	Confident	44 Å²	44	42.2 Å²	42.2	17%	0.167	22%	0.217	C	C	.	.	H	α-helix	trans	-57.9	-47.1	-178.8	-171.3	99.7	0	0	0	111.5	F23 D29 K661 C744 N748 M749 F750	F23-W746 AromaticContact CD2-CD1 3.7Å; F23-W746 HydrophobicContact CD2-CG 4.32Å; F23-W746 HydrophobicContact CE2-CB 4.38Å; F23-W746 AromaticContact CE2-CD1 3.26Å; F23-W746 HydrophobicContact CE2-CD2 4.14Å; F23-W746 AromaticContact CE2-CE2 3.98Å; F23-W746 AromaticContact CE2-CG 3.68Å; F23-W746 HydrophobicContact CE2-CG 3.68Å; F23-W746 AromaticContact CE2-NE1 3.41Å; F23-W746 AromaticContact CZ-NE1 3.95Å; D29-W746 HydrophobicContact CB-CD2 4.4Å; D29-W746 HydrophobicContact CB-CE3 4.13Å; D29-W746 HydrophobicContact CB-CH2 4.09Å; D29-W746 HydrophobicContact CB-CZ2 4.34Å; D29-W746 HydrophobicContact CB-CZ3 3.95Å; D29-W746 VanDerWaalsContact OD2-CD2 3.3Å; K661-W746 HydrophobicContact CD-CE3 4.32Å; K661-W746 HydrophobicContact CD-CZ3 3.66Å; C744-W746 PolarHBondContact O-N 3.49Å; W746-N748 VanDerWaalsContact C-N 3.3Å; W746-N748 PolarHBondContact O-N 3.45Å; W746-M749 PolarHBondContact O-N 2.92Å; W746-F750 HydrophobicContact CD2-CB 4.4Å; W746-F750 HydrophobicContact CE3-CB 4.17Å; W746-F750 HydrophobicContact CH2-CB 4.2Å; W746-F750 HydrophobicContact CH2-CD1 4.43Å; W746-F750 AromaticContact CH2-CD2 3.66Å; W746-F750 HydrophobicContact CH2-CD2 3.66Å; W746-F750 HydrophobicContact CH2-CE2 4.07Å; W746-F750 AromaticContact CH2-CG 3.86Å; W746-F750 HydrophobicContact CH2-CG 3.86Å; W746-F750 HydrophobicContact CZ2-CB 4.44Å; W746-F750 AromaticContact CZ2-CD2 3.96Å; W746-F750 HydrophobicContact CZ2-CD2 3.96Å; W746-F750 HydrophobicContact CZ2-CG 4.36Å; W746-F750 HydrophobicContact CZ3-CB 4.09Å; W746-F750 HydrophobicContact CZ3-CD1 4.33Å; W746-F750 HydrophobicContact CZ3-CD2 4.28Å; W746-F750 AromaticContact CZ3-CG 4Å; W746-F750 HydrophobicContact CZ3-CG 4Å; W746-F750 VanDerWaalsContact O-CB 3.26Å; W746-F750 WeakPolarHBondContact O-CB 3.09Å; W746-F750 PolarHBondContact O-N 3.33Å
747	R	94.7	Very high	82.7	Confident	10 Å²	10	39.3 Å²	39.3	4%	0.038	20%	0.202	C	C	.	.	H	α-helix	trans	-52	-46.4	176.9	-62.2	-177	-71.7	-119.1	-2.8	112.6	E37 R654 E657 K661 T715 C745 S751	E37-R747 VanDerWaalsContact OE1-CD 3.26Å; E37-R747 WeakPolarHBondContact OE1-CD 3.45Å; E37-R747 VanDerWaalsContact OE1-CG 3.3Å; E37-R747 WeakPolarHBondContact OE1-CG 3.41Å; E37-R747 IonicContact OE1-NH1 3.61Å; R654-R747 VanDerWaalsContact CG-NH1 3.35Å; E657-R747 HydrophobicContact CB-CB 4.24Å; E657-R747 IonicContact OE2-CZ 3.81Å; E657-R747 VanDerWaalsContact OE2-CZ 3.3Å; E657-R747 IonicContact OE2-NE 3.29Å; E657-R747 PolarHBondContact OE2-NE 3.4Å; E657-R747 IonicContact OE2-NH2 3.49Å; E657-R747 PolarHBondContact OE2-NH2 2.76Å; K661-R747 HydrophobicContact CD-CG 4.29Å; T715-R747 PolarHBondContact OG1-NH2 3.11Å; T715-R747 VanDerWaalsContact OG1-NH2 3.09Å; C745-R747 PolarHBondContact O-N 3.1Å; R747-S751 WeakPolarHBondContact O-CB 3.35Å; R747-S751 PolarHBondContact O-N 3.09Å; R747-S751 PolarHBondContact O-OG 3.12Å
748	N	95.1	Very high	84.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-73	-41.9	-175.7	-68.8	-10.1	0	0	0	111.4	E657 Y709 S712 C745 W746 C752	E657-N748 WeakPolarHBondContact CB-OD1 3.32Å; E657-N748 VanDerWaalsContact CD-ND2 3.34Å; E657-N748 WeakPolarHBondContact CG-OD1 3.38Å; E657-N748 PolarHBondContact OE1-ND2 3.27Å; Y709-N748 HydrophobicContact CD1-CB 4.08Å; Y709-N748 HydrophobicContact CE1-CB 3.62Å; Y709-N748 HydrophobicContact CE2-CB 4.39Å; Y709-N748 WeakPolarHBondContact CE2-ND2 3.47Å; Y709-N748 VanDerWaalsContact CZ-OD1 3.29Å; Y709-N748 PolarHBondContact O-ND2 3.05Å; Y709-N748 PolarHBondContact OH-OD1 3.17Å; S712-N748 PolarHBondContact OG-ND2 2.98Å; C745-N748 HydrophobicContact CB-CB 4.11Å; C745-N748 PolarHBondContact O-N 2.86Å; W746-N748 VanDerWaalsContact C-N 3.3Å; W746-N748 PolarHBondContact O-N 3.45Å; N748-C752 WeakPolarHBondContact O-CB 2.96Å; N748-C752 PolarHBondContact O-N 3.14Å; N748-C752 PolarHBondContact O-SG 3.47Å
749	M	94.9	Very high	86.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.5	-49.1	175.1	-177.9	64.7	85.3	0	0	111.4	V21 F23 I710 C745 W746 S751 C752 I753 V788 H790 L793	V21-M749 HydrophobicContact CB-CE 4.14Å; V21-M749 HydrophobicContact CG1-CE 3.68Å; V21-M749 HydrophobicContact CG2-CE 4.41Å; F23-M749 HydrophobicContact CB-CG 4.33Å; F23-M749 HydrophobicContact CD1-CG 3.59Å; F23-M749 HydrophobicContact CD2-CB 3.86Å; F23-M749 HydrophobicContact CD2-CG 3.61Å; F23-M749 HydrophobicContact CE1-CG 3.63Å; F23-M749 HydrophobicContact CE2-CB 3.71Å; F23-M749 HydrophobicContact CE2-CG 3.66Å; F23-M749 HydrophobicContact CG-CB 4.33Å; F23-M749 HydrophobicContact CG-CG 3.57Å; F23-M749 HydrophobicContact CZ-CB 4.07Å; F23-M749 HydrophobicContact CZ-CG 3.69Å; I710-M749 HydrophobicContact CD1-CE 4.31Å; I710-M749 HydrophobicContact CD1-SD 4.16Å; I710-M749 HydrophobicContact CG2-CB 4.48Å; I710-M749 HydrophobicContact CG2-CE 3.64Å; I710-M749 HydrophobicContact CG2-SD 4.46Å; C745-M749 PolarHBondContact O-N 3.46Å; C745-M749 VanDerWaalsContact O-N 3.07Å; W746-M749 PolarHBondContact O-N 2.92Å; M749-S751 PolarHBondContact O-N 3.42Å; M749-C752 PolarHBondContact O-N 3.05Å; M749-I753 HydrophobicContact CG-CD1 3.96Å; M749-I753 WeakPolarHBondContact O-CG1 3.47Å; M749-I753 PolarHBondContact O-N 3.4Å; M749-I753 HydrophobicContact SD-CD1 4.17Å; M749-V788 HydrophobicContact CE-CG1 3.97Å; M749-H790 HydrophobicContact CE-CB 3.83Å; M749-H790 HydrophobicContact SD-CB 4.17Å; M749-L793 HydrophobicContact SD-CD1 3.99Å
750	F	96.1	Very high	88.9	Confident	3 Å²	3	28.1 Å²	28.1	1%	0.013	14%	0.136	C	C	.	.	H	α-helix	trans	-57.9	-48.4	177.3	173.4	-94.4	0	0	0	111.5	F23 Y25 N26 W308 K661 A665 W746 C752 I753 N754	F23-F750 HydrophobicContact CZ-CB 4.15Å; Y25-F750 HydrophobicContact CD2-CD2 4.02Å; Y25-F750 AromaticContact CE2-CD2 3.53Å; Y25-F750 HydrophobicContact CE2-CD2 3.53Å; Y25-F750 AromaticContact CE2-CE2 3.82Å; Y25-F750 HydrophobicContact CE2-CE2 3.82Å; Y25-F750 HydrophobicContact CE2-CG 4.43Å; Y25-F750 AromaticContact CZ-CE2 3.84Å; N26-F750 WeakPolarHBondContact O-CD2 3.31Å; N26-F750 WeakPolarHBondContact O-CE2 3.48Å; W308-F750 HydrophobicContact CH2-CE1 4.28Å; W308-F750 HydrophobicContact CH2-CZ 4.32Å; W308-F750 HydrophobicContact CZ2-CE1 4.24Å; W308-F750 AromaticContact CZ2-CZ 3.95Å; W308-F750 HydrophobicContact CZ2-CZ 3.95Å; K661-F750 HydrophobicContact CD-CD1 4.14Å; K661-F750 HydrophobicContact CD-CE1 4.25Å; K661-F750 HydrophobicContact CG-CD1 3.65Å; K661-F750 HydrophobicContact CG-CE1 3.65Å; A665-F750 HydrophobicContact CB-CE1 3.83Å; A665-F750 HydrophobicContact CB-CZ 3.87Å; W746-F750 HydrophobicContact CD2-CB 4.4Å; W746-F750 HydrophobicContact CE3-CB 4.17Å; W746-F750 HydrophobicContact CH2-CB 4.2Å; W746-F750 HydrophobicContact CH2-CD1 4.43Å; W746-F750 AromaticContact CH2-CD2 3.66Å; W746-F750 HydrophobicContact CH2-CD2 3.66Å; W746-F750 HydrophobicContact CH2-CE2 4.07Å; W746-F750 AromaticContact CH2-CG 3.86Å; W746-F750 HydrophobicContact CH2-CG 3.86Å; W746-F750 HydrophobicContact CZ2-CB 4.44Å; W746-F750 AromaticContact CZ2-CD2 3.96Å; W746-F750 HydrophobicContact CZ2-CD2 3.96Å; W746-F750 HydrophobicContact CZ2-CG 4.36Å; W746-F750 HydrophobicContact CZ3-CB 4.09Å; W746-F750 HydrophobicContact CZ3-CD1 4.33Å; W746-F750 HydrophobicContact CZ3-CD2 4.28Å; W746-F750 AromaticContact CZ3-CG 4Å; W746-F750 HydrophobicContact CZ3-CG 4Å; W746-F750 VanDerWaalsContact O-CB 3.26Å; W746-F750 WeakPolarHBondContact O-CB 3.09Å; W746-F750 PolarHBondContact O-N 3.33Å; F750-C752 PolarHBondContact O-N 2.82Å; F750-I753 PolarHBondContact O-N 2.82Å; F750-N754 WeakPolarHBondContact CD1-ND2 3.47Å; F750-N754 WeakPolarHBondContact CE1-ND2 3.17Å; F750-N754 WeakPolarHBondContact CZ-ND2 3.47Å; F750-N754 VanDerWaalsContact O-CG 3.3Å; F750-N754 PolarHBondContact O-N 2.66Å
751	S	97.2	Very high	90.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.8	-46.9	176.6	-64.6	0	0	0	0	112.3	K661 R747 M749 I753 N754 L755	K661-S751 WeakPolarHBondContact CA-OG 3.5Å; K661-S751 PolarHBondContact N-OG 3.23Å; R747-S751 WeakPolarHBondContact O-CB 3.35Å; R747-S751 PolarHBondContact O-N 3.09Å; R747-S751 PolarHBondContact O-OG 3.12Å; M749-S751 PolarHBondContact O-N 3.42Å; S751-I753 VanDerWaalsContact C-N 3.34Å; S751-I753 PolarHBondContact O-N 3.34Å; S751-N754 PolarHBondContact O-N 2.83Å; S751-L755 VanDerWaalsContact O-CG 3.27Å; S751-L755 WeakPolarHBondContact O-CG 3.42Å; S751-L755 PolarHBondContact O-N 3.27Å
752	C	97.4	Very high	93	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-59.9	-45.5	178.6	-71.3	0	0	0	0	111.7	F702 N748 M749 F750 N754 L755 L756 L793	F702-C752 HydrophobicContact CE1-CB 4.04Å; F702-C752 HydrophobicContact CZ-CB 3.94Å; F702-C752 WeakPolarHBondContact CZ-O 3.44Å; N748-C752 WeakPolarHBondContact O-CB 2.96Å; N748-C752 PolarHBondContact O-N 3.14Å; N748-C752 PolarHBondContact O-SG 3.47Å; M749-C752 PolarHBondContact O-N 3.05Å; F750-C752 PolarHBondContact O-N 2.82Å; C752-N754 VanDerWaalsContact C-N 3.33Å; C752-N754 PolarHBondContact O-N 3.09Å; C752-L755 PolarHBondContact O-N 3.41Å; C752-L756 WeakPolarHBondContact O-CB 3.49Å; C752-L756 VanDerWaalsContact O-CG 3.3Å; C752-L756 WeakPolarHBondContact O-CG 3.36Å; C752-L756 PolarHBondContact O-N 2.79Å; C752-L793 HydrophobicContact CB-CD1 4.07Å
753	I	96.8	Very high	94.6	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-62	-43.9	177.9	-68.5	164.4	0	0	0	110.3	F23 Y25 M749 F750 S751 L756 R757 M792 L793 Y796	F23-I753 HydrophobicContact CD1-CD1 4.21Å; F23-I753 HydrophobicContact CE1-CD1 3.56Å; F23-I753 HydrophobicContact CZ-CD1 4.29Å; Y25-I753 HydrophobicContact CD2-CB 4.14Å; Y25-I753 HydrophobicContact CD2-CD1 3.86Å; Y25-I753 HydrophobicContact CD2-CG2 3.71Å; Y25-I753 HydrophobicContact CE2-CB 4.05Å; Y25-I753 HydrophobicContact CE2-CG2 3.56Å; M749-I753 HydrophobicContact CG-CD1 3.96Å; M749-I753 WeakPolarHBondContact O-CG1 3.47Å; M749-I753 PolarHBondContact O-N 3.4Å; M749-I753 HydrophobicContact SD-CD1 4.17Å; F750-I753 PolarHBondContact O-N 2.82Å; S751-I753 VanDerWaalsContact C-N 3.34Å; S751-I753 PolarHBondContact O-N 3.34Å; I753-L756 PolarHBondContact O-N 2.75Å; I753-R757 HydrophobicContact CG2-CG 4.38Å; I753-R757 WeakPolarHBondContact O-CB 3.36Å; I753-R757 WeakPolarHBondContact O-CG 3.36Å; I753-R757 PolarHBondContact O-N 3.26Å; I753-M792 HydrophobicContact CD1-CB 4.43Å; I753-M792 HydrophobicContact CD1-SD 4.26Å; I753-M792 HydrophobicContact CG2-CG 3.98Å; I753-M792 HydrophobicContact CG2-SD 3.66Å; I753-L793 HydrophobicContact CG1-CB 4.16Å; I753-Y796 HydrophobicContact CG2-CD2 4.36Å; I753-Y796 HydrophobicContact CG2-CE2 4.24Å
754	N	97.7	Very high	95.8	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-62.8	-48.1	178.8	-71.9	-8.5	0	0	0	112.3	Y25 S664 L668 F750 S751 C752 L756 R757 I758	Y25-N754 WeakPolarHBondContact CE2-OD1 3.24Å; Y25-N754 PolarHBondContact OH-OD1 3.03Å; S664-N754 PolarHBondContact OG-ND2 2.75Å; L668-N754 HydrophobicContact CD2-CB 4.17Å; L668-N754 VanDerWaalsContact CD2-OD1 3.31Å; L668-N754 WeakPolarHBondContact CD2-OD1 3.15Å; F750-N754 WeakPolarHBondContact CD1-ND2 3.47Å; F750-N754 WeakPolarHBondContact CE1-ND2 3.17Å; F750-N754 WeakPolarHBondContact CZ-ND2 3.47Å; F750-N754 VanDerWaalsContact O-CG 3.3Å; F750-N754 PolarHBondContact O-N 2.66Å; S751-N754 PolarHBondContact O-N 2.83Å; C752-N754 VanDerWaalsContact C-N 3.33Å; C752-N754 PolarHBondContact O-N 3.09Å; N754-L756 VanDerWaalsContact C-N 3.3Å; N754-L756 PolarHBondContact O-N 3.34Å; N754-R757 WeakPolarHBondContact O-CA 3.32Å; N754-R757 WeakPolarHBondContact O-CB 3.36Å; N754-R757 PolarHBondContact O-N 2.85Å; N754-R757 VanDerWaalsContact O-N 3.08Å; N754-I758 VanDerWaalsContact O-CG1 3.31Å; N754-I758 WeakPolarHBondContact O-CG1 3.3Å; N754-I758 PolarHBondContact O-N 2.98Å
755	L	98.4	Very high	95.9	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-61.1	-39.8	177.9	-66	176.3	0	0	0	111.5	L613 I698 F701 F702 S751 C752 I758 L759	L613-L755 HydrophobicContact CD2-CD2 4.12Å; I698-L755 HydrophobicContact CD1-CD2 4.42Å; I698-L755 HydrophobicContact CG1-CD2 4.2Å; I698-L755 HydrophobicContact CG2-CB 4.14Å; F701-L755 HydrophobicContact CD1-CD1 3.66Å; F701-L755 HydrophobicContact CD2-CD1 4.21Å; F701-L755 HydrophobicContact CE1-CD1 3.72Å; F701-L755 HydrophobicContact CE2-CD1 4.26Å; F701-L755 HydrophobicContact CG-CD1 3.93Å; F701-L755 HydrophobicContact CZ-CD1 4.02Å; F702-L755 HydrophobicContact CE2-CB 4.02Å; S751-L755 VanDerWaalsContact O-CG 3.27Å; S751-L755 WeakPolarHBondContact O-CG 3.42Å; S751-L755 PolarHBondContact O-N 3.27Å; C752-L755 PolarHBondContact O-N 3.41Å; L755-I758 HydrophobicContact CD2-CD1 4.42Å; L755-I758 PolarHBondContact O-N 3.15Å; L755-L759 WeakPolarHBondContact O-CB 3.39Å; L755-L759 PolarHBondContact O-N 2.86Å
756	L	98.3	Very high	96	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-66.9	-36.3	173.9	-72	166.7	0	0	0	112.5	F702 C752 I753 N754 N760 L782 L793 V797 L800	F702-L756 HydrophobicContact CE1-CD1 4.19Å; F702-L756 HydrophobicContact CE1-CD2 4.45Å; F702-L756 HydrophobicContact CE1-CG 4.22Å; F702-L756 HydrophobicContact CE2-CD2 3.99Å; F702-L756 HydrophobicContact CE2-CG 3.88Å; F702-L756 HydrophobicContact CZ-CD1 3.89Å; F702-L756 HydrophobicContact CZ-CD2 3.95Å; F702-L756 HydrophobicContact CZ-CG 3.51Å; C752-L756 WeakPolarHBondContact O-CB 3.49Å; C752-L756 VanDerWaalsContact O-CG 3.3Å; C752-L756 WeakPolarHBondContact O-CG 3.36Å; C752-L756 PolarHBondContact O-N 2.79Å; I753-L756 PolarHBondContact O-N 2.75Å; N754-L756 VanDerWaalsContact C-N 3.3Å; N754-L756 PolarHBondContact O-N 3.34Å; L756-N760 WeakPolarHBondContact O-CB 3.43Å; L756-N760 PolarHBondContact O-N 2.8Å; L756-N760 PolarHBondContact O-ND2 3.26Å; L756-L782 HydrophobicContact CD2-CD2 4.21Å; L756-L793 HydrophobicContact CD1-CD2 4.34Å; L756-L793 HydrophobicContact CD1-CG 3.78Å; L756-V797 HydrophobicContact CD1-CG2 3.7Å; L756-V797 HydrophobicContact CD2-CG2 3.92Å; L756-V797 HydrophobicContact CG-CG2 4.48Å; L756-L800 HydrophobicContact CD2-CD1 3.83Å
757	R	97.9	Very high	96	Very high	10 Å²	10	18.3 Å²	18.3	4%	0.038	8%	0.078	C	C	.	.	H	α-helix	trans	-64.9	-45.9	174.6	-76.2	170.3	65.4	162.8	-3.4	111.1	Y25 L668 I753 N754 N760 M761 Y796	Y25-R757 PolarHBondContact OH-NH1 2.96Å; L668-R757 HydrophobicContact CD1-CB 3.81Å; L668-R757 HydrophobicContact CD2-CB 4.41Å; I753-R757 HydrophobicContact CG2-CG 4.38Å; I753-R757 WeakPolarHBondContact O-CB 3.36Å; I753-R757 WeakPolarHBondContact O-CG 3.36Å; I753-R757 PolarHBondContact O-N 3.26Å; N754-R757 WeakPolarHBondContact O-CA 3.32Å; N754-R757 WeakPolarHBondContact O-CB 3.36Å; N754-R757 PolarHBondContact O-N 2.85Å; N754-R757 VanDerWaalsContact O-N 3.08Å; R757-N760 WeakPolarHBondContact O-CB 3.42Å; R757-N760 PolarHBondContact O-N 2.68Å; R757-M761 WeakPolarHBondContact O-CG 3.32Å; R757-M761 PolarHBondContact O-N 2.7Å; R757-Y796 HydrophobicContact CG-CD1 4.05Å; R757-Y796 HydrophobicContact CG-CD2 3.79Å; R757-Y796 HydrophobicContact CG-CE1 3.69Å; R757-Y796 HydrophobicContact CG-CE2 3.39Å; R757-Y796 HydrophobicContact CG-CG 4.12Å
758	I	98.6	Very high	95.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-57.6	-52.8	174.5	-68	161.5	0	0	0	109.2	S664 L667 L668 L671 I698 N754 L755 N760 M761 L762	S664-I758 WeakPolarHBondContact O-CD1 3.31Å; L667-I758 HydrophobicContact CB-CD1 3.69Å; L667-I758 HydrophobicContact CB-CG1 4.5Å; L667-I758 HydrophobicContact CD1-CD1 4.48Å; L668-I758 HydrophobicContact CB-CD1 4.23Å; L668-I758 HydrophobicContact CB-CG1 4.05Å; L668-I758 HydrophobicContact CD1-CG1 4.3Å; L671-I758 HydrophobicContact CD1-CB 4.48Å; L671-I758 HydrophobicContact CD1-CG1 4.25Å; L671-I758 HydrophobicContact CD1-CG2 3.92Å; I698-I758 HydrophobicContact CD1-CB 4.47Å; I698-I758 HydrophobicContact CD1-CG2 4.1Å; N754-I758 VanDerWaalsContact O-CG1 3.31Å; N754-I758 WeakPolarHBondContact O-CG1 3.3Å; N754-I758 PolarHBondContact O-N 2.98Å; L755-I758 HydrophobicContact CD2-CD1 4.42Å; L755-I758 PolarHBondContact O-N 3.15Å; I758-N760 VanDerWaalsContact C-N 3.28Å; I758-N760 PolarHBondContact O-N 3.33Å; I758-M761 WeakPolarHBondContact O-CA 3.38Å; I758-M761 WeakPolarHBondContact O-CB 3.37Å; I758-M761 PolarHBondContact O-N 3.04Å; I758-L762 HydrophobicContact CG2-CD1 4.02Å; I758-L762 HydrophobicContact CG2-CG 4.18Å; I758-L762 WeakPolarHBondContact O-CG 3.31Å; I758-L762 PolarHBondContact O-N 2.99Å
