A0A087XBX7_POEFO Loading...

KH and NYN domain containing

AlphaFold DB , UniProt , Accession A0A087XBX7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 817 aa.

						>A0A087XBX7_POEFO|A0A087XBX7
MDGKRSSGGEGGSGDPEVEDEFACAGMLRGSLTSLHSTVERIFRVTFGIGADDLPNGNNGQIWLKLQGLSTDVKAAKLFVKGVVNQEVQQELSYPGALHCIFCGARGLFMDSLIKNTSALIVVGSPGFLLVSGLAEPVVRAYSLIADLVVRYEGTQSKRTEMGDRVLGESLDSRRAFKTLVEKWEDRHVLDLLVLPGTVKEILLDLVKESGLGSSPSPEPMRDDTGAKSHNDSRDDWDKASSSKKTLPDPFSNADRWAEGKATTYDSAAKDPFLQDIFSPAGTRGKAEGAEERLLHSPQEVGEEEQLEKQAITVKAGEGQGDSEEPEWQLSMGNKEFWLLLKFFTAMGYTEDVVKRVLKKTGPKEASQILDLVQQEQDLSDREQNKCSGRSTKKHGVILHQGKEQPCETEHKEDEDTEEAGRKIKHSNGDFEGLQVGGEELTIRNHKQGRGSEDVQEAEHQEDFVLGVMKKAAATCGYTEENVTKIYSMLSEGSTHQLLLELQKKESKETEGSKKEPREIHDVLVEKEEINLGLAETETKGEFFIHKDKRDPDEGQTKEPKRSMQLAESDLRTWSNKPKQLAPNQPVSQLNQPLNTLRPHQDVLQDVKGPPMPTYASSLGPPLMPFHPNKQQGQTTYGPDPATSKQTHQTHINVPNSKRHSAISSKQEHQAQPNIFFASDPPSTRTRDKRSFISPSSSVVVTGEQRFLEGLQTPFQLKLTDEPGNPNLRAIVIDGSNVAMSHGLGHFFSCRGIALAVQHFWDRGHRHISALVPQWRQKNDPRIKEQHYMTDLQNLGLLSYTPSREVHGKRISSYDDR
					

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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	33.1	Very low	35.5	Very low	233 Å²	233	145.2 Å²	145.2	100%	1.148	88%	0.877	S	S	*	*				0	114.6	0	-82.3	-166.9	170.7	0	0	106.4
2	D	35.8	Very low	35.6	Very low	157 Å²	157	139.8 Å²	139.8	84%	0.84	87%	0.873	S	S	*	*			trans	-117.8	121.3	-135.8	-62	-96.9	0	0	0	110.5
3	G	31.1	Very low	36.3	Very low	81 Å²	81	138.2 Å²	138.2	84%	0.835	87%	0.87	S	S	*	*			trans	-102.9	81	178.9	0	0	0	0	0	111.4	R5	G3-R5 PolarHBondContact O-N 3.31Å
4	K	37.9	Very low	37.4	Very low	211 Å²	211	133.3 Å²	133.3	92%	0.917	86%	0.859	S	S	*	*			trans	-65.8	112.8	168.2	-79.8	-171.7	174.2	-176.1	0	109.4
5	R	35.2	Very low	38.9	Very low	245 Å²	245	133.2 Å²	133.2	93%	0.925	85%	0.849	S	S	*	*			trans	-90.7	142.8	157.7	-91.6	-174.1	168.5	-175.8	-3.9	109.3	G3	G3-R5 PolarHBondContact O-N 3.31Å
6	S	39.1	Very low	41.4	Very low	124 Å²	124	130.9 Å²	130.9	87%	0.867	84%	0.835	S	S	*	*			trans	-82.1	147.3	174.1	-166.1	0	0	0	0	110.7
7	S	37.7	Very low	44	Very low	112 Å²	112	130.4 Å²	130.4	78%	0.783	82%	0.819	S	S	*	*			trans	-132.5	113.6	165.8	54.1	0	0	0	0	107.2
8	G	36	Very low	46.7	Very low	80 Å²	80	125.8 Å²	125.8	83%	0.825	79%	0.79	S	S	*	*			trans	-70.8	143.2	175.4	0	0	0	0	0	111
9	G	31	Very low	49.1	Very low	75 Å²	75	124.3 Å²	124.3	77%	0.773	77%	0.772	S	S	*	*			trans	-108.6	133.5	160.3	0	0	0	0	0	108.4	G11	G9-G11 PolarHBondContact O-N 3.18Å
10	E	37.4	Very low	51.4	Low	202 Å²	202	120.6 Å²	120.6	94%	0.944	75%	0.747	S	S	*	*			trans	-72.1	116.5	175	-69.9	167.8	108.2	0	0	109.3	G12	E10-G12 PolarHBondContact O-N 2.65Å
11	G	36.1	Very low	53.4	Low	77 Å²	77	119.4 Å²	119.4	79%	0.794	73%	0.733	S	S	*	*			trans	-79.2	112.6	174.5	0	0	0	0	0	110.1	G9 S13	G9-G11 PolarHBondContact O-N 3.18Å; G11-S13 PolarHBondContact O-N 3.46Å
12	G	36.9	Very low	56.2	Low	80 Å²	80	109.1 Å²	109.1	83%	0.825	68%	0.682	S	S	*	*			trans	-63.2	117.8	173.6	0	0	0	0	0	111	E10 G14	E10-G12 PolarHBondContact O-N 2.65Å; G12-G14 VanDerWaalsContact C-N 3.32Å; G12-G14 PolarHBondContact O-N 3.29Å
13	S	44.9	Very low	58.8	Low	120 Å²	120	103.6 Å²	103.6	84%	0.839	66%	0.658	S	S	*	*			trans	-77	81.5	176	58.5	0	0	0	0	110.5	G11 D15	G11-S13 PolarHBondContact O-N 3.46Å; S13-D15 PolarHBondContact O-N 3.28Å
14	G	51.3	Low	61.5	Low	69 Å²	69	100.3 Å²	100.3	71%	0.711	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-66.6	119.1	157.7	0	0	0	0	0	108.5	G12	G12-G14 VanDerWaalsContact C-N 3.32Å; G12-G14 PolarHBondContact O-N 3.29Å
15	D	60.5	Low	63.8	Low	132 Å²	132	92.1 Å²	92.1	71%	0.706	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-56.9	137.3	168.9	-97.9	-35.2	0	0	0	108.9	S13 E17 L69	S13-D15 PolarHBondContact O-N 3.28Å; D15-E17 PolarHBondContact O-N 2.93Å; D15-L69 HydrophobicContact CB-CD2 4.15Å
16	P	77.8	Confident	66.1	Low	96 Å²	96	81.5 Å²	81.5	62%	0.623	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-62.8	134.2	-177.9	26.2	-33.9	0	0	0	110.1	V18	P16-V18 PolarHBondContact O-N 2.71Å
17	E	85.8	Confident	68.3	Low	122 Å²	122	84 Å²	84	57%	0.57	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-63.2	127.8	169.4	-164.7	176.3	-139.8	0	0	108.8	D15 Q67	D15-E17 PolarHBondContact O-N 2.93Å; E17-Q67 HydrophobicContact CG-CG 3.89Å; E17-Q67 PolarHBondContact OE2-NE2 3.11Å
18	V	92.8	Very high	70.6	Confident	48 Å²	48	81.3 Å²	81.3	29%	0.291	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.6	-177.7	178.3	0	0	0	0	108.9	P16 Q67 G68	P16-V18 PolarHBondContact O-N 2.71Å; V18-Q67 WeakPolarHBondContact O-CA 3.35Å; V18-G68 PolarHBondContact N-O 3.02Å; V18-G68 PolarHBondContact O-N 3.1Å; V18-G68 VanDerWaalsContact O-N 3.12Å
19	E	93.4	Very high	73	Confident	97 Å²	97	81.3 Å²	81.3	45%	0.453	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.5	169.8	-173.4	174.9	135.8	0	0	109.5	K65 L66	E19-K65 HydrophobicContact CG-CD 4.39Å; E19-K65 HydrophobicContact CG-CG 4.26Å; E19-K65 VanDerWaalsContact OE1-CE 3.3Å; E19-K65 WeakPolarHBondContact OE1-CE 3.4Å; E19-K65 IonicContact OE1-NZ 2.63Å; E19-K65 PolarHBondContact OE1-NZ 3.15Å; E19-K65 WeakPolarHBondContact OE2-CE 3.09Å; E19-K65 IonicContact OE2-NZ 3.74Å; E19-K65 PolarHBondContact OE2-NZ 3.16Å; E19-L66 CarbonylContact C-O 3.33Å; E19-L66 WeakPolarHBondContact CA-O 3.49Å
20	D	94.1	Very high	75.6	Confident	50 Å²	50	80.3 Å²	80.3	27%	0.267	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	127.3	176.1	-165.4	0.5	0	0	0	111.4	L66 V73 K77	D20-L66 PolarHBondContact N-O 3.32Å; D20-L66 PolarHBondContact O-N 2.94Å; D20-V73 HydrophobicContact CB-CG1 3.59Å; D20-K77 IonicContact OD1-NZ 2.67Å; D20-K77 PolarHBondContact OD1-NZ 3.37Å; D20-K77 WeakPolarHBondContact OD2-CD 3.46Å; D20-K77 WeakPolarHBondContact OD2-CE 3.34Å; D20-K77 IonicContact OD2-NZ 3.7Å; D20-K77 PolarHBondContact OD2-NZ 2.99Å
21	E	93.4	Very high	78	Confident	97 Å²	97	73.2 Å²	73.2	45%	0.453	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	149.4	-177.2	-61.9	-164.4	136.8	0	0	112.1	W63 L64 K65 K77	E21-W63 HydrophobicContact CB-CE3 4.34Å; E21-L64 CarbonylContact C-O 3.57Å; E21-L64 VanDerWaalsContact CA-O 3.28Å; E21-L64 WeakPolarHBondContact CA-O 3.28Å; E21-K65 HydrophobicContact CG-CB 4.18Å; E21-K65 HydrophobicContact CG-CG 4.35Å; E21-K77 PolarHBondContact O-NZ 2.97Å
22	F	92.4	Very high	80.6	Confident	17 Å²	17	69.6 Å²	69.6	8%	0.075	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	148.9	173.8	61.1	-69.7	0	0	0	112.4	L64 L66 K77 V80 K81	F22-L64 HydrophobicContact CD1-CB 4.29Å; F22-L64 HydrophobicContact CD2-CD1 4.48Å; F22-L64 HydrophobicContact CE1-CB 3.95Å; F22-L64 HydrophobicContact CE2-CB 4.4Å; F22-L64 HydrophobicContact CE2-CD1 3.78Å; F22-L64 HydrophobicContact CZ-CB 4.03Å; F22-L64 HydrophobicContact CZ-CD1 3.83Å; F22-L64 PolarHBondContact N-O 2.91Å; F22-L64 PolarHBondContact O-N 2.83Å; F22-L66 HydrophobicContact CE1-CD1 3.77Å; F22-L66 HydrophobicContact CE1-CG 4.32Å; F22-L66 HydrophobicContact CZ-CD1 4.36Å; F22-K77 HydrophobicContact CD1-CD 3.86Å; F22-K77 HydrophobicContact CD1-CG 3.97Å; F22-K77 HydrophobicContact CE1-CB 4.45Å; F22-K77 HydrophobicContact CE1-CD 4.16Å; F22-K77 HydrophobicContact CE1-CG 3.83Å; F22-K77 HydrophobicContact CG-CD 4.41Å; F22-K77 HydrophobicContact CG-CG 4.44Å; F22-K77 HydrophobicContact CZ-CG 4.15Å; F22-V80 HydrophobicContact CE2-CG1 4.04Å; F22-V80 HydrophobicContact CZ-CB 4.04Å; F22-V80 HydrophobicContact CZ-CG1 3.73Å; F22-K81 HydrophobicContact CD2-CG 4.33Å; F22-K81 HydrophobicContact CE2-CG 4.06Å
23	A	89.8	Confident	83.2	Confident	40 Å²	40	69.6 Å²	69.6	33%	0.331	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	149.5	177.1	0	0	0	0	0	112.6	I62 W63	A23-I62 CarbonylContact C-O 3.49Å; A23-I62 WeakPolarHBondContact CA-O 3.42Å; A23-W63 HydrophobicContact CB-CD2 4.25Å; A23-W63 HydrophobicContact CB-CE3 4.36Å; A23-W63 HydrophobicContact CB-CZ2 4.4Å; A23-W63 HydrophobicContact CB-CZ3 4.49Å
24	C	88.4	Confident	85.3	Confident	12 Å²	12	66.1 Å²	66.1	8%	0.081	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	174.6	168.4	72.8	0	0	0	0	110.7	G26 L32 Q61 I62 L64 V84	C24-G26 PolarHBondContact O-N 3.27Å; C24-L32 VanDerWaalsContact SG-CD1 3.56Å; C24-Q61 CarbonylContact O-C 3.56Å; C24-Q61 WeakPolarHBondContact O-CA 3.22Å; C24-Q61 WeakPolarHBondContact O-CB 3.38Å; C24-I62 PolarHBondContact N-O 3.06Å; C24-I62 PolarHBondContact O-N 3.47Å; C24-I62 VanDerWaalsContact SG-CG1 3.51Å; C24-L64 HydrophobicContact CB-CD1 4.37Å; C24-V84 HydrophobicContact CB-CB 4.43Å; C24-V84 HydrophobicContact CB-CG1 4.29Å; C24-V84 HydrophobicContact CB-CG2 4.22Å
25	A	86.4	Confident	87.2	Confident	40 Å²	40	63.1 Å²	63.1	33%	0.331	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	125.6	-179.7	0	0	0	0	0	111.9	M27 L28	A25-M27 PolarHBondContact O-N 3.19Å; A25-M27 VanDerWaalsContact O-N 3.1Å; A25-L28 HydrophobicContact CB-CD1 4.31Å; A25-L28 HydrophobicContact CB-CG 4.43Å; A25-L28 WeakPolarHBondContact O-CB 3.44Å; A25-L28 PolarHBondContact O-N 2.99Å
26	G	83.8	Confident	88.7	Confident	22 Å²	22	59.7 Å²	59.7	23%	0.227	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-62.6	-20.8	-174.9	0	0	0	0	0	115	C24 L28 R29 G60	C24-G26 PolarHBondContact O-N 3.27Å; G26-L28 PolarHBondContact O-N 3.23Å; G26-R29 VanDerWaalsContact O-CB 3.3Å; G26-R29 WeakPolarHBondContact O-CB 2.77Å; G26-R29 PolarHBondContact O-N 3.23Å; G26-G60 PolarHBondContact N-O 3.39Å
27	M	84.9	Confident	89.5	Confident	177 Å²	177	58.9 Å²	58.9	87%	0.872	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-61.1	-24.1	171.9	-57.4	-168.5	-55.8	0	0	112.9	A25 R29	A25-M27 PolarHBondContact O-N 3.19Å; A25-M27 VanDerWaalsContact O-N 3.1Å; M27-R29 VanDerWaalsContact C-N 3.29Å; M27-R29 PolarHBondContact O-N 3.15Å
28	L	85.9	Confident	89.8	Confident	55 Å²	55	54.4 Å²	54.4	29%	0.288	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-84.4	-0.5	-179.2	-56.5	176	0	0	0	113.2	A25 G26 G30 S31 L32 V84	A25-L28 HydrophobicContact CB-CD1 4.31Å; A25-L28 HydrophobicContact CB-CG 4.43Å; A25-L28 WeakPolarHBondContact O-CB 3.44Å; A25-L28 PolarHBondContact O-N 2.99Å; G26-L28 PolarHBondContact O-N 3.23Å; L28-G30 VanDerWaalsContact C-N 3.29Å; L28-G30 PolarHBondContact O-N 3.25Å; L28-S31 PolarHBondContact O-N 3.12Å; L28-S31 VanDerWaalsContact O-N 3.17Å; L28-L32 HydrophobicContact CB-CD1 4.18Å; L28-L32 WeakPolarHBondContact O-CG 2.95Å; L28-L32 PolarHBondContact O-N 3.4Å; L28-V84 HydrophobicContact CD1-CB 3.57Å; L28-V84 HydrophobicContact CD1-CG1 3.83Å
29	R	86.1	Confident	90	Very high	79 Å²	79	52.1 Å²	52.1	30%	0.298	31%	0.308	S	S	.	.	H	α-helix	trans	-53.8	-43.3	-176.7	-163.6	178.2	-170.1	-177.7	6.8	112.7	G26 M27 S31 L32 T33 I49 G50 D52 I62	G26-R29 VanDerWaalsContact O-CB 3.3Å; G26-R29 WeakPolarHBondContact O-CB 2.77Å; G26-R29 PolarHBondContact O-N 3.23Å; M27-R29 VanDerWaalsContact C-N 3.29Å; M27-R29 PolarHBondContact O-N 3.15Å; R29-S31 PolarHBondContact O-N 3.43Å; R29-L32 PolarHBondContact O-N 3.29Å; R29-T33 WeakPolarHBondContact O-CB 3.34Å; R29-T33 PolarHBondContact O-N 3.24Å; R29-T33 PolarHBondContact O-OG1 3Å; R29-I49 HydrophobicContact CG-CG2 4.05Å; R29-G50 PolarHBondContact NH2-O 2.95Å; R29-D52 IonicContact CZ-OD2 3.34Å; R29-D52 IonicContact NH1-OD2 2.86Å; R29-D52 PolarHBondContact NH1-OD2 3.35Å; R29-D52 IonicContact NH2-OD2 3.98Å; R29-I62 HydrophobicContact CB-CD1 3.79Å; R29-I62 HydrophobicContact CG-CD1 3.92Å
30	G	86.1	Confident	90.1	Very high	54 Å²	54	50.2 Å²	50.2	56%	0.557	30%	0.299	S	S	*	.	H	α-helix	trans	-59.1	-48.2	178.9	0	0	0	0	0	112.7	L28 L32 T33 S34	L28-G30 VanDerWaalsContact C-N 3.29Å; L28-G30 PolarHBondContact O-N 3.25Å; G30-L32 VanDerWaalsContact C-N 3.33Å; G30-L32 PolarHBondContact O-N 3.39Å; G30-T33 PolarHBondContact O-N 3.02Å; G30-S34 PolarHBondContact O-N 3.23Å
31	S	87	Confident	90.1	Very high	53 Å²	53	53.8 Å²	53.8	37%	0.371	31%	0.309	S	S	.	.	H	α-helix	trans	-63.8	-37.9	176.5	-45.8	0	0	0	0	112.3	L28 R29 S34 L35	L28-S31 PolarHBondContact O-N 3.12Å; L28-S31 VanDerWaalsContact O-N 3.17Å; R29-S31 PolarHBondContact O-N 3.43Å; S31-S34 PolarHBondContact O-N 2.88Å; S31-S34 PolarHBondContact O-OG 2.87Å; S31-L35 WeakPolarHBondContact O-CB 3.24Å; S31-L35 PolarHBondContact O-N 3.07Å
32	L	90.4	Very high	90.2	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-71.5	-35.2	177.4	-69.2	165.2	0	0	0	112.2	C24 L28 R29 G30 L35 H36 F47 I49 I62 L64 V80 V84	C24-L32 VanDerWaalsContact SG-CD1 3.56Å; L28-L32 HydrophobicContact CB-CD1 4.18Å; L28-L32 WeakPolarHBondContact O-CG 2.95Å; L28-L32 PolarHBondContact O-N 3.4Å; R29-L32 PolarHBondContact O-N 3.29Å; G30-L32 VanDerWaalsContact C-N 3.33Å; G30-L32 PolarHBondContact O-N 3.39Å; L32-L35 PolarHBondContact O-N 3.31Å; L32-H36 PolarHBondContact O-N 3.07Å; L32-F47 HydrophobicContact CD2-CZ 4.29Å; L32-I49 HydrophobicContact CB-CD1 3.98Å; L32-I62 HydrophobicContact CD1-CD1 4.16Å; L32-L64 HydrophobicContact CD1-CD1 4Å; L32-L64 HydrophobicContact CD1-CD2 4.2Å; L32-L64 HydrophobicContact CD2-CD1 4.43Å; L32-V80 HydrophobicContact CD2-CG1 3.76Å; L32-V84 HydrophobicContact CD1-CG1 3.95Å; L32-V84 HydrophobicContact CD2-CG1 3.79Å; L32-V84 HydrophobicContact CG-CG1 4.2Å
33	T	91.1	Very high	90.4	Very high	81 Å²	81	48.4 Å²	48.4	50%	0.497	28%	0.284	S	S	.	.	H	α-helix	trans	-66.5	-38.2	172.8	-59	0	0	0	0	111.7	R29 G30 L35 H36	R29-T33 WeakPolarHBondContact O-CB 3.34Å; R29-T33 PolarHBondContact O-N 3.24Å; R29-T33 PolarHBondContact O-OG1 3Å; G30-T33 PolarHBondContact O-N 3.02Å; T33-L35 VanDerWaalsContact C-N 3.34Å; T33-H36 VanDerWaalsContact O-CB 3.29Å; T33-H36 WeakPolarHBondContact O-CB 3.28Å; T33-H36 PolarHBondContact O-N 3.26Å
34	S	90	Very high	90.6	Very high	47 Å²	47	51.5 Å²	51.5	33%	0.329	29%	0.287	S	S	.	.	H	α-helix	trans	-70.4	-29.9	173.3	66.5	0	0	0	0	113	G30 S31	G30-S34 PolarHBondContact O-N 3.23Å; S31-S34 PolarHBondContact O-N 2.88Å; S31-S34 PolarHBondContact O-OG 2.87Å