759	L	98.3	Very high	95.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-58.3	-39.8	-179.6	-168.8	58.9	0	0	0	112.6	I695 I698 L699 L755 T763 L773 L800	I695-L759 HydrophobicContact CB-CD1 4.29Å; I695-L759 HydrophobicContact CG1-CD1 3.91Å; I695-L759 HydrophobicContact CG2-CD1 4.13Å; I698-L759 HydrophobicContact CD1-CB 4.32Å; I698-L759 HydrophobicContact CG2-CB 4.41Å; I698-L759 HydrophobicContact CG2-CD2 3.99Å; L699-L759 HydrophobicContact CD2-CD2 4.13Å; L755-L759 WeakPolarHBondContact O-CB 3.39Å; L755-L759 PolarHBondContact O-N 2.86Å; L759-T763 HydrophobicContact CD1-CG2 4.37Å; L759-T763 WeakPolarHBondContact O-CB 3.45Å; L759-T763 WeakPolarHBondContact O-CG2 3.03Å; L759-T763 PolarHBondContact O-N 3.09Å; L759-T763 PolarHBondContact O-OG1 3.32Å; L759-L773 HydrophobicContact CD1-CD2 4.01Å; L759-L773 HydrophobicContact CD2-CD2 4.19Å; L759-L773 HydrophobicContact CG-CD2 4.31Å; L759-L800 HydrophobicContact CB-CD1 4.37Å; L759-L800 HydrophobicContact CB-CD2 4.44Å; L759-L800 HydrophobicContact CD2-CD1 3.76Å; L759-L800 HydrophobicContact CD2-CD2 4.28Å; L759-L800 HydrophobicContact CG-CD1 4.13Å; L759-L800 HydrophobicContact CG-CD2 3.92Å
760	N	97.9	Very high	95.9	Very high	14 Å²	14	19.1 Å²	19.1	8%	0.075	9%	0.085	C	C	.	.	H	α-helix	trans	-63.4	-42	171.9	-89.9	-82.8	0	0	0	112.2	L756 R757 I758 K764 Y796 K799 L800	L756-N760 WeakPolarHBondContact O-CB 3.43Å; L756-N760 PolarHBondContact O-N 2.8Å; L756-N760 PolarHBondContact O-ND2 3.26Å; R757-N760 WeakPolarHBondContact O-CB 3.42Å; R757-N760 PolarHBondContact O-N 2.68Å; I758-N760 VanDerWaalsContact C-N 3.28Å; I758-N760 PolarHBondContact O-N 3.33Å; N760-K764 WeakPolarHBondContact O-CB 3.48Å; N760-K764 PolarHBondContact O-N 3.44Å; N760-Y796 PolarHBondContact ND2-O 3Å; N760-K799 WeakPolarHBondContact OD1-CB 3.47Å; N760-L800 WeakPolarHBondContact ND2-CG 3.4Å
761	M	97.9	Very high	95.8	Very high	26 Å²	26	19.7 Å²	19.7	13%	0.128	9%	0.087	C	C	.	.	H	α-helix	trans	-66	-41.2	179.5	-74.1	178.9	67.8	0	0	112	L668 L671 K672 K675 F682 R757 I758	L668-M761 HydrophobicContact CD1-SD 3.91Å; L671-M761 HydrophobicContact CB-CE 3.71Å; L671-M761 HydrophobicContact CB-SD 4.48Å; L671-M761 WeakPolarHBondContact O-CE 3.18Å; K672-M761 HydrophobicContact CD-CE 4.01Å; K672-M761 HydrophobicContact CD-SD 4.03Å; K672-M761 HydrophobicContact CG-CE 4.09Å; K672-M761 HydrophobicContact CG-SD 4.15Å; K675-M761 HydrophobicContact CD-CE 4.2Å; F682-M761 HydrophobicContact CD2-CE 4.33Å; F682-M761 HydrophobicContact CE2-CB 4.31Å; F682-M761 HydrophobicContact CE2-CE 3.9Å; F682-M761 HydrophobicContact CZ-CB 4.49Å; R757-M761 WeakPolarHBondContact O-CG 3.32Å; R757-M761 PolarHBondContact O-N 2.7Å; I758-M761 WeakPolarHBondContact O-CA 3.38Å; I758-M761 WeakPolarHBondContact O-CB 3.37Å; I758-M761 PolarHBondContact O-N 3.04Å
762	L	98	Very high	95.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-65.5	-39.6	179.3	-62	-179.4	0	0	0	112.1	L671 S686 L689 V690 C694 I695 I758 R769	L671-L762 HydrophobicContact CD1-CD2 4.38Å; S686-L762 WeakPolarHBondContact OG-CD2 3.5Å; L689-L762 HydrophobicContact CB-CD1 4.47Å; L689-L762 HydrophobicContact CB-CD2 4.29Å; L689-L762 HydrophobicContact CD1-CD2 4.16Å; V690-L762 HydrophobicContact CG2-CB 4.38Å; V690-L762 HydrophobicContact CG2-CD1 4.36Å; C694-L762 HydrophobicContact CB-CD1 4.37Å; I695-L762 HydrophobicContact CG1-CD1 4.35Å; I758-L762 HydrophobicContact CG2-CD1 4.02Å; I758-L762 HydrophobicContact CG2-CG 4.18Å; I758-L762 WeakPolarHBondContact O-CG 3.31Å; I758-L762 PolarHBondContact O-N 2.99Å; L762-R769 WeakPolarHBondContact O-CD 3.29Å; L762-R769 PolarHBondContact O-NH1 2.93Å; L762-R769 VanDerWaalsContact O-NH1 3.13Å
763	T	96.4	Very high	95.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-96.4	-23.9	-169	56.6	0	0	0	0	114.1	I695 L759 W765 K766 R769 I770 L773	I695-T763 HydrophobicContact CD1-CG2 4.08Å; L759-T763 HydrophobicContact CD1-CG2 4.37Å; L759-T763 WeakPolarHBondContact O-CB 3.45Å; L759-T763 WeakPolarHBondContact O-CG2 3.03Å; L759-T763 PolarHBondContact O-N 3.09Å; L759-T763 PolarHBondContact O-OG1 3.32Å; T763-W765 PolarHBondContact O-N 3.26Å; T763-K766 PolarHBondContact O-N 3.41Å; T763-K766 VanDerWaalsContact O-N 3.09Å; T763-R769 HydrophobicContact CG2-CB 4.24Å; T763-I770 WeakPolarHBondContact O-CD1 3.29Å; T763-I770 WeakPolarHBondContact O-CG1 2.94Å; T763-L773 HydrophobicContact CG2-CD1 3.65Å; T763-L773 HydrophobicContact CG2-CD2 4.39Å; T763-L773 HydrophobicContact CG2-CG 3.91Å
764	K	94.1	Very high	95.3	Very high	123 Å²	123	22.9 Å²	22.9	54%	0.535	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	121.9	-174.5	177.3	-176.2	-177.7	-177.3	0	112	N760 K766	N760-K764 WeakPolarHBondContact O-CB 3.48Å; N760-K764 PolarHBondContact O-N 3.44Å; K764-K766 VanDerWaalsContact C-N 3.26Å; K764-K766 PolarHBondContact O-N 2.81Å
765	W	86.3	Confident	95.1	Very high	108 Å²	108	26.9 Å²	26.9	41%	0.409	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	24.1	-178.8	-60.4	111.6	0	0	0	115	K514 T763 R830	K514-W765 VanDerWaalsContact NZ-CD2 3.3Å; T763-W765 PolarHBondContact O-N 3.26Å; W765-R830 VanDerWaalsContact CZ2-NE 3.33Å
766	K	92.8	Very high	94.9	Very high	40 Å²	40	31.1 Å²	31.1	17%	0.174	15%	0.148	C	C	.	.			trans	-122.1	94	175.5	-60.5	-68	-180	170.5	0	108.5	E683 T763 K764 S768 R769 I770	E683-K766 VanDerWaalsContact CD-NZ 3.28Å; E683-K766 WeakPolarHBondContact OE1-CE 3.36Å; E683-K766 IonicContact OE1-NZ 2.86Å; E683-K766 PolarHBondContact OE1-NZ 2.8Å; E683-K766 IonicContact OE2-NZ 3.2Å; E683-K766 PolarHBondContact OE2-NZ 3.09Å; T763-K766 PolarHBondContact O-N 3.41Å; T763-K766 VanDerWaalsContact O-N 3.09Å; K764-K766 VanDerWaalsContact C-N 3.26Å; K764-K766 PolarHBondContact O-N 2.81Å; K766-S768 PolarHBondContact O-N 3.25Å; K766-R769 HydrophobicContact CB-CB 3.93Å; K766-R769 HydrophobicContact CB-CG 3.91Å; K766-R769 PolarHBondContact O-N 3.4Å; K766-I770 WeakPolarHBondContact O-CG1 3.27Å; K766-I770 PolarHBondContact O-N 3.18Å
767	H	91.7	Very high	94.7	Very high	49 Å²	49	38.5 Å²	38.5	23%	0.227	18%	0.18	C	C	.	.	H	α-helix	trans	-55.5	-41.9	-174.8	-60.6	103.7	0	0	0	111.8	R769 I770 M771 R806 Y807 F848 E851	H767-R769 PolarHBondContact O-N 2.87Å; H767-I770 PolarHBondContact O-N 3.4Å; H767-M771 WeakPolarHBondContact O-CB 3.31Å; H767-M771 PolarHBondContact O-N 3.16Å; H767-R806 PolarHBondContact NE2-NH1 3.37Å; H767-Y807 PolarHBondContact CD2-OH 3.2Å; H767-F848 HydrophobicContact CB-CB 4.42Å; H767-F848 HydrophobicContact CB-CD1 3.36Å; H767-F848 HydrophobicContact CB-CD2 4.21Å; H767-F848 HydrophobicContact CB-CE1 3.53Å; H767-F848 HydrophobicContact CB-CE2 4.35Å; H767-F848 HydrophobicContact CB-CG 3.73Å; H767-F848 HydrophobicContact CB-CZ 4.04Å; H767-E851 IonicContact ND1-OE2 3.82Å
768	S	92.3	Very high	94.6	Very high	18 Å²	18	38 Å²	38	13%	0.126	18%	0.178	C	C	.	.	H	α-helix	trans	-52.2	-55	173	-176.4	0	0	0	0	111.8	K766 I770 M771 L772	K766-S768 PolarHBondContact O-N 3.25Å; S768-I770 PolarHBondContact O-N 3Å; S768-M771 WeakPolarHBondContact O-CB 3.2Å; S768-M771 PolarHBondContact O-N 3.17Å; S768-M771 VanDerWaalsContact O-N 3.13Å; S768-L772 WeakPolarHBondContact O-CD1 3.41Å; S768-L772 PolarHBondContact O-N 3.24Å
769	R	95.2	Very high	94.5	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-69.3	-32.9	-177.7	-56.1	174.2	-166.7	173.5	3.7	113.2	E683 S686 V690 I695 L762 T763 K766 H767 M771 L772 L773 E852	E683-R769 IonicContact OE2-CZ 2.75Å; E683-R769 IonicContact OE2-NH1 3.05Å; E683-R769 PolarHBondContact OE2-NH1 3.16Å; E683-R769 IonicContact OE2-NH2 2.82Å; E683-R769 PolarHBondContact OE2-NH2 3.35Å; S686-R769 PolarHBondContact OG-NH1 2.81Å; V690-R769 HydrophobicContact CG2-CG 4.43Å; I695-R769 HydrophobicContact CD1-CB 4.41Å; L762-R769 WeakPolarHBondContact O-CD 3.29Å; L762-R769 PolarHBondContact O-NH1 2.93Å; L762-R769 VanDerWaalsContact O-NH1 3.13Å; T763-R769 HydrophobicContact CG2-CB 4.24Å; K766-R769 HydrophobicContact CB-CB 3.93Å; K766-R769 HydrophobicContact CB-CG 3.91Å; K766-R769 PolarHBondContact O-N 3.4Å; H767-R769 PolarHBondContact O-N 2.87Å; R769-M771 VanDerWaalsContact C-N 3.33Å; R769-L772 WeakPolarHBondContact O-CB 2.92Å; R769-L772 PolarHBondContact O-N 3.41Å; R769-L773 PolarHBondContact O-N 2.83Å; R769-E852 IonicContact CZ-OE1 3.66Å; R769-E852 IonicContact CZ-OE2 3.78Å; R769-E852 IonicContact NE-OE1 2.81Å; R769-E852 PolarHBondContact NE-OE1 3.33Å; R769-E852 IonicContact NE-OE2 3.97Å; R769-E852 IonicContact NH2-OE1 2.56Å; R769-E852 PolarHBondContact NH2-OE1 3.41Å; R769-E852 IonicContact NH2-OE2 3.54Å; R769-E852 PolarHBondContact NH2-OE2 3.34Å; R769-E852 VanDerWaalsContact NH2-OE2 3.1Å
770	I	95.3	Very high	94.4	Very high	8 Å²	8	42.1 Å²	42.1	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-66.5	-40.5	172	-61.4	164	0	0	0	109.9	T763 K766 H767 S768 L772 L773 V774 L803 Q804 Y807	T763-I770 WeakPolarHBondContact O-CD1 3.29Å; T763-I770 WeakPolarHBondContact O-CG1 2.94Å; K766-I770 WeakPolarHBondContact O-CG1 3.27Å; K766-I770 PolarHBondContact O-N 3.18Å; H767-I770 PolarHBondContact O-N 3.4Å; S768-I770 PolarHBondContact O-N 3Å; I770-L772 VanDerWaalsContact C-N 3.27Å; I770-L772 PolarHBondContact O-N 2.93Å; I770-L773 VanDerWaalsContact O-CB 3.28Å; I770-L773 WeakPolarHBondContact O-CB 3.5Å; I770-L773 PolarHBondContact O-N 2.94Å; I770-V774 PolarHBondContact O-N 3.38Å; I770-L803 HydrophobicContact CD1-CB 4.2Å; I770-L803 HydrophobicContact CD1-CD2 4.01Å; I770-L803 HydrophobicContact CG1-CB 4.28Å; I770-L803 HydrophobicContact CG2-CB 4.22Å; I770-L803 WeakPolarHBondContact CG2-O 3.39Å; I770-Q804 HydrophobicContact CG2-CG 4.15Å; I770-Y807 HydrophobicContact CB-CE2 4.34Å; I770-Y807 HydrophobicContact CG2-CD2 4.08Å; I770-Y807 HydrophobicContact CG2-CE2 3.56Å
771	M	92.9	Very high	94.3	Very high	14 Å²	14	42.4 Å²	42.4	7%	0.069	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-35.1	176.4	-167.1	60.6	-173.7	0	0	111.4	H767 S768 R769 L773 V774 V775 Y807 A843 P845 F848	H767-M771 WeakPolarHBondContact O-CB 3.31Å; H767-M771 PolarHBondContact O-N 3.16Å; S768-M771 WeakPolarHBondContact O-CB 3.2Å; S768-M771 PolarHBondContact O-N 3.17Å; S768-M771 VanDerWaalsContact O-N 3.13Å; R769-M771 VanDerWaalsContact C-N 3.33Å; M771-L773 VanDerWaalsContact C-N 3.32Å; M771-L773 PolarHBondContact O-N 3.28Å; M771-V774 WeakPolarHBondContact O-CB 3.45Å; M771-V774 PolarHBondContact O-N 3.01Å; M771-V774 VanDerWaalsContact O-N 3.15Å; M771-V774 HydrophobicContact SD-CB 4.22Å; M771-V774 HydrophobicContact SD-CG1 4.38Å; M771-V775 HydrophobicContact CE-CG2 4.31Å; M771-V775 HydrophobicContact CG-CG2 4.48Å; M771-V775 VanDerWaalsContact O-CG2 3.32Å; M771-V775 WeakPolarHBondContact O-CG2 3.34Å; M771-V775 PolarHBondContact O-N 2.92Å; M771-Y807 HydrophobicContact SD-CD1 4.28Å; M771-A843 WeakPolarHBondContact CE-O 3.31Å; M771-P845 HydrophobicContact CE-CG 4.24Å; M771-P845 HydrophobicContact CG-CB 4.28Å; M771-P845 HydrophobicContact CG-CG 3.96Å; M771-F848 HydrophobicContact CB-CD2 4.32Å; M771-F848 HydrophobicContact CB-CE2 4.44Å
772	L	93.2	Very high	94.3	Very high	39 Å²	39	41.2 Å²	41.2	20%	0.204	20%	0.201	C	C	.	.	H	α-helix	trans	-56.3	-43.4	169.4	-86.3	81.5	0	0	0	111.9	V690 S768 R769 I770 V774 V775 F776	V690-L772 HydrophobicContact CG1-CD2 4.32Å; S768-L772 WeakPolarHBondContact O-CD1 3.41Å; S768-L772 PolarHBondContact O-N 3.24Å; R769-L772 WeakPolarHBondContact O-CB 2.92Å; R769-L772 PolarHBondContact O-N 3.41Å; I770-L772 VanDerWaalsContact C-N 3.27Å; I770-L772 PolarHBondContact O-N 2.93Å; L772-V774 VanDerWaalsContact C-N 3.28Å; L772-V774 PolarHBondContact O-N 3.48Å; L772-V775 PolarHBondContact O-N 3.49Å; L772-F776 HydrophobicContact CB-CD2 4.32Å; L772-F776 HydrophobicContact CB-CE2 4.34Å; L772-F776 HydrophobicContact CD2-CE2 4.24Å; L772-F776 HydrophobicContact CG-CE2 4.47Å; L772-F776 WeakPolarHBondContact O-CB 3.36Å; L772-F776 WeakPolarHBondContact O-CD2 3.04Å; L772-F776 PolarHBondContact O-N 2.89Å
773	L	94.9	Very high	94.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-37.8	176.4	-67.7	175.6	0	0	0	112.9	I695 L699 L759 T763 R769 I770 M771 K777 S778 L800 Q804	I695-L773 HydrophobicContact CG2-CD2 3.76Å; L699-L773 HydrophobicContact CD1-CD2 4.19Å; L699-L773 HydrophobicContact CD2-CD2 4.41Å; L759-L773 HydrophobicContact CD1-CD2 4.01Å; L759-L773 HydrophobicContact CD2-CD2 4.19Å; L759-L773 HydrophobicContact CG-CD2 4.31Å; T763-L773 HydrophobicContact CG2-CD1 3.65Å; T763-L773 HydrophobicContact CG2-CD2 4.39Å; T763-L773 HydrophobicContact CG2-CG 3.91Å; R769-L773 PolarHBondContact O-N 2.83Å; I770-L773 VanDerWaalsContact O-CB 3.28Å; I770-L773 WeakPolarHBondContact O-CB 3.5Å; I770-L773 PolarHBondContact O-N 2.94Å; M771-L773 VanDerWaalsContact C-N 3.32Å; M771-L773 PolarHBondContact O-N 3.28Å; L773-K777 PolarHBondContact O-N 2.94Å; L773-S778 VanDerWaalsContact O-CB 3.3Å; L773-S778 WeakPolarHBondContact O-CB 3.42Å; L773-S778 PolarHBondContact O-N 3.01Å; L773-S778 PolarHBondContact O-OG 3.33Å; L773-S778 VanDerWaalsContact O-OG 3.09Å; L773-L800 HydrophobicContact CD1-CD2 4.02Å; L773-Q804 HydrophobicContact CB-CG 4.12Å; L773-Q804 HydrophobicContact CD1-CG 4.28Å
774	V	93.9	Very high	94	Very high	29 Å²	29	47.2 Å²	47.2	18%	0.176	23%	0.225	C	C	.	.	H	α-helix	trans	-68	-47.8	177.6	174.6	0	0	0	0	110	I770 M771 L772 F776 K777 Q804 Y807 F808	I770-V774 PolarHBondContact O-N 3.38Å; M771-V774 WeakPolarHBondContact O-CB 3.45Å; M771-V774 PolarHBondContact O-N 3.01Å; M771-V774 VanDerWaalsContact O-N 3.15Å; M771-V774 HydrophobicContact SD-CB 4.22Å; M771-V774 HydrophobicContact SD-CG1 4.38Å; L772-V774 VanDerWaalsContact C-N 3.28Å; L772-V774 PolarHBondContact O-N 3.48Å; V774-F776 VanDerWaalsContact C-N 3.33Å; V774-F776 PolarHBondContact O-N 3.31Å; V774-K777 WeakPolarHBondContact O-CA 3.37Å; V774-K777 PolarHBondContact O-N 3.03Å; V774-Q804 HydrophobicContact CG2-CB 4.16Å; V774-Q804 HydrophobicContact CG2-CG 4.07Å; V774-Y807 HydrophobicContact CG2-CD2 3.98Å; V774-Y807 HydrophobicContact CG2-CG 4.18Å; V774-F808 HydrophobicContact CG1-CE1 4.07Å; V774-F808 HydrophobicContact CG2-CE1 4.13Å; V774-F808 HydrophobicContact CG2-CZ 4.27Å
775	V	92.4	Very high	94	Very high	84 Å²	84	41.4 Å²	41.4	51%	0.509	20%	0.2	S	C	.	.	H	α-helix	trans	-60.8	-41.4	177.9	171.7	0	0	0	0	111.5	M771 L772 K777 P845	M771-V775 HydrophobicContact CE-CG2 4.31Å; M771-V775 HydrophobicContact CG-CG2 4.48Å; M771-V775 VanDerWaalsContact O-CG2 3.32Å; M771-V775 WeakPolarHBondContact O-CG2 3.34Å; M771-V775 PolarHBondContact O-N 2.92Å; L772-V775 PolarHBondContact O-N 3.49Å; V775-K777 PolarHBondContact O-N 3.34Å; V775-K777 VanDerWaalsContact O-N 3.15Å; V775-P845 HydrophobicContact CG2-CG 3.76Å
776	F	94.1	Very high	94.4	Very high	89 Å²	89	36.7 Å²	36.7	39%	0.39	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	7	174.9	-73.5	-59.7	0	0	0	114.2	I695 P696 L699 L772 V774 S778	I695-F776 HydrophobicContact CG2-CD2 4.31Å; P696-F776 HydrophobicContact CB-CD1 4.28Å; P696-F776 HydrophobicContact CB-CD2 4.48Å; P696-F776 HydrophobicContact CB-CE1 3.97Å; P696-F776 HydrophobicContact CB-CE2 4.18Å; P696-F776 HydrophobicContact CB-CZ 3.93Å; P696-F776 HydrophobicContact CG-CE1 4.47Å; P696-F776 HydrophobicContact CG-CE2 4.17Å; P696-F776 HydrophobicContact CG-CZ 3.97Å; L699-F776 HydrophobicContact CD1-CB 3.64Å; L699-F776 HydrophobicContact CD1-CG 4.38Å; L772-F776 HydrophobicContact CB-CD2 4.32Å; L772-F776 HydrophobicContact CB-CE2 4.34Å; L772-F776 HydrophobicContact CD2-CE2 4.24Å; L772-F776 HydrophobicContact CG-CE2 4.47Å; L772-F776 WeakPolarHBondContact O-CB 3.36Å; L772-F776 WeakPolarHBondContact O-CD2 3.04Å; L772-F776 PolarHBondContact O-N 2.89Å; V774-F776 VanDerWaalsContact C-N 3.33Å; V774-F776 PolarHBondContact O-N 3.31Å; F776-S778 VanDerWaalsContact C-N 3.27Å; F776-S778 PolarHBondContact O-N 3.05Å