35	L	90.7	Very high	90.9	Very high	5 Å²	5	51.3 Å²	51.3	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-77.8	-16.4	176.1	-160.3	71.9	0	0	0	113.6	S31 L32 T33 S37 T38 V39 F79 V83	S31-L35 WeakPolarHBondContact O-CB 3.24Å; S31-L35 PolarHBondContact O-N 3.07Å; L32-L35 PolarHBondContact O-N 3.31Å; T33-L35 VanDerWaalsContact C-N 3.34Å; L35-S37 PolarHBondContact O-N 2.98Å; L35-T38 HydrophobicContact CD1-CG2 4.48Å; L35-T38 WeakPolarHBondContact O-CA 3.33Å; L35-T38 VanDerWaalsContact O-CB 3.32Å; L35-T38 WeakPolarHBondContact O-CB 3.32Å; L35-T38 PolarHBondContact O-N 3.47Å; L35-V39 HydrophobicContact CD2-CG2 3.98Å; L35-V39 HydrophobicContact CG-CG2 3.94Å; L35-V39 PolarHBondContact O-N 3.1Å; L35-F79 HydrophobicContact CD1-CE1 4.2Å; L35-F79 HydrophobicContact CD1-CZ 4.25Å; L35-F79 HydrophobicContact CD2-CE1 3.78Å; L35-F79 HydrophobicContact CD2-CZ 4.45Å; L35-F79 HydrophobicContact CG-CE1 4.14Å; L35-V83 HydrophobicContact CD2-CB 4.26Å; L35-V83 HydrophobicContact CD2-CG1 4.11Å; L35-V83 HydrophobicContact CD2-CG2 4.06Å
36	H	93.4	Very high	91.4	Very high	61 Å²	61	53.1 Å²	53.1	28%	0.282	29%	0.292	S	S	.	.	H	α-helix	trans	-50.5	-56.5	-169	-171.9	-49.7	0	0	0	113.5	L32 T33 T38 V39 E40 F47	L32-H36 PolarHBondContact O-N 3.07Å; T33-H36 VanDerWaalsContact O-CB 3.29Å; T33-H36 WeakPolarHBondContact O-CB 3.28Å; T33-H36 PolarHBondContact O-N 3.26Å; H36-T38 PolarHBondContact O-N 3Å; H36-V39 PolarHBondContact O-N 3.46Å; H36-E40 IonicContact CE1-OE1 2.74Å; H36-E40 PolarHBondContact CE1-OE1 3.28Å; H36-E40 IonicContact CE1-OE2 3.35Å; H36-E40 PolarHBondContact CE1-OE2 3.3Å; H36-E40 VanDerWaalsContact ND1-CD 3.29Å; H36-E40 IonicContact ND1-OE1 2.96Å; H36-E40 IonicContact ND1-OE2 3.09Å; H36-E40 PolarHBondContact ND1-OE2 3.38Å; H36-E40 WeakPolarHBondContact O-CG 3.34Å; H36-E40 PolarHBondContact O-N 3.22Å; H36-E40 VanDerWaalsContact O-N 3.14Å; H36-F47 HydrophobicContact CB-CD1 4.21Å; H36-F47 PolarHBondContact CE1-O 3.36Å; H36-F47 AromaticContact CG-CD1 4Å; H36-F47 PolarHBondContact NE2-O 3.17Å
37	S	93.2	Very high	92	Very high	78 Å²	78	52.1 Å²	52.1	55%	0.545	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-25	178.7	57.3	0	0	0	0	113.1	L35 R41	L35-S37 PolarHBondContact O-N 2.98Å; S37-R41 WeakPolarHBondContact O-CB 3.47Å; S37-R41 PolarHBondContact O-N 3.47Å
38	T	93.5	Very high	92.3	Very high	29 Å²	29	45.2 Å²	45.2	18%	0.178	26%	0.256	C	S	.	.	H	α-helix	trans	-79	-41.2	176.5	-65.6	0	0	0	0	111.6	L35 H36 I42	L35-T38 HydrophobicContact CD1-CG2 4.48Å; L35-T38 WeakPolarHBondContact O-CA 3.33Å; L35-T38 VanDerWaalsContact O-CB 3.32Å; L35-T38 WeakPolarHBondContact O-CB 3.32Å; L35-T38 PolarHBondContact O-N 3.47Å; H36-T38 PolarHBondContact O-N 3Å; T38-I42 HydrophobicContact CG2-CD1 3.57Å; T38-I42 HydrophobicContact CG2-CG1 4.24Å; T38-I42 WeakPolarHBondContact O-CB 3.36Å; T38-I42 VanDerWaalsContact O-CG1 3.32Å; T38-I42 WeakPolarHBondContact O-CG1 3.47Å; T38-I42 PolarHBondContact O-N 2.82Å
39	V	95.4	Very high	92.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-59.8	-52.2	174.8	179.8	0	0	0	0	110.3	L35 H36 R41 F43 V45 F47 L66 A76 F79 V80	L35-V39 HydrophobicContact CD2-CG2 3.98Å; L35-V39 HydrophobicContact CG-CG2 3.94Å; L35-V39 PolarHBondContact O-N 3.1Å; H36-V39 PolarHBondContact O-N 3.46Å; V39-R41 PolarHBondContact O-N 3.5Å; V39-F43 HydrophobicContact CG1-CD2 4.33Å; V39-F43 WeakPolarHBondContact O-CB 3.23Å; V39-F43 WeakPolarHBondContact O-CD2 3.38Å; V39-F43 PolarHBondContact O-N 3.26Å; V39-V45 HydrophobicContact CG1-CG2 4Å; V39-F47 HydrophobicContact CB-CB 4.48Å; V39-F47 HydrophobicContact CB-CD1 4.3Å; V39-F47 HydrophobicContact CB-CG 4.38Å; V39-F47 HydrophobicContact CG1-CB 4.19Å; V39-F47 HydrophobicContact CG1-CD2 4.46Å; V39-F47 HydrophobicContact CG1-CG 4.16Å; V39-F47 HydrophobicContact CG2-CD1 4.38Å; V39-F47 HydrophobicContact CG2-CE1 4.44Å; V39-L66 HydrophobicContact CG1-CD2 4.15Å; V39-A76 HydrophobicContact CG1-CB 4.16Å; V39-F79 HydrophobicContact CG2-CD1 4.27Å; V39-F79 HydrophobicContact CG2-CE1 4.1Å; V39-V80 HydrophobicContact CG1-CG2 4.13Å; V39-V80 HydrophobicContact CG2-CG2 3.71Å
40	E	95.4	Very high	92.4	Very high	56 Å²	56	41.7 Å²	41.7	26%	0.262	25%	0.249	S	C	.	.	H	α-helix	trans	-64.9	-42.3	-175.7	-61.3	-176.7	129.8	0	0	112	H36 R44 V45 F47	H36-E40 IonicContact CE1-OE1 2.74Å; H36-E40 PolarHBondContact CE1-OE1 3.28Å; H36-E40 IonicContact CE1-OE2 3.35Å; H36-E40 PolarHBondContact CE1-OE2 3.3Å; H36-E40 VanDerWaalsContact ND1-CD 3.29Å; H36-E40 IonicContact ND1-OE1 2.96Å; H36-E40 IonicContact ND1-OE2 3.09Å; H36-E40 PolarHBondContact ND1-OE2 3.38Å; H36-E40 WeakPolarHBondContact O-CG 3.34Å; H36-E40 PolarHBondContact O-N 3.22Å; H36-E40 VanDerWaalsContact O-N 3.14Å; E40-R44 WeakPolarHBondContact O-CA 3.4Å; E40-R44 PolarHBondContact O-N 2.97Å; E40-V45 VanDerWaalsContact CA-O 3.26Å; E40-V45 WeakPolarHBondContact CA-O 3.27Å; E40-V45 VanDerWaalsContact CB-O 3.25Å; E40-V45 WeakPolarHBondContact CB-O 3.47Å; E40-V45 VanDerWaalsContact CG-O 3.28Å; E40-V45 WeakPolarHBondContact CG-O 3.35Å; E40-F47 HydrophobicContact CG-CB 3.72Å; E40-F47 PolarHBondContact OE1-N 3.21Å
41	R	94.8	Very high	91.5	Very high	126 Å²	126	42 Å²	42	48%	0.475	25%	0.247	S	C	.	.	H	α-helix	trans	-68.3	-43.2	-179.8	-176.7	-175.2	67.4	74.1	5.4	113.6	S37 V39 D111	S37-R41 WeakPolarHBondContact O-CB 3.47Å; S37-R41 PolarHBondContact O-N 3.47Å; V39-R41 PolarHBondContact O-N 3.5Å; R41-D111 IonicContact CZ-OD1 3.38Å; R41-D111 IonicContact CZ-OD2 2.63Å; R41-D111 IonicContact NH1-OD1 2.83Å; R41-D111 PolarHBondContact NH1-OD1 2.79Å; R41-D111 VanDerWaalsContact NH1-OD1 3.09Å; R41-D111 IonicContact NH1-OD2 3.92Å; R41-D111 PolarHBondContact NH1-OD2 2.91Å; R41-D111 IonicContact NH2-OD1 3.9Å; R41-D111 PolarHBondContact NH2-OD1 2.68Å; R41-D111 IonicContact NH2-OD2 2.9Å
42	I	95.7	Very high	90.1	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-76.9	-46.5	-178.9	-66.1	-178.9	0	0	0	110.7	T38 D111 I114 K115	T38-I42 HydrophobicContact CG2-CD1 3.57Å; T38-I42 HydrophobicContact CG2-CG1 4.24Å; T38-I42 WeakPolarHBondContact O-CB 3.36Å; T38-I42 VanDerWaalsContact O-CG1 3.32Å; T38-I42 WeakPolarHBondContact O-CG1 3.47Å; T38-I42 PolarHBondContact O-N 2.82Å; I42-D111 HydrophobicContact CD1-CB 4.45Å; I42-D111 WeakPolarHBondContact CD1-OD1 3.35Å; I42-D111 HydrophobicContact CG1-CB 4.12Å; I42-D111 WeakPolarHBondContact CG1-OD1 3.27Å; I42-I114 HydrophobicContact CD1-CB 4.28Å; I42-I114 HydrophobicContact CD1-CD1 4.22Å; I42-I114 HydrophobicContact CD1-CG2 3.89Å; I42-I114 HydrophobicContact CG2-CB 4.47Å; I42-I114 HydrophobicContact CG2-CG2 4.11Å; I42-K115 HydrophobicContact CG2-CB 3.78Å; I42-K115 HydrophobicContact CG2-CG 4.2Å; I42-K115 WeakPolarHBondContact O-CD 3.39Å
43	F	96	Very high	88.1	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-89.7	-14	-172.9	-63.7	-83.9	0	0	0	113.6	V39 V45 D72 A75 A76 F79 I114 K115	V39-F43 HydrophobicContact CG1-CD2 4.33Å; V39-F43 WeakPolarHBondContact O-CB 3.23Å; V39-F43 WeakPolarHBondContact O-CD2 3.38Å; V39-F43 PolarHBondContact O-N 3.26Å; F43-V45 HydrophobicContact CB-CG1 4.21Å; F43-V45 HydrophobicContact CB-CG2 3.95Å; F43-D72 WeakPolarHBondContact O-CB 3.07Å; F43-A75 HydrophobicContact CD1-CB 3.69Å; F43-A75 HydrophobicContact CE1-CB 3.71Å; F43-A76 HydrophobicContact CB-CB 3.75Å; F43-A76 HydrophobicContact CD1-CB 4.14Å; F43-A76 HydrophobicContact CD2-CB 4.15Å; F43-A76 HydrophobicContact CG-CB 3.72Å; F43-F79 HydrophobicContact CD2-CD1 4.42Å; F43-F79 HydrophobicContact CE1-CB 4.31Å; F43-F79 HydrophobicContact CE2-CB 3.78Å; F43-F79 AromaticContact CE2-CD1 3.52Å; F43-F79 HydrophobicContact CE2-CD1 3.52Å; F43-F79 HydrophobicContact CE2-CD2 4.16Å; F43-F79 HydrophobicContact CE2-CE1 4.09Å; F43-F79 AromaticContact CE2-CG 3.56Å; F43-F79 HydrophobicContact CE2-CG 3.56Å; F43-F79 HydrophobicContact CZ-CB 3.48Å; F43-F79 VanDerWaalsContact CZ-CB 3.48Å; F43-F79 HydrophobicContact CZ-CD1 4.1Å; F43-F79 HydrophobicContact CZ-CD2 4.03Å; F43-F79 AromaticContact CZ-CG 3.62Å; F43-F79 HydrophobicContact CZ-CG 3.62Å; F43-I114 HydrophobicContact CE2-CG2 4.43Å; F43-I114 HydrophobicContact CZ-CG2 4.22Å; F43-K115 HydrophobicContact CD1-CG 3.78Å; F43-K115 HydrophobicContact CE1-CB 4.42Å; F43-K115 HydrophobicContact CE1-CG 3.95Å
44	R	94.5	Very high	86	Confident	104 Å²	104	54.7 Å²	54.7	39%	0.392	31%	0.306	S	S	.	.			trans	59.7	44.4	-174.8	-58.3	-173.2	175.8	-172	-0.2	112.7	E40 G211 L212 S214	E40-R44 WeakPolarHBondContact O-CA 3.4Å; E40-R44 PolarHBondContact O-N 2.97Å; R44-G211 PolarHBondContact NH2-O 2.86Å; R44-L212 HydrophobicContact CG-CD2 4.41Å; R44-L212 PolarHBondContact NH2-O 2.83Å; R44-S214 PolarHBondContact NH1-O 3.18Å; R44-S214 PolarHBondContact NH2-O 3.46Å
45	V	95.5	Very high	84.1	Confident	9 Å²	9	57.9 Å²	57.9	6%	0.055	33%	0.326	C	S	.	.			trans	-121	160.6	177.9	-62.6	0	0	0	0	109.8	V39 E40 F43 L66 Q67 D72 V73 A76	V39-V45 HydrophobicContact CG1-CG2 4Å; E40-V45 VanDerWaalsContact CA-O 3.26Å; E40-V45 WeakPolarHBondContact CA-O 3.27Å; E40-V45 VanDerWaalsContact CB-O 3.25Å; E40-V45 WeakPolarHBondContact CB-O 3.47Å; E40-V45 VanDerWaalsContact CG-O 3.28Å; E40-V45 WeakPolarHBondContact CG-O 3.35Å; F43-V45 HydrophobicContact CB-CG1 4.21Å; F43-V45 HydrophobicContact CB-CG2 3.95Å; V45-L66 HydrophobicContact CB-CD2 4.42Å; V45-L66 HydrophobicContact CG2-CD2 3.78Å; V45-Q67 CarbonylContact C-O 3.59Å; V45-Q67 VanDerWaalsContact CA-O 3.3Å; V45-Q67 WeakPolarHBondContact CA-O 3.22Å; V45-Q67 WeakPolarHBondContact CB-O 3.13Å; V45-D72 HydrophobicContact CG1-CB 4.01Å; V45-V73 HydrophobicContact CG1-CG2 3.94Å; V45-A76 HydrophobicContact CG1-CB 4.33Å; V45-A76 HydrophobicContact CG2-CB 3.95Å
46	T	95.6	Very high	82	Confident	77 Å²	77	65.1 Å²	65.1	47%	0.472	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	136.6	161.8	-53.9	0	0	0	0	108.7	L66 Q67	T46-L66 WeakPolarHBondContact O-CA 3.39Å; T46-Q67 PolarHBondContact N-O 2.86Å; T46-Q67 PolarHBondContact O-N 2.78Å; T46-Q67 VanDerWaalsContact O-N 3.07Å
47	F	95.9	Very high	79.5	Confident	1 Å²	1	65.2 Å²	65.2	0%	0.004	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	92.5	-176.3	178.2	-124.4	0	0	0	112.5	L32 H36 V39 E40 I49 L64 K65 L66 V80	L32-F47 HydrophobicContact CD2-CZ 4.29Å; H36-F47 HydrophobicContact CB-CD1 4.21Å; H36-F47 PolarHBondContact CE1-O 3.36Å; H36-F47 AromaticContact CG-CD1 4Å; H36-F47 PolarHBondContact NE2-O 3.17Å; V39-F47 HydrophobicContact CB-CB 4.48Å; V39-F47 HydrophobicContact CB-CD1 4.3Å; V39-F47 HydrophobicContact CB-CG 4.38Å; V39-F47 HydrophobicContact CG1-CB 4.19Å; V39-F47 HydrophobicContact CG1-CD2 4.46Å; V39-F47 HydrophobicContact CG1-CG 4.16Å; V39-F47 HydrophobicContact CG2-CD1 4.38Å; V39-F47 HydrophobicContact CG2-CE1 4.44Å; E40-F47 HydrophobicContact CG-CB 3.72Å; E40-F47 PolarHBondContact OE1-N 3.21Å; F47-I49 HydrophobicContact CD1-CG1 4.3Å; F47-I49 HydrophobicContact CE1-CD1 3.87Å; F47-I49 HydrophobicContact CE1-CG1 3.8Å; F47-I49 HydrophobicContact CZ-CD1 4.4Å; F47-I49 HydrophobicContact CZ-CG1 4.04Å; F47-L64 HydrophobicContact CE2-CB 4.15Å; F47-L64 HydrophobicContact CE2-CD1 4.21Å; F47-L64 HydrophobicContact CE2-CD2 4.25Å; F47-L64 HydrophobicContact CE2-CG 4.45Å; F47-L64 HydrophobicContact CZ-CD1 4.24Å; F47-L64 HydrophobicContact CZ-CD2 4.1Å; F47-K65 CarbonylContact C-O 3.57Å; F47-L66 HydrophobicContact CB-CD2 4.14Å; F47-L66 HydrophobicContact CD2-CD2 3.55Å; F47-L66 HydrophobicContact CD2-CG 4.15Å; F47-L66 HydrophobicContact CE2-CD2 4.42Å; F47-L66 HydrophobicContact CG-CD2 4.24Å; F47-V80 HydrophobicContact CE2-CG1 4.32Å; F47-V80 HydrophobicContact CE2-CG2 4.26Å; F47-V80 HydrophobicContact CZ-CG1 4.26Å; F47-V80 HydrophobicContact CZ-CG2 4.35Å
48	G	91.9	Very high	77.3	Confident	32 Å²	32	68 Å²	68	33%	0.33	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	128.3	175.8	0	0	0	0	0	112.6	L64 K65	G48-L64 WeakPolarHBondContact O-CA 3.4Å; G48-K65 PolarHBondContact N-O 3.31Å; G48-K65 PolarHBondContact O-N 2.94Å
49	I	91.2	Very high	75.4	Confident	34 Å²	34	72.9 Å²	72.9	17%	0.174	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.4	167.3	-53.9	177.1	0	0	0	108	R29 L32 F47 I62 L64	R29-I49 HydrophobicContact CG-CG2 4.05Å; L32-I49 HydrophobicContact CB-CD1 3.98Å; F47-I49 HydrophobicContact CD1-CG1 4.3Å; F47-I49 HydrophobicContact CE1-CD1 3.87Å; F47-I49 HydrophobicContact CE1-CG1 3.8Å; F47-I49 HydrophobicContact CZ-CD1 4.4Å; F47-I49 HydrophobicContact CZ-CG1 4.04Å; I49-I62 HydrophobicContact CG2-CD1 4.13Å; I49-L64 HydrophobicContact CB-CD2 4.26Å; I49-L64 HydrophobicContact CG1-CD2 4.04Å; I49-L64 HydrophobicContact CG2-CD2 3.98Å
50	G	82.4	Confident	74.4	Confident	27 Å²	27	75.8 Å²	75.8	28%	0.278	45%	0.446	S	S	.	.			trans	-57.9	149.9	-176.4	0	0	0	0	0	114.4	R29 W63	R29-G50 PolarHBondContact NH2-O 2.95Å; G50-W63 PolarHBondContact N-O 3.45Å
51	A	68.4	Low	73.8	Confident	61 Å²	61	78.8 Å²	78.8	50%	0.504	46%	0.46	S	S	.	.			trans	-87.3	156.1	169.6	0	0	0	0	0	111.3	D53	A51-D53 WeakPolarHBondContact CB-OD2 3.34Å; A51-D53 PolarHBondContact O-N 2.67Å
52	D	58	Low	73.5	Confident	113 Å²	113	73.1 Å²	73.1	60%	0.604	44%	0.439	S	S	*	.			trans	-81.3	46.7	177.8	-53.2	-73.8	0	0	0	111.6	R29 L54	R29-D52 IonicContact CZ-OD2 3.34Å; R29-D52 IonicContact NH1-OD2 2.86Å; R29-D52 PolarHBondContact NH1-OD2 3.35Å; R29-D52 IonicContact NH2-OD2 3.98Å; D52-L54 PolarHBondContact O-N 3.07Å
53	D	48.5	Very low	73.2	Confident	143 Å²	143	80.5 Å²	80.5	77%	0.765	47%	0.467	S	S	*	.			trans	-78.4	45	-175.1	-71.9	-35.7	0	0	0	112.8	A51	A51-D53 WeakPolarHBondContact CB-OD2 3.34Å; A51-D53 PolarHBondContact O-N 2.67Å
54	L	46.7	Very low	73.1	Confident	144 Å²	144	80.5 Å²	80.5	75%	0.754	47%	0.467	S	S	*	.			trans	-151.9	109.4	163.8	-145.6	76.9	0	0	0	112.3	D52	D52-L54 PolarHBondContact O-N 3.07Å
55	P	49.4	Very low	73.1	Confident	114 Å²	114	78.8 Å²	78.8	74%	0.74	46%	0.462	S	S	*	.	S	Bend	trans	-70.4	134.9	167.5	29.2	-32.1	0	0	0	110.2
56	N	46.8	Very low	73.1	Confident	158 Å²	158	78.4 Å²	78.4	85%	0.845	46%	0.46	S	S	*	.	S	Bend	trans	79.5	96.8	-178.9	-52.6	3.9	0	0	0	115.6
57	G	40.9	Very low	73.1	Confident	62 Å²	62	77.6 Å²	77.6	64%	0.639	45%	0.45	S	S	*	.			trans	173.1	98.9	167.6	0	0	0	0	0	113.3	N59	G57-N59 PolarHBondContact O-N 3.24Å
58	N	47.1	Very low	73.1	Confident	138 Å²	138	77.8 Å²	77.8	74%	0.738	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	28	-168.2	-71.6	-9.8	0	0	0	116.9
59	N	54.3	Low	73.2	Confident	131 Å²	131	80.3 Å²	80.3	70%	0.701	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-20.5	-171.2	-69.7	-2.2	0	0	0	114.5	G57 Q61	G57-N59 PolarHBondContact O-N 3.24Å; N59-Q61 PolarHBondContact O-N 3.21Å; N59-Q61 VanDerWaalsContact O-N 3.12Å
60	G	72.8	Confident	73.3	Confident	60 Å²	60	80.5 Å²	80.5	62%	0.619	46%	0.463	S	S	*	.			trans	60	24.3	174.6	0	0	0	0	0	115.1	G26	G26-G60 PolarHBondContact N-O 3.39Å
61	Q	83.2	Confident	73.8	Confident	119 Å²	119	83.9 Å²	83.9	56%	0.556	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.4	-177.6	-74.8	174.1	-7.2	0	0	110.7	C24 N59	C24-Q61 CarbonylContact O-C 3.56Å; C24-Q61 WeakPolarHBondContact O-CA 3.22Å; C24-Q61 WeakPolarHBondContact O-CB 3.38Å; N59-Q61 PolarHBondContact O-N 3.21Å; N59-Q61 VanDerWaalsContact O-N 3.12Å
62	I	88.5	Confident	75	Confident	8 Å²	8	82 Å²	82	4%	0.041	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	146.2	170.6	59.5	-179.3	0	0	0	109.7	A23 C24 R29 L32 I49 L64	A23-I62 CarbonylContact C-O 3.49Å; A23-I62 WeakPolarHBondContact CA-O 3.42Å; C24-I62 PolarHBondContact N-O 3.06Å; C24-I62 PolarHBondContact O-N 3.47Å; C24-I62 VanDerWaalsContact SG-CG1 3.51Å; R29-I62 HydrophobicContact CB-CD1 3.79Å; R29-I62 HydrophobicContact CG-CD1 3.92Å; L32-I62 HydrophobicContact CD1-CD1 4.16Å; I49-I62 HydrophobicContact CG2-CD1 4.13Å; I62-L64 HydrophobicContact CD1-CD2 4.35Å
63	W	90	Very high	76.8	Confident	156 Å²	156	76.8 Å²	76.8	59%	0.591	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	139.4	172.3	-72.2	89.5	0	0	0	110.7	E21 A23 G50	E21-W63 HydrophobicContact CB-CE3 4.34Å; A23-W63 HydrophobicContact CB-CD2 4.25Å; A23-W63 HydrophobicContact CB-CE3 4.36Å; A23-W63 HydrophobicContact CB-CZ2 4.4Å; A23-W63 HydrophobicContact CB-CZ3 4.49Å; G50-W63 PolarHBondContact N-O 3.45Å
64	L	94	Very high	79	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	136.3	174.5	-56.8	-178.8	0	0	0	108.5	E21 F22 C24 L32 F47 G48 I49 I62 V80	E21-L64 CarbonylContact C-O 3.57Å; E21-L64 VanDerWaalsContact CA-O 3.28Å; E21-L64 WeakPolarHBondContact CA-O 3.28Å; F22-L64 HydrophobicContact CD1-CB 4.29Å; F22-L64 HydrophobicContact CD2-CD1 4.48Å; F22-L64 HydrophobicContact CE1-CB 3.95Å; F22-L64 HydrophobicContact CE2-CB 4.4Å; F22-L64 HydrophobicContact CE2-CD1 3.78Å; F22-L64 HydrophobicContact CZ-CB 4.03Å; F22-L64 HydrophobicContact CZ-CD1 3.83Å; F22-L64 PolarHBondContact N-O 2.91Å; F22-L64 PolarHBondContact O-N 2.83Å; C24-L64 HydrophobicContact CB-CD1 4.37Å; L32-L64 HydrophobicContact CD1-CD1 4Å; L32-L64 HydrophobicContact CD1-CD2 4.2Å; L32-L64 HydrophobicContact CD2-CD1 4.43Å; F47-L64 HydrophobicContact CE2-CB 4.15Å; F47-L64 HydrophobicContact CE2-CD1 4.21Å; F47-L64 HydrophobicContact CE2-CD2 4.25Å; F47-L64 HydrophobicContact CE2-CG 4.45Å; F47-L64 HydrophobicContact CZ-CD1 4.24Å; F47-L64 HydrophobicContact CZ-CD2 4.1Å; G48-L64 WeakPolarHBondContact O-CA 3.4Å; I49-L64 HydrophobicContact CB-CD2 4.26Å; I49-L64 HydrophobicContact CG1-CD2 4.04Å; I49-L64 HydrophobicContact CG2-CD2 3.98Å; I62-L64 HydrophobicContact CD1-CD2 4.35Å; L64-V80 HydrophobicContact CD1-CG1 3.74Å
65	K	94.4	Very high	81.4	Confident	68 Å²	68	69.6 Å²	69.6	30%	0.296	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.8	-178.1	168.7	168	171.1	146.9	0	109.4	E19 E21 F47 G48	E19-K65 HydrophobicContact CG-CD 4.39Å; E19-K65 HydrophobicContact CG-CG 4.26Å; E19-K65 VanDerWaalsContact OE1-CE 3.3Å; E19-K65 WeakPolarHBondContact OE1-CE 3.4Å; E19-K65 IonicContact OE1-NZ 2.63Å; E19-K65 PolarHBondContact OE1-NZ 3.15Å; E19-K65 WeakPolarHBondContact OE2-CE 3.09Å; E19-K65 IonicContact OE2-NZ 3.74Å; E19-K65 PolarHBondContact OE2-NZ 3.16Å; E21-K65 HydrophobicContact CG-CB 4.18Å; E21-K65 HydrophobicContact CG-CG 4.35Å; F47-K65 CarbonylContact C-O 3.57Å; G48-K65 PolarHBondContact N-O 3.31Å; G48-K65 PolarHBondContact O-N 2.94Å
66	L	96.3	Very high	83.6	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	134.2	174.3	-73.9	166.6	0	0	0	109.3	E19 D20 F22 V39 V45 T46 F47 V73 A76 K77	E19-L66 CarbonylContact C-O 3.33Å; E19-L66 WeakPolarHBondContact CA-O 3.49Å; D20-L66 PolarHBondContact N-O 3.32Å; D20-L66 PolarHBondContact O-N 2.94Å; F22-L66 HydrophobicContact CE1-CD1 3.77Å; F22-L66 HydrophobicContact CE1-CG 4.32Å; F22-L66 HydrophobicContact CZ-CD1 4.36Å; V39-L66 HydrophobicContact CG1-CD2 4.15Å; V45-L66 HydrophobicContact CB-CD2 4.42Å; V45-L66 HydrophobicContact CG2-CD2 3.78Å; T46-L66 WeakPolarHBondContact O-CA 3.39Å; F47-L66 HydrophobicContact CB-CD2 4.14Å; F47-L66 HydrophobicContact CD2-CD2 3.55Å; F47-L66 HydrophobicContact CD2-CG 4.15Å; F47-L66 HydrophobicContact CE2-CD2 4.42Å; F47-L66 HydrophobicContact CG-CD2 4.24Å; L66-V73 HydrophobicContact CB-CG1 3.93Å; L66-A76 HydrophobicContact CD1-CB 3.88Å; L66-A76 HydrophobicContact CD2-CB 3.88Å; L66-K77 HydrophobicContact CD1-CB 3.71Å; L66-K77 HydrophobicContact CD1-CG 4.47Å
67	Q	95.6	Very high	85.9	Confident	60 Å²	60	58.1 Å²	58.1	28%	0.28	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	134.1	178.4	-178.6	178.8	-14.5	0	0	110.2	E17 V18 V45 T46	E17-Q67 HydrophobicContact CG-CG 3.89Å; E17-Q67 PolarHBondContact OE2-NE2 3.11Å; V18-Q67 WeakPolarHBondContact O-CA 3.35Å; V45-Q67 CarbonylContact C-O 3.59Å; V45-Q67 VanDerWaalsContact CA-O 3.3Å; V45-Q67 WeakPolarHBondContact CA-O 3.22Å; V45-Q67 WeakPolarHBondContact CB-O 3.13Å; T46-Q67 PolarHBondContact N-O 2.86Å; T46-Q67 PolarHBondContact O-N 2.78Å; T46-Q67 VanDerWaalsContact O-N 3.07Å
68	G	94.6	Very high	88.6	Confident	6 Å²	6	58.6 Å²	58.6	6%	0.062	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.3	-159.3	-178.8	0	0	0	0	0	112.8	V18 V73	V18-G68 PolarHBondContact N-O 3.02Å; V18-G68 PolarHBondContact O-N 3.1Å; V18-G68 VanDerWaalsContact O-N 3.12Å; G68-V73 VanDerWaalsContact N-CG2 3.35Å
69	L	94.4	Very high	91	Very high	84 Å²	84	52.1 Å²	52.1	44%	0.44	28%	0.275	S	S	.	.			trans	-63.8	141.4	174.9	-67.3	174.4	0	0	0	111.2	D15 T71 D72 V73	D15-L69 HydrophobicContact CB-CD2 4.15Å; L69-T71 PolarHBondContact O-N 3.19Å; L69-T71 VanDerWaalsContact O-N 3.11Å; L69-D72 HydrophobicContact CB-CB 4.29Å; L69-D72 PolarHBondContact O-N 3.13Å; L69-V73 WeakPolarHBondContact O-CG2 3.33Å; L69-V73 PolarHBondContact O-N 3.1Å
70	S	93.1	Very high	92.9	Very high	39 Å²	39	45.9 Å²	45.9	27%	0.273	24%	0.241	S	C	.	.	H	α-helix	trans	-58.1	-31.7	-172.8	-163.4	0	0	0	0	114.5	K74	S70-K74 WeakPolarHBondContact O-CB 3.21Å; S70-K74 WeakPolarHBondContact O-CD 3.26Å; S70-K74 WeakPolarHBondContact O-CG 3.42Å; S70-K74 PolarHBondContact O-N 2.74Å; S70-K74 PolarHBondContact OG-NZ 3.14Å
71	T	92.9	Very high	93.9	Very high	98 Å²	98	47.1 Å²	47.1	60%	0.601	23%	0.229	S	C	*	.	H	α-helix	trans	-70.4	-44.3	174.6	46.9	0	0	0	0	112	L69 K74 A75	L69-T71 PolarHBondContact O-N 3.19Å; L69-T71 VanDerWaalsContact O-N 3.11Å; T71-K74 PolarHBondContact O-N 3.39Å; T71-A75 PolarHBondContact O-N 2.99Å
72	D	94.8	Very high	94.4	Very high	22 Å²	22	41.5 Å²	41.5	12%	0.118	20%	0.204	C	C	.	.	H	α-helix	trans	-72.7	-39.1	-175.6	-78.8	-5.4	0	0	0	111.4	F43 V45 L69 A75 A76 K115	F43-D72 WeakPolarHBondContact O-CB 3.07Å; V45-D72 HydrophobicContact CG1-CB 4.01Å; L69-D72 HydrophobicContact CB-CB 4.29Å; L69-D72 PolarHBondContact O-N 3.13Å; D72-A75 PolarHBondContact O-N 2.96Å; D72-A76 VanDerWaalsContact O-CB 3.29Å; D72-A76 WeakPolarHBondContact O-CB 3.19Å; D72-A76 PolarHBondContact O-N 3.49Å; D72-K115 WeakPolarHBondContact OD1-CE 3.44Å; D72-K115 IonicContact OD1-NZ 3.32Å; D72-K115 PolarHBondContact OD1-NZ 3.47Å; D72-K115 IonicContact OD2-NZ 3.26Å; D72-K115 PolarHBondContact OD2-NZ 3.46Å
73	V	95.5	Very high	94.5	Very high	2 Å²	2	43 Å²	43	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-61.9	-42.2	171.3	169.8	0	0	0	0	111.7	D20 V45 L66 G68 L69 K77	D20-V73 HydrophobicContact CB-CG1 3.59Å; V45-V73 HydrophobicContact CG1-CG2 3.94Å; L66-V73 HydrophobicContact CB-CG1 3.93Å; G68-V73 VanDerWaalsContact N-CG2 3.35Å; L69-V73 WeakPolarHBondContact O-CG2 3.33Å; L69-V73 PolarHBondContact O-N 3.1Å; V73-K77 VanDerWaalsContact O-CB 3.25Å; V73-K77 WeakPolarHBondContact O-CB 3.36Å; V73-K77 PolarHBondContact O-N 3.11Å
74	K	94.8	Very high	94.5	Very high	120 Å²	120	37.4 Å²	37.4	52%	0.522	20%	0.196	S	C	.	.	H	α-helix	trans	-63.9	-44	175.8	-75.4	165.6	-174	139.3	0	111.9	S70 T71 K77 L78	S70-K74 WeakPolarHBondContact O-CB 3.21Å; S70-K74 WeakPolarHBondContact O-CD 3.26Å; S70-K74 WeakPolarHBondContact O-CG 3.42Å; S70-K74 PolarHBondContact O-N 2.74Å; S70-K74 PolarHBondContact OG-NZ 3.14Å; T71-K74 PolarHBondContact O-N 3.39Å; K74-K77 PolarHBondContact O-N 2.98Å; K74-L78 WeakPolarHBondContact O-CG 3.49Å; K74-L78 PolarHBondContact O-N 3.02Å
75	A	95.4	Very high	94.2	Very high	16 Å²	16	41.8 Å²	41.8	13%	0.132	22%	0.22	C	C	.	.	H	α-helix	trans	-65.1	-46.9	177.6	0	0	0	0	0	111.8	F43 T71 D72 K77 L78 F79 S118	F43-A75 HydrophobicContact CD1-CB 3.69Å; F43-A75 HydrophobicContact CE1-CB 3.71Å; T71-A75 PolarHBondContact O-N 2.99Å; D72-A75 PolarHBondContact O-N 2.96Å; A75-K77 VanDerWaalsContact C-N 3.31Å; A75-K77 PolarHBondContact O-N 3.39Å; A75-L78 PolarHBondContact O-N 3.11Å; A75-F79 WeakPolarHBondContact O-CB 3.48Å; A75-F79 PolarHBondContact O-N 3.16Å; A75-S118 WeakPolarHBondContact CA-OG 3.34Å; A75-S118 PolarHBondContact O-OG 2.83Å
76	A	96.9	Very high	94	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.1	-41.9	174	0	0	0	0	0	112.1	V39 F43 V45 L66 D72 F79 V80	V39-A76 HydrophobicContact CG1-CB 4.16Å; F43-A76 HydrophobicContact CB-CB 3.75Å; F43-A76 HydrophobicContact CD1-CB 4.14Å; F43-A76 HydrophobicContact CD2-CB 4.15Å; F43-A76 HydrophobicContact CG-CB 3.72Å; V45-A76 HydrophobicContact CG1-CB 4.33Å; V45-A76 HydrophobicContact CG2-CB 3.95Å; L66-A76 HydrophobicContact CD1-CB 3.88Å; L66-A76 HydrophobicContact CD2-CB 3.88Å; D72-A76 VanDerWaalsContact O-CB 3.29Å; D72-A76 WeakPolarHBondContact O-CB 3.19Å; D72-A76 PolarHBondContact O-N 3.49Å; A76-F79 PolarHBondContact O-N 3.08Å; A76-V80 WeakPolarHBondContact O-CB 3.39Å; A76-V80 WeakPolarHBondContact O-CG2 3.45Å; A76-V80 PolarHBondContact O-N 3.24Å
77	K	95.5	Very high	93.8	Very high	31 Å²	31	47.7 Å²	47.7	14%	0.135	25%	0.248	C	C	.	.	H	α-helix	trans	-66.5	-37.7	177.9	-172.1	162.9	178.8	170.5	0	112.4	D20 E21 F22 L66 V73 K74 A75 K81	D20-K77 IonicContact OD1-NZ 2.67Å; D20-K77 PolarHBondContact OD1-NZ 3.37Å; D20-K77 WeakPolarHBondContact OD2-CD 3.46Å; D20-K77 WeakPolarHBondContact OD2-CE 3.34Å; D20-K77 IonicContact OD2-NZ 3.7Å; D20-K77 PolarHBondContact OD2-NZ 2.99Å; E21-K77 PolarHBondContact O-NZ 2.97Å; F22-K77 HydrophobicContact CD1-CD 3.86Å; F22-K77 HydrophobicContact CD1-CG 3.97Å; F22-K77 HydrophobicContact CE1-CB 4.45Å; F22-K77 HydrophobicContact CE1-CD 4.16Å; F22-K77 HydrophobicContact CE1-CG 3.83Å; F22-K77 HydrophobicContact CG-CD 4.41Å; F22-K77 HydrophobicContact CG-CG 4.44Å; F22-K77 HydrophobicContact CZ-CG 4.15Å; L66-K77 HydrophobicContact CD1-CB 3.71Å; L66-K77 HydrophobicContact CD1-CG 4.47Å; V73-K77 VanDerWaalsContact O-CB 3.25Å; V73-K77 WeakPolarHBondContact O-CB 3.36Å; V73-K77 PolarHBondContact O-N 3.11Å; K74-K77 PolarHBondContact O-N 2.98Å; A75-K77 VanDerWaalsContact C-N 3.31Å; A75-K77 PolarHBondContact O-N 3.39Å; K77-K81 HydrophobicContact CG-CD 4.34Å; K77-K81 WeakPolarHBondContact O-CB 3.41Å; K77-K81 WeakPolarHBondContact O-CG 3.44Å; K77-K81 PolarHBondContact O-N 3.46Å
78	L	96.3	Very high	93.7	Very high	73 Å²	73	47.1 Å²	47.1	38%	0.382	25%	0.249	S	C	.	.	H	α-helix	trans	-66	-44.4	173	-73.2	171.5	0	0	0	111.6	K74 A75 K81 G82 L134	K74-L78 WeakPolarHBondContact O-CG 3.49Å; K74-L78 PolarHBondContact O-N 3.02Å; A75-L78 PolarHBondContact O-N 3.11Å; L78-K81 PolarHBondContact O-N 3.11Å; L78-G82 PolarHBondContact O-N 2.92Å; L78-L134 HydrophobicContact CD2-CD1 3.93Å
79	F	97	Very high	93.7	Very high	2 Å²	2	52 Å²	52	1%	0.009	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-53.9	177.7	175	-102.1	0	0	0	112.1	L35 V39 F43 A75 A76 K81 G82 V83 I114 S118 L120	L35-F79 HydrophobicContact CD1-CE1 4.2Å; L35-F79 HydrophobicContact CD1-CZ 4.25Å; L35-F79 HydrophobicContact CD2-CE1 3.78Å; L35-F79 HydrophobicContact CD2-CZ 4.45Å; L35-F79 HydrophobicContact CG-CE1 4.14Å; V39-F79 HydrophobicContact CG2-CD1 4.27Å; V39-F79 HydrophobicContact CG2-CE1 4.1Å; F43-F79 HydrophobicContact CD2-CD1 4.42Å; F43-F79 HydrophobicContact CE1-CB 4.31Å; F43-F79 HydrophobicContact CE2-CB 3.78Å; F43-F79 AromaticContact CE2-CD1 3.52Å; F43-F79 HydrophobicContact CE2-CD1 3.52Å; F43-F79 HydrophobicContact CE2-CD2 4.16Å; F43-F79 HydrophobicContact CE2-CE1 4.09Å; F43-F79 AromaticContact CE2-CG 3.56Å; F43-F79 HydrophobicContact CE2-CG 3.56Å; F43-F79 HydrophobicContact CZ-CB 3.48Å; F43-F79 VanDerWaalsContact CZ-CB 3.48Å; F43-F79 HydrophobicContact CZ-CD1 4.1Å; F43-F79 HydrophobicContact CZ-CD2 4.03Å; F43-F79 AromaticContact CZ-CG 3.62Å; F43-F79 HydrophobicContact CZ-CG 3.62Å; A75-F79 WeakPolarHBondContact O-CB 3.48Å; A75-F79 PolarHBondContact O-N 3.16Å; A76-F79 PolarHBondContact O-N 3.08Å; F79-K81 VanDerWaalsContact C-N 3.29Å; F79-K81 PolarHBondContact O-N 3Å; F79-G82 WeakPolarHBondContact O-CA 3.47Å; F79-G82 PolarHBondContact O-N 3.39Å; F79-V83 HydrophobicContact CE1-CG2 4.5Å; F79-V83 HydrophobicContact CZ-CG2 4.38Å; F79-V83 PolarHBondContact O-N 2.82Å; F79-I114 HydrophobicContact CD2-CG2 3.9Å; F79-I114 HydrophobicContact CE2-CG2 3.54Å; F79-I114 HydrophobicContact CZ-CG2 4.2Å; F79-S118 WeakPolarHBondContact CA-O 3Å; F79-L120 HydrophobicContact CE2-CB 4.1Å; F79-L120 HydrophobicContact CE2-CD1 4.33Å; F79-L120 HydrophobicContact CZ-CD1 4.33Å