777	K	95.1	Very high	94.3	Very high	155 Å²	155	39.1 Å²	39.1	67%	0.674	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	47.4	179.5	-58.7	-179	-179.3	175.8	0	111.6	L773 V774 V775 A779 P780	L773-K777 PolarHBondContact O-N 2.94Å; V774-K777 WeakPolarHBondContact O-CA 3.37Å; V774-K777 PolarHBondContact O-N 3.03Å; V775-K777 PolarHBondContact O-N 3.34Å; V775-K777 VanDerWaalsContact O-N 3.15Å; K777-A779 VanDerWaalsContact C-N 3.31Å; K777-A779 PolarHBondContact O-N 3.02Å; K777-P780 WeakPolarHBondContact O-CD 3.49Å
778	S	96.5	Very high	94.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-70.1	-25.1	-174.9	74.4	0	0	0	0	113.9	L699 L773 F776 I781 L782 Q804	L699-S778 VanDerWaalsContact CD2-CB 3.49Å; L773-S778 VanDerWaalsContact O-CB 3.3Å; L773-S778 WeakPolarHBondContact O-CB 3.42Å; L773-S778 PolarHBondContact O-N 3.01Å; L773-S778 PolarHBondContact O-OG 3.33Å; L773-S778 VanDerWaalsContact O-OG 3.09Å; F776-S778 VanDerWaalsContact C-N 3.27Å; F776-S778 PolarHBondContact O-N 3.05Å; S778-I781 WeakPolarHBondContact O-CB 3.21Å; S778-I781 PolarHBondContact O-N 3.44Å; S778-I781 VanDerWaalsContact O-N 3.08Å; S778-L782 WeakPolarHBondContact O-CG 3.3Å; S778-L782 PolarHBondContact O-N 3.21Å; S778-Q804 PolarHBondContact OG-NE2 2.85Å; S778-Q804 PolarHBondContact OG-OE1 2.94Å
779	A	95.8	Very high	94.1	Very high	8 Å²	8	38.1 Å²	38.1	7%	0.066	18%	0.183	C	C	.	.	H	α-helix	trans	-58.4	-44.6	-172.1	0	0	0	0	0	115.1	K777 I781 L782 K783 L801 F808 W812	K777-A779 VanDerWaalsContact C-N 3.31Å; K777-A779 PolarHBondContact O-N 3.02Å; A779-I781 VanDerWaalsContact C-N 3.35Å; A779-I781 PolarHBondContact O-N 3.42Å; A779-L782 PolarHBondContact O-N 2.9Å; A779-K783 WeakPolarHBondContact O-CB 3.4Å; A779-K783 PolarHBondContact O-N 2.87Å; A779-L801 HydrophobicContact CB-CD2 4.05Å; A779-F808 HydrophobicContact CB-CE2 3.69Å; A779-F808 HydrophobicContact CB-CZ 3.59Å; A779-W812 HydrophobicContact CB-CZ2 4.38Å
780	P	95.3	Very high	93.9	Very high	79 Å²	79	39 Å²	39	51%	0.513	19%	0.188	S	C	.	.	H	α-helix	trans	-60.7	-38.8	172.8	-26.1	35.5	0	0	0	114	K777 K783 R784	K777-P780 WeakPolarHBondContact O-CD 3.49Å; P780-K783 PolarHBondContact O-N 2.89Å; P780-R784 PolarHBondContact O-N 3.49Å
781	I	96.3	Very high	93.7	Very high	19 Å²	19	39.5 Å²	39.5	10%	0.097	19%	0.193	C	C	.	.	H	α-helix	trans	-63.4	-48.2	177.9	-58.7	169.7	0	0	0	109.3	L699 F702 N703 S778 A779 K783 R784 A785	L699-I781 HydrophobicContact CB-CD1 4.29Å; F702-I781 HydrophobicContact CB-CG2 3.62Å; N703-I781 HydrophobicContact CB-CD1 4.14Å; N703-I781 HydrophobicContact CB-CG1 4.33Å; N703-I781 HydrophobicContact CB-CG2 4.36Å; S778-I781 WeakPolarHBondContact O-CB 3.21Å; S778-I781 PolarHBondContact O-N 3.44Å; S778-I781 VanDerWaalsContact O-N 3.08Å; A779-I781 VanDerWaalsContact C-N 3.35Å; A779-I781 PolarHBondContact O-N 3.42Å; I781-K783 PolarHBondContact O-N 3.33Å; I781-R784 WeakPolarHBondContact O-CB 3.39Å; I781-R784 PolarHBondContact O-N 3.18Å; I781-A785 PolarHBondContact O-N 3.04Å; I781-A785 VanDerWaalsContact O-N 3.1Å
782	L	96.9	Very high	93.6	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-39.8	177	-68.4	175.9	0	0	0	112.3	L756 S778 A779 R784 A785 L786 V797 L800 L801	L756-L782 HydrophobicContact CD2-CD2 4.21Å; S778-L782 WeakPolarHBondContact O-CG 3.3Å; S778-L782 PolarHBondContact O-N 3.21Å; A779-L782 PolarHBondContact O-N 2.9Å; L782-R784 VanDerWaalsContact C-N 3.28Å; L782-R784 PolarHBondContact O-N 2.84Å; L782-A785 WeakPolarHBondContact O-CB 3.2Å; L782-A785 PolarHBondContact O-N 2.92Å; L782-A785 VanDerWaalsContact O-N 3.1Å; L782-L786 PolarHBondContact O-N 3.46Å; L782-V797 HydrophobicContact CB-CG1 3.91Å; L782-V797 HydrophobicContact CD2-CG1 4.3Å; L782-V797 WeakPolarHBondContact O-CG1 3.49Å; L782-L800 HydrophobicContact CD1-CB 3.72Å; L782-L800 HydrophobicContact CD1-CD1 4.4Å; L782-L800 HydrophobicContact CD2-CD1 3.9Å; L782-L801 HydrophobicContact CB-CD1 4.44Å; L782-L801 HydrophobicContact CB-CD2 3.97Å; L782-L801 HydrophobicContact CB-CG 4.17Å; L782-L801 HydrophobicContact CD1-CD2 4.17Å; L782-L801 HydrophobicContact CD1-CG 4.34Å
783	K	95.1	Very high	93.7	Very high	56 Å²	56	37.2 Å²	37.2	24%	0.243	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-38.4	174.8	-178.2	178.1	177.7	-172.8	0	111.7	D360 A779 P780 I781 L786 N816 I819	D360-K783 IonicContact OD2-NZ 3.24Å; A779-K783 WeakPolarHBondContact O-CB 3.4Å; A779-K783 PolarHBondContact O-N 2.87Å; P780-K783 PolarHBondContact O-N 2.89Å; I781-K783 PolarHBondContact O-N 3.33Å; K783-L786 WeakPolarHBondContact O-CB 3.48Å; K783-L786 PolarHBondContact O-N 2.73Å; K783-N816 PolarHBondContact NZ-OD1 3.17Å; K783-I819 HydrophobicContact CB-CD1 4.36Å; K783-I819 HydrophobicContact CD-CD1 4.04Å; K783-I819 HydrophobicContact CG-CD1 3.93Å
784	R	94.2	Very high	93.7	Very high	71 Å²	71	37.4 Å²	37.4	27%	0.268	18%	0.182	S	C	.	.	H	α-helix	trans	-65.1	-40.9	173.6	-165.9	-174.2	-57.5	127.5	1.8	111.4	N703 P780 I781 L782 L786 R787	N703-R784 PolarHBondContact OD1-NH1 3.38Å; P780-R784 PolarHBondContact O-N 3.49Å; I781-R784 WeakPolarHBondContact O-CB 3.39Å; I781-R784 PolarHBondContact O-N 3.18Å; L782-R784 VanDerWaalsContact C-N 3.28Å; L782-R784 PolarHBondContact O-N 2.84Å; R784-L786 PolarHBondContact O-N 2.84Å; R784-R787 VanDerWaalsContact O-CB 3.28Å; R784-R787 WeakPolarHBondContact O-CB 3.44Å; R784-R787 VanDerWaalsContact O-CG 3.31Å; R784-R787 WeakPolarHBondContact O-CG 3.43Å; R784-R787 PolarHBondContact O-N 2.89Å
785	A	94.8	Very high	93.7	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-61.6	-26.1	177.2	0	0	0	0	0	114.3	F702 I781 L782 R787 V788 L793 V797	F702-A785 HydrophobicContact CD1-CB 4.29Å; I781-A785 PolarHBondContact O-N 3.04Å; I781-A785 VanDerWaalsContact O-N 3.1Å; L782-A785 WeakPolarHBondContact O-CB 3.2Å; L782-A785 PolarHBondContact O-N 2.92Å; L782-A785 VanDerWaalsContact O-N 3.1Å; A785-R787 PolarHBondContact O-N 2.7Å; A785-R787 VanDerWaalsContact O-N 3.16Å; A785-V788 PolarHBondContact O-N 3.13Å; A785-L793 WeakPolarHBondContact O-CD2 3.41Å; A785-V797 HydrophobicContact CB-CG2 4.04Å
786	L	94.6	Very high	93.9	Very high	8 Å²	8	33.1 Å²	33.1	4%	0.042	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.4	173.4	-69	175.6	0	0	0	114.1	L782 K783 R784 V788 Q794 V797 L798 L801 I819	L782-L786 PolarHBondContact O-N 3.46Å; K783-L786 WeakPolarHBondContact O-CB 3.48Å; K783-L786 PolarHBondContact O-N 2.73Å; R784-L786 PolarHBondContact O-N 2.84Å; L786-V788 PolarHBondContact O-N 3.15Å; L786-Q794 HydrophobicContact CD2-CB 4.14Å; L786-Q794 HydrophobicContact CD2-CG 4.12Å; L786-Q794 PolarHBondContact O-NE2 2.7Å; L786-V797 HydrophobicContact CD1-CG1 4.48Å; L786-V797 HydrophobicContact CD2-CB 3.79Å; L786-V797 HydrophobicContact CD2-CG1 3.53Å; L786-V797 HydrophobicContact CG-CB 4.44Å; L786-V797 HydrophobicContact CG-CG1 3.66Å; L786-L798 HydrophobicContact CD1-CD2 4.15Å; L786-L798 HydrophobicContact CD2-CD2 4.03Å; L786-L798 HydrophobicContact CD2-CG 4Å; L786-L801 HydrophobicContact CD1-CD1 3.9Å; L786-I819 HydrophobicContact CD1-CD1 4.38Å; L786-I819 HydrophobicContact CD1-CG1 4.3Å
787	R	90.8	Very high	94	Very high	91 Å²	91	28.9 Å²	28.9	34%	0.343	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-25.6	176	-68.8	178.7	174.1	-179.9	-3.2	112.8	M356 R784 A785 R789	M356-R787 PolarHBondContact SD-NH2 3.48Å; R784-R787 VanDerWaalsContact O-CB 3.28Å; R784-R787 WeakPolarHBondContact O-CB 3.44Å; R784-R787 VanDerWaalsContact O-CG 3.31Å; R784-R787 WeakPolarHBondContact O-CG 3.43Å; R784-R787 PolarHBondContact O-N 2.89Å; A785-R787 PolarHBondContact O-N 2.7Å; A785-R787 VanDerWaalsContact O-N 3.16Å; R787-R789 PolarHBondContact O-N 3.29Å
788	V	91.1	Very high	94.1	Very high	7 Å²	7	21.6 Å²	21.6	4%	0.042	10%	0.104	C	C	.	.	S	Bend	trans	-72.5	117.9	175.5	-177.3	0	0	0	0	108.6	I706 I710 M749 A785 L786 H790 L793 Q794	I706-V788 HydrophobicContact CG2-CG2 3.91Å; I710-V788 HydrophobicContact CD1-CB 4.19Å; I710-V788 HydrophobicContact CD1-CG1 3.6Å; I710-V788 HydrophobicContact CD1-CG2 3.61Å; M749-V788 HydrophobicContact CE-CG1 3.97Å; A785-V788 PolarHBondContact O-N 3.13Å; L786-V788 PolarHBondContact O-N 3.15Å; V788-H790 HydrophobicContact CG1-CB 4.34Å; V788-H790 PolarHBondContact O-N 3.39Å; V788-L793 HydrophobicContact CB-CD1 4.3Å; V788-L793 HydrophobicContact CB-CD2 4.1Å; V788-L793 HydrophobicContact CG1-CD1 4.08Å; V788-Q794 WeakPolarHBondContact O-CG 3.39Å; V788-Q794 PolarHBondContact O-NE2 3.31Å; V788-Q794 VanDerWaalsContact O-NE2 3.15Å
789	R	87.8	Confident	94.1	Very high	40 Å²	40	24 Å²	24	15%	0.151	11%	0.114	C	C	.	.			trans	-84.6	63.7	-176.5	-65.8	-176.5	63.1	167.4	-10.3	111.9	N18 D20 V21 A350 P353 R787	N18-R789 VanDerWaalsContact C-NH1 3.28Å; N18-R789 PolarHBondContact O-NH1 3.07Å; N18-R789 PolarHBondContact O-NH2 3.13Å; D20-R789 IonicContact OD1-CZ 2.99Å; D20-R789 IonicContact OD1-NE 3.43Å; D20-R789 PolarHBondContact OD1-NE 3.11Å; D20-R789 IonicContact OD1-NH2 2.87Å; D20-R789 PolarHBondContact OD1-NH2 2.91Å; D20-R789 IonicContact OD2-NH2 3.49Å; V21-R789 PolarHBondContact N-O 2.94Å; V21-R789 VanDerWaalsContact N-O 3.08Å; A350-R789 HydrophobicContact CB-CB 4.32Å; P353-R789 HydrophobicContact CG-CG 4.42Å; R787-R789 PolarHBondContact O-N 3.29Å
790	H	90.7	Very high	94.2	Very high	21 Å²	21	23.6 Å²	23.6	10%	0.097	11%	0.111	C	C	.	.			trans	-129.8	125.4	173	-178	-115.1	0	0	0	110.3	F23 M749 V788 M792 L793 Q794	F23-H790 AromaticContact CD1-CE1 3.55Å; F23-H790 AromaticContact CD1-NE2 3.56Å; M749-H790 HydrophobicContact CE-CB 3.83Å; M749-H790 HydrophobicContact SD-CB 4.17Å; V788-H790 HydrophobicContact CG1-CB 4.34Å; V788-H790 PolarHBondContact O-N 3.39Å; H790-M792 VanDerWaalsContact CE1-CB 3.42Å; H790-M792 WeakPolarHBondContact CE1-CB 3.44Å; H790-M792 PolarHBondContact O-N 3.26Å; H790-L793 HydrophobicContact CB-CB 4.27Å; H790-L793 PolarHBondContact O-N 3.05Å; H790-Q794 WeakPolarHBondContact O-CB 3.33Å; H790-Q794 WeakPolarHBondContact O-CG 3.44Å; H790-Q794 PolarHBondContact O-N 3.44Å
791	A	90.4	Very high	94.2	Very high	18 Å²	18	19.9 Å²	19.9	15%	0.149	9%	0.087	C	C	.	.	H	α-helix	trans	-61.2	-43	-168.9	0	0	0	0	0	113.2	V348 L795	V348-A791 WeakPolarHBondContact O-CB 3.41Å; A791-L795 WeakPolarHBondContact O-CB 3.4Å; A791-L795 PolarHBondContact O-N 3.39Å
792	M	92	Very high	94.2	Very high	5 Å²	5	20 Å²	20	3%	0.025	9%	0.087	C	C	.	.	H	α-helix	trans	-65.8	-45.7	-179.6	-168.7	175.4	-128.7	0	0	111.8	Y25 V342 I345 I753 H790 L795 Y796	Y25-M792 VanDerWaalsContact CB-SD 3.6Å; Y25-M792 HydrophobicContact CD1-CE 4.11Å; Y25-M792 HydrophobicContact CD1-SD 4.09Å; Y25-M792 HydrophobicContact CD2-SD 3.88Å; Y25-M792 HydrophobicContact CG-CE 4.19Å; Y25-M792 HydrophobicContact CG-SD 3.56Å; Y25-M792 VanDerWaalsContact CG-SD 3.56Å; V342-M792 HydrophobicContact CB-CE 4.37Å; V342-M792 HydrophobicContact CG1-CE 4.05Å; V342-M792 HydrophobicContact CG2-CE 3.96Å; I345-M792 HydrophobicContact CD1-CE 4.18Å; I345-M792 HydrophobicContact CD1-CG 4.3Å; I345-M792 HydrophobicContact CG2-CB 3.61Å; I345-M792 HydrophobicContact CG2-CG 3.95Å; I753-M792 HydrophobicContact CD1-CB 4.43Å; I753-M792 HydrophobicContact CD1-SD 4.26Å; I753-M792 HydrophobicContact CG2-CG 3.98Å; I753-M792 HydrophobicContact CG2-SD 3.66Å; H790-M792 VanDerWaalsContact CE1-CB 3.42Å; H790-M792 WeakPolarHBondContact CE1-CB 3.44Å; H790-M792 PolarHBondContact O-N 3.26Å; M792-L795 PolarHBondContact O-N 3.04Å; M792-Y796 HydrophobicContact CE-CE2 4.34Å; M792-Y796 HydrophobicContact CG-CD2 4Å; M792-Y796 HydrophobicContact CG-CE2 3.55Å; M792-Y796 WeakPolarHBondContact O-CD2 3.43Å; M792-Y796 PolarHBondContact O-N 2.89Å; M792-Y796 HydrophobicContact SD-CE2 4.38Å
793	L	94.7	Very high	94.1	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.4	-52.3	177.9	-176.9	152.4	0	0	0	109.9	I710 M749 C752 I753 L756 A785 V788 H790 L795 Y796 V797	I710-L793 HydrophobicContact CD1-CD1 3.98Å; M749-L793 HydrophobicContact SD-CD1 3.99Å; C752-L793 HydrophobicContact CB-CD1 4.07Å; I753-L793 HydrophobicContact CG1-CB 4.16Å; L756-L793 HydrophobicContact CD1-CD2 4.34Å; L756-L793 HydrophobicContact CD1-CG 3.78Å; A785-L793 WeakPolarHBondContact O-CD2 3.41Å; V788-L793 HydrophobicContact CB-CD1 4.3Å; V788-L793 HydrophobicContact CB-CD2 4.1Å; V788-L793 HydrophobicContact CG1-CD1 4.08Å; H790-L793 HydrophobicContact CB-CB 4.27Å; H790-L793 PolarHBondContact O-N 3.05Å; L793-L795 VanDerWaalsContact C-N 3.3Å; L793-L795 PolarHBondContact O-N 2.76Å; L793-Y796 PolarHBondContact O-N 2.76Å; L793-V797 HydrophobicContact CD2-CG2 3.98Å; L793-V797 WeakPolarHBondContact O-CG2 3.23Å; L793-V797 PolarHBondContact O-N 3.09Å
794	Q	94.9	Very high	94.1	Very high	3 Å²	3	19.4 Å²	19.4	1%	0.014	9%	0.086	C	C	.	.	H	α-helix	trans	-59.6	-39.7	179.3	-72.5	-174.6	-9.6	0	0	112.2	S351 L786 V788 H790 Y796 V797 L798	S351-Q794 PolarHBondContact O-NE2 3.45Å; S351-Q794 PolarHBondContact OG-OE1 3.06Å; L786-Q794 HydrophobicContact CD2-CB 4.14Å; L786-Q794 HydrophobicContact CD2-CG 4.12Å; L786-Q794 PolarHBondContact O-NE2 2.7Å; V788-Q794 WeakPolarHBondContact O-CG 3.39Å; V788-Q794 PolarHBondContact O-NE2 3.31Å; V788-Q794 VanDerWaalsContact O-NE2 3.15Å; H790-Q794 WeakPolarHBondContact O-CB 3.33Å; H790-Q794 WeakPolarHBondContact O-CG 3.44Å; H790-Q794 PolarHBondContact O-N 3.44Å; Q794-Y796 VanDerWaalsContact C-N 3.34Å; Q794-Y796 PolarHBondContact O-N 3.33Å; Q794-V797 PolarHBondContact O-N 3.37Å; Q794-L798 WeakPolarHBondContact O-CB 3.3Å; Q794-L798 WeakPolarHBondContact O-CG 3.18Å; Q794-L798 PolarHBondContact O-N 3.37Å
795	L	94	Very high	94.1	Very high	9 Å²	9	16 Å²	16	5%	0.047	7%	0.073	C	C	.	.	H	α-helix	trans	-60.9	-43.7	178.3	-177.8	67.4	0	0	0	111.9	I345 W509 A791 M792 L793 V797 L798 K799 K826 V827	I345-L795 HydrophobicContact CD1-CD2 3.54Å; I345-L795 HydrophobicContact CG1-CD2 3.36Å; W509-L795 HydrophobicContact CZ2-CD2 4.14Å; A791-L795 WeakPolarHBondContact O-CB 3.4Å; A791-L795 PolarHBondContact O-N 3.39Å; M792-L795 PolarHBondContact O-N 3.04Å; L793-L795 VanDerWaalsContact C-N 3.3Å; L793-L795 PolarHBondContact O-N 2.76Å; L795-V797 VanDerWaalsContact C-N 3.35Å; L795-L798 PolarHBondContact O-N 3.19Å; L795-K799 HydrophobicContact CG-CD 4.33Å; L795-K799 VanDerWaalsContact O-CG 3.3Å; L795-K799 WeakPolarHBondContact O-CG 3.33Å; L795-K799 PolarHBondContact O-N 2.92Å; L795-K826 HydrophobicContact CD1-CB 4.28Å; L795-K826 WeakPolarHBondContact CD1-O 3.39Å; L795-V827 HydrophobicContact CD1-CG2 3.95Å
796	Y	96.4	Very high	93.9	Very high	15 Å²	15	18.9 Å²	18.9	6%	0.059	8%	0.083	C	C	.	.	H	α-helix	trans	-69.7	-33.3	178.7	-70.8	-62.8	0	0	0	112.6	I753 R757 N760 M792 L793 Q794 K799 L800	I753-Y796 HydrophobicContact CG2-CD2 4.36Å; I753-Y796 HydrophobicContact CG2-CE2 4.24Å; R757-Y796 HydrophobicContact CG-CD1 4.05Å; R757-Y796 HydrophobicContact CG-CD2 3.79Å; R757-Y796 HydrophobicContact CG-CE1 3.69Å; R757-Y796 HydrophobicContact CG-CE2 3.39Å; R757-Y796 HydrophobicContact CG-CG 4.12Å; N760-Y796 PolarHBondContact ND2-O 3Å; M792-Y796 HydrophobicContact CE-CE2 4.34Å; M792-Y796 HydrophobicContact CG-CD2 4Å; M792-Y796 HydrophobicContact CG-CE2 3.55Å; M792-Y796 WeakPolarHBondContact O-CD2 3.43Å; M792-Y796 PolarHBondContact O-N 2.89Å; M792-Y796 HydrophobicContact SD-CE2 4.38Å; L793-Y796 PolarHBondContact O-N 2.76Å; Q794-Y796 VanDerWaalsContact C-N 3.34Å; Q794-Y796 PolarHBondContact O-N 3.33Å; Y796-K799 HydrophobicContact CD1-CD 4.08Å; Y796-K799 HydrophobicContact CE1-CD 4.5Å; Y796-L800 WeakPolarHBondContact O-CG 3.46Å; Y796-L800 PolarHBondContact O-N 3.35Å
797	V	97.4	Very high	93.8	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.8	-46.6	170.9	177.3	0	0	0	0	111.2	L756 L782 A785 L786 L793 Q794 L795 K799 L800 L801	L756-V797 HydrophobicContact CD1-CG2 3.7Å; L756-V797 HydrophobicContact CD2-CG2 3.92Å; L756-V797 HydrophobicContact CG-CG2 4.48Å; L782-V797 HydrophobicContact CB-CG1 3.91Å; L782-V797 HydrophobicContact CD2-CG1 4.3Å; L782-V797 WeakPolarHBondContact O-CG1 3.49Å; A785-V797 HydrophobicContact CB-CG2 4.04Å; L786-V797 HydrophobicContact CD1-CG1 4.48Å; L786-V797 HydrophobicContact CD2-CB 3.79Å; L786-V797 HydrophobicContact CD2-CG1 3.53Å; L786-V797 HydrophobicContact CG-CB 4.44Å; L786-V797 HydrophobicContact CG-CG1 3.66Å; L793-V797 HydrophobicContact CD2-CG2 3.98Å; L793-V797 WeakPolarHBondContact O-CG2 3.23Å; L793-V797 PolarHBondContact O-N 3.09Å; Q794-V797 PolarHBondContact O-N 3.37Å; L795-V797 VanDerWaalsContact C-N 3.35Å; V797-K799 VanDerWaalsContact C-N 3.32Å; V797-K799 PolarHBondContact O-N 3.37Å; V797-L800 PolarHBondContact O-N 3.43Å; V797-L800 VanDerWaalsContact O-N 3.17Å; V797-L801 HydrophobicContact CG1-CD1 4.05Å; V797-L801 WeakPolarHBondContact O-CG 3.48Å; V797-L801 PolarHBondContact O-N 2.94Å