80	V	95.7	Very high	93.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.8	-38.6	178.7	174.9	0	0	0	0	111	F22 L32 V39 F47 L64 A76 G82 V83 V84	F22-V80 HydrophobicContact CE2-CG1 4.04Å; F22-V80 HydrophobicContact CZ-CB 4.04Å; F22-V80 HydrophobicContact CZ-CG1 3.73Å; L32-V80 HydrophobicContact CD2-CG1 3.76Å; V39-V80 HydrophobicContact CG1-CG2 4.13Å; V39-V80 HydrophobicContact CG2-CG2 3.71Å; F47-V80 HydrophobicContact CE2-CG1 4.32Å; F47-V80 HydrophobicContact CE2-CG2 4.26Å; F47-V80 HydrophobicContact CZ-CG1 4.26Å; F47-V80 HydrophobicContact CZ-CG2 4.35Å; L64-V80 HydrophobicContact CD1-CG1 3.74Å; A76-V80 WeakPolarHBondContact O-CB 3.39Å; A76-V80 WeakPolarHBondContact O-CG2 3.45Å; A76-V80 PolarHBondContact O-N 3.24Å; V80-G82 PolarHBondContact O-N 3.48Å; V80-V83 PolarHBondContact O-N 3.4Å; V80-V84 WeakPolarHBondContact O-CG2 3.47Å; V80-V84 PolarHBondContact O-N 3.26Å
81	K	93.8	Very high	93.7	Very high	85 Å²	85	55.5 Å²	55.5	37%	0.37	28%	0.28	S	S	.	.	H	α-helix	trans	-59.6	-42.9	171	-81.5	178.8	173.3	-169.1	0	112.7	F22 K77 L78 F79 V83 V84 N85 L134	F22-K81 HydrophobicContact CD2-CG 4.33Å; F22-K81 HydrophobicContact CE2-CG 4.06Å; K77-K81 HydrophobicContact CG-CD 4.34Å; K77-K81 WeakPolarHBondContact O-CB 3.41Å; K77-K81 WeakPolarHBondContact O-CG 3.44Å; K77-K81 PolarHBondContact O-N 3.46Å; L78-K81 PolarHBondContact O-N 3.11Å; F79-K81 VanDerWaalsContact C-N 3.29Å; F79-K81 PolarHBondContact O-N 3Å; K81-V83 VanDerWaalsContact C-N 3.3Å; K81-V83 PolarHBondContact O-N 3.2Å; K81-V84 WeakPolarHBondContact O-CG2 3.35Å; K81-V84 PolarHBondContact O-N 3.13Å; K81-N85 WeakPolarHBondContact O-CA 3.34Å; K81-N85 WeakPolarHBondContact O-CB 3.44Å; K81-N85 PolarHBondContact O-N 2.93Å; K81-L134 HydrophobicContact CB-CD1 3.97Å; K81-L134 HydrophobicContact CB-CD2 4.41Å; K81-L134 HydrophobicContact CB-CG 4.48Å
82	G	93.2	Very high	93.7	Very high	2 Å²	2	51.4 Å²	51.4	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-32	176.7	0	0	0	0	0	113.8	L78 F79 V80 N85 Q86	L78-G82 PolarHBondContact O-N 2.92Å; F79-G82 WeakPolarHBondContact O-CA 3.47Å; F79-G82 PolarHBondContact O-N 3.39Å; V80-G82 PolarHBondContact O-N 3.48Å; G82-N85 CarbonylContact O-C 3.52Å; G82-Q86 WeakPolarHBondContact O-CA 3.36Å; G82-Q86 PolarHBondContact O-N 3.33Å
83	V	91.3	Very high	93.7	Very high	40 Å²	40	54.1 Å²	54.1	24%	0.242	28%	0.275	C	S	.	.	H	α-helix	trans	-76.7	-36.4	175.8	-179.9	0	0	0	0	112.3	L35 F79 V80 K81 L120	L35-V83 HydrophobicContact CD2-CB 4.26Å; L35-V83 HydrophobicContact CD2-CG1 4.11Å; L35-V83 HydrophobicContact CD2-CG2 4.06Å; F79-V83 HydrophobicContact CE1-CG2 4.5Å; F79-V83 HydrophobicContact CZ-CG2 4.38Å; F79-V83 PolarHBondContact O-N 2.82Å; V80-V83 PolarHBondContact O-N 3.4Å; K81-V83 VanDerWaalsContact C-N 3.3Å; K81-V83 PolarHBondContact O-N 3.2Å; V83-L120 HydrophobicContact CG2-CB 4.14Å; V83-L120 HydrophobicContact CG2-CD2 4.1Å
84	V	89.3	Confident	93.6	Very high	38 Å²	38	54.6 Å²	54.6	23%	0.23	28%	0.277	C	S	.	.	H	α-helix	trans	-83.6	-22.9	177.3	-56.9	0	0	0	0	114.2	C24 L28 L32 V80 K81	C24-V84 HydrophobicContact CB-CB 4.43Å; C24-V84 HydrophobicContact CB-CG1 4.29Å; C24-V84 HydrophobicContact CB-CG2 4.22Å; L28-V84 HydrophobicContact CD1-CB 3.57Å; L28-V84 HydrophobicContact CD1-CG1 3.83Å; L32-V84 HydrophobicContact CD1-CG1 3.95Å; L32-V84 HydrophobicContact CD2-CG1 3.79Å; L32-V84 HydrophobicContact CG-CG1 4.2Å; V80-V84 WeakPolarHBondContact O-CG2 3.47Å; V80-V84 PolarHBondContact O-N 3.26Å; K81-V84 WeakPolarHBondContact O-CG2 3.35Å; K81-V84 PolarHBondContact O-N 3.13Å
85	N	88	Confident	93.6	Very high	92 Å²	92	50.4 Å²	50.4	49%	0.492	26%	0.262	S	S	.	.	S	Bend	trans	-138.6	80.3	179.8	-177.2	81.7	0	0	0	108.7	K81 G82 E87 L134	K81-N85 WeakPolarHBondContact O-CA 3.34Å; K81-N85 WeakPolarHBondContact O-CB 3.44Å; K81-N85 PolarHBondContact O-N 2.93Å; G82-N85 CarbonylContact O-C 3.52Å; N85-E87 WeakPolarHBondContact ND2-CG 3.38Å; N85-E87 PolarHBondContact O-N 3.31Å; N85-L134 WeakPolarHBondContact O-CD2 3.47Å
86	Q	89.9	Confident	93.4	Very high	80 Å²	80	52.3 Å²	52.3	37%	0.374	28%	0.283	S	S	.	.			trans	-76.5	105.8	-179.9	-171.3	-177.1	-7.4	0	0	110	G82 Q89 S132	G82-Q86 WeakPolarHBondContact O-CA 3.36Å; G82-Q86 PolarHBondContact O-N 3.33Å; Q86-Q89 VanDerWaalsContact NE2-CB 3.34Å; Q86-S132 VanDerWaalsContact NE2-CB 3.26Å
87	E	91.4	Very high	93.1	Very high	111 Å²	111	54.6 Å²	54.6	52%	0.519	30%	0.301	S	S	.	.			trans	-84.4	-34.8	-179.8	-61.5	174.4	163.8	0	0	111.8	N85 G133 L134 A135	N85-E87 WeakPolarHBondContact ND2-CG 3.38Å; N85-E87 PolarHBondContact O-N 3.31Å; E87-G133 PolarHBondContact N-O 2.94Å; E87-L134 HydrophobicContact CG-CD2 3.99Å; E87-L134 VanDerWaalsContact OE2-CA 3.29Å; E87-L134 WeakPolarHBondContact OE2-CA 3.32Å; E87-A135 PolarHBondContact OE2-N 2.86Å
88	V	93.6	Very high	93.1	Very high	49 Å²	49	53.1 Å²	53.1	30%	0.297	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	143	-177.2	-173	0	0	0	0	110.3	S132 G133 A135 V138	V88-S132 WeakPolarHBondContact O-CA 3.44Å; V88-G133 PolarHBondContact N-O 3.16Å; V88-G133 PolarHBondContact O-N 3.03Å; V88-G133 VanDerWaalsContact O-N 3.17Å; V88-A135 HydrophobicContact CG2-CB 3.8Å; V88-V138 HydrophobicContact CB-CB 4.2Å; V88-V138 HydrophobicContact CB-CG1 4.15Å; V88-V138 HydrophobicContact CB-CG2 4.2Å; V88-V138 HydrophobicContact CG1-CB 4.32Å; V88-V138 HydrophobicContact CG1-CG1 3.74Å
89	Q	94.6	Very high	93	Very high	109 Å²	109	51.5 Å²	51.5	51%	0.509	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	132.5	166.3	-165.3	171.2	-69.4	0	0	108.5	Q86 L130 V131	Q86-Q89 VanDerWaalsContact NE2-CB 3.34Å; Q89-L130 HydrophobicContact CG-CD1 3.69Å; Q89-L130 HydrophobicContact CG-CG 4.25Å; Q89-V131 WeakPolarHBondContact CA-O 3.4Å
90	Q	93.1	Very high	92.8	Very high	67 Å²	67	51.6 Å²	51.6	31%	0.313	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	131.4	179.3	-169.2	170.1	12.7	0	0	110.6	V131 V138 Y142	Q90-V131 PolarHBondContact N-O 3.24Å; Q90-V131 PolarHBondContact O-N 3.25Å; Q90-V138 HydrophobicContact CB-CG1 4.33Å; Q90-Y142 HydrophobicContact CG-CD2 4.33Å; Q90-Y142 VanDerWaalsContact NE2-CD2 3.32Å
91	E	94.6	Very high	92.8	Very high	129 Å²	129	51.7 Å²	51.7	60%	0.603	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	140.5	169.6	-173.9	169.3	-158.7	0	0	109.6	F128 L129	E91-F128 HydrophobicContact CG-CD1 4.12Å; E91-F128 WeakPolarHBondContact OE1-CD1 3.32Å; E91-L129 CarbonylContact C-O 3.53Å; E91-L129 WeakPolarHBondContact CA-O 3.39Å
92	L	93.5	Very high	92.8	Very high	11 Å²	11	48.1 Å²	48.1	6%	0.058	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	116.2	-173.4	-128.1	174.6	0	0	0	110.3	F128 L129 V131 Y142 I145	L92-F128 WeakPolarHBondContact O-CA 3.33Å; L92-L129 HydrophobicContact CB-CB 4.37Å; L92-L129 PolarHBondContact N-O 2.74Å; L92-L129 PolarHBondContact O-N 2.99Å; L92-V131 HydrophobicContact CD1-CG2 4.27Å; L92-Y142 HydrophobicContact CD1-CD2 3.37Å; L92-Y142 HydrophobicContact CD1-CE2 3.92Å; L92-Y142 HydrophobicContact CD1-CG 4.02Å; L92-Y142 HydrophobicContact CD2-CD2 4.23Å; L92-Y142 HydrophobicContact CD2-CE2 3.89Å; L92-Y142 HydrophobicContact CG-CD2 3.6Å; L92-Y142 HydrophobicContact CG-CE2 3.64Å; L92-I145 HydrophobicContact CD1-CB 3.85Å; L92-I145 HydrophobicContact CD1-CD1 3.76Å; L92-I145 HydrophobicContact CD1-CG1 4.43Å; L92-I145 HydrophobicContact CD1-CG2 3.84Å; L92-I145 HydrophobicContact CD2-CG2 4.2Å
93	S	94.2	Very high	92.8	Very high	80 Å²	80	50.4 Å²	50.4	56%	0.559	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	145.5	175.3	51.9	0	0	0	0	111.8	G127	S93-G127 CarbonylContact C-O 3.58Å; S93-G127 VanDerWaalsContact CA-O 3.28Å; S93-G127 WeakPolarHBondContact CA-O 3.21Å
94	Y	94.6	Very high	92.8	Very high	12 Å²	12	48.5 Å²	48.5	5%	0.047	28%	0.275	C	S	.	.			trans	-144	149.1	176.7	59.2	-93.3	0	0	0	111.7	G96 L98 H99 F102 G127 F128 L129	Y94-G96 PolarHBondContact O-N 3.26Å; Y94-L98 HydrophobicContact CD2-CB 4.15Å; Y94-H99 HydrophobicContact CE2-CB 3.9Å; Y94-H99 AromaticContact CZ-ND1 3.9Å; Y94-H99 PolarHBondContact OH-ND1 3.21Å; Y94-F102 HydrophobicContact CD1-CD2 4.24Å; Y94-F102 AromaticContact CD1-CE2 3.81Å; Y94-F102 HydrophobicContact CD1-CE2 3.81Å; Y94-F102 HydrophobicContact CD2-CD2 4.11Å; Y94-F102 AromaticContact CD2-CE2 3.75Å; Y94-F102 HydrophobicContact CD2-CE2 3.75Å; Y94-F102 AromaticContact CE1-CD2 3.89Å; Y94-F102 HydrophobicContact CE1-CD2 3.89Å; Y94-F102 AromaticContact CE1-CE2 3.95Å; Y94-F102 HydrophobicContact CE1-CE2 3.95Å; Y94-F102 AromaticContact CE2-CD2 3.77Å; Y94-F102 HydrophobicContact CE2-CD2 3.77Å; Y94-F102 AromaticContact CE2-CE2 3.91Å; Y94-F102 HydrophobicContact CE2-CE2 3.91Å; Y94-F102 HydrophobicContact CG-CD2 4.35Å; Y94-F102 AromaticContact CG-CE2 3.71Å; Y94-F102 HydrophobicContact CG-CE2 3.71Å; Y94-F102 AromaticContact CZ-CD2 3.66Å; Y94-G127 WeakPolarHBondContact CD1-O 3.32Å; Y94-G127 VanDerWaalsContact CE2-CA 3.48Å; Y94-G127 VanDerWaalsContact CZ-CA 3.45Å; Y94-G127 VanDerWaalsContact CZ-N 3.34Å; Y94-G127 PolarHBondContact N-O 3.35Å; Y94-G127 WeakPolarHBondContact O-CA 3.4Å; Y94-G127 PolarHBondContact OH-N 2.88Å; Y94-G127 VanDerWaalsContact OH-N 3.15Å; Y94-F128 VanDerWaalsContact CE1-C 3.43Å; Y94-L129 HydrophobicContact CD1-CG 3.89Å; Y94-L129 HydrophobicContact CE1-CB 4.48Å; Y94-L129 HydrophobicContact CE1-CD2 3.73Å; Y94-L129 HydrophobicContact CE1-CG 3.56Å
95	P	94.2	Very high	93	Very high	32 Å²	32	46.7 Å²	46.7	21%	0.208	26%	0.264	C	S	.	.			trans	-57.8	130.7	174.8	-26.5	35.5	0	0	0	111.9	A97 L98 V149 Y152 E153	P95-A97 PolarHBondContact O-N 3.43Å; P95-L98 WeakPolarHBondContact O-CB 3.14Å; P95-L98 PolarHBondContact O-N 3.22Å; P95-V149 HydrophobicContact CG-CG1 4.2Å; P95-Y152 HydrophobicContact CB-CD1 4.08Å; P95-Y152 HydrophobicContact CB-CE1 3.84Å; P95-Y152 HydrophobicContact CG-CD1 4.07Å; P95-Y152 HydrophobicContact CG-CE1 4.28Å; P95-E153 HydrophobicContact CG-CG 4.32Å
96	G	90.8	Very high	93.1	Very high	55 Å²	55	50.2 Å²	50.2	57%	0.567	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-56	-22.8	-171.3	0	0	0	0	0	116	Y94 L98 H99	Y94-G96 PolarHBondContact O-N 3.26Å; G96-L98 PolarHBondContact O-N 2.64Å; G96-H99 WeakPolarHBondContact O-CB 3.49Å; G96-H99 PolarHBondContact O-N 3.41Å; G96-H99 VanDerWaalsContact O-N 3.1Å
97	A	91.2	Very high	93.2	Very high	48 Å²	48	47.1 Å²	47.1	40%	0.397	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-62.2	-27.5	172	0	0	0	0	0	113.5	P95 H99 C100 Y152	P95-A97 PolarHBondContact O-N 3.43Å; A97-H99 VanDerWaalsContact C-N 3.29Å; A97-C100 PolarHBondContact O-SG 3.09Å; A97-Y152 HydrophobicContact CB-CE2 4.09Å; A97-Y152 WeakPolarHBondContact CB-OH 3.26Å
98	L	94.4	Very high	93.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-79.5	-7.8	175.9	-57.4	-175.6	0	0	0	113.1	Y94 P95 G96 C100 I101 F102 V149 Y152 L195 V199	Y94-L98 HydrophobicContact CD2-CB 4.15Å; P95-L98 WeakPolarHBondContact O-CB 3.14Å; P95-L98 PolarHBondContact O-N 3.22Å; G96-L98 PolarHBondContact O-N 2.64Å; L98-C100 PolarHBondContact O-N 2.93Å; L98-C100 VanDerWaalsContact O-N 3.15Å; L98-I101 HydrophobicContact CB-CD1 4.14Å; L98-I101 HydrophobicContact CD2-CD1 3.76Å; L98-I101 HydrophobicContact CG-CD1 4.48Å; L98-I101 VanDerWaalsContact O-CB 3.26Å; L98-I101 WeakPolarHBondContact O-CB 3.42Å; L98-I101 WeakPolarHBondContact O-CG1 3.36Å; L98-I101 PolarHBondContact O-N 3.48Å; L98-F102 HydrophobicContact CB-CE2 4.38Å; L98-V149 HydrophobicContact CD1-CG2 3.99Å; L98-Y152 HydrophobicContact CD1-CG 4.26Å; L98-Y152 HydrophobicContact CD2-CD2 3.57Å; L98-Y152 HydrophobicContact CD2-CE2 4.18Å; L98-Y152 HydrophobicContact CD2-CG 3.79Å; L98-Y152 HydrophobicContact CG-CD1 4.49Å; L98-Y152 HydrophobicContact CG-CD2 4.34Å; L98-Y152 HydrophobicContact CG-CG 4.17Å; L98-L195 HydrophobicContact CD2-CD2 3.91Å; L98-V199 HydrophobicContact CD2-CG1 4.37Å
99	H	94.3	Very high	93.4	Very high	40 Å²	40	40.2 Å²	40.2	19%	0.185	23%	0.225	C	C	.	.	H	α-helix	trans	-57.1	-31.9	178.3	-169.6	56.8	0	0	0	112.6	Y94 G96 A97 I101 F102 C103	Y94-H99 HydrophobicContact CE2-CB 3.9Å; Y94-H99 AromaticContact CZ-ND1 3.9Å; Y94-H99 PolarHBondContact OH-ND1 3.21Å; G96-H99 WeakPolarHBondContact O-CB 3.49Å; G96-H99 PolarHBondContact O-N 3.41Å; G96-H99 VanDerWaalsContact O-N 3.1Å; A97-H99 VanDerWaalsContact C-N 3.29Å; H99-I101 PolarHBondContact O-N 2.9Å; H99-F102 PolarHBondContact O-N 3.07Å; H99-F102 VanDerWaalsContact O-N 3.12Å; H99-C103 PolarHBondContact CE1-SG 3.12Å; H99-C103 PolarHBondContact O-N 2.84Å
100	C	93.9	Very high	93.4	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.02	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-23.8	174.9	66.2	0	0	0	0	114.2	A97 L98 G104 H188 D191 L192	A97-C100 PolarHBondContact O-SG 3.09Å; L98-C100 PolarHBondContact O-N 2.93Å; L98-C100 VanDerWaalsContact O-N 3.15Å; C100-G104 WeakPolarHBondContact O-CA 3.39Å; C100-G104 PolarHBondContact O-N 3.37Å; C100-H188 HydrophobicContact CB-CB 4.02Å; C100-D191 HydrophobicContact CB-CB 3.37Å; C100-L192 HydrophobicContact CB-CD2 4.34Å; C100-L192 HydrophobicContact CB-CG 4.19Å; C100-L192 WeakPolarHBondContact O-CD2 3.43Å
101	I	95.2	Very high	93.5	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.015	20%	0.195	C	C	.	.	H	α-helix	trans	-71.2	-43.5	175.2	-58.3	175.4	0	0	0	110	L98 H99 F109 L148 L192 L195 V199 L203	L98-I101 HydrophobicContact CB-CD1 4.14Å; L98-I101 HydrophobicContact CD2-CD1 3.76Å; L98-I101 HydrophobicContact CG-CD1 4.48Å; L98-I101 VanDerWaalsContact O-CB 3.26Å; L98-I101 WeakPolarHBondContact O-CB 3.42Å; L98-I101 WeakPolarHBondContact O-CG1 3.36Å; L98-I101 PolarHBondContact O-N 3.48Å; H99-I101 PolarHBondContact O-N 2.9Å; I101-F109 HydrophobicContact CG2-CB 3.9Å; I101-F109 HydrophobicContact CG2-CD2 4.45Å; I101-F109 HydrophobicContact CG2-CG 4.3Å; I101-L148 HydrophobicContact CD1-CD2 3.92Å; I101-L148 HydrophobicContact CD1-CG 4.45Å; I101-L192 HydrophobicContact CG1-CD2 4.29Å; I101-L195 HydrophobicContact CD1-CD1 3.91Å; I101-L195 HydrophobicContact CD1-CD2 4.5Å; I101-L195 HydrophobicContact CG1-CD1 3.67Å; I101-V199 HydrophobicContact CD1-CG1 3.82Å; I101-L203 HydrophobicContact CD1-CD1 3.89Å; I101-L203 HydrophobicContact CD1-CD2 4.49Å; I101-L203 HydrophobicContact CG1-CD1 3.95Å; I101-L203 HydrophobicContact CG2-CD1 4.17Å; I101-L203 HydrophobicContact CG2-CD2 3.56Å
102	F	94.8	Very high	93.6	Very high	10 Å²	10	27.4 Å²	27.4	4%	0.044	17%	0.166	C	C	.	.	H	α-helix	trans	-85.2	-17.1	-173.3	-50.6	-56.7	0	0	0	113.5	Y94 L98 H99 M110 L113 V123 L129 I145 L148	Y94-F102 HydrophobicContact CD1-CD2 4.24Å; Y94-F102 AromaticContact CD1-CE2 3.81Å; Y94-F102 HydrophobicContact CD1-CE2 3.81Å; Y94-F102 HydrophobicContact CD2-CD2 4.11Å; Y94-F102 AromaticContact CD2-CE2 3.75Å; Y94-F102 HydrophobicContact CD2-CE2 3.75Å; Y94-F102 AromaticContact CE1-CD2 3.89Å; Y94-F102 HydrophobicContact CE1-CD2 3.89Å; Y94-F102 AromaticContact CE1-CE2 3.95Å; Y94-F102 HydrophobicContact CE1-CE2 3.95Å; Y94-F102 AromaticContact CE2-CD2 3.77Å; Y94-F102 HydrophobicContact CE2-CD2 3.77Å; Y94-F102 AromaticContact CE2-CE2 3.91Å; Y94-F102 HydrophobicContact CE2-CE2 3.91Å; Y94-F102 HydrophobicContact CG-CD2 4.35Å; Y94-F102 AromaticContact CG-CE2 3.71Å; Y94-F102 HydrophobicContact CG-CE2 3.71Å; Y94-F102 AromaticContact CZ-CD2 3.66Å; L98-F102 HydrophobicContact CB-CE2 4.38Å; H99-F102 PolarHBondContact O-N 3.07Å; H99-F102 VanDerWaalsContact O-N 3.12Å; F102-M110 HydrophobicContact CB-CG 4.27Å; F102-M110 HydrophobicContact CB-SD 3.8Å; F102-M110 HydrophobicContact CD1-SD 3.66Å; F102-M110 HydrophobicContact CG-SD 4.15Å; F102-M110 WeakPolarHBondContact O-CG 3.4Å; F102-L113 HydrophobicContact CE1-CD2 4.48Å; F102-V123 HydrophobicContact CB-CG2 3.83Å; F102-L129 HydrophobicContact CB-CD2 4.26Å; F102-L129 HydrophobicContact CD1-CD1 4.05Å; F102-L129 HydrophobicContact CD1-CD2 4.46Å; F102-L129 HydrophobicContact CD2-CD1 4.36Å; F102-L129 HydrophobicContact CD2-CD2 4.13Å; F102-L129 HydrophobicContact CD2-CG 4.49Å; F102-L129 HydrophobicContact CE1-CD1 3.84Å; F102-L129 HydrophobicContact CE2-CD1 4.17Å; F102-L129 HydrophobicContact CG-CD1 4.31Å; F102-L129 HydrophobicContact CG-CD2 4.03Å; F102-L129 HydrophobicContact CZ-CD1 3.9Å; F102-I145 HydrophobicContact CZ-CG2 4.5Å; F102-L148 HydrophobicContact CE1-CD2 4.42Å; F102-L148 HydrophobicContact CZ-CD2 4.1Å
103	C	92	Very high	93.7	Very high	49 Å²	49	27.3 Å²	27.3	33%	0.331	17%	0.166	S	C	.	.	H	α-helix	trans	-118.9	-7.1	178.6	-61.9	0	0	0	0	114.8	H99	H99-C103 PolarHBondContact CE1-SG 3.12Å; H99-C103 PolarHBondContact O-N 2.84Å
104	G	91.8	Very high	93.9	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	-101.6	179.7	-176.6	0	0	0	0	0	114.9	C100 R106 G107 D186	C100-G104 WeakPolarHBondContact O-CA 3.39Å; C100-G104 PolarHBondContact O-N 3.37Å; G104-R106 PolarHBondContact O-N 2.9Å; G104-G107 PolarHBondContact O-N 2.71Å; G104-D186 VanDerWaalsContact C-OD2 3.24Å; G104-D186 WeakPolarHBondContact CA-OD2 3.22Å
105	A	92.7	Very high	93.9	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.008	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	48.6	37.6	-174.4	0	0	0	0	0	113.2	G107 L108 F109 W184 D186 L192	A105-G107 PolarHBondContact O-N 2.88Å; A105-G107 VanDerWaalsContact O-N 3.13Å; A105-L108 HydrophobicContact CB-CB 4.17Å; A105-L108 WeakPolarHBondContact O-CB 3.27Å; A105-L108 PolarHBondContact O-N 3.06Å; A105-L108 VanDerWaalsContact O-N 3.1Å; A105-F109 HydrophobicContact CB-CD2 4.08Å; A105-F109 HydrophobicContact CB-CE2 3.69Å; A105-F109 HydrophobicContact CB-CZ 4.48Å; A105-W184 HydrophobicContact CB-CG 4.27Å; A105-D186 PolarHBondContact N-OD2 3.18Å; A105-L192 HydrophobicContact CB-CD1 4.19Å
106	R	90.4	Very high	94	Very high	165 Å²	165	24.1 Å²	24.1	62%	0.623	14%	0.14	S	C	*	.	G	3₁₀ helix	trans	49.6	31.4	-172.8	-62.4	-164.9	177.5	-173.5	-0.5	114.8	G104 W184 D186	G104-R106 PolarHBondContact O-N 2.9Å; R106-W184 HydrophobicContact CB-CE3 4Å; R106-W184 HydrophobicContact CB-CZ3 4.31Å; R106-W184 HydrophobicContact CG-CE3 3.99Å; R106-D186 PolarHBondContact N-OD2 3.34Å
107	G	91.9	Very high	94.3	Very high	16 Å²	16	21.6 Å²	21.6	17%	0.165	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	89.5	0.5	178.3	0	0	0	0	0	115.4	G104 A105 F109 M110 D111	G104-G107 PolarHBondContact O-N 2.71Å; A105-G107 PolarHBondContact O-N 2.88Å; A105-G107 VanDerWaalsContact O-N 3.13Å; G107-F109 PolarHBondContact O-N 2.95Å; G107-M110 WeakPolarHBondContact O-CA 3.38Å; G107-M110 WeakPolarHBondContact O-CB 3.42Å; G107-M110 PolarHBondContact O-N 3.08Å; G107-D111 PolarHBondContact O-N 3.28Å
108	L	94	Very high	94.6	Very high	12 Å²	12	19.7 Å²	19.7	6%	0.063	10%	0.098	C	C	.	.	H	α-helix	trans	-48.8	-41.2	-176.5	174.4	63.4	0	0	0	114.3	A105 S112 L180 W184 V207 L212	A105-L108 HydrophobicContact CB-CB 4.17Å; A105-L108 WeakPolarHBondContact O-CB 3.27Å; A105-L108 PolarHBondContact O-N 3.06Å; A105-L108 VanDerWaalsContact O-N 3.1Å; L108-S112 WeakPolarHBondContact O-CB 3.23Å; L108-S112 PolarHBondContact O-N 3.16Å; L108-S112 PolarHBondContact O-OG 3.02Å; L108-L180 HydrophobicContact CD2-CD1 3.92Å; L108-L180 HydrophobicContact CD2-CD2 4.25Å; L108-L180 HydrophobicContact CD2-CG 4.12Å; L108-W184 HydrophobicContact CD2-CZ2 4.33Å; L108-V207 HydrophobicContact CD2-CG1 4.47Å; L108-V207 HydrophobicContact CD2-CG2 4.48Å; L108-V207 HydrophobicContact CG-CG2 4.25Å; L108-L212 HydrophobicContact CD1-CB 4.02Å
109	F	95.6	Very high	94.7	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.009	10%	0.098	C	C	.	.	H	α-helix	trans	-74.8	-34	179.3	-56.2	-64.2	0	0	0	112.5	I101 A105 G107 L113 F177 L180 V181 L192 L203 V207	I101-F109 HydrophobicContact CG2-CB 3.9Å; I101-F109 HydrophobicContact CG2-CD2 4.45Å; I101-F109 HydrophobicContact CG2-CG 4.3Å; A105-F109 HydrophobicContact CB-CD2 4.08Å; A105-F109 HydrophobicContact CB-CE2 3.69Å; A105-F109 HydrophobicContact CB-CZ 4.48Å; G107-F109 PolarHBondContact O-N 2.95Å; F109-L113 VanDerWaalsContact O-CB 3.31Å; F109-L113 WeakPolarHBondContact O-CB 3.41Å; F109-L113 PolarHBondContact O-N 2.88Å; F109-F177 HydrophobicContact CE1-CE2 4.18Å; F109-F177 AromaticContact CZ-CE2 3.72Å; F109-F177 HydrophobicContact CZ-CE2 3.72Å; F109-F177 HydrophobicContact CZ-CZ 4.08Å; F109-L180 HydrophobicContact CE1-CD2 4.33Å; F109-V181 HydrophobicContact CE2-CG2 4.38Å; F109-V181 HydrophobicContact CZ-CG2 4.09Å; F109-L192 HydrophobicContact CD2-CD2 4.28Å; F109-L192 HydrophobicContact CE2-CD1 4.15Å; F109-L192 HydrophobicContact CE2-CD2 3.8Å; F109-L203 HydrophobicContact CB-CD2 4.33Å; F109-L203 HydrophobicContact CD1-CB 4.01Å; F109-L203 HydrophobicContact CD1-CD2 3.93Å; F109-L203 HydrophobicContact CD1-CG 4.37Å; F109-L203 HydrophobicContact CE1-CB 3.82Å; F109-L203 HydrophobicContact CE1-CD1 4.43Å; F109-L203 HydrophobicContact CE1-CG 4.49Å; F109-L203 HydrophobicContact CG-CD2 4.19Å; F109-V207 HydrophobicContact CD1-CG2 3.71Å; F109-V207 HydrophobicContact CE1-CG2 3.85Å
110	M	94.6	Very high	94.7	Very high	17 Å²	17	18.4 Å²	18.4	8%	0.084	9%	0.092	C	C	.	.	H	α-helix	trans	-65.2	-47.5	170.9	-75.5	-69.6	-70.2	0	0	111.1	F102 G107 S112 L113 I114 I121 V123	F102-M110 HydrophobicContact CB-CG 4.27Å; F102-M110 HydrophobicContact CB-SD 3.8Å; F102-M110 HydrophobicContact CD1-SD 3.66Å; F102-M110 HydrophobicContact CG-SD 4.15Å; F102-M110 WeakPolarHBondContact O-CG 3.4Å; G107-M110 WeakPolarHBondContact O-CA 3.38Å; G107-M110 WeakPolarHBondContact O-CB 3.42Å; G107-M110 PolarHBondContact O-N 3.08Å; M110-S112 VanDerWaalsContact C-N 3.31Å; M110-S112 PolarHBondContact O-N 3.5Å; M110-L113 PolarHBondContact O-N 3.22Å; M110-I114 WeakPolarHBondContact O-CB 3.45Å; M110-I114 VanDerWaalsContact O-CG1 3.28Å; M110-I114 WeakPolarHBondContact O-CG1 3.19Å; M110-I114 PolarHBondContact O-N 2.88Å; M110-I121 HydrophobicContact CE-CB 4.07Å; M110-I121 HydrophobicContact CE-CG2 3.81Å; M110-I121 VanDerWaalsContact CE-O 3.29Å; M110-I121 WeakPolarHBondContact CE-O 3.29Å; M110-I121 HydrophobicContact SD-CG2 4.42Å; M110-V123 HydrophobicContact CE-CG2 4.08Å; M110-V123 HydrophobicContact SD-CG2 4.39Å
111	D	95.4	Very high	94.9	Very high	19 Å²	19	18.3 Å²	18.3	10%	0.102	9%	0.091	C	C	.	.	H	α-helix	trans	-61.2	-41.7	178.5	-64.1	-45.2	0	0	0	111.3	R41 I42 G107 I114 K115 L212	R41-D111 IonicContact CZ-OD1 3.38Å; R41-D111 IonicContact CZ-OD2 2.63Å; R41-D111 IonicContact NH1-OD1 2.83Å; R41-D111 PolarHBondContact NH1-OD1 2.79Å; R41-D111 VanDerWaalsContact NH1-OD1 3.09Å; R41-D111 IonicContact NH1-OD2 3.92Å; R41-D111 PolarHBondContact NH1-OD2 2.91Å; R41-D111 IonicContact NH2-OD1 3.9Å; R41-D111 PolarHBondContact NH2-OD1 2.68Å; R41-D111 IonicContact NH2-OD2 2.9Å; I42-D111 HydrophobicContact CD1-CB 4.45Å; I42-D111 WeakPolarHBondContact CD1-OD1 3.35Å; I42-D111 HydrophobicContact CG1-CB 4.12Å; I42-D111 WeakPolarHBondContact CG1-OD1 3.27Å; G107-D111 PolarHBondContact O-N 3.28Å; D111-I114 PolarHBondContact O-N 3.16Å; D111-K115 WeakPolarHBondContact O-CB 3.32Å; D111-K115 PolarHBondContact O-N 2.82Å; D111-L212 HydrophobicContact CB-CD1 3.63Å
112	S	96.2	Very high	94.8	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-65.8	-39	176	-61.2	0	0	0	0	112.1	L108 M110 K115 N116 S210	L108-S112 WeakPolarHBondContact O-CB 3.23Å; L108-S112 PolarHBondContact O-N 3.16Å; L108-S112 PolarHBondContact O-OG 3.02Å; M110-S112 VanDerWaalsContact C-N 3.31Å; M110-S112 PolarHBondContact O-N 3.5Å; S112-K115 PolarHBondContact O-N 3.18Å; S112-N116 WeakPolarHBondContact O-CB 3.46Å; S112-N116 PolarHBondContact O-N 3.32Å; S112-N116 PolarHBondContact O-OD1 3.29Å; S112-S210 WeakPolarHBondContact CB-OG 3.5Å; S112-S210 PolarHBondContact OG-OG 2.84Å
113	L	96.3	Very high	94.8	Very high	10 Å²	10	20.3 Å²	20.3	5%	0.052	10%	0.104	C	C	.	.	H	α-helix	trans	-66.6	-44.5	175.6	-169.7	63.9	0	0	0	111.4	F102 F109 M110 T117 I121 L144 I145 L206	F102-L113 HydrophobicContact CE1-CD2 4.48Å; F109-L113 VanDerWaalsContact O-CB 3.31Å; F109-L113 WeakPolarHBondContact O-CB 3.41Å; F109-L113 PolarHBondContact O-N 2.88Å; M110-L113 PolarHBondContact O-N 3.22Å; L113-T117 HydrophobicContact CD1-CG2 4.12Å; L113-T117 HydrophobicContact CG-CG2 4.44Å; L113-T117 VanDerWaalsContact O-CB 3.27Å; L113-T117 WeakPolarHBondContact O-CB 3.28Å; L113-T117 WeakPolarHBondContact O-CG2 3.46Å; L113-T117 PolarHBondContact O-N 3.5Å; L113-T117 PolarHBondContact O-OG1 2.91Å; L113-I121 HydrophobicContact CB-CD1 4.34Å; L113-I121 HydrophobicContact CD2-CD1 3.61Å; L113-I121 HydrophobicContact CG-CD1 3.59Å; L113-L144 HydrophobicContact CD1-CB 4.05Å; L113-L144 HydrophobicContact CD1-CD1 3.97Å; L113-I145 HydrophobicContact CD2-CD1 4.1Å; L113-I145 HydrophobicContact CD2-CG1 3.85Å; L113-L206 HydrophobicContact CB-CD2 4.12Å; L113-L206 HydrophobicContact CD1-CD1 4.13Å; L113-L206 HydrophobicContact CD1-CD2 4.31Å
114	I	96.7	Very high	94.4	Very high	10 Å²	10	20.2 Å²	20.2	5%	0.051	11%	0.112	C	C	.	.	H	α-helix	trans	-62	-43.5	175.6	-69.5	166	0	0	0	110.5	I42 F43 F79 M110 D111 T117 S118 I121	I42-I114 HydrophobicContact CD1-CB 4.28Å; I42-I114 HydrophobicContact CD1-CD1 4.22Å; I42-I114 HydrophobicContact CD1-CG2 3.89Å; I42-I114 HydrophobicContact CG2-CB 4.47Å; I42-I114 HydrophobicContact CG2-CG2 4.11Å; F43-I114 HydrophobicContact CE2-CG2 4.43Å; F43-I114 HydrophobicContact CZ-CG2 4.22Å; F79-I114 HydrophobicContact CD2-CG2 3.9Å; F79-I114 HydrophobicContact CE2-CG2 3.54Å; F79-I114 HydrophobicContact CZ-CG2 4.2Å; M110-I114 WeakPolarHBondContact O-CB 3.45Å; M110-I114 VanDerWaalsContact O-CG1 3.28Å; M110-I114 WeakPolarHBondContact O-CG1 3.19Å; M110-I114 PolarHBondContact O-N 2.88Å; D111-I114 PolarHBondContact O-N 3.16Å; I114-T117 PolarHBondContact O-OG1 3.14Å; I114-S118 VanDerWaalsContact O-CA 3.29Å; I114-S118 WeakPolarHBondContact O-CA 3.49Å; I114-S118 PolarHBondContact O-N 3.2Å; I114-I121 HydrophobicContact CG1-CB 4.09Å; I114-I121 HydrophobicContact CG1-CD1 4.25Å; I114-I121 HydrophobicContact CG1-CG1 4.14Å
115	K	95.8	Very high	94.2	Very high	19 Å²	19	23 Å²	23	8%	0.083	13%	0.132	C	C	.	.	H	α-helix	trans	-62.9	-51.1	178.3	-157	-167	-177.3	-171.3	0	111.9	I42 F43 D72 D111 S112 T117 S210 L212	I42-K115 HydrophobicContact CG2-CB 3.78Å; I42-K115 HydrophobicContact CG2-CG 4.2Å; I42-K115 WeakPolarHBondContact O-CD 3.39Å; F43-K115 HydrophobicContact CD1-CG 3.78Å; F43-K115 HydrophobicContact CE1-CB 4.42Å; F43-K115 HydrophobicContact CE1-CG 3.95Å; D72-K115 WeakPolarHBondContact OD1-CE 3.44Å; D72-K115 IonicContact OD1-NZ 3.32Å; D72-K115 PolarHBondContact OD1-NZ 3.47Å; D72-K115 IonicContact OD2-NZ 3.26Å; D72-K115 PolarHBondContact OD2-NZ 3.46Å; D111-K115 WeakPolarHBondContact O-CB 3.32Å; D111-K115 PolarHBondContact O-N 2.82Å; S112-K115 PolarHBondContact O-N 3.18Å; K115-T117 VanDerWaalsContact C-N 3.27Å; K115-T117 PolarHBondContact O-N 2.88Å; K115-S210 VanDerWaalsContact CD-O 3.23Å; K115-S210 WeakPolarHBondContact CD-O 3.25Å; K115-S210 PolarHBondContact NZ-O 3.39Å; K115-L212 HydrophobicContact CD-CG 4.45Å
116	N	95.4	Very high	93.9	Very high	28 Å²	28	27.8 Å²	27.8	15%	0.15	16%	0.162	C	C	.	.	H	α-helix	trans	-71.4	-22.6	-174.6	-62.4	9.3	0	0	0	112.7	S112 L206 E209 S210	S112-N116 WeakPolarHBondContact O-CB 3.46Å; S112-N116 PolarHBondContact O-N 3.32Å; S112-N116 PolarHBondContact O-OD1 3.29Å; N116-L206 HydrophobicContact CB-CD1 4.33Å; N116-L206 PolarHBondContact ND2-O 3.32Å; N116-L206 VanDerWaalsContact ND2-O 3.08Å; N116-E209 VanDerWaalsContact ND2-CB 3.32Å; N116-E209 WeakPolarHBondContact ND2-CB 3.45Å; N116-E209 PolarHBondContact ND2-OE2 3.2Å; N116-S210 WeakPolarHBondContact OD1-CA 3.44Å; N116-S210 WeakPolarHBondContact OD1-CB 3.36Å; N116-S210 PolarHBondContact OD1-N 2.99Å