798	L	96.4	Very high	93.8	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	7%	0.073	C	C	.	.	H	α-helix	trans	-63.4	-36.4	178.3	-69.7	171.6	0	0	0	112	L786 Q794 L795 L801 K802 I819 A822 I823 K826 V827	L786-L798 HydrophobicContact CD1-CD2 4.15Å; L786-L798 HydrophobicContact CD2-CD2 4.03Å; L786-L798 HydrophobicContact CD2-CG 4Å; Q794-L798 WeakPolarHBondContact O-CB 3.3Å; Q794-L798 WeakPolarHBondContact O-CG 3.18Å; Q794-L798 PolarHBondContact O-N 3.37Å; L795-L798 PolarHBondContact O-N 3.19Å; L798-L801 PolarHBondContact O-N 3.14Å; L798-K802 WeakPolarHBondContact O-CB 3.32Å; L798-K802 PolarHBondContact O-N 3.31Å; L798-I819 HydrophobicContact CD2-CG2 4.28Å; L798-A822 HydrophobicContact CD1-CB 4.07Å; L798-A822 HydrophobicContact CD2-CB 3.87Å; L798-I823 HydrophobicContact CB-CG1 4.25Å; L798-I823 HydrophobicContact CD2-CG1 3.98Å; L798-K826 HydrophobicContact CD1-CB 4.27Å; L798-K826 HydrophobicContact CD1-CD 4.2Å; L798-V827 HydrophobicContact CB-CG2 3.73Å
799	K	96.1	Very high	93.7	Very high	51 Å²	51	16.6 Å²	16.6	22%	0.222	8%	0.08	C	C	.	.	H	α-helix	trans	-60.8	-43.6	173	-76.7	169.4	178.2	166.8	0	111.9	N760 L795 Y796 V797 K802 L803 V827	N760-K799 WeakPolarHBondContact OD1-CB 3.47Å; L795-K799 HydrophobicContact CG-CD 4.33Å; L795-K799 VanDerWaalsContact O-CG 3.3Å; L795-K799 WeakPolarHBondContact O-CG 3.33Å; L795-K799 PolarHBondContact O-N 2.92Å; Y796-K799 HydrophobicContact CD1-CD 4.08Å; Y796-K799 HydrophobicContact CE1-CD 4.5Å; V797-K799 VanDerWaalsContact C-N 3.32Å; V797-K799 PolarHBondContact O-N 3.37Å; K799-K802 PolarHBondContact O-N 3.48Å; K799-L803 WeakPolarHBondContact O-CG 3.35Å; K799-L803 PolarHBondContact O-N 3.45Å; K799-V827 HydrophobicContact CG-CG1 3.95Å; K799-V827 HydrophobicContact CG-CG2 4.37Å
800	L	97.8	Very high	93.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.4	-37.5	176.7	-69.6	164.6	0	0	0	112.2	L756 L759 N760 L773 L782 Y796 V797 L803 Q804	L756-L800 HydrophobicContact CD2-CD1 3.83Å; L759-L800 HydrophobicContact CB-CD1 4.37Å; L759-L800 HydrophobicContact CB-CD2 4.44Å; L759-L800 HydrophobicContact CD2-CD1 3.76Å; L759-L800 HydrophobicContact CD2-CD2 4.28Å; L759-L800 HydrophobicContact CG-CD1 4.13Å; L759-L800 HydrophobicContact CG-CD2 3.92Å; N760-L800 WeakPolarHBondContact ND2-CG 3.4Å; L773-L800 HydrophobicContact CD1-CD2 4.02Å; L782-L800 HydrophobicContact CD1-CB 3.72Å; L782-L800 HydrophobicContact CD1-CD1 4.4Å; L782-L800 HydrophobicContact CD2-CD1 3.9Å; Y796-L800 WeakPolarHBondContact O-CG 3.46Å; Y796-L800 PolarHBondContact O-N 3.35Å; V797-L800 PolarHBondContact O-N 3.43Å; V797-L800 VanDerWaalsContact O-N 3.17Å; L800-L803 PolarHBondContact O-N 2.86Å; L800-Q804 WeakPolarHBondContact O-CG 3.46Å; L800-Q804 PolarHBondContact O-N 3.23Å; L800-Q804 PolarHBondContact O-NE2 3.4Å
801	L	96.9	Very high	93.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68.9	-37.5	175.2	-69.8	168.8	0	0	0	111.8	A779 L782 L786 V797 L798 Q804 S805 I819 I823	A779-L801 HydrophobicContact CB-CD2 4.05Å; L782-L801 HydrophobicContact CB-CD1 4.44Å; L782-L801 HydrophobicContact CB-CD2 3.97Å; L782-L801 HydrophobicContact CB-CG 4.17Å; L782-L801 HydrophobicContact CD1-CD2 4.17Å; L782-L801 HydrophobicContact CD1-CG 4.34Å; L786-L801 HydrophobicContact CD1-CD1 3.9Å; V797-L801 HydrophobicContact CG1-CD1 4.05Å; V797-L801 WeakPolarHBondContact O-CG 3.48Å; V797-L801 PolarHBondContact O-N 2.94Å; L798-L801 PolarHBondContact O-N 3.14Å; L801-Q804 PolarHBondContact O-N 3.36Å; L801-S805 PolarHBondContact O-N 3.45Å; L801-S805 VanDerWaalsContact O-N 3.07Å; L801-I819 HydrophobicContact CB-CG2 4.38Å; L801-I819 HydrophobicContact CD1-CD1 4.48Å; L801-I819 HydrophobicContact CD1-CG2 3.78Å; L801-I823 HydrophobicContact CB-CD1 4.24Å
802	K	95.8	Very high	94	Very high	22 Å²	22	30 Å²	30	10%	0.096	13%	0.131	C	C	.	.	H	α-helix	trans	-61.1	-42.4	172.4	179.1	177	173.7	162.1	0	111.8	L798 K799 Q804 S805 I823 V827 R828 H829 D833 W835	L798-K802 WeakPolarHBondContact O-CB 3.32Å; L798-K802 PolarHBondContact O-N 3.31Å; K799-K802 PolarHBondContact O-N 3.48Å; K802-Q804 PolarHBondContact O-N 2.73Å; K802-S805 PolarHBondContact O-N 2.76Å; K802-S805 PolarHBondContact O-OG 3.04Å; K802-I823 HydrophobicContact CB-CD1 4.18Å; K802-I823 HydrophobicContact CB-CG1 4.48Å; K802-I823 HydrophobicContact CB-CG2 3.82Å; K802-I823 HydrophobicContact CD-CG2 3.86Å; K802-I823 HydrophobicContact CG-CG2 3.96Å; K802-V827 HydrophobicContact CD-CB 4.33Å; K802-V827 HydrophobicContact CD-CG1 3.6Å; K802-R828 PolarHBondContact NZ-O 3.36Å; K802-H829 PolarHBondContact NZ-ND1 3.4Å; K802-D833 WeakPolarHBondContact CE-OD2 3.37Å; K802-D833 IonicContact NZ-OD2 3.77Å; K802-D833 PolarHBondContact NZ-OD2 2.72Å; K802-W835 HydrophobicContact CD-CD2 4.34Å; K802-W835 HydrophobicContact CD-CG 4.32Å; K802-W835 HydrophobicContact CG-CB 4.2Å; K802-W835 HydrophobicContact CG-CD2 3.92Å; K802-W835 HydrophobicContact CG-CE3 4.15Å; K802-W835 HydrophobicContact CG-CG 3.91Å
803	L	94.7	Very high	94	Very high	44 Å²	44	30.8 Å²	30.8	23%	0.23	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-34.6	178.4	-71.3	173.7	0	0	0	112.1	I770 K799 L800	I770-L803 HydrophobicContact CD1-CB 4.2Å; I770-L803 HydrophobicContact CD1-CD2 4.01Å; I770-L803 HydrophobicContact CG1-CB 4.28Å; I770-L803 HydrophobicContact CG2-CB 4.22Å; I770-L803 WeakPolarHBondContact CG2-O 3.39Å; K799-L803 WeakPolarHBondContact O-CG 3.35Å; K799-L803 PolarHBondContact O-N 3.45Å; L800-L803 PolarHBondContact O-N 2.86Å
804	Q	94.5	Very high	93.9	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-88.3	-18.2	-176.4	-64.5	173.3	77.1	0	0	114	I770 L773 V774 S778 L800 L801 K802 R806 Y807 F808	I770-Q804 HydrophobicContact CG2-CG 4.15Å; L773-Q804 HydrophobicContact CB-CG 4.12Å; L773-Q804 HydrophobicContact CD1-CG 4.28Å; V774-Q804 HydrophobicContact CG2-CB 4.16Å; V774-Q804 HydrophobicContact CG2-CG 4.07Å; S778-Q804 PolarHBondContact OG-NE2 2.85Å; S778-Q804 PolarHBondContact OG-OE1 2.94Å; L800-Q804 WeakPolarHBondContact O-CG 3.46Å; L800-Q804 PolarHBondContact O-N 3.23Å; L800-Q804 PolarHBondContact O-NE2 3.4Å; L801-Q804 PolarHBondContact O-N 3.36Å; K802-Q804 PolarHBondContact O-N 2.73Å; Q804-R806 PolarHBondContact O-N 3.47Å; Q804-R806 VanDerWaalsContact O-N 3.1Å; Q804-Y807 PolarHBondContact O-N 3.2Å; Q804-F808 HydrophobicContact CB-CD2 4.03Å; Q804-F808 HydrophobicContact CB-CE2 3.26Å; Q804-F808 HydrophobicContact CB-CZ 3.56Å; Q804-F808 HydrophobicContact CG-CE2 4.34Å; Q804-F808 HydrophobicContact CG-CZ 4.31Å; Q804-F808 WeakPolarHBondContact O-CD2 3.42Å; Q804-F808 PolarHBondContact O-N 2.92Å
805	S	93.7	Very high	93.9	Very high	0 Å²	0	43 Å²	43	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.7	-168.9	64.5	0	0	0	0	114.8	L801 K802 Y807 F808 R813 W835	L801-S805 PolarHBondContact O-N 3.45Å; L801-S805 VanDerWaalsContact O-N 3.07Å; K802-S805 PolarHBondContact O-N 2.76Å; K802-S805 PolarHBondContact O-OG 3.04Å; S805-Y807 VanDerWaalsContact C-N 3.26Å; S805-Y807 PolarHBondContact O-N 3.37Å; S805-F808 PolarHBondContact O-N 3.17Å; S805-F808 VanDerWaalsContact O-O 3.06Å; S805-R813 PolarHBondContact O-NH1 2.96Å; S805-W835 PolarHBondContact OG-O 3.38Å
806	R	91.9	Very high	93.9	Very high	61 Å²	61	43.1 Å²	43.1	23%	0.23	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-30.9	176.9	115.1	-180	-136.1	-174.1	2.9	112.7	H767 Q804 G838 D840	H767-R806 PolarHBondContact NE2-NH1 3.37Å; Q804-R806 PolarHBondContact O-N 3.47Å; Q804-R806 VanDerWaalsContact O-N 3.1Å; R806-G838 CarbonylContact O-C 3.24Å; R806-D840 IonicContact CZ-OD2 3.12Å; R806-D840 IonicContact NE-OD2 2.83Å; R806-D840 PolarHBondContact NE-OD2 2.95Å; R806-D840 IonicContact NH2-OD2 2.63Å; R806-D840 PolarHBondContact NH2-OD2 3.43Å; R806-D840 PolarHBondContact O-N 2.87Å; R806-D840 VanDerWaalsContact O-N 3.08Å
807	Y	92.6	Very high	93.7	Very high	13 Å²	13	47.8 Å²	47.8	5%	0.051	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-15	179.9	-53.1	-72.9	0	0	0	111.7	H767 I770 M771 V774 Q804 S805 D840 A843	H767-Y807 PolarHBondContact CD2-OH 3.2Å; I770-Y807 HydrophobicContact CB-CE2 4.34Å; I770-Y807 HydrophobicContact CG2-CD2 4.08Å; I770-Y807 HydrophobicContact CG2-CE2 3.56Å; M771-Y807 HydrophobicContact SD-CD1 4.28Å; V774-Y807 HydrophobicContact CG2-CD2 3.98Å; V774-Y807 HydrophobicContact CG2-CG 4.18Å; Q804-Y807 PolarHBondContact O-N 3.2Å; S805-Y807 VanDerWaalsContact C-N 3.26Å; S805-Y807 PolarHBondContact O-N 3.37Å; Y807-D840 HydrophobicContact CD1-CB 4.42Å; Y807-D840 WeakPolarHBondContact CD1-O 3.31Å; Y807-A843 HydrophobicContact CD1-CB 3.88Å; Y807-A843 HydrophobicContact CE1-CB 3.84Å
808	F	90.2	Very high	93.5	Very high	28 Å²	28	50.9 Å²	50.9	12%	0.123	24%	0.238	C	C	.	.	S	Bend	trans	-91.5	108.1	176.3	-59.2	-35	0	0	0	109.6	V774 A779 Q804 S805 W812 R813	V774-F808 HydrophobicContact CG1-CE1 4.07Å; V774-F808 HydrophobicContact CG2-CE1 4.13Å; V774-F808 HydrophobicContact CG2-CZ 4.27Å; A779-F808 HydrophobicContact CB-CE2 3.69Å; A779-F808 HydrophobicContact CB-CZ 3.59Å; Q804-F808 HydrophobicContact CB-CD2 4.03Å; Q804-F808 HydrophobicContact CB-CE2 3.26Å; Q804-F808 HydrophobicContact CB-CZ 3.56Å; Q804-F808 HydrophobicContact CG-CE2 4.34Å; Q804-F808 HydrophobicContact CG-CZ 4.31Å; Q804-F808 WeakPolarHBondContact O-CD2 3.42Å; Q804-F808 PolarHBondContact O-N 2.92Å; S805-F808 PolarHBondContact O-N 3.17Å; S805-F808 VanDerWaalsContact O-O 3.06Å; F808-W812 HydrophobicContact CB-CB 3.99Å; F808-W812 HydrophobicContact CB-CD2 3.65Å; F808-W812 HydrophobicContact CB-CE3 3.46Å; F808-W812 VanDerWaalsContact CB-CE3 3.46Å; F808-W812 HydrophobicContact CB-CG 3.86Å; F808-W812 HydrophobicContact CB-CZ3 4.14Å; F808-W812 AromaticContact CD2-CD2 3.9Å; F808-W812 HydrophobicContact CD2-CD2 3.9Å; F808-W812 AromaticContact CD2-CE2 3.93Å; F808-W812 AromaticContact CD2-CE3 3.74Å; F808-W812 HydrophobicContact CD2-CE3 3.74Å; F808-W812 AromaticContact CD2-CH2 3.78Å; F808-W812 HydrophobicContact CD2-CH2 3.78Å; F808-W812 AromaticContact CD2-CZ2 3.93Å; F808-W812 HydrophobicContact CD2-CZ2 3.93Å; F808-W812 AromaticContact CD2-CZ3 3.63Å; F808-W812 HydrophobicContact CD2-CZ3 3.63Å; F808-W812 HydrophobicContact CE2-CH2 4.26Å; F808-W812 HydrophobicContact CE2-CZ2 4.23Å; F808-W812 AromaticContact CG-CD2 3.96Å; F808-W812 HydrophobicContact CG-CD2 3.96Å; F808-W812 AromaticContact CG-CE3 3.98Å; F808-W812 HydrophobicContact CG-CE3 3.98Å; F808-W812 HydrophobicContact CG-CG 4.32Å; F808-W812 HydrophobicContact CG-CZ3 4.33Å; F808-R813 PolarHBondContact O-NH1 3.38Å
809	G	88.7	Confident	93.4	Very high	18 Å²	18	50.9 Å²	50.9	19%	0.186	24%	0.238	C	C	.	.			trans	-56.1	169.2	-175.8	0	0	0	0	0	114.9	Q811 W812 N839 V841	G809-Q811 PolarHBondContact O-N 3.37Å; G809-W812 WeakPolarHBondContact O-CB 3.36Å; G809-W812 PolarHBondContact O-N 3.06Å; G809-N839 WeakPolarHBondContact CA-OD1 2.97Å; G809-V841 VanDerWaalsContact CA-CG2 3.45Å
810	R	91.1	Very high	93.3	Very high	186 Å²	186	49.2 Å²	49.2	70%	0.702	23%	0.231	S	C	*	.	H	α-helix	trans	-48.5	-39.1	-174.7	-64	-178.1	-177.2	-124.9	0.2	114.5	W812 R813 K814 N839	R810-W812 VanDerWaalsContact C-N 3.33Å; R810-W812 PolarHBondContact O-N 2.84Å; R810-R813 PolarHBondContact O-N 3.33Å; R810-K814 PolarHBondContact O-N 3.39Å; R810-K814 VanDerWaalsContact O-N 3.07Å; R810-N839 PolarHBondContact N-OD1 3.27Å
811	Q	91	Very high	93	Very high	116 Å²	116	51.6 Å²	51.6	54%	0.542	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-38.6	-179.9	-172.7	59.8	37.2	0	0	112.7	G809 R813 K814 N815	G809-Q811 PolarHBondContact O-N 3.37Å; Q811-R813 VanDerWaalsContact C-N 3.35Å; Q811-K814 PolarHBondContact O-N 2.84Å; Q811-N815 PolarHBondContact NE2-OD1 2.98Å; Q811-N815 PolarHBondContact O-N 2.96Å; Q811-N815 VanDerWaalsContact O-N 3.1Å; Q811-N815 PolarHBondContact O-OD1 3.02Å
812	W	92.7	Very high	92.8	Very high	57 Å²	57	52.2 Å²	52.2	22%	0.216	25%	0.253	C	S	.	.	H	α-helix	trans	-65.9	-40.2	177.9	-177.6	89.9	0	0	0	111.3	A779 F808 G809 R810 N815 N816 M820	A779-W812 HydrophobicContact CB-CZ2 4.38Å; F808-W812 HydrophobicContact CB-CB 3.99Å; F808-W812 HydrophobicContact CB-CD2 3.65Å; F808-W812 HydrophobicContact CB-CE3 3.46Å; F808-W812 VanDerWaalsContact CB-CE3 3.46Å; F808-W812 HydrophobicContact CB-CG 3.86Å; F808-W812 HydrophobicContact CB-CZ3 4.14Å; F808-W812 AromaticContact CD2-CD2 3.9Å; F808-W812 HydrophobicContact CD2-CD2 3.9Å; F808-W812 AromaticContact CD2-CE2 3.93Å; F808-W812 AromaticContact CD2-CE3 3.74Å; F808-W812 HydrophobicContact CD2-CE3 3.74Å; F808-W812 AromaticContact CD2-CH2 3.78Å; F808-W812 HydrophobicContact CD2-CH2 3.78Å; F808-W812 AromaticContact CD2-CZ2 3.93Å; F808-W812 HydrophobicContact CD2-CZ2 3.93Å; F808-W812 AromaticContact CD2-CZ3 3.63Å; F808-W812 HydrophobicContact CD2-CZ3 3.63Å; F808-W812 HydrophobicContact CE2-CH2 4.26Å; F808-W812 HydrophobicContact CE2-CZ2 4.23Å; F808-W812 AromaticContact CG-CD2 3.96Å; F808-W812 HydrophobicContact CG-CD2 3.96Å; F808-W812 AromaticContact CG-CE3 3.98Å; F808-W812 HydrophobicContact CG-CE3 3.98Å; F808-W812 HydrophobicContact CG-CG 4.32Å; F808-W812 HydrophobicContact CG-CZ3 4.33Å; G809-W812 WeakPolarHBondContact O-CB 3.36Å; G809-W812 PolarHBondContact O-N 3.06Å; R810-W812 VanDerWaalsContact C-N 3.33Å; R810-W812 PolarHBondContact O-N 2.84Å; W812-N815 PolarHBondContact O-N 3.47Å; W812-N816 VanDerWaalsContact CE2-ND2 3.35Å; W812-N816 HydrophobicContact CH2-CB 4.45Å; W812-N816 HydrophobicContact CZ2-CB 4.25Å; W812-N816 PolarHBondContact NE1-ND2 2.95Å; W812-N816 WeakPolarHBondContact O-CB 3.46Å; W812-N816 PolarHBondContact O-N 3.47Å; W812-N816 PolarHBondContact O-ND2 3.11Å; W812-M820 HydrophobicContact CE3-CE 3.84Å; W812-M820 HydrophobicContact CH2-CE 4.14Å; W812-M820 HydrophobicContact CZ3-CE 3.2Å
813	R	93.1	Very high	92.7	Very high	22 Å²	22	51.1 Å²	51.1	8%	0.083	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-42.7	177	-58.2	-164.4	-82.4	-96.7	15.1	111.9	S805 F808 R810 Q811 N815 N816 M817 M820 A836 Y837 G838	S805-R813 PolarHBondContact O-NH1 2.96Å; F808-R813 PolarHBondContact O-NH1 3.38Å; R810-R813 PolarHBondContact O-N 3.33Å; Q811-R813 VanDerWaalsContact C-N 3.35Å; R813-N815 VanDerWaalsContact C-N 3.32Å; R813-N815 PolarHBondContact O-N 3.1Å; R813-N816 CarbonylContact O-C 3.38Å; R813-N816 PolarHBondContact O-N 3.1Å; R813-M817 PolarHBondContact O-N 3.01Å; R813-M820 HydrophobicContact CB-CE 4.11Å; R813-M820 HydrophobicContact CB-CG 4.41Å; R813-M820 HydrophobicContact CB-SD 4.39Å; R813-M820 HydrophobicContact CG-CE 3.59Å; R813-M820 HydrophobicContact CG-SD 4.2Å; R813-A836 VanDerWaalsContact CD-O 3.24Å; R813-A836 WeakPolarHBondContact CD-O 3.4Å; R813-A836 PolarHBondContact NE-O 2.95Å; R813-A836 VanDerWaalsContact NE-O 3.11Å; R813-Y837 PolarHBondContact NH2-O 3.07Å; R813-G838 VanDerWaalsContact CZ-O 3.3Å; R813-G838 PolarHBondContact NH1-O 3.21Å; R813-G838 PolarHBondContact NH2-O 3.48Å
814	K	92.5	Very high	92.5	Very high	151 Å²	151	56.7 Å²	56.7	66%	0.657	27%	0.267	S	S	*	.	H	α-helix	trans	-57.2	-45.1	174	-175.3	179.3	178.2	-179.8	0	111.6	R810 Q811 N816	R810-K814 PolarHBondContact O-N 3.39Å; R810-K814 VanDerWaalsContact O-N 3.07Å; Q811-K814 PolarHBondContact O-N 2.84Å; K814-N816 VanDerWaalsContact C-N 3.32Å; K814-N816 PolarHBondContact O-N 3.4Å
815	N	93.9	Very high	92.2	Very high	109 Å²	109	63 Å²	63	58%	0.583	30%	0.297	S	S	*	.	H	α-helix	trans	-73.7	-21.9	-179.2	-68.9	3.7	0	0	0	113.5	Q811 W812 R813	Q811-N815 PolarHBondContact NE2-OD1 2.98Å; Q811-N815 PolarHBondContact O-N 2.96Å; Q811-N815 VanDerWaalsContact O-N 3.1Å; Q811-N815 PolarHBondContact O-OD1 3.02Å; W812-N815 PolarHBondContact O-N 3.47Å; R813-N815 VanDerWaalsContact C-N 3.32Å; R813-N815 PolarHBondContact O-N 3.1Å