117	T	96.9	Very high	93.9	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.012	14%	0.136	C	C	.	.	H	α-helix	trans	-97	-30.3	178.9	61.9	0	0	0	0	113.7	L113 I114 K115 A119 P137 R140 A141 L144	L113-T117 HydrophobicContact CD1-CG2 4.12Å; L113-T117 HydrophobicContact CG-CG2 4.44Å; L113-T117 VanDerWaalsContact O-CB 3.27Å; L113-T117 WeakPolarHBondContact O-CB 3.28Å; L113-T117 WeakPolarHBondContact O-CG2 3.46Å; L113-T117 PolarHBondContact O-N 3.5Å; L113-T117 PolarHBondContact O-OG1 2.91Å; I114-T117 PolarHBondContact O-OG1 3.14Å; K115-T117 VanDerWaalsContact C-N 3.27Å; K115-T117 PolarHBondContact O-N 2.88Å; T117-A119 PolarHBondContact O-N 3.26Å; T117-A119 PolarHBondContact OG1-N 3.36Å; T117-P137 WeakPolarHBondContact O-CA 3.01Å; T117-P137 VanDerWaalsContact O-CB 3.29Å; T117-P137 WeakPolarHBondContact O-CB 3.36Å; T117-R140 HydrophobicContact CG2-CG 4.45Å; T117-A141 VanDerWaalsContact CG2-CA 3.45Å; T117-A141 HydrophobicContact CG2-CB 3.64Å; T117-L144 HydrophobicContact CG2-CD1 3.82Å
118	S	97.3	Very high	94	Very high	8 Å²	8	23.3 Å²	23.3	6%	0.056	15%	0.145	C	C	.	.			trans	58.1	26.1	-165.1	-51.1	0	0	0	0	114	A75 F79 I114	A75-S118 WeakPolarHBondContact CA-OG 3.34Å; A75-S118 PolarHBondContact O-OG 2.83Å; F79-S118 WeakPolarHBondContact CA-O 3Å; I114-S118 VanDerWaalsContact O-CA 3.29Å; I114-S118 WeakPolarHBondContact O-CA 3.49Å; I114-S118 PolarHBondContact O-N 3.2Å
119	A	97.1	Very high	94.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.142	C	C	.	.			trans	-103.4	150	174.9	0	0	0	0	0	111.4	T117 I121 V131 P137 A141	T117-A119 PolarHBondContact O-N 3.26Å; T117-A119 PolarHBondContact OG1-N 3.36Å; A119-I121 HydrophobicContact CB-CG1 4.34Å; A119-V131 HydrophobicContact CB-CG1 4.27Å; A119-P137 HydrophobicContact CB-CB 3.94Å; A119-A141 HydrophobicContact CB-CB 4Å
120	L	95.6	Very high	94.1	Very high	13 Å²	13	24.5 Å²	24.5	7%	0.068	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	116.2	168.7	174.4	64.5	0	0	0	109.1	F79 V83 V122 S132 F278	F79-L120 HydrophobicContact CE2-CB 4.1Å; F79-L120 HydrophobicContact CE2-CD1 4.33Å; F79-L120 HydrophobicContact CZ-CD1 4.33Å; V83-L120 HydrophobicContact CG2-CB 4.14Å; V83-L120 HydrophobicContact CG2-CD2 4.1Å; L120-V122 HydrophobicContact CD1-CG2 4.13Å; L120-V122 HydrophobicContact CG-CG2 4.2Å; L120-S132 WeakPolarHBondContact CB-OG 3.45Å; L120-S132 WeakPolarHBondContact CG-OG 3.4Å; L120-S132 PolarHBondContact N-O 3.45Å; L120-S132 PolarHBondContact O-N 3.27Å; L120-S132 PolarHBondContact O-OG 3.46Å; L120-F278 HydrophobicContact CD2-CE2 4.34Å; L120-F278 HydrophobicContact CD2-CZ 4.49Å
121	I	96.4	Very high	94.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	120.9	-177.9	-49.8	177	0	0	0	108.1	M110 L113 I114 A119 L129 L130 V131 A141	M110-I121 HydrophobicContact CE-CB 4.07Å; M110-I121 HydrophobicContact CE-CG2 3.81Å; M110-I121 VanDerWaalsContact CE-O 3.29Å; M110-I121 WeakPolarHBondContact CE-O 3.29Å; M110-I121 HydrophobicContact SD-CG2 4.42Å; L113-I121 HydrophobicContact CB-CD1 4.34Å; L113-I121 HydrophobicContact CD2-CD1 3.61Å; L113-I121 HydrophobicContact CG-CD1 3.59Å; I114-I121 HydrophobicContact CG1-CB 4.09Å; I114-I121 HydrophobicContact CG1-CD1 4.25Å; I114-I121 HydrophobicContact CG1-CG1 4.14Å; A119-I121 HydrophobicContact CB-CG1 4.34Å; I121-L129 HydrophobicContact CG2-CB 4.5Å; I121-L129 HydrophobicContact CG2-CD1 3.98Å; I121-L130 WeakPolarHBondContact CA-O 3.31Å; I121-V131 HydrophobicContact CG1-CG1 4.43Å; I121-V131 HydrophobicContact CG2-CG2 4.4Å; I121-A141 HydrophobicContact CD1-CB 4.03Å
122	V	94.1	Very high	94.3	Very high	20 Å²	20	22.9 Å²	22.9	12%	0.121	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135.7	-178.9	-175.5	0	0	0	0	109.2	L120 G124 L130 L274	L120-V122 HydrophobicContact CD1-CG2 4.13Å; L120-V122 HydrophobicContact CG-CG2 4.2Å; V122-G124 PolarHBondContact O-N 3.08Å; V122-L130 PolarHBondContact N-O 3.33Å; V122-L130 PolarHBondContact O-N 3.37Å; V122-L274 HydrophobicContact CG1-CB 4.3Å
123	V	93.6	Very high	94.3	Very high	35 Å²	35	22.9 Å²	22.9	21%	0.212	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	121.3	172.4	-173.7	0	0	0	0	108.5	F102 M110 L129	F102-V123 HydrophobicContact CB-CG2 3.83Å; M110-V123 HydrophobicContact CE-CG2 4.08Å; M110-V123 HydrophobicContact SD-CG2 4.39Å; V123-L129 HydrophobicContact CB-CD2 4.28Å; V123-L129 HydrophobicContact CG1-CD2 4.42Å; V123-L129 HydrophobicContact CG2-CD2 3.85Å
124	G	85.6	Confident	94.3	Very high	48 Å²	48	23.4 Å²	23.4	50%	0.495	15%	0.146	S	C	.	.			trans	-85.9	-108.8	178.8	0	0	0	0	0	111.2	V122 F128	V122-G124 PolarHBondContact O-N 3.08Å; G124-F128 PolarHBondContact N-O 3.4Å
125	S	85.8	Confident	94.2	Very high	59 Å²	59	24.8 Å²	24.8	41%	0.413	16%	0.159	S	C	.	.	S	Bend	trans	-88.2	162.9	165.5	57.2	0	0	0	0	110.8	G127 F128	S125-G127 PolarHBondContact O-N 3.1Å; S125-G127 VanDerWaalsContact O-N 3.16Å; S125-F128 PolarHBondContact O-N 3.17Å; S125-F128 WeakPolarHBondContact OG-CD2 3.41Å
126	P	87.3	Confident	94.2	Very high	100 Å²	100	29.5 Å²	29.5	65%	0.649	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	121	174.6	-24.5	35.2	0	0	0	111.2
127	G	90.8	Very high	94.3	Very high	7 Å²	7	28.5 Å²	28.5	7%	0.072	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.8	-2.5	-172.9	0	0	0	0	0	115.3	S93 Y94 S125	S93-G127 CarbonylContact C-O 3.58Å; S93-G127 VanDerWaalsContact CA-O 3.28Å; S93-G127 WeakPolarHBondContact CA-O 3.21Å; Y94-G127 WeakPolarHBondContact CD1-O 3.32Å; Y94-G127 VanDerWaalsContact CE2-CA 3.48Å; Y94-G127 VanDerWaalsContact CZ-CA 3.45Å; Y94-G127 VanDerWaalsContact CZ-N 3.34Å; Y94-G127 PolarHBondContact N-O 3.35Å; Y94-G127 WeakPolarHBondContact O-CA 3.4Å; Y94-G127 PolarHBondContact OH-N 2.88Å; Y94-G127 VanDerWaalsContact OH-N 3.15Å; S125-G127 PolarHBondContact O-N 3.1Å; S125-G127 VanDerWaalsContact O-N 3.16Å
128	F	94.1	Very high	94.4	Very high	81 Å²	81	28.4 Å²	28.4	36%	0.355	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	132.6	-179	-63.5	-95.7	0	0	0	112.7	E91 L92 Y94 G124 S125	E91-F128 HydrophobicContact CG-CD1 4.12Å; E91-F128 WeakPolarHBondContact OE1-CD1 3.32Å; L92-F128 WeakPolarHBondContact O-CA 3.33Å; Y94-F128 VanDerWaalsContact CE1-C 3.43Å; G124-F128 PolarHBondContact N-O 3.4Å; S125-F128 PolarHBondContact O-N 3.17Å; S125-F128 WeakPolarHBondContact OG-CD2 3.41Å
129	L	96.2	Very high	94.3	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	145	168.9	-63.3	-174.6	0	0	0	109.9	E91 L92 Y94 F102 I121 V123 I145	E91-L129 CarbonylContact C-O 3.53Å; E91-L129 WeakPolarHBondContact CA-O 3.39Å; L92-L129 HydrophobicContact CB-CB 4.37Å; L92-L129 PolarHBondContact N-O 2.74Å; L92-L129 PolarHBondContact O-N 2.99Å; Y94-L129 HydrophobicContact CD1-CG 3.89Å; Y94-L129 HydrophobicContact CE1-CB 4.48Å; Y94-L129 HydrophobicContact CE1-CD2 3.73Å; Y94-L129 HydrophobicContact CE1-CG 3.56Å; F102-L129 HydrophobicContact CB-CD2 4.26Å; F102-L129 HydrophobicContact CD1-CD1 4.05Å; F102-L129 HydrophobicContact CD1-CD2 4.46Å; F102-L129 HydrophobicContact CD2-CD1 4.36Å; F102-L129 HydrophobicContact CD2-CD2 4.13Å; F102-L129 HydrophobicContact CD2-CG 4.49Å; F102-L129 HydrophobicContact CE1-CD1 3.84Å; F102-L129 HydrophobicContact CE2-CD1 4.17Å; F102-L129 HydrophobicContact CG-CD1 4.31Å; F102-L129 HydrophobicContact CG-CD2 4.03Å; F102-L129 HydrophobicContact CZ-CD1 3.9Å; I121-L129 HydrophobicContact CG2-CB 4.5Å; I121-L129 HydrophobicContact CG2-CD1 3.98Å; V123-L129 HydrophobicContact CB-CD2 4.28Å; V123-L129 HydrophobicContact CG1-CD2 4.42Å; V123-L129 HydrophobicContact CG2-CD2 3.85Å; L129-I145 HydrophobicContact CD1-CD1 3.85Å; L129-I145 HydrophobicContact CD1-CG1 4.41Å; L129-I145 HydrophobicContact CD1-CG2 4.47Å
130	L	95.9	Very high	94.3	Very high	37 Å²	37	37.8 Å²	37.8	19%	0.194	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	119	164.2	-169.3	64.7	0	0	0	108.9	Q89 I121 V122	Q89-L130 HydrophobicContact CG-CD1 3.69Å; Q89-L130 HydrophobicContact CG-CG 4.25Å; I121-L130 WeakPolarHBondContact CA-O 3.31Å; V122-L130 PolarHBondContact N-O 3.33Å; V122-L130 PolarHBondContact O-N 3.37Å
131	V	96.9	Very high	94.3	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	132.6	176.9	-172.8	0	0	0	0	108.6	Q89 Q90 L92 A119 I121 V138 A141 I145	Q89-V131 WeakPolarHBondContact CA-O 3.4Å; Q90-V131 PolarHBondContact N-O 3.24Å; Q90-V131 PolarHBondContact O-N 3.25Å; L92-V131 HydrophobicContact CD1-CG2 4.27Å; A119-V131 HydrophobicContact CB-CG1 4.27Å; I121-V131 HydrophobicContact CG1-CG1 4.43Å; I121-V131 HydrophobicContact CG2-CG2 4.4Å; V131-V138 HydrophobicContact CB-CG1 4.48Å; V131-V138 HydrophobicContact CG1-CB 4.31Å; V131-V138 HydrophobicContact CG1-CG1 3.9Å; V131-V138 HydrophobicContact CG1-CG2 4.27Å; V131-A141 HydrophobicContact CG1-CB 3.72Å; V131-I145 HydrophobicContact CG2-CD1 4.05Å
132	S	96.1	Very high	94.3	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.014	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	149	-170.6	51.1	0	0	0	0	112.3	Q86 V88 L120 V138	Q86-S132 VanDerWaalsContact NE2-CB 3.26Å; V88-S132 WeakPolarHBondContact O-CA 3.44Å; L120-S132 WeakPolarHBondContact CB-OG 3.45Å; L120-S132 WeakPolarHBondContact CG-OG 3.4Å; L120-S132 PolarHBondContact N-O 3.45Å; L120-S132 PolarHBondContact O-N 3.27Å; L120-S132 PolarHBondContact O-OG 3.46Å; S132-V138 VanDerWaalsContact C-CG2 3.4Å
133	G	96.3	Very high	94.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.1	-150.5	175.6	0	0	0	0	0	113.8	E87 V88 V138	E87-G133 PolarHBondContact N-O 2.94Å; V88-G133 PolarHBondContact N-O 3.16Å; V88-G133 PolarHBondContact O-N 3.03Å; V88-G133 VanDerWaalsContact O-N 3.17Å; G133-V138 VanDerWaalsContact N-CG2 3.35Å
134	L	96.1	Very high	94.4	Very high	21 Å²	21	45.3 Å²	45.3	11%	0.11	26%	0.256	C	S	.	.	S	Bend	trans	-70.7	155.1	169	-52.7	177.3	0	0	0	110.5	L78 K81 N85 E87 E136 P137 V138	L78-L134 HydrophobicContact CD2-CD1 3.93Å; K81-L134 HydrophobicContact CB-CD1 3.97Å; K81-L134 HydrophobicContact CB-CD2 4.41Å; K81-L134 HydrophobicContact CB-CG 4.48Å; N85-L134 WeakPolarHBondContact O-CD2 3.47Å; E87-L134 HydrophobicContact CG-CD2 3.99Å; E87-L134 VanDerWaalsContact OE2-CA 3.29Å; E87-L134 WeakPolarHBondContact OE2-CA 3.32Å; L134-E136 PolarHBondContact O-N 3.15Å; L134-P137 HydrophobicContact CB-CG 4.06Å; L134-P137 WeakPolarHBondContact O-CD 3.23Å; L134-V138 WeakPolarHBondContact O-CG2 3.47Å; L134-V138 PolarHBondContact O-N 2.74Å; L134-V138 VanDerWaalsContact O-N 3.12Å
135	A	95.8	Very high	94.9	Very high	39 Å²	39	43.1 Å²	43.1	32%	0.322	23%	0.233	S	C	.	.	H	α-helix	trans	-59.1	-46	-171.2	0	0	0	0	0	114.2	E87 V88 V138 V139	E87-A135 PolarHBondContact OE2-N 2.86Å; V88-A135 HydrophobicContact CG2-CB 3.8Å; A135-V138 PolarHBondContact O-N 3.09Å; A135-V139 WeakPolarHBondContact O-CG2 3.49Å; A135-V139 PolarHBondContact O-N 3.27Å
136	E	95.9	Very high	95.2	Very high	118 Å²	118	41.7 Å²	41.7	55%	0.551	23%	0.225	S	C	*	.	H	α-helix	trans	-65.5	-51.2	-180	-173.1	-152.9	147.5	0	0	112.4	L134 V138 V139 R140	L134-E136 PolarHBondContact O-N 3.15Å; E136-V138 VanDerWaalsContact C-N 3.31Å; E136-V138 PolarHBondContact O-N 3.02Å; E136-V139 PolarHBondContact O-N 3.33Å; E136-R140 VanDerWaalsContact O-CB 3.25Å; E136-R140 WeakPolarHBondContact O-CB 2.96Å; E136-R140 PolarHBondContact O-N 3.35Å; E136-R140 IonicContact OE1-CZ 2.65Å; E136-R140 IonicContact OE1-NE 3.65Å; E136-R140 IonicContact OE1-NH2 3.49Å; E136-R140 PolarHBondContact OE1-NH2 3.24Å
137	P	97.5	Very high	95.5	Very high	6 Å²	6	39.7 Å²	39.7	4%	0.039	21%	0.209	C	C	.	.	H	α-helix	trans	-47.8	-46	169.4	-34.8	38.2	0	0	0	115.2	T117 A119 L134 R140 A141	T117-P137 WeakPolarHBondContact O-CA 3.01Å; T117-P137 VanDerWaalsContact O-CB 3.29Å; T117-P137 WeakPolarHBondContact O-CB 3.36Å; A119-P137 HydrophobicContact CB-CB 3.94Å; L134-P137 HydrophobicContact CB-CG 4.06Å; L134-P137 WeakPolarHBondContact O-CD 3.23Å; P137-R140 PolarHBondContact O-N 3.45Å; P137-A141 WeakPolarHBondContact O-CB 3.16Å; P137-A141 PolarHBondContact O-N 2.85Å
138	V	97.3	Very high	95.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-45.9	-178.3	173.4	0	0	0	0	111.3	V88 Q90 V131 S132 G133 L134 A135 E136 R140 A141 Y142	V88-V138 HydrophobicContact CB-CB 4.2Å; V88-V138 HydrophobicContact CB-CG1 4.15Å; V88-V138 HydrophobicContact CB-CG2 4.2Å; V88-V138 HydrophobicContact CG1-CB 4.32Å; V88-V138 HydrophobicContact CG1-CG1 3.74Å; Q90-V138 HydrophobicContact CB-CG1 4.33Å; V131-V138 HydrophobicContact CB-CG1 4.48Å; V131-V138 HydrophobicContact CG1-CB 4.31Å; V131-V138 HydrophobicContact CG1-CG1 3.9Å; V131-V138 HydrophobicContact CG1-CG2 4.27Å; S132-V138 VanDerWaalsContact C-CG2 3.4Å; G133-V138 VanDerWaalsContact N-CG2 3.35Å; L134-V138 WeakPolarHBondContact O-CG2 3.47Å; L134-V138 PolarHBondContact O-N 2.74Å; L134-V138 VanDerWaalsContact O-N 3.12Å; A135-V138 PolarHBondContact O-N 3.09Å; E136-V138 VanDerWaalsContact C-N 3.31Å; E136-V138 PolarHBondContact O-N 3.02Å; V138-R140 VanDerWaalsContact C-N 3.31Å; V138-R140 PolarHBondContact O-N 2.89Å; V138-A141 PolarHBondContact O-N 3.44Å; V138-Y142 WeakPolarHBondContact O-CB 3.15Å; V138-Y142 PolarHBondContact O-N 2.82Å
139	V	96.3	Very high	95.7	Very high	88 Å²	88	36.9 Å²	36.9	53%	0.533	20%	0.196	S	C	.	.	H	α-helix	trans	-64.3	-37.1	176.7	172.3	0	0	0	0	111.4	A135 E136 S143	A135-V139 WeakPolarHBondContact O-CG2 3.49Å; A135-V139 PolarHBondContact O-N 3.27Å; E136-V139 PolarHBondContact O-N 3.33Å; V139-S143 WeakPolarHBondContact O-CB 3.43Å; V139-S143 PolarHBondContact O-N 3.11Å; V139-S143 PolarHBondContact O-OG 3.49Å