816	N	93.9	Very high	92	Very high	12 Å²	12	64.1 Å²	64.1	6%	0.064	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	38.6	-176.7	-61.9	-81.9	0	0	0	111.8	K783 W812 R813 K814 S818 I819 M820	K783-N816 PolarHBondContact NZ-OD1 3.17Å; W812-N816 VanDerWaalsContact CE2-ND2 3.35Å; W812-N816 HydrophobicContact CH2-CB 4.45Å; W812-N816 HydrophobicContact CZ2-CB 4.25Å; W812-N816 PolarHBondContact NE1-ND2 2.95Å; W812-N816 WeakPolarHBondContact O-CB 3.46Å; W812-N816 PolarHBondContact O-N 3.47Å; W812-N816 PolarHBondContact O-ND2 3.11Å; R813-N816 CarbonylContact O-C 3.38Å; R813-N816 PolarHBondContact O-N 3.1Å; K814-N816 VanDerWaalsContact C-N 3.32Å; K814-N816 PolarHBondContact O-N 3.4Å; N816-S818 PolarHBondContact O-N 3.24Å; N816-I819 HydrophobicContact CB-CB 4.29Å; N816-I819 HydrophobicContact CB-CD1 4.06Å; N816-I819 HydrophobicContact CB-CG1 4.31Å; N816-I819 WeakPolarHBondContact O-CB 3.3Å; N816-I819 PolarHBondContact O-N 3.42Å; N816-M820 PolarHBondContact O-N 3.39Å
817	M	93	Very high	91.9	Very high	112 Å²	112	61.6 Å²	61.6	55%	0.552	29%	0.293	S	S	*	.	H	α-helix	trans	-57.8	-34.1	-178.3	-171.7	58.5	69.3	0	0	113.1	R813 I819 M820 S821	R813-M817 PolarHBondContact O-N 3.01Å; M817-I819 VanDerWaalsContact C-N 3.34Å; M817-I819 PolarHBondContact O-N 3.22Å; M817-M820 WeakPolarHBondContact O-CB 3.48Å; M817-M820 PolarHBondContact O-N 2.73Å; M817-M820 HydrophobicContact SD-CB 4.36Å; M817-S821 WeakPolarHBondContact O-CB 3.42Å; M817-S821 PolarHBondContact O-N 3.44Å; M817-S821 PolarHBondContact O-OG 3.34Å
818	S	92.7	Very high	91.8	Very high	65 Å²	65	63.2 Å²	63.2	46%	0.455	30%	0.299	S	S	.	.	H	α-helix	trans	-62.8	-40	175.1	54	0	0	0	0	112.3	N816 S821 A822	N816-S818 PolarHBondContact O-N 3.24Å; S818-S821 PolarHBondContact O-N 2.99Å; S818-A822 WeakPolarHBondContact O-CB 3.43Å; S818-A822 PolarHBondContact O-N 3.07Å
819	I	94.4	Very high	91.6	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-67.6	-44.6	175.6	-58.5	-178.1	0	0	0	110	K783 L786 L798 L801 N816 M817 S821 A822 I823	K783-I819 HydrophobicContact CB-CD1 4.36Å; K783-I819 HydrophobicContact CD-CD1 4.04Å; K783-I819 HydrophobicContact CG-CD1 3.93Å; L786-I819 HydrophobicContact CD1-CD1 4.38Å; L786-I819 HydrophobicContact CD1-CG1 4.3Å; L798-I819 HydrophobicContact CD2-CG2 4.28Å; L801-I819 HydrophobicContact CB-CG2 4.38Å; L801-I819 HydrophobicContact CD1-CD1 4.48Å; L801-I819 HydrophobicContact CD1-CG2 3.78Å; N816-I819 HydrophobicContact CB-CB 4.29Å; N816-I819 HydrophobicContact CB-CD1 4.06Å; N816-I819 HydrophobicContact CB-CG1 4.31Å; N816-I819 WeakPolarHBondContact O-CB 3.3Å; N816-I819 PolarHBondContact O-N 3.42Å; M817-I819 VanDerWaalsContact C-N 3.34Å; M817-I819 PolarHBondContact O-N 3.22Å; I819-S821 VanDerWaalsContact C-N 3.27Å; I819-S821 PolarHBondContact O-N 3.46Å; I819-A822 PolarHBondContact O-N 3.3Å; I819-I823 HydrophobicContact CG2-CD1 4.04Å; I819-I823 HydrophobicContact CG2-CG1 4.44Å; I819-I823 VanDerWaalsContact O-CG1 3.32Å; I819-I823 WeakPolarHBondContact O-CG1 3.28Å; I819-I823 PolarHBondContact O-N 3.05Å
820	M	93.7	Very high	91.5	Very high	17 Å²	17	64.6 Å²	64.6	8%	0.084	30%	0.299	C	S	.	.	H	α-helix	trans	-55.9	-45.1	175.4	-69.4	-74	145.8	0	0	111.5	W812 R813 N816 M817 I823 Y824 W835	W812-M820 HydrophobicContact CE3-CE 3.84Å; W812-M820 HydrophobicContact CH2-CE 4.14Å; W812-M820 HydrophobicContact CZ3-CE 3.2Å; R813-M820 HydrophobicContact CB-CE 4.11Å; R813-M820 HydrophobicContact CB-CG 4.41Å; R813-M820 HydrophobicContact CB-SD 4.39Å; R813-M820 HydrophobicContact CG-CE 3.59Å; R813-M820 HydrophobicContact CG-SD 4.2Å; N816-M820 PolarHBondContact O-N 3.39Å; M817-M820 WeakPolarHBondContact O-CB 3.48Å; M817-M820 PolarHBondContact O-N 2.73Å; M817-M820 HydrophobicContact SD-CB 4.36Å; M820-I823 PolarHBondContact O-N 3.02Å; M820-Y824 PolarHBondContact O-N 3.35Å; M820-W835 HydrophobicContact SD-CE3 4.44Å; M820-W835 HydrophobicContact SD-CH2 4.47Å; M820-W835 HydrophobicContact SD-CZ3 3.67Å
821	S	92.7	Very high	91.1	Very high	49 Å²	49	59.8 Å²	59.8	34%	0.343	29%	0.287	S	S	.	.	H	α-helix	trans	-64.6	-43.5	177.7	-55.4	0	0	0	0	111.5	M817 S818 I819 I823 Y824 Q825	M817-S821 WeakPolarHBondContact O-CB 3.42Å; M817-S821 PolarHBondContact O-N 3.44Å; M817-S821 PolarHBondContact O-OG 3.34Å; S818-S821 PolarHBondContact O-N 2.99Å; I819-S821 VanDerWaalsContact C-N 3.27Å; I819-S821 PolarHBondContact O-N 3.46Å; S821-I823 PolarHBondContact O-N 3.44Å; S821-Y824 WeakPolarHBondContact O-CB 3.32Å; S821-Y824 PolarHBondContact O-N 3.08Å; S821-Y824 VanDerWaalsContact O-N 3.17Å; S821-Q825 WeakPolarHBondContact O-CB 3.49Å; S821-Q825 VanDerWaalsContact O-CG 3.3Å; S821-Q825 WeakPolarHBondContact O-CG 3.31Å; S821-Q825 PolarHBondContact O-N 3.16Å
822	A	92.6	Very high	90.7	Very high	13 Å²	13	56.8 Å²	56.8	11%	0.107	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-38.8	176.6	0	0	0	0	0	112.5	L798 S818 I819 Y824 Q825 K826	L798-A822 HydrophobicContact CD1-CB 4.07Å; L798-A822 HydrophobicContact CD2-CB 3.87Å; S818-A822 WeakPolarHBondContact O-CB 3.43Å; S818-A822 PolarHBondContact O-N 3.07Å; I819-A822 PolarHBondContact O-N 3.3Å; A822-Y824 VanDerWaalsContact C-N 3.33Å; A822-Q825 PolarHBondContact O-N 3.14Å; A822-K826 WeakPolarHBondContact O-CB 3.39Å; A822-K826 PolarHBondContact O-N 3.4Å; A822-K826 VanDerWaalsContact O-N 3.09Å
823	I	92.7	Very high	90.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.1	-46.7	172.4	-66.6	166.6	0	0	0	109.4	L798 L801 K802 I819 M820 S821 Q825 K826 V827 W835	L798-I823 HydrophobicContact CB-CG1 4.25Å; L798-I823 HydrophobicContact CD2-CG1 3.98Å; L801-I823 HydrophobicContact CB-CD1 4.24Å; K802-I823 HydrophobicContact CB-CD1 4.18Å; K802-I823 HydrophobicContact CB-CG1 4.48Å; K802-I823 HydrophobicContact CB-CG2 3.82Å; K802-I823 HydrophobicContact CD-CG2 3.86Å; K802-I823 HydrophobicContact CG-CG2 3.96Å; I819-I823 HydrophobicContact CG2-CD1 4.04Å; I819-I823 HydrophobicContact CG2-CG1 4.44Å; I819-I823 VanDerWaalsContact O-CG1 3.32Å; I819-I823 WeakPolarHBondContact O-CG1 3.28Å; I819-I823 PolarHBondContact O-N 3.05Å; M820-I823 PolarHBondContact O-N 3.02Å; S821-I823 PolarHBondContact O-N 3.44Å; I823-Q825 VanDerWaalsContact C-N 3.3Å; I823-Q825 PolarHBondContact O-N 2.86Å; I823-K826 PolarHBondContact O-N 3.4Å; I823-V827 HydrophobicContact CG2-CB 4.09Å; I823-V827 HydrophobicContact CG2-CG2 4.17Å; I823-V827 WeakPolarHBondContact O-CB 3.34Å; I823-V827 PolarHBondContact O-N 2.72Å; I823-W835 HydrophobicContact CB-CH2 3.73Å; I823-W835 HydrophobicContact CB-CZ2 4.49Å; I823-W835 HydrophobicContact CB-CZ3 3.93Å; I823-W835 HydrophobicContact CD1-CZ3 3.97Å; I823-W835 HydrophobicContact CG2-CD2 4.41Å; I823-W835 HydrophobicContact CG2-CE3 4.08Å; I823-W835 HydrophobicContact CG2-CH2 3.33Å; I823-W835 HydrophobicContact CG2-CZ2 3.68Å; I823-W835 HydrophobicContact CG2-CZ3 3.54Å
824	Y	90.5	Very high	90.1	Very high	160 Å²	160	57.6 Å²	57.6	63%	0.627	29%	0.287	S	S	*	.	H	α-helix	trans	-58.8	-41	179.5	-171.4	-95.1	0	0	0	112.5	M820 S821 A822 H829	M820-Y824 PolarHBondContact O-N 3.35Å; S821-Y824 WeakPolarHBondContact O-CB 3.32Å; S821-Y824 PolarHBondContact O-N 3.08Å; S821-Y824 VanDerWaalsContact O-N 3.17Å; A822-Y824 VanDerWaalsContact C-N 3.33Å; Y824-H829 WeakPolarHBondContact CA-NE2 3.42Å; Y824-H829 AromaticContact CD2-NE2 3.81Å; Y824-H829 PolarHBondContact O-NE2 3.38Å
825	Q	89.3	Confident	89.9	Confident	134 Å²	134	51.6 Å²	51.6	63%	0.626	26%	0.26	S	S	*	.	H	α-helix	trans	-82.5	-18.1	-175.7	-70.8	171.6	-3.8	0	0	115.3	L507 S821 A822 I823	L507-Q825 WeakPolarHBondContact CD2-O 3.34Å; S821-Q825 WeakPolarHBondContact O-CB 3.49Å; S821-Q825 VanDerWaalsContact O-CG 3.3Å; S821-Q825 WeakPolarHBondContact O-CG 3.31Å; S821-Q825 PolarHBondContact O-N 3.16Å; A822-Q825 PolarHBondContact O-N 3.14Å; I823-Q825 VanDerWaalsContact C-N 3.3Å; I823-Q825 PolarHBondContact O-N 2.86Å
826	K	87.9	Confident	89.7	Confident	23 Å²	23	48.4 Å²	48.4	10%	0.1	25%	0.249	C	C	.	.	H	α-helix	trans	-128.1	-27.4	-170	-58.6	-170.1	178.9	-165.2	0	114.9	V348 R349 A350 S351 W509 L795 L798 A822 I823	V348-K826 HydrophobicContact CG1-CD 4.1Å; V348-K826 HydrophobicContact CG1-CG 4.28Å; R349-K826 PolarHBondContact O-NZ 2.84Å; A350-K826 VanDerWaalsContact C-NZ 3.25Å; S351-K826 VanDerWaalsContact CA-NZ 3.31Å; S351-K826 VanDerWaalsContact CB-NZ 3.32Å; S351-K826 WeakPolarHBondContact OG-CE 3.43Å; S351-K826 PolarHBondContact OG-NZ 3.44Å; W509-K826 PolarHBondContact NE1-O 3.23Å; W509-K826 VanDerWaalsContact NE1-O 3.13Å; L795-K826 HydrophobicContact CD1-CB 4.28Å; L795-K826 WeakPolarHBondContact CD1-O 3.39Å; L798-K826 HydrophobicContact CD1-CB 4.27Å; L798-K826 HydrophobicContact CD1-CD 4.2Å; A822-K826 WeakPolarHBondContact O-CB 3.39Å; A822-K826 PolarHBondContact O-N 3.4Å; A822-K826 VanDerWaalsContact O-N 3.09Å; I823-K826 PolarHBondContact O-N 3.4Å
827	V	91	Very high	89.4	Confident	7 Å²	7	55.4 Å²	55.4	4%	0.042	28%	0.276	C	S	.	.	S	Bend	trans	-97.4	132.1	-175.9	-174.6	0	0	0	0	109.5	L795 L798 K799 K802 I823 H829	L795-V827 HydrophobicContact CD1-CG2 3.95Å; L798-V827 HydrophobicContact CB-CG2 3.73Å; K799-V827 HydrophobicContact CG-CG1 3.95Å; K799-V827 HydrophobicContact CG-CG2 4.37Å; K802-V827 HydrophobicContact CD-CB 4.33Å; K802-V827 HydrophobicContact CD-CG1 3.6Å; I823-V827 HydrophobicContact CG2-CB 4.09Å; I823-V827 HydrophobicContact CG2-CG2 4.17Å; I823-V827 WeakPolarHBondContact O-CB 3.34Å; I823-V827 PolarHBondContact O-N 2.72Å; V827-H829 PolarHBondContact O-CE1 3.15Å; V827-H829 PolarHBondContact O-N 3.27Å; V827-H829 PolarHBondContact O-NE2 3.21Å
828	R	89.3	Confident	89	Confident	48 Å²	48	50.5 Å²	50.5	18%	0.181	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-52.7	133.6	174.8	-175.3	-176	-162.9	110.3	-1	111.7	E339 W509 K510 P511 K512 K802	E339-R828 IonicContact OE1-NH1 3.65Å; E339-R828 IonicContact OE1-NH2 3.81Å; E339-R828 IonicContact OE2-CZ 3.4Å; E339-R828 IonicContact OE2-NH1 3.42Å; E339-R828 PolarHBondContact OE2-NH1 3.27Å; E339-R828 IonicContact OE2-NH2 2.76Å; W509-R828 HydrophobicContact CB-CB 3.81Å; W509-R828 HydrophobicContact CB-CG 3.66Å; W509-R828 HydrophobicContact CD2-CB 4.33Å; W509-R828 HydrophobicContact CG-CB 3.75Å; W509-R828 HydrophobicContact CG-CG 4.18Å; K510-R828 PolarHBondContact O-NE 3.44Å; K510-R828 PolarHBondContact O-NH1 2.91Å; K510-R828 PolarHBondContact O-NH2 3.09Å; P511-R828 PolarHBondContact O-NH2 2.99Å; K512-R828 VanDerWaalsContact CE-CZ 3.46Å; K512-R828 VanDerWaalsContact CE-NH2 3.27Å; K802-R828 PolarHBondContact NZ-O 3.36Å
829	H	87.1	Confident	88.8	Confident	37 Å²	37	50.9 Å²	50.9	17%	0.171	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-101	152.7	171.8	-54.5	-50.1	0	0	0	112.1	L507 K802 Y824 V827 D833 W835	L507-H829 WeakPolarHBondContact CD1-CD2 3.43Å; K802-H829 PolarHBondContact NZ-ND1 3.4Å; Y824-H829 WeakPolarHBondContact CA-NE2 3.42Å; Y824-H829 AromaticContact CD2-NE2 3.81Å; Y824-H829 PolarHBondContact O-NE2 3.38Å; V827-H829 PolarHBondContact O-CE1 3.15Å; V827-H829 PolarHBondContact O-N 3.27Å; V827-H829 PolarHBondContact O-NE2 3.21Å; H829-D833 WeakPolarHBondContact CA-OD2 3.28Å; H829-W835 AromaticContact CE1-CZ2 3.76Å; H829-W835 AromaticContact ND1-NE1 3.61Å
830	R	85.8	Confident	88.4	Confident	37 Å²	37	54.1 Å²	54.1	14%	0.14	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-101.3	159	165.7	-57.1	179	153.1	-116.3	-4.2	109.3	K512 K514 D517 W765 T832 D833	K512-R830 WeakPolarHBondContact O-CA 3.44Å; K512-R830 VanDerWaalsContact O-CB 3.23Å; K512-R830 WeakPolarHBondContact O-CB 3.22Å; K512-R830 WeakPolarHBondContact O-CG 2.96Å; K514-R830 VanDerWaalsContact CG-NH1 3.32Å; D517-R830 IonicContact OD2-NH1 2.73Å; D517-R830 PolarHBondContact OD2-NH1 3.44Å; W765-R830 VanDerWaalsContact CZ2-NE 3.33Å; R830-T832 PolarHBondContact O-N 3.12Å; R830-D833 HydrophobicContact CB-CB 4.07Å; R830-D833 VanDerWaalsContact CB-CG 3.47Å; R830-D833 VanDerWaalsContact CB-OD1 3.3Å; R830-D833 WeakPolarHBondContact CB-OD1 3.3Å; R830-D833 WeakPolarHBondContact CD-OD1 3.44Å; R830-D833 WeakPolarHBondContact CG-OD1 3.42Å; R830-D833 VanDerWaalsContact N-CG 3.34Å; R830-D833 PolarHBondContact N-OD2 3.38Å; R830-D833 WeakPolarHBondContact O-CB 3.43Å; R830-D833 PolarHBondContact O-N 2.9Å
831	L	83.5	Confident	88	Confident	85 Å²	85	56.8 Å²	56.8	45%	0.445	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-25.5	176.7	-62.8	177.4	0	0	0	112.1	P511 V513 V554 H558	P511-L831 HydrophobicContact CB-CD2 4.14Å; P511-L831 HydrophobicContact CB-CG 4.13Å; P511-L831 HydrophobicContact CG-CD2 4.48Å; V513-L831 HydrophobicContact CG2-CB 4.02Å; V513-L831 HydrophobicContact CG2-CD1 3.75Å; V513-L831 HydrophobicContact CG2-CG 4.09Å; V554-L831 HydrophobicContact CG1-CD1 3.97Å; H558-L831 HydrophobicContact CB-CD1 4.26Å
832	T	82.7	Confident	87.7	Confident	53 Å²	53	61.1 Å²	61.1	33%	0.325	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	10.3	-178	51.2	0	0	0	0	113.4	D517 R830 D834	D517-T832 HydrophobicContact CB-CG2 4.09Å; D517-T832 PolarHBondContact OD2-OG1 3.4Å; R830-T832 PolarHBondContact O-N 3.12Å; T832-D834 PolarHBondContact O-N 3.46Å
833	D	85.4	Confident	87.5	Confident	33 Å²	33	61 Å²	61	18%	0.176	30%	0.303	C	S	.	.			trans	-70	123.5	-176.5	-101.2	4.3	0	0	0	111.3	K802 H829 R830	K802-D833 WeakPolarHBondContact CE-OD2 3.37Å; K802-D833 IonicContact NZ-OD2 3.77Å; K802-D833 PolarHBondContact NZ-OD2 2.72Å; H829-D833 WeakPolarHBondContact CA-OD2 3.28Å; R830-D833 HydrophobicContact CB-CB 4.07Å; R830-D833 VanDerWaalsContact CB-CG 3.47Å; R830-D833 VanDerWaalsContact CB-OD1 3.3Å; R830-D833 WeakPolarHBondContact CB-OD1 3.3Å; R830-D833 WeakPolarHBondContact CD-OD1 3.44Å; R830-D833 WeakPolarHBondContact CG-OD1 3.42Å; R830-D833 VanDerWaalsContact N-CG 3.34Å; R830-D833 PolarHBondContact N-OD2 3.38Å; R830-D833 WeakPolarHBondContact O-CB 3.43Å; R830-D833 PolarHBondContact O-N 2.9Å
834	D	87.3	Confident	87.1	Confident	63 Å²	63	64.2 Å²	64.2	34%	0.337	32%	0.32	S	S	.	.			trans	-105.2	2.6	178.7	70.1	-21.2	0	0	0	114.1	T832 A836 Y837 G838	T832-D834 PolarHBondContact O-N 3.46Å; D834-A836 PolarHBondContact O-N 3.24Å; D834-Y837 HydrophobicContact CB-CD2 4.39Å; D834-Y837 HydrophobicContact CB-CE1 4.36Å; D834-Y837 HydrophobicContact CB-CE2 3.65Å; D834-Y837 PolarHBondContact O-N 3Å; D834-G838 PolarHBondContact O-N 3.37Å
835	W	89.3	Confident	86.6	Confident	25 Å²	25	58.2 Å²	58.2	10%	0.095	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-30	-171.1	70.3	-86.4	0	0	0	115.4	K802 S805 M820 I823 H829	K802-W835 HydrophobicContact CD-CD2 4.34Å; K802-W835 HydrophobicContact CD-CG 4.32Å; K802-W835 HydrophobicContact CG-CB 4.2Å; K802-W835 HydrophobicContact CG-CD2 3.92Å; K802-W835 HydrophobicContact CG-CE3 4.15Å; K802-W835 HydrophobicContact CG-CG 3.91Å; S805-W835 PolarHBondContact OG-O 3.38Å; M820-W835 HydrophobicContact SD-CE3 4.44Å; M820-W835 HydrophobicContact SD-CH2 4.47Å; M820-W835 HydrophobicContact SD-CZ3 3.67Å; I823-W835 HydrophobicContact CB-CH2 3.73Å; I823-W835 HydrophobicContact CB-CZ2 4.49Å; I823-W835 HydrophobicContact CB-CZ3 3.93Å; I823-W835 HydrophobicContact CD1-CZ3 3.97Å; I823-W835 HydrophobicContact CG2-CD2 4.41Å; I823-W835 HydrophobicContact CG2-CE3 4.08Å; I823-W835 HydrophobicContact CG2-CH2 3.33Å; I823-W835 HydrophobicContact CG2-CZ2 3.68Å; I823-W835 HydrophobicContact CG2-CZ3 3.54Å; H829-W835 AromaticContact CE1-CZ2 3.76Å; H829-W835 AromaticContact ND1-NE1 3.61Å
836	A	88.4	Confident	86.1	Confident	43 Å²	43	59.1 Å²	59.1	36%	0.355	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-25.7	-176.2	0	0	0	0	0	113.3	R813 D834	R813-A836 VanDerWaalsContact CD-O 3.24Å; R813-A836 WeakPolarHBondContact CD-O 3.4Å; R813-A836 PolarHBondContact NE-O 2.95Å; R813-A836 VanDerWaalsContact NE-O 3.11Å; D834-A836 PolarHBondContact O-N 3.24Å
837	Y	88.5	Confident	85.9	Confident	158 Å²	158	63 Å²	63	62%	0.62	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.1	-15.4	-176.1	57.5	-95.6	0	0	0	114.3	R813 D834	R813-Y837 PolarHBondContact NH2-O 3.07Å; D834-Y837 HydrophobicContact CB-CD2 4.39Å; D834-Y837 HydrophobicContact CB-CE1 4.36Å; D834-Y837 HydrophobicContact CB-CE2 3.65Å; D834-Y837 PolarHBondContact O-N 3Å
838	G	84.8	Confident	85.7	Confident	9 Å²	9	63.7 Å²	63.7	9%	0.093	32%	0.32	C	S	.	.			trans	-50.1	141.8	171.9	0	0	0	0	0	111.9	R806 R813 D834	R806-G838 CarbonylContact O-C 3.24Å; R813-G838 VanDerWaalsContact CZ-O 3.3Å; R813-G838 PolarHBondContact NH1-O 3.21Å; R813-G838 PolarHBondContact NH2-O 3.48Å; D834-G838 PolarHBondContact O-N 3.37Å
839	N	86.9	Confident	85.5	Confident	74 Å²	74	65 Å²	65	40%	0.396	33%	0.328	S	S	.	.			trans	-144.9	52.2	-171.5	-165.6	73.9	0	0	0	111.7	G809 R810 V841	G809-N839 WeakPolarHBondContact CA-OD1 2.97Å; R810-N839 PolarHBondContact N-OD1 3.27Å; N839-V841 PolarHBondContact O-N 3.44Å; N839-V841 VanDerWaalsContact O-N 3.13Å
840	D	87.7	Confident	85.7	Confident	68 Å²	68	68.7 Å²	68.7	36%	0.364	35%	0.353	S	S	.	.			trans	-88.7	61.6	175.2	-68.8	-32.7	0	0	0	110.4	R806 Y807 D842 A843	R806-D840 IonicContact CZ-OD2 3.12Å; R806-D840 IonicContact NE-OD2 2.83Å; R806-D840 PolarHBondContact NE-OD2 2.95Å; R806-D840 IonicContact NH2-OD2 2.63Å; R806-D840 PolarHBondContact NH2-OD2 3.43Å; R806-D840 PolarHBondContact O-N 2.87Å; R806-D840 VanDerWaalsContact O-N 3.08Å; Y807-D840 HydrophobicContact CD1-CB 4.42Å; Y807-D840 WeakPolarHBondContact CD1-O 3.31Å; D840-D842 PolarHBondContact O-N 3.39Å; D840-A843 HydrophobicContact CB-CB 4.15Å; D840-A843 WeakPolarHBondContact O-CB 3.41Å; D840-A843 PolarHBondContact O-N 3.43Å
841	V	84.7	Confident	85.8	Confident	73 Å²	73	72 Å²	72	44%	0.442	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-27.9	178.9	-172.3	0	0	0	0	110.9	G809 N839 A843	G809-V841 VanDerWaalsContact CA-CG2 3.45Å; N839-V841 PolarHBondContact O-N 3.44Å; N839-V841 VanDerWaalsContact O-N 3.13Å; V841-A843 VanDerWaalsContact C-N 3.31Å
842	D	85.9	Confident	86.1	Confident	140 Å²	140	69.4 Å²	69.4	75%	0.749	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	8.4	-179.2	-52.6	-44	0	0	0	112.8	D840 L844	D840-D842 PolarHBondContact O-N 3.39Å; D842-L844 WeakPolarHBondContact O-CG 3.4Å
843	A	88	Confident	86.5	Confident	10 Å²	10	69.8 Å²	69.8	8%	0.083	36%	0.359	C	S	.	.			trans	-64.6	138.9	172.8	0	0	0	0	0	110	M771 Y807 D840 V841 F848	M771-A843 WeakPolarHBondContact CE-O 3.31Å; Y807-A843 HydrophobicContact CD1-CB 3.88Å; Y807-A843 HydrophobicContact CE1-CB 3.84Å; D840-A843 HydrophobicContact CB-CB 4.15Å; D840-A843 WeakPolarHBondContact O-CB 3.41Å; D840-A843 PolarHBondContact O-N 3.43Å; V841-A843 VanDerWaalsContact C-N 3.31Å; A843-F848 HydrophobicContact CB-CE2 4.31Å; A843-F848 HydrophobicContact CB-CZ 4.33Å
844	L	85.2	Confident	86.9	Confident	68 Å²	68	71.2 Å²	71.2	36%	0.356	37%	0.372	S	S	.	.			trans	-123.9	144.4	-173.7	-64.6	162.8	0	0	0	110.2	D842 W846 Q847	D842-L844 WeakPolarHBondContact O-CG 3.4Å; L844-W846 VanDerWaalsContact C-N 3.28Å; L844-W846 HydrophobicContact CB-CD2 3.8Å; L844-W846 HydrophobicContact CB-CE3 3.89Å; L844-W846 HydrophobicContact CB-CH2 3.61Å; L844-W846 HydrophobicContact CB-CZ2 3.51Å; L844-W846 HydrophobicContact CB-CZ3 3.78Å; L844-W846 HydrophobicContact CD1-CH2 3.46Å; L844-W846 VanDerWaalsContact CD1-CH2 3.46Å; L844-W846 HydrophobicContact CD1-CZ2 3.09Å; L844-W846 HydrophobicContact CD1-CZ3 4.46Å; L844-W846 HydrophobicContact CD2-CH2 3.65Å; L844-W846 HydrophobicContact CD2-CZ2 4.17Å; L844-W846 HydrophobicContact CD2-CZ3 4.09Å; L844-W846 HydrophobicContact CG-CH2 3.7Å; L844-W846 HydrophobicContact CG-CZ2 3.7Å; L844-W846 HydrophobicContact CG-CZ3 4.28Å; L844-W846 PolarHBondContact O-N 2.84Å; L844-W846 VanDerWaalsContact O-N 3.15Å; L844-Q847 HydrophobicContact CB-CG 4.34Å; L844-Q847 WeakPolarHBondContact O-CB 3.25Å; L844-Q847 PolarHBondContact O-N 3.39Å; L844-Q847 VanDerWaalsContact O-N 3.08Å
845	P	79.6	Confident	87.2	Confident	35 Å²	35	69.2 Å²	69.2	23%	0.227	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-56.1	-36.5	-172.1	-27.5	35.5	0	0	0	115.1	M771 V775 Q847 F848	M771-P845 HydrophobicContact CE-CG 4.24Å; M771-P845 HydrophobicContact CG-CB 4.28Å; M771-P845 HydrophobicContact CG-CG 3.96Å; V775-P845 HydrophobicContact CG2-CG 3.76Å; P845-Q847 VanDerWaalsContact C-N 3.25Å; P845-Q847 PolarHBondContact O-N 3.02Å; P845-F848 PolarHBondContact O-N 3.39Å
846	W	79.2	Confident	87.4	Confident	153 Å²	153	72.4 Å²	72.4	58%	0.58	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-69.1	-20.3	-178.4	57.6	89.6	0	0	0	113.9	L844 F848 Q849	L844-W846 VanDerWaalsContact C-N 3.28Å; L844-W846 HydrophobicContact CB-CD2 3.8Å; L844-W846 HydrophobicContact CB-CE3 3.89Å; L844-W846 HydrophobicContact CB-CH2 3.61Å; L844-W846 HydrophobicContact CB-CZ2 3.51Å; L844-W846 HydrophobicContact CB-CZ3 3.78Å; L844-W846 HydrophobicContact CD1-CH2 3.46Å; L844-W846 VanDerWaalsContact CD1-CH2 3.46Å; L844-W846 HydrophobicContact CD1-CZ2 3.09Å; L844-W846 HydrophobicContact CD1-CZ3 4.46Å; L844-W846 HydrophobicContact CD2-CH2 3.65Å; L844-W846 HydrophobicContact CD2-CZ2 4.17Å; L844-W846 HydrophobicContact CD2-CZ3 4.09Å; L844-W846 HydrophobicContact CG-CH2 3.7Å; L844-W846 HydrophobicContact CG-CZ2 3.7Å; L844-W846 HydrophobicContact CG-CZ3 4.28Å; L844-W846 PolarHBondContact O-N 2.84Å; L844-W846 VanDerWaalsContact O-N 3.15Å; W846-F848 PolarHBondContact O-N 3.02Å; W846-F848 VanDerWaalsContact O-N 3.12Å; W846-Q849 PolarHBondContact O-N 2.89Å
847	Q	84.5	Confident	87.7	Confident	104 Å²	104	73.7 Å²	73.7	49%	0.486	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-62.1	-22.3	177.5	-66.7	174.2	-29.9	0	0	112.5	L844 P845	L844-Q847 HydrophobicContact CB-CG 4.34Å; L844-Q847 WeakPolarHBondContact O-CB 3.25Å; L844-Q847 PolarHBondContact O-N 3.39Å; L844-Q847 VanDerWaalsContact O-N 3.08Å; P845-Q847 VanDerWaalsContact C-N 3.25Å; P845-Q847 PolarHBondContact O-N 3.02Å
848	F	86.8	Confident	87.9	Confident	22 Å²	22	68.3 Å²	68.3	10%	0.096	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-108.2	6.2	-176.5	-50.5	-67	0	0	0	113.3	H767 M771 A843 P845 W846	H767-F848 HydrophobicContact CB-CB 4.42Å; H767-F848 HydrophobicContact CB-CD1 3.36Å; H767-F848 HydrophobicContact CB-CD2 4.21Å; H767-F848 HydrophobicContact CB-CE1 3.53Å; H767-F848 HydrophobicContact CB-CE2 4.35Å; H767-F848 HydrophobicContact CB-CG 3.73Å; H767-F848 HydrophobicContact CB-CZ 4.04Å; M771-F848 HydrophobicContact CB-CD2 4.32Å; M771-F848 HydrophobicContact CB-CE2 4.44Å; A843-F848 HydrophobicContact CB-CE2 4.31Å; A843-F848 HydrophobicContact CB-CZ 4.33Å; P845-F848 PolarHBondContact O-N 3.39Å; W846-F848 PolarHBondContact O-N 3.02Å; W846-F848 VanDerWaalsContact O-N 3.12Å
849	Q	85.3	Confident	88.4	Confident	74 Å²	74	67.9 Å²	67.9	35%	0.346	35%	0.354	S	S	.	.	H	α-helix	trans	-68	-37.7	-179.6	-79.6	174.6	-23.1	0	0	112.3	W846 E851 E852 C853	W846-Q849 PolarHBondContact O-N 2.89Å; Q849-E851 VanDerWaalsContact C-N 3.27Å; Q849-E851 PolarHBondContact O-N 3.31Å; Q849-E852 PolarHBondContact O-N 2.84Å; Q849-E852 VanDerWaalsContact O-N 3.14Å; Q849-C853 PolarHBondContact O-N 3.33Å; Q849-C853 PolarHBondContact O-SG 3.13Å; Q849-C853 VanDerWaalsContact O-SG 3.37Å
850	V	89.5	Confident	88.7	Confident	115 Å²	115	66.9 Å²	66.9	70%	0.697	35%	0.349	S	S	*	.	H	α-helix	trans	-58.3	-40.6	178.9	-179.6	0	0	0	0	111.4	C853 S854	V850-C853 PolarHBondContact O-N 3.32Å; V850-S854 WeakPolarHBondContact O-CB 3.47Å; V850-S854 PolarHBondContact O-N 2.88Å
851	E	87.9	Confident	88.8	Confident	106 Å²	106	68.5 Å²	68.5	50%	0.495	35%	0.354	S	S	.	.	H	α-helix	trans	-64.7	-39.4	177.9	-64.7	-177.5	178.6	0	0	112.5	H767 Q849 L855	H767-E851 IonicContact ND1-OE2 3.82Å; Q849-E851 VanDerWaalsContact C-N 3.27Å; Q849-E851 PolarHBondContact O-N 3.31Å; E851-L855 VanDerWaalsContact O-CB 3.31Å; E851-L855 WeakPolarHBondContact O-CB 3.39Å; E851-L855 PolarHBondContact O-N 3.36Å
852	E	90.6	Very high	89.1	Confident	32 Å²	32	65.1 Å²	65.1	15%	0.15	33%	0.334	C	S	.	.	H	α-helix	trans	-72.9	-37.8	177.1	-77.2	-67.6	166.1	0	0	112.3	Q687 R769 Q849 L855 R856	Q687-E852 PolarHBondContact NE2-O 2.8Å; Q687-E852 PolarHBondContact NE2-OE2 2.8Å; Q687-E852 VanDerWaalsContact NE2-OE2 3.09Å; R769-E852 IonicContact CZ-OE1 3.66Å; R769-E852 IonicContact CZ-OE2 3.78Å; R769-E852 IonicContact NE-OE1 2.81Å; R769-E852 PolarHBondContact NE-OE1 3.33Å; R769-E852 IonicContact NE-OE2 3.97Å; R769-E852 IonicContact NH2-OE1 2.56Å; R769-E852 PolarHBondContact NH2-OE1 3.41Å; R769-E852 IonicContact NH2-OE2 3.54Å; R769-E852 PolarHBondContact NH2-OE2 3.34Å; R769-E852 VanDerWaalsContact NH2-OE2 3.1Å; Q849-E852 PolarHBondContact O-N 2.84Å; Q849-E852 VanDerWaalsContact O-N 3.14Å; E852-L855 PolarHBondContact O-N 3.23Å; E852-R856 PolarHBondContact O-N 3.08Å
853	C	91.1	Very high	89.4	Confident	60 Å²	60	58.5 Å²	58.5	41%	0.405	30%	0.298	S	S	.	.	H	α-helix	trans	-64	-47.6	175.1	-67.7	0	0	0	0	111.1	Q849 V850 L855 R856 T857	Q849-C853 PolarHBondContact O-N 3.33Å; Q849-C853 PolarHBondContact O-SG 3.13Å; Q849-C853 VanDerWaalsContact O-SG 3.37Å; V850-C853 PolarHBondContact O-N 3.32Å; C853-L855 VanDerWaalsContact C-N 3.31Å; C853-L855 PolarHBondContact O-N 3.12Å; C853-R856 WeakPolarHBondContact O-CB 3.28Å; C853-R856 PolarHBondContact O-N 2.96Å; C853-R856 VanDerWaalsContact O-N 3.17Å; C853-T857 PolarHBondContact O-N 2.88Å; C853-T857 PolarHBondContact O-OG1 3.29Å
854	S	93.2	Very high	89.3	Confident	64 Å²	64	62.9 Å²	62.9	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-60.2	-41.4	176.1	172.1	0	0	0	0	111.9	V850 R856 T857 N858	V850-S854 WeakPolarHBondContact O-CB 3.47Å; V850-S854 PolarHBondContact O-N 2.88Å; S854-R856 VanDerWaalsContact C-N 3.34Å; S854-R856 PolarHBondContact O-N 2.94Å; S854-T857 PolarHBondContact O-N 2.8Å; S854-N858 PolarHBondContact O-N 3.25Å; S854-N858 VanDerWaalsContact O-N 3.13Å; S854-N858 PolarHBondContact O-OD1 2.89Å
855	L	93.7	Very high	89.4	Confident	20 Å²	20	61.7 Å²	61.7	11%	0.105	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-42.7	175.7	178.5	64.7	0	0	0	112.1	Y680 E683 E851 E852 C853 N858 V859	Y680-L855 HydrophobicContact CE1-CD1 4.23Å; E683-L855 HydrophobicContact CB-CD1 4.37Å; E683-L855 HydrophobicContact CB-CD2 4.43Å; E683-L855 HydrophobicContact CG-CD1 4.14Å; E683-L855 HydrophobicContact CG-CD2 4.3Å; E851-L855 VanDerWaalsContact O-CB 3.31Å; E851-L855 WeakPolarHBondContact O-CB 3.39Å; E851-L855 PolarHBondContact O-N 3.36Å; E852-L855 PolarHBondContact O-N 3.23Å; C853-L855 VanDerWaalsContact C-N 3.31Å; C853-L855 PolarHBondContact O-N 3.12Å; L855-N858 PolarHBondContact O-N 2.87Å; L855-V859 HydrophobicContact CD1-CG2 4.37Å; L855-V859 HydrophobicContact CG-CG2 4.5Å; L855-V859 VanDerWaalsContact O-CG2 3.25Å; L855-V859 WeakPolarHBondContact O-CG2 3.3Å; L855-V859 PolarHBondContact O-N 3.32Å
856	R	94	Very high	89.7	Confident	93 Å²	93	61.5 Å²	61.5	35%	0.351	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-47.3	177.5	173.8	167.9	-79.4	-154.5	-8	111	E852 C853 S854 N858 V859 D860	E852-R856 PolarHBondContact O-N 3.08Å; C853-R856 WeakPolarHBondContact O-CB 3.28Å; C853-R856 PolarHBondContact O-N 2.96Å; C853-R856 VanDerWaalsContact O-N 3.17Å; S854-R856 VanDerWaalsContact C-N 3.34Å; S854-R856 PolarHBondContact O-N 2.94Å; R856-N858 VanDerWaalsContact C-N 3.31Å; R856-N858 PolarHBondContact O-N 2.79Å; R856-V859 PolarHBondContact O-N 3.06Å; R856-V859 VanDerWaalsContact O-N 3.1Å; R856-D860 WeakPolarHBondContact CG-OD2 3.46Å; R856-D860 VanDerWaalsContact O-CG 3.31Å; R856-D860 PolarHBondContact O-N 3.33Å
857	T	93.7	Very high	90	Very high	69 Å²	69	55.8 Å²	55.8	42%	0.423	28%	0.282	S	S	.	.	H	α-helix	trans	-55.9	-45.2	177.4	-56.3	0	0	0	0	112.1	C853 S854 V859 D860 Q861	C853-T857 PolarHBondContact O-N 2.88Å; C853-T857 PolarHBondContact O-OG1 3.29Å; S854-T857 PolarHBondContact O-N 2.8Å; T857-V859 VanDerWaalsContact C-N 3.33Å; T857-V859 PolarHBondContact O-N 3.48Å; T857-D860 PolarHBondContact O-N 3.22Å; T857-Q861 VanDerWaalsContact O-CG 3.3Å; T857-Q861 WeakPolarHBondContact O-CG 3.46Å; T857-Q861 PolarHBondContact O-N 3.05Å
858	N	94.7	Very high	89.7	Confident	45 Å²	45	53 Å²	53	24%	0.241	27%	0.273	C	S	.	.	H	α-helix	trans	-64.7	-38	178.5	-65.8	-1.2	0	0	0	112.4	Y680 S854 L855 R856 F862	Y680-N858 HydrophobicContact CE1-CB 4.1Å; Y680-N858 HydrophobicContact CE2-CB 4.35Å; S854-N858 PolarHBondContact O-N 3.25Å; S854-N858 VanDerWaalsContact O-N 3.13Å; S854-N858 PolarHBondContact O-OD1 2.89Å; L855-N858 PolarHBondContact O-N 2.87Å; R856-N858 VanDerWaalsContact C-N 3.31Å; R856-N858 PolarHBondContact O-N 2.79Å; N858-F862 WeakPolarHBondContact O-CB 3.37Å; N858-F862 PolarHBondContact O-N 3.43Å; N858-F862 VanDerWaalsContact O-N 3.07Å
859	V	94.9	Very high	88.8	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-67.1	-42.8	177.1	171.7	0	0	0	0	111	Y680 E683 Y684 L855 R856 T857 F862 N863	Y680-V859 HydrophobicContact CD1-CG2 3.62Å; Y680-V859 HydrophobicContact CE1-CG2 4.39Å; Y680-V859 HydrophobicContact CG-CG2 4.05Å; E683-V859 HydrophobicContact CB-CG2 3.88Å; Y684-V859 HydrophobicContact CD2-CG1 3.47Å; Y684-V859 VanDerWaalsContact CD2-CG1 3.47Å; Y684-V859 HydrophobicContact CG-CG1 3.95Å; L855-V859 HydrophobicContact CD1-CG2 4.37Å; L855-V859 HydrophobicContact CG-CG2 4.5Å; L855-V859 VanDerWaalsContact O-CG2 3.25Å; L855-V859 WeakPolarHBondContact O-CG2 3.3Å; L855-V859 PolarHBondContact O-N 3.32Å; R856-V859 PolarHBondContact O-N 3.06Å; R856-V859 VanDerWaalsContact O-N 3.1Å; T857-V859 VanDerWaalsContact C-N 3.33Å; T857-V859 PolarHBondContact O-N 3.48Å; V859-F862 PolarHBondContact O-N 3.02Å; V859-N863 WeakPolarHBondContact O-CB 3.41Å; V859-N863 PolarHBondContact O-N 3.23Å; V859-N863 PolarHBondContact O-ND2 3.43Å
860	D	92	Very high	87.6	Confident	54 Å²	54	63.4 Å²	63.4	29%	0.289	33%	0.326	S	S	.	.	H	α-helix	trans	-65.4	-42.3	178.8	-67	-23.6	0	0	0	111	R856 T857 F862 N863 Q864	R856-D860 WeakPolarHBondContact CG-OD2 3.46Å; R856-D860 VanDerWaalsContact O-CG 3.31Å; R856-D860 PolarHBondContact O-N 3.33Å; T857-D860 PolarHBondContact O-N 3.22Å; D860-F862 PolarHBondContact O-N 2.78Å; D860-N863 PolarHBondContact O-N 2.72Å; D860-Q864 WeakPolarHBondContact O-CB 3.43Å; D860-Q864 VanDerWaalsContact O-CG 3.25Å; D860-Q864 WeakPolarHBondContact O-CG 3.38Å; D860-Q864 PolarHBondContact O-N 2.89Å
861	Q	90.1	Very high	86.2	Confident	101 Å²	101	62.1 Å²	62.1	47%	0.472	31%	0.309	S	S	.	.	H	α-helix	trans	-59.3	-46.1	173.9	-74.6	174	-3.2	0	0	112.2	T857 R865	T857-Q861 VanDerWaalsContact O-CG 3.3Å; T857-Q861 WeakPolarHBondContact O-CG 3.46Å; T857-Q861 PolarHBondContact O-N 3.05Å; Q861-R865 WeakPolarHBondContact O-CB 3.03Å; Q861-R865 PolarHBondContact O-N 3Å; Q861-R865 VanDerWaalsContact O-N 3.07Å
862	F	91.8	Very high	84.9	Confident	3 Å²	3	59 Å²	59	1%	0.013	29%	0.294	C	S	.	.	H	α-helix	trans	-59.1	-49.4	175.1	165.3	-96.9	0	0	0	111.5	E571 H678 Y680 Q681 N858 V859 D860 R865 H866 Y867	E571-F862 HydrophobicContact CG-CD2 4.48Å; E571-F862 WeakPolarHBondContact OE1-CD2 3.43Å; H678-F862 HydrophobicContact CB-CZ 4.15Å; H678-F862 AromaticContact CE1-CD2 3.62Å; H678-F862 AromaticContact CE1-CE2 3.4Å; H678-F862 WeakPolarHBondContact CE1-CE2 3.21Å; H678-F862 AromaticContact CE1-CZ 3.88Å; H678-F862 AromaticContact CG-CE2 3.86Å; H678-F862 AromaticContact CG-CZ 3.71Å; H678-F862 AromaticContact ND1-CD2 3.84Å; H678-F862 AromaticContact ND1-CE1 3.76Å; H678-F862 AromaticContact ND1-CE2 3.33Å; H678-F862 VanDerWaalsContact ND1-CE2 3.33Å; H678-F862 WeakPolarHBondContact ND1-CE2 3.33Å; H678-F862 AromaticContact ND1-CZ 3.3Å; H678-F862 VanDerWaalsContact ND1-CZ 3.3Å; H678-F862 WeakPolarHBondContact ND1-CZ 3.33Å; H678-F862 AromaticContact NE2-CE2 3.97Å; Y680-F862 HydrophobicContact CD2-CB 3.67Å; Y680-F862 HydrophobicContact CD2-CD1 4.49Å; Y680-F862 HydrophobicContact CD2-CD2 4.21Å; Y680-F862 AromaticContact CD2-CG 3.87Å; Y680-F862 HydrophobicContact CD2-CG 3.87Å; Y680-F862 HydrophobicContact CE2-CB 4.44Å; Y680-F862 HydrophobicContact CG-CB 4.36Å; Y680-F862 HydrophobicContact CG-CG 4.41Å; Q681-F862 HydrophobicContact CG-CE1 3.94Å; Q681-F862 HydrophobicContact CG-CZ 4.31Å; N858-F862 WeakPolarHBondContact O-CB 3.37Å; N858-F862 PolarHBondContact O-N 3.43Å; N858-F862 VanDerWaalsContact O-N 3.07Å; V859-F862 PolarHBondContact O-N 3.02Å; D860-F862 PolarHBondContact O-N 2.78Å; F862-R865 PolarHBondContact O-N 2.97Å; F862-H866 AromaticContact CD2-CD2 3.52Å; F862-H866 AromaticContact CD2-NE2 3.79Å; F862-H866 AromaticContact CE2-CD2 3.35Å; F862-H866 WeakPolarHBondContact CE2-CD2 3.32Å; F862-H866 AromaticContact CE2-CE1 3.83Å; F862-H866 AromaticContact CE2-CG 3.81Å; F862-H866 AromaticContact CE2-NE2 3.38Å; F862-H866 WeakPolarHBondContact CE2-NE2 3.2Å; F862-H866 WeakPolarHBondContact O-CB 3.09Å; F862-H866 PolarHBondContact O-CD2 3.39Å; F862-H866 PolarHBondContact O-N 2.98Å; F862-Y867 AromaticContact CE1-CE2 3.95Å; F862-Y867 HydrophobicContact CE1-CE2 3.95Å; F862-Y867 HydrophobicContact CZ-CE2 4.49Å