140	R	95.9	Very high	95.5	Very high	118 Å²	118	41.2 Å²	41.2	45%	0.445	22%	0.223	S	C	.	.	H	α-helix	trans	-64.3	-47.1	174.9	-174.6	-172	-72.9	-143.8	5.1	111.5	T117 E136 P137 V138 S143 L144	T117-R140 HydrophobicContact CG2-CG 4.45Å; E136-R140 VanDerWaalsContact O-CB 3.25Å; E136-R140 WeakPolarHBondContact O-CB 2.96Å; E136-R140 PolarHBondContact O-N 3.35Å; E136-R140 IonicContact OE1-CZ 2.65Å; E136-R140 IonicContact OE1-NE 3.65Å; E136-R140 IonicContact OE1-NH2 3.49Å; E136-R140 PolarHBondContact OE1-NH2 3.24Å; P137-R140 PolarHBondContact O-N 3.45Å; V138-R140 VanDerWaalsContact C-N 3.31Å; V138-R140 PolarHBondContact O-N 2.89Å; R140-S143 PolarHBondContact O-N 3Å; R140-L144 PolarHBondContact O-N 3.41Å
141	A	97.1	Very high	95.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-46.9	175.1	0	0	0	0	0	112	T117 A119 I121 V131 P137 V138 S143 L144 I145	T117-A141 VanDerWaalsContact CG2-CA 3.45Å; T117-A141 HydrophobicContact CG2-CB 3.64Å; A119-A141 HydrophobicContact CB-CB 4Å; I121-A141 HydrophobicContact CD1-CB 4.03Å; V131-A141 HydrophobicContact CG1-CB 3.72Å; P137-A141 WeakPolarHBondContact O-CB 3.16Å; P137-A141 PolarHBondContact O-N 2.85Å; V138-A141 PolarHBondContact O-N 3.44Å; A141-S143 VanDerWaalsContact C-N 3.29Å; A141-S143 PolarHBondContact O-N 3.18Å; A141-L144 PolarHBondContact O-N 2.97Å; A141-I145 WeakPolarHBondContact O-CD1 3.35Å; A141-I145 VanDerWaalsContact O-CG1 3.29Å; A141-I145 WeakPolarHBondContact O-CG1 3.49Å; A141-I145 PolarHBondContact O-N 3.37Å
142	Y	95.6	Very high	94.9	Very high	90 Å²	90	46.9 Å²	46.9	35%	0.353	24%	0.242	S	C	.	.	H	α-helix	trans	-55.5	-45.8	175.9	-177	-84.1	0	0	0	111.5	Q90 L92 V138 L144 I145 A146	Q90-Y142 HydrophobicContact CG-CD2 4.33Å; Q90-Y142 VanDerWaalsContact NE2-CD2 3.32Å; L92-Y142 HydrophobicContact CD1-CD2 3.37Å; L92-Y142 HydrophobicContact CD1-CE2 3.92Å; L92-Y142 HydrophobicContact CD1-CG 4.02Å; L92-Y142 HydrophobicContact CD2-CD2 4.23Å; L92-Y142 HydrophobicContact CD2-CE2 3.89Å; L92-Y142 HydrophobicContact CG-CD2 3.6Å; L92-Y142 HydrophobicContact CG-CE2 3.64Å; V138-Y142 WeakPolarHBondContact O-CB 3.15Å; V138-Y142 PolarHBondContact O-N 2.82Å; Y142-L144 PolarHBondContact O-N 3.11Å; Y142-I145 PolarHBondContact O-N 3.04Å; Y142-A146 HydrophobicContact CD1-CB 4.46Å; Y142-A146 HydrophobicContact CE1-CB 4.23Å; Y142-A146 VanDerWaalsContact O-CB 3.22Å; Y142-A146 WeakPolarHBondContact O-CB 3.32Å; Y142-A146 PolarHBondContact O-N 2.95Å
143	S	95	Very high	94.6	Very high	65 Å²	65	51.6 Å²	51.6	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-62.2	-41.8	-178.8	-58.3	0	0	0	0	112.9	V139 R140 A141 D147	V139-S143 WeakPolarHBondContact O-CB 3.43Å; V139-S143 PolarHBondContact O-N 3.11Å; V139-S143 PolarHBondContact O-OG 3.49Å; R140-S143 PolarHBondContact O-N 3Å; A141-S143 VanDerWaalsContact C-N 3.29Å; A141-S143 PolarHBondContact O-N 3.18Å; S143-D147 PolarHBondContact O-N 2.96Å; S143-D147 VanDerWaalsContact O-N 3.11Å
144	L	95.1	Very high	94.1	Very high	71 Å²	71	53.3 Å²	53.3	37%	0.372	28%	0.281	S	S	.	.	H	α-helix	trans	-68.8	-42	177.4	-68.9	176.4	0	0	0	112.3	L113 T117 R140 A141 Y142 A146 L148 L206	L113-L144 HydrophobicContact CD1-CB 4.05Å; L113-L144 HydrophobicContact CD1-CD1 3.97Å; T117-L144 HydrophobicContact CG2-CD1 3.82Å; R140-L144 PolarHBondContact O-N 3.41Å; A141-L144 PolarHBondContact O-N 2.97Å; Y142-L144 PolarHBondContact O-N 3.11Å; L144-A146 VanDerWaalsContact C-N 3.33Å; L144-L148 WeakPolarHBondContact O-CB 3.41Å; L144-L148 PolarHBondContact O-N 2.78Å; L144-L148 VanDerWaalsContact O-N 3.11Å; L144-L206 HydrophobicContact CD1-CD1 4.33Å
145	I	95.3	Very high	93.5	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-67.1	-37.7	177.2	-61.3	157.3	0	0	0	110.3	L92 F102 L113 L129 V131 A141 Y142 L148 V149	L92-I145 HydrophobicContact CD1-CB 3.85Å; L92-I145 HydrophobicContact CD1-CD1 3.76Å; L92-I145 HydrophobicContact CD1-CG1 4.43Å; L92-I145 HydrophobicContact CD1-CG2 3.84Å; L92-I145 HydrophobicContact CD2-CG2 4.2Å; F102-I145 HydrophobicContact CZ-CG2 4.5Å; L113-I145 HydrophobicContact CD2-CD1 4.1Å; L113-I145 HydrophobicContact CD2-CG1 3.85Å; L129-I145 HydrophobicContact CD1-CD1 3.85Å; L129-I145 HydrophobicContact CD1-CG1 4.41Å; L129-I145 HydrophobicContact CD1-CG2 4.47Å; V131-I145 HydrophobicContact CG2-CD1 4.05Å; A141-I145 WeakPolarHBondContact O-CD1 3.35Å; A141-I145 VanDerWaalsContact O-CG1 3.29Å; A141-I145 WeakPolarHBondContact O-CG1 3.49Å; A141-I145 PolarHBondContact O-N 3.37Å; Y142-I145 PolarHBondContact O-N 3.04Å; I145-L148 WeakPolarHBondContact O-CB 3.45Å; I145-L148 PolarHBondContact O-N 3.22Å; I145-V149 WeakPolarHBondContact O-CG2 3.29Å; I145-V149 PolarHBondContact O-N 3.05Å
146	A	93.3	Very high	92.6	Very high	30 Å²	30	55 Å²	55	25%	0.248	29%	0.285	C	S	.	.	H	α-helix	trans	-65.6	-45.2	177.9	0	0	0	0	0	112.8	Y142 L144 L148 V149 V150	Y142-A146 HydrophobicContact CD1-CB 4.46Å; Y142-A146 HydrophobicContact CE1-CB 4.23Å; Y142-A146 VanDerWaalsContact O-CB 3.22Å; Y142-A146 WeakPolarHBondContact O-CB 3.32Å; Y142-A146 PolarHBondContact O-N 2.95Å; L144-A146 VanDerWaalsContact C-N 3.33Å; A146-L148 VanDerWaalsContact C-N 3.34Å; A146-L148 PolarHBondContact O-N 3.04Å; A146-V149 PolarHBondContact O-N 3.19Å; A146-V150 WeakPolarHBondContact O-CB 3.4Å; A146-V150 WeakPolarHBondContact O-CG2 3.46Å; A146-V150 PolarHBondContact O-N 3Å
147	D	93.3	Very high	91.4	Very high	58 Å²	58	53.1 Å²	53.1	31%	0.31	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-42.7	173	-174.5	69.3	0	0	0	110.4	S143 V149 V150 R151	S143-D147 PolarHBondContact O-N 2.96Å; S143-D147 VanDerWaalsContact O-N 3.11Å; D147-V149 VanDerWaalsContact C-N 3.3Å; D147-V149 PolarHBondContact O-N 3.34Å; D147-V150 PolarHBondContact O-N 3.39Å; D147-R151 VanDerWaalsContact O-CB 3.27Å; D147-R151 WeakPolarHBondContact O-CB 3.43Å; D147-R151 WeakPolarHBondContact O-CG 3.14Å; D147-R151 PolarHBondContact O-N 3.38Å; D147-R151 IonicContact OD1-CZ 3.86Å; D147-R151 IonicContact OD1-NE 3.97Å; D147-R151 PolarHBondContact OD1-NE 3.23Å; D147-R151 IonicContact OD1-NH2 2.99Å; D147-R151 PolarHBondContact OD1-NH2 2.65Å; D147-R151 IonicContact OD2-CZ 3.74Å; D147-R151 IonicContact OD2-NE 2.64Å; D147-R151 PolarHBondContact OD2-NE 3.42Å; D147-R151 IonicContact OD2-NH2 2.78Å
148	L	94.3	Very high	89.8	Confident	10 Å²	10	60.7 Å²	60.7	5%	0.052	32%	0.317	C	S	.	.	H	α-helix	trans	-54.6	-43.1	176.4	-165.4	76.3	0	0	0	112.8	I101 F102 L144 I145 A146 Y152 V199 I202 L203	I101-L148 HydrophobicContact CD1-CD2 3.92Å; I101-L148 HydrophobicContact CD1-CG 4.45Å; F102-L148 HydrophobicContact CE1-CD2 4.42Å; F102-L148 HydrophobicContact CZ-CD2 4.1Å; L144-L148 WeakPolarHBondContact O-CB 3.41Å; L144-L148 PolarHBondContact O-N 2.78Å; L144-L148 VanDerWaalsContact O-N 3.11Å; I145-L148 WeakPolarHBondContact O-CB 3.45Å; I145-L148 PolarHBondContact O-N 3.22Å; A146-L148 VanDerWaalsContact C-N 3.34Å; A146-L148 PolarHBondContact O-N 3.04Å; L148-Y152 PolarHBondContact O-N 3.08Å; L148-Y152 VanDerWaalsContact O-N 3.16Å; L148-V199 HydrophobicContact CD1-CG1 3.81Å; L148-V199 HydrophobicContact CG-CG1 4.43Å; L148-I202 HydrophobicContact CD1-CB 4.36Å; L148-I202 HydrophobicContact CD1-CG2 3.91Å; L148-L203 HydrophobicContact CD1-CD2 4.29Å; L148-L203 HydrophobicContact CD1-CG 4.43Å
149	V	94.1	Very high	87.9	Confident	18 Å²	18	68.8 Å²	68.8	11%	0.109	35%	0.347	C	S	.	.	H	α-helix	trans	-68	-51.3	175.8	171.8	0	0	0	0	111.4	P95 L98 I145 A146 D147 R151 Y152 E153	P95-V149 HydrophobicContact CG-CG1 4.2Å; L98-V149 HydrophobicContact CD1-CG2 3.99Å; I145-V149 WeakPolarHBondContact O-CG2 3.29Å; I145-V149 PolarHBondContact O-N 3.05Å; A146-V149 PolarHBondContact O-N 3.19Å; D147-V149 VanDerWaalsContact C-N 3.3Å; D147-V149 PolarHBondContact O-N 3.34Å; V149-R151 VanDerWaalsContact C-N 3.26Å; V149-R151 PolarHBondContact O-N 3.33Å; V149-Y152 WeakPolarHBondContact O-CB 3.47Å; V149-Y152 PolarHBondContact O-N 3.01Å; V149-Y152 VanDerWaalsContact O-N 3.08Å; V149-E153 HydrophobicContact CG1-CG 4.42Å; V149-E153 PolarHBondContact O-N 3.42Å
150	V	93.1	Very high	86	Confident	92 Å²	92	70.4 Å²	70.4	56%	0.558	36%	0.357	S	S	*	.	H	α-helix	trans	-59.3	-37.6	180	169.4	0	0	0	0	111.6	A146 D147 G154	A146-V150 WeakPolarHBondContact O-CB 3.4Å; A146-V150 WeakPolarHBondContact O-CG2 3.46Å; A146-V150 PolarHBondContact O-N 3Å; D147-V150 PolarHBondContact O-N 3.39Å; V150-G154 PolarHBondContact O-N 2.98Å
151	R	89.2	Confident	83.8	Confident	124 Å²	124	73 Å²	73	47%	0.468	37%	0.374	S	S	.	.	H	α-helix	trans	-69.1	-37.2	177.1	-64.3	-82	175.6	169.8	4.6	112	D147 V149 T155 I202	D147-R151 VanDerWaalsContact O-CB 3.27Å; D147-R151 WeakPolarHBondContact O-CB 3.43Å; D147-R151 WeakPolarHBondContact O-CG 3.14Å; D147-R151 PolarHBondContact O-N 3.38Å; D147-R151 IonicContact OD1-CZ 3.86Å; D147-R151 IonicContact OD1-NE 3.97Å; D147-R151 PolarHBondContact OD1-NE 3.23Å; D147-R151 IonicContact OD1-NH2 2.99Å; D147-R151 PolarHBondContact OD1-NH2 2.65Å; D147-R151 IonicContact OD2-CZ 3.74Å; D147-R151 IonicContact OD2-NE 2.64Å; D147-R151 PolarHBondContact OD2-NE 3.42Å; D147-R151 IonicContact OD2-NH2 2.78Å; V149-R151 VanDerWaalsContact C-N 3.26Å; V149-R151 PolarHBondContact O-N 3.33Å; R151-T155 WeakPolarHBondContact O-CG2 3.38Å; R151-T155 PolarHBondContact O-N 2.93Å; R151-T155 PolarHBondContact O-OG1 2.87Å; R151-I202 HydrophobicContact CB-CD1 4.14Å; R151-I202 HydrophobicContact CG-CD1 3.7Å
152	Y	91.5	Very high	81.2	Confident	34 Å²	34	80.1 Å²	80.1	13%	0.133	41%	0.409	C	S	.	.	H	α-helix	trans	-64.5	-54.7	172.8	175.4	-96.9	0	0	0	110.7	P95 A97 L98 L148 V149 G154 T155 Q156 P196	P95-Y152 HydrophobicContact CB-CD1 4.08Å; P95-Y152 HydrophobicContact CB-CE1 3.84Å; P95-Y152 HydrophobicContact CG-CD1 4.07Å; P95-Y152 HydrophobicContact CG-CE1 4.28Å; A97-Y152 HydrophobicContact CB-CE2 4.09Å; A97-Y152 WeakPolarHBondContact CB-OH 3.26Å; L98-Y152 HydrophobicContact CD1-CG 4.26Å; L98-Y152 HydrophobicContact CD2-CD2 3.57Å; L98-Y152 HydrophobicContact CD2-CE2 4.18Å; L98-Y152 HydrophobicContact CD2-CG 3.79Å; L98-Y152 HydrophobicContact CG-CD1 4.49Å; L98-Y152 HydrophobicContact CG-CD2 4.34Å; L98-Y152 HydrophobicContact CG-CG 4.17Å; L148-Y152 PolarHBondContact O-N 3.08Å; L148-Y152 VanDerWaalsContact O-N 3.16Å; V149-Y152 WeakPolarHBondContact O-CB 3.47Å; V149-Y152 PolarHBondContact O-N 3.01Å; V149-Y152 VanDerWaalsContact O-N 3.08Å; Y152-G154 PolarHBondContact O-N 3.34Å; Y152-T155 PolarHBondContact O-N 3.09Å; Y152-T155 PolarHBondContact O-OG1 3.32Å; Y152-Q156 HydrophobicContact CD1-CG 4.36Å; Y152-Q156 HydrophobicContact CE1-CG 3.86Å; Y152-Q156 HydrophobicContact CE2-CG 4.25Å; Y152-Q156 VanDerWaalsContact CE2-NE2 3.3Å; Y152-Q156 VanDerWaalsContact CZ-NE2 3.27Å; Y152-Q156 PolarHBondContact O-N 2.75Å; Y152-Q156 VanDerWaalsContact O-N 3.14Å; Y152-Q156 PolarHBondContact OH-NE2 3.1Å; Y152-P196 HydrophobicContact CD2-CG 3.83Å; Y152-P196 HydrophobicContact CE2-CG 4.22Å
153	E	89.9	Confident	79	Confident	101 Å²	101	80.2 Å²	80.2	47%	0.472	44%	0.438	S	S	.	.	H	α-helix	trans	-61	-43.1	-177.6	-67.8	178.6	170.7	0	0	112.3	P95 V149 T155 Q156 S157	P95-E153 HydrophobicContact CG-CG 4.32Å; V149-E153 HydrophobicContact CG1-CG 4.42Å; V149-E153 PolarHBondContact O-N 3.42Å; E153-T155 PolarHBondContact O-N 3.2Å; E153-T155 VanDerWaalsContact O-N 3.16Å; E153-Q156 PolarHBondContact O-N 3.3Å; E153-Q156 VanDerWaalsContact O-N 3.08Å; E153-S157 PolarHBondContact O-N 3.26Å
154	G	85.5	Confident	76.3	Confident	35 Å²	35	82.1 Å²	82.1	36%	0.361	44%	0.443	S	S	.	.	H	α-helix	trans	-62.6	-18.1	175	0	0	0	0	0	114.9	V150 Y152 K158	V150-G154 PolarHBondContact O-N 2.98Å; Y152-G154 PolarHBondContact O-N 3.34Å; G154-K158 WeakPolarHBondContact O-CG 3.32Å
155	T	83.3	Confident	74	Confident	39 Å²	39	88 Å²	88	24%	0.239	46%	0.46	C	S	.	.	H	α-helix	trans	-90.6	-31.9	169.9	60.5	0	0	0	0	113.5	R151 Y152 E153 R159 P196 T198	R151-T155 WeakPolarHBondContact O-CG2 3.38Å; R151-T155 PolarHBondContact O-N 2.93Å; R151-T155 PolarHBondContact O-OG1 2.87Å; Y152-T155 PolarHBondContact O-N 3.09Å; Y152-T155 PolarHBondContact O-OG1 3.32Å; E153-T155 PolarHBondContact O-N 3.2Å; E153-T155 VanDerWaalsContact O-N 3.16Å; T155-R159 PolarHBondContact O-N 2.66Å; T155-P196 HydrophobicContact CG2-CB 4.13Å; T155-P196 WeakPolarHBondContact OG1-CB 3.36Å; T155-P196 WeakPolarHBondContact OG1-CG 3.47Å; T155-T198 HydrophobicContact CG2-CG2 4.43Å; T155-T198 WeakPolarHBondContact CG2-OG1 3.28Å
156	Q	76.6	Confident	71.9	Confident	58 Å²	58	93.3 Å²	93.3	27%	0.271	49%	0.492	S	S	.	.	H	α-helix	trans	-71.4	-39.4	176.7	-61.7	-63.1	0.5	0	0	112	Y152 E153 K158 R159 T160	Y152-Q156 HydrophobicContact CD1-CG 4.36Å; Y152-Q156 HydrophobicContact CE1-CG 3.86Å; Y152-Q156 HydrophobicContact CE2-CG 4.25Å; Y152-Q156 VanDerWaalsContact CE2-NE2 3.3Å; Y152-Q156 VanDerWaalsContact CZ-NE2 3.27Å; Y152-Q156 PolarHBondContact O-N 2.75Å; Y152-Q156 VanDerWaalsContact O-N 3.14Å; Y152-Q156 PolarHBondContact OH-NE2 3.1Å; E153-Q156 PolarHBondContact O-N 3.3Å; E153-Q156 VanDerWaalsContact O-N 3.08Å; Q156-K158 PolarHBondContact O-N 3.46Å; Q156-R159 WeakPolarHBondContact O-CB 3.36Å; Q156-R159 PolarHBondContact O-N 3.37Å; Q156-R159 VanDerWaalsContact O-N 3.11Å; Q156-T160 PolarHBondContact O-N 2.9Å; Q156-T160 PolarHBondContact O-OG1 2.86Å
157	S	69.6	Low	69.9	Low	78 Å²	78	99.9 Å²	99.9	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-53.6	-55.2	173.2	171.3	0	0	0	0	111.4	E153 R159 T160	E153-S157 PolarHBondContact O-N 3.26Å; S157-R159 PolarHBondContact O-N 3.19Å; S157-R159 VanDerWaalsContact O-N 3.11Å; S157-T160 WeakPolarHBondContact O-CB 3.37Å; S157-T160 PolarHBondContact O-N 2.85Å
158	K	64.3	Low	68.1	Low	165 Å²	165	99.6 Å²	99.6	72%	0.717	53%	0.533	S	S	*	.	H	α-helix	trans	-59.6	-24.9	177.2	-67.8	179.7	-178.8	-178.1	0	114.4	G154 Q156 T160	G154-K158 WeakPolarHBondContact O-CG 3.32Å; Q156-K158 PolarHBondContact O-N 3.46Å; K158-T160 VanDerWaalsContact C-N 3.25Å; K158-T160 PolarHBondContact O-N 2.85Å