863	N	91.7	Very high	83.4	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-67.4	-39.7	-176.9	-76.2	-30.3	0	0	0	112.4	Y595 Y599 Y684 V859 D860 R865 H866 Y867	Y595-N863 PolarHBondContact OH-ND2 3.26Å; Y595-N863 PolarHBondContact OH-OD1 3.26Å; Y599-N863 HydrophobicContact CE2-CB 3.66Å; Y684-N863 WeakPolarHBondContact CD2-ND2 3.37Å; Y684-N863 WeakPolarHBondContact CE2-ND2 3.45Å; V859-N863 WeakPolarHBondContact O-CB 3.41Å; V859-N863 PolarHBondContact O-N 3.23Å; V859-N863 PolarHBondContact O-ND2 3.43Å; D860-N863 PolarHBondContact O-N 2.72Å; N863-R865 VanDerWaalsContact C-N 3.35Å; N863-H866 PolarHBondContact O-N 3.15Å; N863-Y867 HydrophobicContact CB-CD2 4.08Å; N863-Y867 HydrophobicContact CB-CE2 4.46Å; N863-Y867 VanDerWaalsContact O-CD2 3.32Å; N863-Y867 WeakPolarHBondContact O-CD2 3.31Å; N863-Y867 PolarHBondContact O-N 3.33Å; N863-Y867 WeakPolarHBondContact OD1-CE2 3.26Å
864	Q	86.6	Confident	81.9	Confident	103 Å²	103	63.1 Å²	63.1	48%	0.481	32%	0.318	S	S	.	.	H	α-helix	trans	-58.8	-49.3	173.8	-74.9	171.3	3.2	0	0	110.1	D860 H866 T868 W871	D860-Q864 WeakPolarHBondContact O-CB 3.43Å; D860-Q864 VanDerWaalsContact O-CG 3.25Å; D860-Q864 WeakPolarHBondContact O-CG 3.38Å; D860-Q864 PolarHBondContact O-N 2.89Å; Q864-H866 VanDerWaalsContact C-N 3.34Å; Q864-H866 PolarHBondContact O-N 3.43Å; Q864-T868 VanDerWaalsContact C-OG1 3.32Å; Q864-T868 WeakPolarHBondContact CA-OG1 3.33Å; Q864-T868 WeakPolarHBondContact O-CB 3.32Å; Q864-T868 PolarHBondContact O-N 3.35Å; Q864-T868 VanDerWaalsContact O-N 3.13Å; Q864-T868 PolarHBondContact O-OG1 3.43Å; Q864-W871 WeakPolarHBondContact O-CB 3.35Å
865	R	85.5	Confident	80.4	Confident	43 Å²	43	68 Å²	68	16%	0.162	33%	0.334	C	S	.	.	H	α-helix	trans	-62	-38.6	179.3	-173	172	59.2	67.8	4.4	113.7	E571 Q861 F862 N863 W871	E571-R865 IonicContact OE1-NH2 2.8Å; E571-R865 PolarHBondContact OE1-NH2 3.08Å; E571-R865 IonicContact OE2-CZ 3.1Å; E571-R865 IonicContact OE2-NH2 3.53Å; E571-R865 PolarHBondContact OE2-NH2 3.1Å; Q861-R865 WeakPolarHBondContact O-CB 3.03Å; Q861-R865 PolarHBondContact O-N 3Å; Q861-R865 VanDerWaalsContact O-N 3.07Å; F862-R865 PolarHBondContact O-N 2.97Å; N863-R865 VanDerWaalsContact C-N 3.35Å; R865-W871 HydrophobicContact CB-CB 4.5Å; R865-W871 HydrophobicContact CB-CD2 4.24Å; R865-W871 HydrophobicContact CB-CE3 4.44Å; R865-W871 HydrophobicContact CB-CG 4.28Å; R865-W871 HydrophobicContact CG-CD2 3.79Å; R865-W871 HydrophobicContact CG-CE3 3.99Å; R865-W871 HydrophobicContact CG-CG 4.22Å; R865-W871 HydrophobicContact CG-CH2 4.27Å; R865-W871 HydrophobicContact CG-CZ2 4.07Å; R865-W871 HydrophobicContact CG-CZ3 4.23Å
866	H	86	Confident	78.7	Confident	31 Å²	31	73.9 Å²	73.9	14%	0.144	36%	0.356	C	S	.	.	H	α-helix	trans	-87.8	-34.1	-174.2	-86.4	-102.6	0	0	0	115	I586 F862 N863 Q864	I586-H866 HydrophobicContact CD1-CB 4.38Å; I586-H866 WeakPolarHBondContact CD1-O 3.35Å; F862-H866 AromaticContact CD2-CD2 3.52Å; F862-H866 AromaticContact CD2-NE2 3.79Å; F862-H866 AromaticContact CE2-CD2 3.35Å; F862-H866 WeakPolarHBondContact CE2-CD2 3.32Å; F862-H866 AromaticContact CE2-CE1 3.83Å; F862-H866 AromaticContact CE2-CG 3.81Å; F862-H866 AromaticContact CE2-NE2 3.38Å; F862-H866 WeakPolarHBondContact CE2-NE2 3.2Å; F862-H866 WeakPolarHBondContact O-CB 3.09Å; F862-H866 PolarHBondContact O-CD2 3.39Å; F862-H866 PolarHBondContact O-N 2.98Å; N863-H866 PolarHBondContact O-N 3.15Å; Q864-H866 VanDerWaalsContact C-N 3.34Å; Q864-H866 PolarHBondContact O-N 3.43Å
867	Y	85.9	Confident	77.2	Confident	32 Å²	32	74.8 Å²	74.8	13%	0.125	36%	0.362	C	S	.	.	H	α-helix	trans	-123.9	5.9	-169.1	-46.5	-74.9	0	0	0	113.9	E592 Y595 R596 Y599 Q681 F862 N863	E592-Y867 VanDerWaalsContact OE1-CE1 3.26Å; E592-Y867 WeakPolarHBondContact OE1-CE1 3.5Å; E592-Y867 PolarHBondContact OE1-OH 3.4Å; Y595-Y867 HydrophobicContact CD1-CD1 4.41Å; Y595-Y867 HydrophobicContact CD1-CD2 4.41Å; Y595-Y867 AromaticContact CD1-CE1 3.68Å; Y595-Y867 HydrophobicContact CD1-CE1 3.68Å; Y595-Y867 AromaticContact CD1-CE2 3.75Å; Y595-Y867 HydrophobicContact CD1-CE2 3.75Å; Y595-Y867 AromaticContact CD1-CZ 3.32Å; Y595-Y867 WeakPolarHBondContact CD1-OH 3.4Å; Y595-Y867 AromaticContact CE1-CD2 3.93Å; Y595-Y867 HydrophobicContact CE1-CD2 3.93Å; Y595-Y867 HydrophobicContact CE1-CE1 4.14Å; Y595-Y867 AromaticContact CE1-CE2 3.32Å; Y595-Y867 HydrophobicContact CE1-CE2 3.32Å; Y595-Y867 AromaticContact CE1-CZ 3.44Å; Y595-Y867 VanDerWaalsContact CE1-CZ 3.44Å; R596-Y867 HydrophobicContact CB-CD1 4.25Å; R596-Y867 HydrophobicContact CB-CE1 4.46Å; R596-Y867 HydrophobicContact CG-CD1 4.42Å; Y599-Y867 HydrophobicContact CD1-CG 4.34Å; Y599-Y867 HydrophobicContact CD2-CD2 4.41Å; Y599-Y867 HydrophobicContact CE2-CD2 4.49Å; Y599-Y867 HydrophobicContact CG-CD2 4.48Å; Y599-Y867 HydrophobicContact CG-CG 4.42Å; Q681-Y867 PolarHBondContact NE2-OH 2.98Å; F862-Y867 AromaticContact CE1-CE2 3.95Å; F862-Y867 HydrophobicContact CE1-CE2 3.95Å; F862-Y867 HydrophobicContact CZ-CE2 4.49Å; N863-Y867 HydrophobicContact CB-CD2 4.08Å; N863-Y867 HydrophobicContact CB-CE2 4.46Å; N863-Y867 VanDerWaalsContact O-CD2 3.32Å; N863-Y867 WeakPolarHBondContact O-CD2 3.31Å; N863-Y867 PolarHBondContact O-N 3.33Å; N863-Y867 WeakPolarHBondContact OD1-CE2 3.26Å
868	T	78.8	Confident	75.6	Confident	47 Å²	47	77.3 Å²	77.3	29%	0.288	38%	0.38	S	S	.	.			trans	-125.2	134.8	174.1	73.3	0	0	0	0	110.8	Y599 Q864 H870	Y599-T868 HydrophobicContact CE1-CG2 4.42Å; Q864-T868 VanDerWaalsContact C-OG1 3.32Å; Q864-T868 WeakPolarHBondContact CA-OG1 3.33Å; Q864-T868 WeakPolarHBondContact O-CB 3.32Å; Q864-T868 PolarHBondContact O-N 3.35Å; Q864-T868 VanDerWaalsContact O-N 3.13Å; Q864-T868 PolarHBondContact O-OG1 3.43Å; T868-H870 PolarHBondContact O-N 2.63Å
869	D	67.6	Low	74	Confident	148 Å²	148	80.8 Å²	80.8	79%	0.791	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-12.2	-178.4	-63.2	-35.8	0	0	0	113
870	H	60.7	Low	72.5	Confident	166 Å²	166	83.8 Å²	83.8	77%	0.769	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	20.5	-171.2	-60.9	-54	0	0	0	114.8	T868 F872	T868-H870 PolarHBondContact O-N 2.63Å; H870-F872 VanDerWaalsContact C-N 3.29Å; H870-F872 PolarHBondContact O-N 2.83Å
871	W	59.7	Low	71.5	Confident	87 Å²	87	88.2 Å²	88.2	33%	0.33	44%	0.442	S	S	.	.			trans	-71.8	-23.5	-177.3	76.4	-94.6	0	0	0	114.1	V582 Q864 R865	V582-W871 HydrophobicContact CG1-CH2 4.43Å; V582-W871 HydrophobicContact CG1-CZ2 4.01Å; V582-W871 HydrophobicContact CG2-CH2 4.26Å; Q864-W871 WeakPolarHBondContact O-CB 3.35Å; R865-W871 HydrophobicContact CB-CB 4.5Å; R865-W871 HydrophobicContact CB-CD2 4.24Å; R865-W871 HydrophobicContact CB-CE3 4.44Å; R865-W871 HydrophobicContact CB-CG 4.28Å; R865-W871 HydrophobicContact CG-CD2 3.79Å; R865-W871 HydrophobicContact CG-CE3 3.99Å; R865-W871 HydrophobicContact CG-CG 4.22Å; R865-W871 HydrophobicContact CG-CH2 4.27Å; R865-W871 HydrophobicContact CG-CZ2 4.07Å; R865-W871 HydrophobicContact CG-CZ3 4.23Å
872	F	60.1	Low	70.7	Confident	41 Å²	41	86.1 Å²	86.1	18%	0.18	44%	0.438	C	S	.	.	S	Bend	trans	-93	125.1	-177.1	-156	-105	0	0	0	110.4	L579 V582 H870 Y876 K877	L579-F872 HydrophobicContact CD2-CE2 4.05Å; L579-F872 HydrophobicContact CD2-CZ 3.57Å; V582-F872 HydrophobicContact CG2-CE2 4.12Å; H870-F872 VanDerWaalsContact C-N 3.29Å; H870-F872 PolarHBondContact O-N 2.83Å; F872-Y876 VanDerWaalsContact CE1-C 3.45Å; F872-Y876 WeakPolarHBondContact CE1-O 3.26Å; F872-K877 HydrophobicContact CD1-CG 4.16Å
873	D	60.1	Low	69.7	Low	77 Å²	77	92.4 Å²	92.4	41%	0.412	47%	0.471	S	S	.	.			trans	-54.8	122.1	177.7	179.4	-12	0	0	0	109.6	E875 Y876	D873-E875 PolarHBondContact O-N 2.84Å; D873-E875 WeakPolarHBondContact OD1-CB 3.21Å; D873-E875 PolarHBondContact OD1-N 3.38Å; D873-Y876 HydrophobicContact CB-CD2 3.74Å; D873-Y876 HydrophobicContact CB-CE2 4.24Å; D873-Y876 PolarHBondContact O-N 3.45Å
874	P	59.9	Low	68.9	Low	101 Å²	101	99.4 Å²	99.4	66%	0.656	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-51.5	-30.3	-179.3	-25.6	32.5	0	0	0	113.5	Y876 K877	P874-Y876 PolarHBondContact O-N 2.83Å; P874-K877 PolarHBondContact O-N 2.99Å
875	E	60.5	Low	68	Low	168 Å²	168	98.2 Å²	98.2	79%	0.785	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-62.9	-22.9	179.1	-68.8	-171.6	174.4	0	0	113.3	D873	D873-E875 PolarHBondContact O-N 2.84Å; D873-E875 WeakPolarHBondContact OD1-CB 3.21Å; D873-E875 PolarHBondContact OD1-N 3.38Å
876	Y	59.1	Low	67	Low	143 Å²	143	99.7 Å²	99.7	56%	0.561	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-101.9	-4.4	-178.2	-64.4	-87.9	0	0	0	113.6	F872 D873 P874	F872-Y876 VanDerWaalsContact CE1-C 3.45Å; F872-Y876 WeakPolarHBondContact CE1-O 3.26Å; D873-Y876 HydrophobicContact CB-CD2 3.74Å; D873-Y876 HydrophobicContact CB-CE2 4.24Å; D873-Y876 PolarHBondContact O-N 3.45Å; P874-Y876 PolarHBondContact O-N 2.83Å
877	K	61.2	Low	66.1	Low	111 Å²	111	104.3 Å²	104.3	48%	0.483	54%	0.541	S	S	.	.	S	Bend	trans	-58.7	137.3	176.5	-74.7	-174.3	176.6	-177.3	0	108.8	F872 P874 V879	F872-K877 HydrophobicContact CD1-CG 4.16Å; P874-K877 PolarHBondContact O-N 2.99Å; K877-V879 PolarHBondContact O-N 3.42Å; K877-V879 VanDerWaalsContact O-N 3.07Å
878	P	59.9	Low	65.4	Low	122 Å²	122	107 Å²	107	79%	0.792	57%	0.565	S	S	*	*			trans	-52.4	123	173.8	-20.4	29.5	0	0	0	108.7	D880	P878-D880 PolarHBondContact O-N 2.88Å; P878-D880 VanDerWaalsContact O-N 3.08Å
879	V	62.9	Low	64.7	Low	119 Å²	119	110.5 Å²	110.5	72%	0.721	58%	0.578	S	S	*	*			trans	-62.4	116	176.5	179.8	0	0	0	0	107.3	K877 N881	K877-V879 PolarHBondContact O-N 3.42Å; K877-V879 VanDerWaalsContact O-N 3.07Å; V879-N881 PolarHBondContact O-N 3.06Å; V879-N881 VanDerWaalsContact O-N 3.08Å
880	D	62.5	Low	64.4	Low	63 Å²	63	109 Å²	109	34%	0.337	58%	0.579	S	S	.	*			trans	-71.8	103.9	177.1	-167.4	-11.1	0	0	0	108.8	P878 C882 N885 V886	P878-D880 PolarHBondContact O-N 2.88Å; P878-D880 VanDerWaalsContact O-N 3.08Å; D880-C882 VanDerWaalsContact C-N 3.26Å; D880-C882 WeakPolarHBondContact OD1-CB 3.47Å; D880-C882 PolarHBondContact OD1-N 3.12Å; D880-N885 WeakPolarHBondContact OD2-CB 3.23Å; D880-N885 PolarHBondContact OD2-ND2 3.25Å; D880-V886 HydrophobicContact CB-CG2 4.35Å; D880-V886 VanDerWaalsContact O-CG2 3.32Å; D880-V886 WeakPolarHBondContact O-CG2 3.41Å
881	N	71.5	Confident	64.7	Low	146 Å²	146	106.4 Å²	106.4	78%	0.781	58%	0.575	S	S	*	*			trans	-84.5	0.7	178.6	-63.8	-37.4	0	0	0	112.4	V879 L883	V879-N881 PolarHBondContact O-N 3.06Å; V879-N881 VanDerWaalsContact O-N 3.08Å; N881-L883 PolarHBondContact O-N 3.15Å
882	C	72.7	Confident	65.1	Low	57 Å²	57	111.1 Å²	111.1	39%	0.385	60%	0.601	S	S	.	*			trans	-82.8	104.9	176.6	-174.4	0	0	0	0	110.1	D880 M884 N885 V886	D880-C882 VanDerWaalsContact C-N 3.26Å; D880-C882 WeakPolarHBondContact OD1-CB 3.47Å; D880-C882 PolarHBondContact OD1-N 3.12Å; C882-M884 PolarHBondContact O-N 3.41Å; C882-M884 VanDerWaalsContact O-N 3.08Å; C882-N885 HydrophobicContact CB-CB 4.12Å; C882-N885 PolarHBondContact O-N 3.19Å; C882-V886 PolarHBondContact O-N 3.46Å; C882-V886 VanDerWaalsContact O-N 3.11Å
883	L	71.3	Confident	65.9	Low	136 Å²	136	113.1 Å²	113.1	71%	0.712	61%	0.613	S	S	*	*	H	α-helix	trans	-51.4	-37.4	-179.4	-155.2	88.5	0	0	0	112.8	N881 V886 L887	N881-L883 PolarHBondContact O-N 3.15Å; L883-V886 PolarHBondContact O-N 3.27Å; L883-L887 HydrophobicContact CD2-CD1 4.05Å; L883-L887 HydrophobicContact CG-CD1 4.09Å; L883-L887 WeakPolarHBondContact O-CB 3.44Å; L883-L887 VanDerWaalsContact O-CG 3.26Å; L883-L887 WeakPolarHBondContact O-CG 3.44Å; L883-L887 PolarHBondContact O-N 3.08Å
884	M	73.9	Confident	66.9	Low	147 Å²	147	112.8 Å²	112.8	72%	0.724	62%	0.616	S	S	*	*	H	α-helix	trans	-68.1	-38.8	-179.2	-159.8	62.7	124.8	0	0	112.3	C882 S888	C882-M884 PolarHBondContact O-N 3.41Å; C882-M884 VanDerWaalsContact O-N 3.08Å; M884-S888 VanDerWaalsContact O-CB 3.28Å; M884-S888 WeakPolarHBondContact O-CB 3.47Å; M884-S888 PolarHBondContact O-N 3.43Å; M884-S888 PolarHBondContact O-OG 3.41Å
885	N	67.3	Low	67.8	Low	78 Å²	78	113.7 Å²	113.7	42%	0.417	62%	0.616	S	S	.	*	H	α-helix	trans	-66.7	-46.6	175.6	-74	3.5	0	0	0	110.8	D880 C882 L887 S888 Q889	D880-N885 WeakPolarHBondContact OD2-CB 3.23Å; D880-N885 PolarHBondContact OD2-ND2 3.25Å; C882-N885 HydrophobicContact CB-CB 4.12Å; C882-N885 PolarHBondContact O-N 3.19Å; N885-L887 VanDerWaalsContact C-N 3.32Å; N885-L887 PolarHBondContact O-N 3.1Å; N885-S888 WeakPolarHBondContact CA-OG 3.33Å; N885-S888 PolarHBondContact O-N 3.37Å; N885-S888 VanDerWaalsContact O-N 3.12Å; N885-S888 PolarHBondContact O-OG 3.17Å; N885-Q889 PolarHBondContact O-N 3.39Å
886	V	65.3	Low	68.9	Low	73 Å²	73	112.5 Å²	112.5	44%	0.442	61%	0.61	S	S	.	*	H	α-helix	trans	-59	-43.8	179.5	176.8	0	0	0	0	111.1	D880 C882 L883 S888 Q889	D880-V886 HydrophobicContact CB-CG2 4.35Å; D880-V886 VanDerWaalsContact O-CG2 3.32Å; D880-V886 WeakPolarHBondContact O-CG2 3.41Å; C882-V886 PolarHBondContact O-N 3.46Å; C882-V886 VanDerWaalsContact O-N 3.11Å; L883-V886 PolarHBondContact O-N 3.27Å; V886-S888 VanDerWaalsContact C-N 3.34Å; V886-S888 PolarHBondContact O-N 2.79Å; V886-Q889 PolarHBondContact O-N 3.21Å
887	L	68.3	Low	70.1	Confident	129 Å²	129	108.2 Å²	108.2	68%	0.675	59%	0.594	S	S	*	*	H	α-helix	trans	-72.4	-24.6	178.1	-69.3	170.9	0	0	0	113.6	L883 N885	L883-L887 HydrophobicContact CD2-CD1 4.05Å; L883-L887 HydrophobicContact CG-CD1 4.09Å; L883-L887 WeakPolarHBondContact O-CB 3.44Å; L883-L887 VanDerWaalsContact O-CG 3.26Å; L883-L887 WeakPolarHBondContact O-CG 3.44Å; L883-L887 PolarHBondContact O-N 3.08Å; N885-L887 VanDerWaalsContact C-N 3.32Å; N885-L887 PolarHBondContact O-N 3.1Å
888	S	70.7	Confident	71.3	Confident	89 Å²	89	108.5 Å²	108.5	62%	0.622	60%	0.596	S	S	*	*	H	α-helix	trans	-83.4	-12.2	178.1	69	0	0	0	0	114.2	M884 N885 V886 S890	M884-S888 VanDerWaalsContact O-CB 3.28Å; M884-S888 WeakPolarHBondContact O-CB 3.47Å; M884-S888 PolarHBondContact O-N 3.43Å; M884-S888 PolarHBondContact O-OG 3.41Å; N885-S888 WeakPolarHBondContact CA-OG 3.33Å; N885-S888 PolarHBondContact O-N 3.37Å; N885-S888 VanDerWaalsContact O-N 3.12Å; N885-S888 PolarHBondContact O-OG 3.17Å; V886-S888 VanDerWaalsContact C-N 3.34Å; V886-S888 PolarHBondContact O-N 2.79Å; S888-S890 PolarHBondContact O-N 3.07Å
889	Q	63.6	Low	72.5	Confident	119 Å²	119	110.4 Å²	110.4	56%	0.556	59%	0.594	S	S	*	*	S	Bend	trans	-66.6	117.6	176.4	-75.7	179.8	9.4	0	0	109.6	N885 V886 T891	N885-Q889 PolarHBondContact O-N 3.39Å; V886-Q889 PolarHBondContact O-N 3.21Å; Q889-T891 PolarHBondContact O-N 3.25Å; Q889-T891 VanDerWaalsContact O-N 3.07Å
890	S	61	Low	73.7	Confident	116 Å²	116	108.4 Å²	108.4	81%	0.811	58%	0.58	S	S	*	*			trans	-67.5	106	170.1	57.4	0	0	0	0	108.9	S888 E892	S888-S890 PolarHBondContact O-N 3.07Å; S890-E892 PolarHBondContact O-N 3.42Å
891	T	67.3	Low	75	Confident	113 Å²	113	110.9 Å²	110.9	69%	0.693	59%	0.585	S	S	*	*			trans	-82.3	112.7	169.2	41	0	0	0	0	108.8	Q889 L893	Q889-T891 PolarHBondContact O-N 3.25Å; Q889-T891 VanDerWaalsContact O-N 3.07Å; T891-L893 PolarHBondContact O-N 2.85Å
892	E	67.9	Low	75.7	Confident	186 Å²	186	111.9 Å²	111.9	87%	0.869	59%	0.585	S	S	*	*			trans	-68	107.5	170	-79	-163.9	150.5	0	0	109.4	S890	S890-E892 PolarHBondContact O-N 3.42Å
893	L	77.3	Confident	76.3	Confident	82 Å²	82	114.9 Å²	114.9	43%	0.429	59%	0.591	S	S	.	*			trans	-71.5	137.6	173.6	-61.8	168	0	0	0	109.5	T891 F897 K898	T891-L893 PolarHBondContact O-N 2.85Å; L893-F897 HydrophobicContact CB-CD1 3.92Å; L893-F897 HydrophobicContact CD1-CD1 3.92Å; L893-F897 HydrophobicContact CD1-CE1 3.84Å; L893-F897 HydrophobicContact CD2-CD1 3.83Å; L893-F897 HydrophobicContact CD2-CE1 3.85Å; L893-F897 HydrophobicContact CG-CD1 4.1Å; L893-F897 HydrophobicContact CG-CE1 4.31Å; L893-K898 HydrophobicContact CB-CG 4.18Å; L893-K898 WeakPolarHBondContact O-CE 3.47Å; L893-K898 PolarHBondContact O-NZ 2.75Å
894	S	80.4	Confident	77.2	Confident	70 Å²	70	113.4 Å²	113.4	49%	0.49	58%	0.577	S	S	.	*			trans	-58.9	150.8	177.5	72.6	0	0	0	0	111	E896 F897 K898	S894-E896 PolarHBondContact O-N 3.24Å; S894-F897 PolarHBondContact O-N 2.98Å; S894-F897 VanDerWaalsContact O-N 3.08Å; S894-F897 WeakPolarHBondContact OG-CB 3.47Å; S894-F897 PolarHBondContact OG-N 3.16Å; S894-K898 PolarHBondContact O-N 3.28Å
895	N	79.9	Confident	77.8	Confident	121 Å²	121	108 Å²	108	65%	0.647	55%	0.55	S	S	*	*	H	α-helix	trans	-60.3	-37.9	179.9	-67.9	-24.7	0	0	0	111.8	F897 K898 E899	N895-F897 VanDerWaalsContact C-N 3.33Å; N895-F897 PolarHBondContact O-N 3.48Å; N895-K898 PolarHBondContact O-N 2.79Å; N895-E899 PolarHBondContact O-N 3.03Å
896	E	82.6	Confident	78.7	Confident	143 Å²	143	110.7 Å²	110.7	67%	0.668	56%	0.56	S	S	*	*	H	α-helix	trans	-60.7	-40.1	174.5	-175.3	-179.2	-174.9	0	0	112.4	S894 N900	S894-E896 PolarHBondContact O-N 3.24Å; E896-N900 WeakPolarHBondContact O-CB 3.5Å; E896-N900 PolarHBondContact O-N 3.1Å; E896-N900 PolarHBondContact O-ND2 3.2Å
897	F	84.7	Confident	79.7	Confident	52 Å²	52	111.8 Å²	111.8	23%	0.228	56%	0.561	C	S	.	*	H	α-helix	trans	-68.6	-39.3	176	-176.3	-93.2	0	0	0	111.6	L893 S894 N895 E899 N900 Y901 W904	L893-F897 HydrophobicContact CB-CD1 3.92Å; L893-F897 HydrophobicContact CD1-CD1 3.92Å; L893-F897 HydrophobicContact CD1-CE1 3.84Å; L893-F897 HydrophobicContact CD2-CD1 3.83Å; L893-F897 HydrophobicContact CD2-CE1 3.85Å; L893-F897 HydrophobicContact CG-CD1 4.1Å; L893-F897 HydrophobicContact CG-CE1 4.31Å; S894-F897 PolarHBondContact O-N 2.98Å; S894-F897 VanDerWaalsContact O-N 3.08Å; S894-F897 WeakPolarHBondContact OG-CB 3.47Å; S894-F897 PolarHBondContact OG-N 3.16Å; N895-F897 VanDerWaalsContact C-N 3.33Å; N895-F897 PolarHBondContact O-N 3.48Å; F897-E899 VanDerWaalsContact C-N 3.33Å; F897-E899 PolarHBondContact O-N 3.11Å; F897-N900 CarbonylContact O-C 3.49Å; F897-N900 PolarHBondContact O-N 3.02Å; F897-Y901 HydrophobicContact CD1-CD2 4.43Å; F897-Y901 AromaticContact CE1-CD2 3.65Å; F897-Y901 HydrophobicContact CE1-CD2 3.65Å; F897-Y901 HydrophobicContact CE1-CE2 4.22Å; F897-Y901 HydrophobicContact CZ-CD2 4.05Å; F897-Y901 VanDerWaalsContact O-CA 3.28Å; F897-Y901 WeakPolarHBondContact O-CA 3.49Å; F897-Y901 WeakPolarHBondContact O-CB 2.96Å; F897-Y901 PolarHBondContact O-N 3.21Å; F897-W904 HydrophobicContact CE2-CB 4.25Å; F897-W904 AromaticContact CE2-CD1 3.9Å; F897-W904 AromaticContact CE2-CD2 3.55Å; F897-W904 HydrophobicContact CE2-CD2 3.55Å; F897-W904 AromaticContact CE2-CE2 3.82Å; F897-W904 HydrophobicContact CE2-CE3 4.03Å; F897-W904 AromaticContact CE2-CG 3.62Å; F897-W904 HydrophobicContact CE2-CG 3.62Å; F897-W904 HydrophobicContact CE2-CZ2 4.49Å; F897-W904 AromaticContact CE2-NE1 3.99Å; F897-W904 AromaticContact CZ-CD2 3.69Å; F897-W904 HydrophobicContact CZ-CD2 3.69Å; F897-W904 AromaticContact CZ-CE3 3.66Å; F897-W904 HydrophobicContact CZ-CE3 3.66Å; F897-W904 HydrophobicContact CZ-CG 4.18Å; F897-W904 HydrophobicContact CZ-CH2 4.42Å; F897-W904 HydrophobicContact CZ-CZ2 4.45Å; F897-W904 HydrophobicContact CZ-CZ3 4.04Å
898	K	85.4	Confident	80.3	Confident	117 Å²	117	111.1 Å²	111.1	51%	0.509	55%	0.554	S	S	.	*	H	α-helix	trans	-62.2	-40.3	176.5	-70.5	172.6	179.9	161.5	0	111.8	L893 S894 N895	L893-K898 HydrophobicContact CB-CG 4.18Å; L893-K898 WeakPolarHBondContact O-CE 3.47Å; L893-K898 PolarHBondContact O-NZ 2.75Å; S894-K898 PolarHBondContact O-N 3.28Å; N895-K898 PolarHBondContact O-N 2.79Å
899	E	86.4	Confident	80.8	Confident	163 Å²	163	109.9 Å²	109.9	76%	0.762	54%	0.543	S	S	*	.	H	α-helix	trans	-68.8	-39.5	176.6	-72.8	-178.3	175.6	0	0	112.5	N895 F897	N895-E899 PolarHBondContact O-N 3.03Å; F897-E899 VanDerWaalsContact C-N 3.33Å; F897-E899 PolarHBondContact O-N 3.11Å
900	N	88	Confident	81.8	Confident	77 Å²	77	111.5 Å²	111.5	41%	0.412	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	12.3	-178	-64.8	-61.2	0	0	0	113.7	E896 F897 E902 K903 W904	E896-N900 WeakPolarHBondContact O-CB 3.5Å; E896-N900 PolarHBondContact O-N 3.1Å; E896-N900 PolarHBondContact O-ND2 3.2Å; F897-N900 CarbonylContact O-C 3.49Å; F897-N900 PolarHBondContact O-N 3.02Å; N900-E902 VanDerWaalsContact C-N 3.35Å; N900-E902 PolarHBondContact O-N 3.46Å; N900-K903 PolarHBondContact O-N 2.94Å; N900-K903 VanDerWaalsContact O-N 3.12Å; N900-W904 PolarHBondContact O-N 3.41Å
901	Y	88.6	Confident	82.9	Confident	114 Å²	114	110 Å²	110	45%	0.447	54%	0.538	S	S	.	.	H	α-helix	trans	-57.7	-45.3	-171.1	176	-108	0	0	0	112.4	F897 K903 W904 L905	F897-Y901 HydrophobicContact CD1-CD2 4.43Å; F897-Y901 AromaticContact CE1-CD2 3.65Å; F897-Y901 HydrophobicContact CE1-CD2 3.65Å; F897-Y901 HydrophobicContact CE1-CE2 4.22Å; F897-Y901 HydrophobicContact CZ-CD2 4.05Å; F897-Y901 VanDerWaalsContact O-CA 3.28Å; F897-Y901 WeakPolarHBondContact O-CA 3.49Å; F897-Y901 WeakPolarHBondContact O-CB 2.96Å; F897-Y901 PolarHBondContact O-N 3.21Å; Y901-K903 VanDerWaalsContact C-N 3.34Å; Y901-K903 PolarHBondContact O-N 3.13Å; Y901-W904 HydrophobicContact CD2-CE3 4.49Å; Y901-W904 HydrophobicContact CE2-CE3 4.46Å; Y901-W904 PolarHBondContact O-N 3.38Å; Y901-L905 HydrophobicContact CD1-CD1 4.25Å; Y901-L905 HydrophobicContact CD2-CD1 4.36Å; Y901-L905 HydrophobicContact CE1-CD1 3.5Å; Y901-L905 HydrophobicContact CE2-CD1 3.64Å; Y901-L905 WeakPolarHBondContact O-CB 3.36Å; Y901-L905 PolarHBondContact O-N 3.44Å; Y901-L905 WeakPolarHBondContact OH-CD1 3.24Å
902	E	86.9	Confident	83.4	Confident	167 Å²	167	107.9 Å²	107.9	78%	0.78	53%	0.525	S	S	*	.	H	α-helix	trans	-61.2	-43.7	178.5	-73.6	-172.5	160.7	0	0	111.9	N900 L905 E906	N900-E902 VanDerWaalsContact C-N 3.35Å; N900-E902 PolarHBondContact O-N 3.46Å; E902-L905 WeakPolarHBondContact O-CB 3.45Å; E902-L905 PolarHBondContact O-N 3.07Å; E902-E906 PolarHBondContact O-N 3.02Å
903	K	86.6	Confident	83.9	Confident	121 Å²	121	104.5 Å²	104.5	53%	0.526	52%	0.518	S	S	.	.	H	α-helix	trans	-65.4	-44.5	179.3	-173.6	179.2	174.2	-173.6	0	111.3	N900 Y901 L905 E906 E907	N900-K903 PolarHBondContact O-N 2.94Å; N900-K903 VanDerWaalsContact O-N 3.12Å; Y901-K903 VanDerWaalsContact C-N 3.34Å; Y901-K903 PolarHBondContact O-N 3.13Å; K903-L905 VanDerWaalsContact C-N 3.27Å; K903-L905 PolarHBondContact O-N 3.47Å; K903-E906 PolarHBondContact O-N 3.05Å; K903-E907 WeakPolarHBondContact CE-OE1 3.28Å; K903-E907 HydrophobicContact CG-CG 4.48Å; K903-E907 IonicContact NZ-OE1 3.59Å; K903-E907 WeakPolarHBondContact O-CB 3.39Å; K903-E907 WeakPolarHBondContact O-CG 3.41Å; K903-E907 PolarHBondContact O-N 3.22Å
904	W	89.2	Confident	83.7	Confident	105 Å²	105	105.1 Å²	105.1	40%	0.398	52%	0.521	S	S	.	.	H	α-helix	trans	-59.9	-39.5	174.4	177.2	83	0	0	0	111.5	F897 N900 Y901 E906 E907 E908 V909	F897-W904 HydrophobicContact CE2-CB 4.25Å; F897-W904 AromaticContact CE2-CD1 3.9Å; F897-W904 AromaticContact CE2-CD2 3.55Å; F897-W904 HydrophobicContact CE2-CD2 3.55Å; F897-W904 AromaticContact CE2-CE2 3.82Å; F897-W904 HydrophobicContact CE2-CE3 4.03Å; F897-W904 AromaticContact CE2-CG 3.62Å; F897-W904 HydrophobicContact CE2-CG 3.62Å; F897-W904 HydrophobicContact CE2-CZ2 4.49Å; F897-W904 AromaticContact CE2-NE1 3.99Å; F897-W904 AromaticContact CZ-CD2 3.69Å; F897-W904 HydrophobicContact CZ-CD2 3.69Å; F897-W904 AromaticContact CZ-CE3 3.66Å; F897-W904 HydrophobicContact CZ-CE3 3.66Å; F897-W904 HydrophobicContact CZ-CG 4.18Å; F897-W904 HydrophobicContact CZ-CH2 4.42Å; F897-W904 HydrophobicContact CZ-CZ2 4.45Å; F897-W904 HydrophobicContact CZ-CZ3 4.04Å; N900-W904 PolarHBondContact O-N 3.41Å; Y901-W904 HydrophobicContact CD2-CE3 4.49Å; Y901-W904 HydrophobicContact CE2-CE3 4.46Å; Y901-W904 PolarHBondContact O-N 3.38Å; W904-E906 PolarHBondContact O-N 3.47Å; W904-E907 PolarHBondContact O-N 3.09Å; W904-E908 HydrophobicContact CD2-CB 4.45Å; W904-E908 HydrophobicContact CG-CG 4.43Å; W904-E908 HydrophobicContact CZ2-CB 4.39Å; W904-E908 WeakPolarHBondContact O-CB 3.34Å; W904-E908 PolarHBondContact O-N 3.44Å; W904-V909 HydrophobicContact CE3-CG2 4.39Å; W904-V909 HydrophobicContact CH2-CG2 3.9Å; W904-V909 HydrophobicContact CZ3-CG2 3.79Å
905	L	86.6	Confident	83.5	Confident	33 Å²	33	106.4 Å²	106.4	17%	0.173	52%	0.523	C	S	.	.	I	π-helix	trans	-65	-40.9	178.8	-137	122.5	0	0	0	112	Y901 E902 K903 V909 F910	Y901-L905 HydrophobicContact CD1-CD1 4.25Å; Y901-L905 HydrophobicContact CD2-CD1 4.36Å; Y901-L905 HydrophobicContact CE1-CD1 3.5Å; Y901-L905 HydrophobicContact CE2-CD1 3.64Å; Y901-L905 WeakPolarHBondContact O-CB 3.36Å; Y901-L905 PolarHBondContact O-N 3.44Å; Y901-L905 WeakPolarHBondContact OH-CD1 3.24Å; E902-L905 WeakPolarHBondContact O-CB 3.45Å; E902-L905 PolarHBondContact O-N 3.07Å; K903-L905 VanDerWaalsContact C-N 3.27Å; K903-L905 PolarHBondContact O-N 3.47Å; L905-V909 HydrophobicContact CG-CB 4.4Å; L905-V909 HydrophobicContact CG-CG2 4.3Å; L905-V909 WeakPolarHBondContact O-CA 3.48Å; L905-V909 VanDerWaalsContact O-CB 3.28Å; L905-V909 WeakPolarHBondContact O-CB 3.35Å; L905-V909 PolarHBondContact O-N 2.88Å; L905-V909 VanDerWaalsContact O-N 3.11Å; L905-F910 HydrophobicContact CD2-CD1 4.49Å; L905-F910 HydrophobicContact CD2-CD2 4.16Å; L905-F910 HydrophobicContact CD2-CE1 3.79Å; L905-F910 HydrophobicContact CD2-CE2 3.4Å; L905-F910 VanDerWaalsContact CD2-CE2 3.4Å; L905-F910 HydrophobicContact CD2-CZ 3.19Å; L905-F910 PolarHBondContact O-N 3.12Å
906	E	87	Confident	83.3	Confident	134 Å²	134	108.6 Å²	108.6	63%	0.626	52%	0.522	S	S	*	.	I	π-helix	trans	-68.8	-45.3	177.9	-165.8	162.9	-158.4	0	0	111.9	E902 K903 W904 S911	E902-E906 PolarHBondContact O-N 3.02Å; K903-E906 PolarHBondContact O-N 3.05Å; W904-E906 PolarHBondContact O-N 3.47Å; E906-S911 VanDerWaalsContact O-CB 3.3Å; E906-S911 WeakPolarHBondContact O-CB 3.41Å; E906-S911 PolarHBondContact O-N 3.46Å
907	E	85.9	Confident	82.9	Confident	97 Å²	97	105.7 Å²	105.7	45%	0.453	52%	0.518	S	S	.	.	I	π-helix	trans	-71.4	-49.6	-178.3	-70.7	179	171.4	0	0	112.1	K903 W904 S911 V912	K903-E907 WeakPolarHBondContact CE-OE1 3.28Å; K903-E907 HydrophobicContact CG-CG 4.48Å; K903-E907 IonicContact NZ-OE1 3.59Å; K903-E907 WeakPolarHBondContact O-CB 3.39Å; K903-E907 WeakPolarHBondContact O-CG 3.41Å; K903-E907 PolarHBondContact O-N 3.22Å; W904-E907 PolarHBondContact O-N 3.09Å; E907-S911 PolarHBondContact O-OG 3.3Å; E907-V912 WeakPolarHBondContact O-CG2 3.47Å
908	E	81.1	Confident	82.3	Confident	114 Å²	114	109.5 Å²	109.5	53%	0.533	54%	0.536	S	S	.	.	I	π-helix	trans	-97.5	-24.5	-168.4	-65.3	-66.4	149.6	0	0	114	W904 V912	W904-E908 HydrophobicContact CD2-CB 4.45Å; W904-E908 HydrophobicContact CG-CG 4.43Å; W904-E908 HydrophobicContact CZ2-CB 4.39Å; W904-E908 WeakPolarHBondContact O-CB 3.34Å; W904-E908 PolarHBondContact O-N 3.44Å; E908-V912 WeakPolarHBondContact O-CB 3.42Å; E908-V912 VanDerWaalsContact O-CG2 3.26Å; E908-V912 WeakPolarHBondContact O-CG2 3.34Å
909	V	80.8	Confident	81.6	Confident	64 Å²	64	107.9 Å²	107.9	39%	0.388	54%	0.536	S	S	.	.	I	π-helix	trans	-105.7	-50.9	-176.5	-172.6	0	0	0	0	111.5	W904 L905	W904-V909 HydrophobicContact CE3-CG2 4.39Å; W904-V909 HydrophobicContact CH2-CG2 3.9Å; W904-V909 HydrophobicContact CZ3-CG2 3.79Å; L905-V909 HydrophobicContact CG-CB 4.4Å; L905-V909 HydrophobicContact CG-CG2 4.3Å; L905-V909 WeakPolarHBondContact O-CA 3.48Å; L905-V909 VanDerWaalsContact O-CB 3.28Å; L905-V909 WeakPolarHBondContact O-CB 3.35Å; L905-V909 PolarHBondContact O-N 2.88Å; L905-V909 VanDerWaalsContact O-N 3.11Å
910	F	84.1	Confident	80.7	Confident	152 Å²	152	107 Å²	107	67%	0.667	54%	0.535	S	S	*	.	I	π-helix	trans	-81.3	-38.7	-175.9	-62.8	-33.6	0	0	0	113.3	L905	L905-F910 HydrophobicContact CD2-CD1 4.49Å; L905-F910 HydrophobicContact CD2-CD2 4.16Å; L905-F910 HydrophobicContact CD2-CE1 3.79Å; L905-F910 HydrophobicContact CD2-CE2 3.4Å; L905-F910 VanDerWaalsContact CD2-CE2 3.4Å; L905-F910 HydrophobicContact CD2-CZ 3.19Å; L905-F910 PolarHBondContact O-N 3.12Å
911	S	83.4	Confident	79.4	Confident	85 Å²	85	107.3 Å²	107.3	59%	0.594	55%	0.549	S	S	*	.	S	Bend	trans	-82.7	-17.6	-177.6	93.8	0	0	0	0	113.7	E906 E907 P913	E906-S911 VanDerWaalsContact O-CB 3.3Å; E906-S911 WeakPolarHBondContact O-CB 3.41Å; E906-S911 PolarHBondContact O-N 3.46Å; E907-S911 PolarHBondContact O-OG 3.3Å; S911-P913 WeakPolarHBondContact O-CD 3.48Å
912	V	78.8	Confident	77.2	Confident	69 Å²	69	112.2 Å²	112.2	42%	0.418	58%	0.575	S	S	.	*	S	Bend	trans	-90.7	115.9	-179.2	-175.4	0	0	0	0	110.5	E907 E908 I914	E907-V912 WeakPolarHBondContact O-CG2 3.47Å; E908-V912 WeakPolarHBondContact O-CB 3.42Å; E908-V912 VanDerWaalsContact O-CG2 3.26Å; E908-V912 WeakPolarHBondContact O-CG2 3.34Å; V912-I914 PolarHBondContact O-N 3.19Å; V912-I914 VanDerWaalsContact O-N 3.13Å
913	P	78.2	Confident	76.7	Confident	114 Å²	114	109.5 Å²	109.5	74%	0.74	57%	0.565	S	S	*	*			trans	-65.6	116.2	175.6	24.8	-31.2	0	0	0	110.5	S911 N915	S911-P913 WeakPolarHBondContact O-CD 3.48Å; P913-N915 PolarHBondContact O-N 3.02Å
914	I	73.3	Confident	76.2	Confident	96 Å²	96	108.9 Å²	108.9	49%	0.492	57%	0.567	S	S	.	*			trans	-61.7	117.9	178.9	-60.4	171.6	0	0	0	109.5	V912 W916 V919	V912-I914 PolarHBondContact O-N 3.19Å; V912-I914 VanDerWaalsContact O-N 3.13Å; I914-W916 VanDerWaalsContact C-N 3.34Å; I914-W916 HydrophobicContact CB-CZ2 4.42Å; I914-W916 HydrophobicContact CD1-CZ2 4.13Å; I914-W916 HydrophobicContact CG2-CD2 3.91Å; I914-W916 HydrophobicContact CG2-CE3 4.26Å; I914-W916 HydrophobicContact CG2-CG 4.3Å; I914-W916 HydrophobicContact CG2-CH2 4.45Å; I914-W916 HydrophobicContact CG2-CZ2 4.12Å; I914-W916 PolarHBondContact O-N 3.31Å; I914-V919 HydrophobicContact CG2-CG2 4.41Å
915	N	75.4	Confident	75.5	Confident	96 Å²	96	109.1 Å²	109.1	51%	0.513	58%	0.576	S	S	.	*			trans	-80.4	83.1	172.9	-170.4	-10.1	0	0	0	110.3	P913 S917 H918 V919	P913-N915 PolarHBondContact O-N 3.02Å; N915-S917 PolarHBondContact O-N 3.41Å; N915-S917 PolarHBondContact OD1-N 3.45Å; N915-S917 PolarHBondContact OD1-OG 3.24Å; N915-H918 PolarHBondContact O-N 3.18Å; N915-V919 PolarHBondContact O-N 3.48Å
916	W	76.7	Confident	74.8	Confident	168 Å²	168	113.6 Å²	113.6	64%	0.636	60%	0.6	S	S	*	*	H	α-helix	trans	-54	-28.1	-179.6	-66.5	103	0	0	0	114.1	I914 H918 V919 L920	I914-W916 VanDerWaalsContact C-N 3.34Å; I914-W916 HydrophobicContact CB-CZ2 4.42Å; I914-W916 HydrophobicContact CD1-CZ2 4.13Å; I914-W916 HydrophobicContact CG2-CD2 3.91Å; I914-W916 HydrophobicContact CG2-CE3 4.26Å; I914-W916 HydrophobicContact CG2-CG 4.3Å; I914-W916 HydrophobicContact CG2-CH2 4.45Å; I914-W916 HydrophobicContact CG2-CZ2 4.12Å; I914-W916 PolarHBondContact O-N 3.31Å; W916-H918 VanDerWaalsContact C-N 3.27Å; W916-H918 PolarHBondContact O-N 3.5Å; W916-V919 PolarHBondContact O-N 3.37Å; W916-L920 WeakPolarHBondContact O-CG 3.48Å; W916-L920 PolarHBondContact O-N 3.41Å
917	S	73.9	Confident	74.1	Confident	82 Å²	82	112.3 Å²	112.3	57%	0.573	60%	0.599	S	S	*	*	H	α-helix	trans	-66.1	-30.1	177.8	70.2	0	0	0	0	113	N915 A921	N915-S917 PolarHBondContact O-N 3.41Å; N915-S917 PolarHBondContact OD1-N 3.45Å; N915-S917 PolarHBondContact OD1-OG 3.24Å; S917-A921 WeakPolarHBondContact O-CB 3.39Å
918	H	72.8	Confident	73.3	Confident	131 Å²	131	113.3 Å²	113.3	61%	0.606	61%	0.608	S	S	*	*	H	α-helix	trans	-80	-35.7	177.3	-131.9	-110	0	0	0	111.8	N915 W916 A921	N915-H918 PolarHBondContact O-N 3.18Å; W916-H918 VanDerWaalsContact C-N 3.27Å; W916-H918 PolarHBondContact O-N 3.5Å; H918-A921 PolarHBondContact O-N 3.33Å
919	V	70.1	Confident	72.7	Confident	84 Å²	84	113.3 Å²	113.3	51%	0.509	61%	0.614	S	S	.	*	H	α-helix	trans	-69.8	-35.6	178.4	-179.9	0	0	0	0	111.6	I914 N915 W916 A921	I914-V919 HydrophobicContact CG2-CG2 4.41Å; N915-V919 PolarHBondContact O-N 3.48Å; W916-V919 PolarHBondContact O-N 3.37Å; V919-A921 VanDerWaalsContact C-N 3.33Å
920	L	66.8	Low	72.1	Confident	144 Å²	144	117.1 Å²	117.1	75%	0.754	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-11.2	178.3	-73.5	166.7	0	0	0	114.1	W916	W916-L920 WeakPolarHBondContact O-CG 3.48Å; W916-L920 PolarHBondContact O-N 3.41Å
921	A	61.4	Low	71.1	Confident	84 Å²	84	114.2 Å²	114.2	69%	0.694	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-16.8	179	0	0	0	0	0	113.2	S917 H918 V919	S917-A921 WeakPolarHBondContact O-CB 3.39Å; H918-A921 PolarHBondContact O-N 3.33Å; V919-A921 VanDerWaalsContact C-N 3.33Å
922	H	42.2	Very low	70	Confident	217 Å²	217	116.8 Å²	116.8	100%	1.005	63%	0.631	S	S	*	*			trans	-97.1	0	168.1	-92.8	-72.1	0	0	0	110

Retrieved 922 of 922 residues in 297.1 ms (Link to these results)

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