159	R	58	Low	66.7	Low	170 Å²	170	101.7 Å²	101.7	64%	0.642	54%	0.542	S	S	*	.	H	α-helix	trans	-76.3	-12.9	178.1	-152.3	-179.7	-166.2	178.4	5.6	113.4	T155 Q156 S157	T155-R159 PolarHBondContact O-N 2.66Å; Q156-R159 WeakPolarHBondContact O-CB 3.36Å; Q156-R159 PolarHBondContact O-N 3.37Å; Q156-R159 VanDerWaalsContact O-N 3.11Å; S157-R159 PolarHBondContact O-N 3.19Å; S157-R159 VanDerWaalsContact O-N 3.11Å
160	T	55.5	Low	66.1	Low	121 Å²	121	103.4 Å²	103.4	74%	0.742	56%	0.555	S	S	*	*	H	α-helix	trans	-90	-30.4	-176.7	-53.3	0	0	0	0	111.8	Q156 S157 K158	Q156-T160 PolarHBondContact O-N 2.9Å; Q156-T160 PolarHBondContact O-OG1 2.86Å; S157-T160 WeakPolarHBondContact O-CB 3.37Å; S157-T160 PolarHBondContact O-N 2.85Å; K158-T160 VanDerWaalsContact C-N 3.25Å; K158-T160 PolarHBondContact O-N 2.85Å
161	E	50.2	Low	65.5	Low	172 Å²	172	104 Å²	104	80%	0.804	56%	0.555	S	S	*	*	H	α-helix	trans	-92.7	-21.8	-171.8	-63.3	-161.5	135.3	0	0	115.5
162	M	42.7	Very low	65.3	Low	150 Å²	150	102.8 Å²	102.8	74%	0.739	56%	0.558	S	S	*	*			trans	-146	124.7	178.7	-157.2	62.4	166.4	0	0	113.4	D164	M162-D164 VanDerWaalsContact C-N 3.25Å; M162-D164 PolarHBondContact O-N 3.02Å; M162-D164 VanDerWaalsContact O-N 3.11Å
163	G	49.6	Very low	65.1	Low	92 Å²	92	102.5 Å²	102.5	95%	0.948	56%	0.561	S	S	*	*			trans	-81.2	30.4	-176.1	0	0	0	0	0	115.9
164	D	37.5	Very low	64.9	Low	105 Å²	105	103.9 Å²	103.9	56%	0.561	56%	0.561	S	S	*	*			trans	-128.3	137.9	-179.3	-160.8	23.3	0	0	0	114.2	M162	M162-D164 VanDerWaalsContact C-N 3.25Å; M162-D164 PolarHBondContact O-N 3.02Å; M162-D164 VanDerWaalsContact O-N 3.11Å
165	R	46.9	Very low	65.2	Low	196 Å²	196	109.3 Å²	109.3	74%	0.74	57%	0.571	S	S	*	*			trans	31.8	111.4	169	-72	147.4	-146.3	-114.6	-4.3	119.7	L167	R165-L167 PolarHBondContact O-N 3.42Å
166	V	52	Low	65.6	Low	112 Å²	112	109.6 Å²	109.6	68%	0.679	58%	0.578	S	S	*	*			trans	-46.4	104.4	147.6	179.9	0	0	0	0	110.3	E169	V166-E169 HydrophobicContact CG1-CG 3.74Å
167	L	51.6	Low	66.4	Low	168 Å²	168	106.9 Å²	106.9	88%	0.88	57%	0.565	S	S	*	*			trans	-130.4	24.9	-178.6	-153.4	78.3	0	0	0	112.6	R165	R165-L167 PolarHBondContact O-N 3.42Å
168	G	55.8	Low	67.5	Low	52 Å²	52	107.7 Å²	107.7	54%	0.536	56%	0.559	S	S	.	*	S	Bend	trans	-130	5.9	-175.1	0	0	0	0	0	115.6
169	E	64.4	Low	68.8	Low	53 Å²	53	103.9 Å²	103.9	25%	0.248	55%	0.549	C	S	.	.	S	Bend	trans	-107.8	130.7	171.4	-27.8	-165.7	153.9	0	0	108.8	V166 L171 R174 G197	V166-E169 HydrophobicContact CG1-CG 3.74Å; E169-L171 PolarHBondContact O-N 3.08Å; E169-R174 VanDerWaalsContact OE2-CD 3.28Å; E169-R174 WeakPolarHBondContact OE2-CD 3.25Å; E169-G197 VanDerWaalsContact CD-CA 3.42Å; E169-G197 WeakPolarHBondContact OE1-CA 3.46Å; E169-G197 PolarHBondContact OE1-N 2.98Å
170	S	80.1	Confident	70.5	Confident	54 Å²	54	96.7 Å²	96.7	38%	0.378	52%	0.523	S	S	.	.			trans	-64.6	134.6	165.4	168.6	0	0	0	0	109.7	D172 S173 R174 E201	S170-D172 PolarHBondContact O-N 3.34Å; S170-D172 VanDerWaalsContact O-N 3.12Å; S170-D172 PolarHBondContact OG-N 2.86Å; S170-S173 WeakPolarHBondContact CB-OG 3.28Å; S170-S173 PolarHBondContact O-N 3.2Å; S170-R174 PolarHBondContact O-N 3.2Å; S170-E201 WeakPolarHBondContact CB-OE1 3.19Å; S170-E201 PolarHBondContact N-OE1 3.31Å
171	L	81.9	Confident	72.2	Confident	106 Å²	106	90.9 Å²	90.9	56%	0.555	49%	0.488	S	S	*	.	H	α-helix	trans	-58.7	-25	176.3	-69.8	176.3	0	0	0	112.2	E169 R175	E169-L171 PolarHBondContact O-N 3.08Å; L171-R175 WeakPolarHBondContact O-CG 3.26Å; L171-R175 PolarHBondContact O-N 3.14Å; L171-R175 PolarHBondContact O-NE 3.03Å
172	D	84.4	Confident	74.1	Confident	97 Å²	97	87.9 Å²	87.9	52%	0.519	47%	0.474	S	S	.	.	H	α-helix	trans	-88.5	-36.8	-179.7	-61.9	-34.6	0	0	0	112	S170 R174 R175 A176	S170-D172 PolarHBondContact O-N 3.34Å; S170-D172 VanDerWaalsContact O-N 3.12Å; S170-D172 PolarHBondContact OG-N 2.86Å; D172-R174 VanDerWaalsContact C-N 3.31Å; D172-R174 PolarHBondContact O-N 2.91Å; D172-R175 PolarHBondContact O-N 3.03Å; D172-R175 IonicContact OD1-CZ 3.3Å; D172-R175 VanDerWaalsContact OD1-CZ 3.3Å; D172-R175 IonicContact OD1-NE 3.23Å; D172-R175 PolarHBondContact OD1-NE 2.98Å; D172-R175 IonicContact OD1-NH2 2.65Å; D172-R175 PolarHBondContact OD1-NH2 3.32Å; D172-A176 VanDerWaalsContact O-CB 3.28Å; D172-A176 WeakPolarHBondContact O-CB 3.42Å; D172-A176 PolarHBondContact O-N 3.23Å
173	S	86.8	Confident	76.4	Confident	28 Å²	28	87.3 Å²	87.3	20%	0.196	47%	0.467	C	S	.	.	H	α-helix	trans	-57.4	-45.9	166	-56.6	0	0	0	0	111	S170 R175 A176 F177 E201 L204	S170-S173 WeakPolarHBondContact CB-OG 3.28Å; S170-S173 PolarHBondContact O-N 3.2Å; S173-R175 VanDerWaalsContact C-N 3.33Å; S173-R175 PolarHBondContact O-N 3.18Å; S173-A176 PolarHBondContact O-N 3.46Å; S173-F177 WeakPolarHBondContact O-CB 3.4Å; S173-F177 PolarHBondContact O-N 2.98Å; S173-E201 VanDerWaalsContact CB-CG 3.45Å; S173-E201 WeakPolarHBondContact CB-OE1 3.34Å; S173-E201 WeakPolarHBondContact OG-CG 3.46Å; S173-E201 PolarHBondContact OG-OE1 2.95Å; S173-L204 WeakPolarHBondContact O-CD1 3.49Å
174	R	86.8	Confident	78.2	Confident	130 Å²	130	87 Å²	87	49%	0.491	44%	0.438	S	S	.	.	H	α-helix	trans	-62.9	-37.1	177.7	-167.9	178.6	65.6	143.8	-1.9	112.5	E169 S170 D172 K178	E169-R174 VanDerWaalsContact OE2-CD 3.28Å; E169-R174 WeakPolarHBondContact OE2-CD 3.25Å; S170-R174 PolarHBondContact O-N 3.2Å; D172-R174 VanDerWaalsContact C-N 3.31Å; D172-R174 PolarHBondContact O-N 2.91Å; R174-K178 VanDerWaalsContact O-CB 3.24Å; R174-K178 WeakPolarHBondContact O-CB 3.29Å; R174-K178 PolarHBondContact O-N 3.35Å; R174-K178 VanDerWaalsContact O-N 3.15Å
175	R	90.9	Very high	80.4	Confident	149 Å²	149	90.2 Å²	90.2	56%	0.562	45%	0.449	S	S	*	.	H	α-helix	trans	-73.3	-39	174.9	-79.5	-173.7	-78	-155.7	0.5	112.9	L171 D172 S173 T179	L171-R175 WeakPolarHBondContact O-CG 3.26Å; L171-R175 PolarHBondContact O-N 3.14Å; L171-R175 PolarHBondContact O-NE 3.03Å; D172-R175 PolarHBondContact O-N 3.03Å; D172-R175 IonicContact OD1-CZ 3.3Å; D172-R175 VanDerWaalsContact OD1-CZ 3.3Å; D172-R175 IonicContact OD1-NE 3.23Å; D172-R175 PolarHBondContact OD1-NE 2.98Å; D172-R175 IonicContact OD1-NH2 2.65Å; D172-R175 PolarHBondContact OD1-NH2 3.32Å; S173-R175 VanDerWaalsContact C-N 3.33Å; S173-R175 PolarHBondContact O-N 3.18Å; R175-T179 WeakPolarHBondContact O-CB 3.12Å; R175-T179 PolarHBondContact O-N 3.49Å; R175-T179 PolarHBondContact O-OG1 2.94Å
176	A	91.1	Very high	82.4	Confident	46 Å²	46	82.5 Å²	82.5	38%	0.38	42%	0.423	S	S	.	.	H	α-helix	trans	-66.5	-48.2	177	0	0	0	0	0	111.2	D172 S173 K178 T179 L180 L204	D172-A176 VanDerWaalsContact O-CB 3.28Å; D172-A176 WeakPolarHBondContact O-CB 3.42Å; D172-A176 PolarHBondContact O-N 3.23Å; S173-A176 PolarHBondContact O-N 3.46Å; A176-K178 PolarHBondContact O-N 2.87Å; A176-T179 PolarHBondContact O-N 2.91Å; A176-L180 WeakPolarHBondContact O-CB 3.27Å; A176-L180 PolarHBondContact O-N 3.48Å; A176-L204 HydrophobicContact CB-CD1 3.96Å; A176-L204 HydrophobicContact CB-CD2 4.21Å
177	F	93.8	Very high	84.2	Confident	1 Å²	1	86.7 Å²	86.7	0%	0.004	43%	0.426	C	S	.	.	H	α-helix	trans	-61.4	-43.9	177.1	-173.6	-87.1	0	0	0	111.4	F109 S173 T179 L180 V181 L192 L195 K200 L203 L204	F109-F177 HydrophobicContact CE1-CE2 4.18Å; F109-F177 AromaticContact CZ-CE2 3.72Å; F109-F177 HydrophobicContact CZ-CE2 3.72Å; F109-F177 HydrophobicContact CZ-CZ 4.08Å; S173-F177 WeakPolarHBondContact O-CB 3.4Å; S173-F177 PolarHBondContact O-N 2.98Å; F177-T179 PolarHBondContact O-N 3Å; F177-L180 PolarHBondContact O-N 3.18Å; F177-V181 HydrophobicContact CD1-CG2 4.04Å; F177-V181 HydrophobicContact CE1-CG2 3.59Å; F177-V181 HydrophobicContact CE2-CG2 4.3Å; F177-V181 HydrophobicContact CZ-CG2 3.75Å; F177-V181 WeakPolarHBondContact O-CG2 3.39Å; F177-V181 PolarHBondContact O-N 3.41Å; F177-L192 HydrophobicContact CE1-CB 4.17Å; F177-L192 VanDerWaalsContact CE1-O 3.27Å; F177-L192 WeakPolarHBondContact CE1-O 3.39Å; F177-L192 HydrophobicContact CZ-CB 4.23Å; F177-L192 HydrophobicContact CZ-CD2 4.29Å; F177-L195 HydrophobicContact CZ-CD1 4.46Å; F177-K200 HydrophobicContact CB-CB 4.19Å; F177-K200 HydrophobicContact CB-CD 4.47Å; F177-K200 HydrophobicContact CB-CG 4.48Å; F177-K200 HydrophobicContact CD1-CB 4.33Å; F177-K200 HydrophobicContact CD1-CD 3.84Å; F177-K200 HydrophobicContact CD1-CG 3.76Å; F177-K200 HydrophobicContact CD2-CB 3.71Å; F177-K200 HydrophobicContact CD2-CG 3.9Å; F177-K200 HydrophobicContact CE1-CD 4.25Å; F177-K200 HydrophobicContact CE1-CG 3.89Å; F177-K200 HydrophobicContact CE2-CB 4.16Å; F177-K200 HydrophobicContact CE2-CG 4.02Å; F177-K200 HydrophobicContact CG-CB 3.81Å; F177-K200 HydrophobicContact CG-CD 4.08Å; F177-K200 HydrophobicContact CG-CG 3.77Å; F177-K200 HydrophobicContact CZ-CG 4.01Å; F177-L203 HydrophobicContact CE2-CB 4Å; F177-L203 HydrophobicContact CE2-CD1 3.81Å; F177-L203 HydrophobicContact CZ-CD1 4.23Å; F177-L204 HydrophobicContact CB-CD1 4.07Å; F177-L204 HydrophobicContact CB-CD2 4.37Å; F177-L204 HydrophobicContact CB-CG 4.19Å; F177-L204 HydrophobicContact CD2-CG 4.25Å
178	K	92.8	Very high	86.2	Confident	95 Å²	95	79.9 Å²	79.9	41%	0.413	39%	0.39	S	S	.	.	H	α-helix	trans	-56.8	-52	173.9	-179.8	175.3	177.1	179.6	0	111.6	R174 A176 L180 V181 E182 L193	R174-K178 VanDerWaalsContact O-CB 3.24Å; R174-K178 WeakPolarHBondContact O-CB 3.29Å; R174-K178 PolarHBondContact O-N 3.35Å; R174-K178 VanDerWaalsContact O-N 3.15Å; A176-K178 PolarHBondContact O-N 2.87Å; K178-L180 PolarHBondContact O-N 3.37Å; K178-V181 PolarHBondContact O-N 2.69Å; K178-E182 WeakPolarHBondContact CE-OE1 3.22Å; K178-E182 WeakPolarHBondContact CE-OE2 3.4Å; K178-E182 HydrophobicContact CG-CG 4.27Å; K178-E182 IonicContact NZ-OE1 3.18Å; K178-E182 PolarHBondContact NZ-OE1 2.96Å; K178-E182 IonicContact NZ-OE2 3.76Å; K178-E182 WeakPolarHBondContact O-CB 3.4Å; K178-E182 PolarHBondContact O-N 3.19Å; K178-L193 HydrophobicContact CB-CD2 3.98Å; K178-L193 HydrophobicContact CG-CD2 3.92Å
179	T	92.7	Very high	87.9	Confident	84 Å²	84	78.6 Å²	78.6	52%	0.515	37%	0.371	S	S	.	.	H	α-helix	trans	-64.9	-23.9	178.8	-51.4	0	0	0	0	113.2	R175 A176 F177 K183	R175-T179 WeakPolarHBondContact O-CB 3.12Å; R175-T179 PolarHBondContact O-N 3.49Å; R175-T179 PolarHBondContact O-OG1 2.94Å; A176-T179 PolarHBondContact O-N 2.91Å; F177-T179 PolarHBondContact O-N 3Å; T179-K183 WeakPolarHBondContact O-CG 3.33Å
180	L	92.4	Very high	89.2	Confident	19 Å²	19	82.1 Å²	82.1	10%	0.099	39%	0.391	C	S	.	.	H	α-helix	trans	-77.7	-44.5	174.5	-178.3	64	0	0	0	111.7	L108 F109 A176 F177 K178 W184 L204 V207	L108-L180 HydrophobicContact CD2-CD1 3.92Å; L108-L180 HydrophobicContact CD2-CD2 4.25Å; L108-L180 HydrophobicContact CD2-CG 4.12Å; F109-L180 HydrophobicContact CE1-CD2 4.33Å; A176-L180 WeakPolarHBondContact O-CB 3.27Å; A176-L180 PolarHBondContact O-N 3.48Å; F177-L180 PolarHBondContact O-N 3.18Å; K178-L180 PolarHBondContact O-N 3.37Å; L180-W184 VanDerWaalsContact O-CD1 3.22Å; L180-W184 PolarHBondContact O-NE1 2.8Å; L180-L204 HydrophobicContact CD2-CD2 4Å; L180-V207 HydrophobicContact CD2-CB 4.45Å; L180-V207 HydrophobicContact CD2-CG1 4.04Å; L180-V207 HydrophobicContact CD2-CG2 4.43Å
181	V	92	Very high	89.8	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-77.6	-39.1	-176.4	174.8	0	0	0	0	112.2	F109 F177 K178 K183 W184 V189 L192	F109-V181 HydrophobicContact CE2-CG2 4.38Å; F109-V181 HydrophobicContact CZ-CG2 4.09Å; F177-V181 HydrophobicContact CD1-CG2 4.04Å; F177-V181 HydrophobicContact CE1-CG2 3.59Å; F177-V181 HydrophobicContact CE2-CG2 4.3Å; F177-V181 HydrophobicContact CZ-CG2 3.75Å; F177-V181 WeakPolarHBondContact O-CG2 3.39Å; F177-V181 PolarHBondContact O-N 3.41Å; K178-V181 PolarHBondContact O-N 2.69Å; V181-K183 PolarHBondContact O-N 3.22Å; V181-K183 VanDerWaalsContact O-N 3.1Å; V181-W184 PolarHBondContact O-N 3.05Å; V181-V189 HydrophobicContact CG1-CB 4.22Å; V181-V189 HydrophobicContact CG1-CG1 4.11Å; V181-V189 HydrophobicContact CG1-CG2 3.98Å; V181-L192 HydrophobicContact CG1-CB 4.04Å; V181-L192 HydrophobicContact CG1-CD1 3.75Å; V181-L192 HydrophobicContact CG2-CB 4.39Å; V181-L192 HydrophobicContact CG2-CD1 4.23Å
182	E	90.6	Very high	90.4	Very high	108 Å²	108	78.3 Å²	78.3	51%	0.505	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-9.3	178.3	-74.6	-175.5	151.7	0	0	114.4	K178 W184	K178-E182 WeakPolarHBondContact CE-OE1 3.22Å; K178-E182 WeakPolarHBondContact CE-OE2 3.4Å; K178-E182 HydrophobicContact CG-CG 4.27Å; K178-E182 IonicContact NZ-OE1 3.18Å; K178-E182 PolarHBondContact NZ-OE1 2.96Å; K178-E182 IonicContact NZ-OE2 3.76Å; K178-E182 WeakPolarHBondContact O-CB 3.4Å; K178-E182 PolarHBondContact O-N 3.19Å; E182-W184 PolarHBondContact O-N 2.65Å
183	K	89.9	Confident	90.7	Very high	138 Å²	138	76 Å²	76	60%	0.6	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-15	168.8	-72.9	172.9	-179.5	-174.2	0	113.3	T179 V181	T179-K183 WeakPolarHBondContact O-CG 3.33Å; V181-K183 PolarHBondContact O-N 3.22Å; V181-K183 VanDerWaalsContact O-N 3.1Å
184	W	86.9	Confident	91	Very high	87 Å²	87	80.1 Å²	80.1	33%	0.33	38%	0.378	S	S	.	.	S	Bend	trans	-112.4	117	-173.8	-57.3	103	0	0	0	110.7	A105 R106 L108 L180 V181 E182 D186 V189	A105-W184 HydrophobicContact CB-CG 4.27Å; R106-W184 HydrophobicContact CB-CE3 4Å; R106-W184 HydrophobicContact CB-CZ3 4.31Å; R106-W184 HydrophobicContact CG-CE3 3.99Å; L108-W184 HydrophobicContact CD2-CZ2 4.33Å; L180-W184 VanDerWaalsContact O-CD1 3.22Å; L180-W184 PolarHBondContact O-NE1 2.8Å; V181-W184 PolarHBondContact O-N 3.05Å; E182-W184 PolarHBondContact O-N 2.65Å; W184-D186 PolarHBondContact O-N 2.88Å; W184-V189 VanDerWaalsContact O-CG2 3.23Å; W184-V189 WeakPolarHBondContact O-CG2 3.41Å
185	E	83.6	Confident	91.2	Very high	171 Å²	171	74.2 Å²	74.2	80%	0.799	36%	0.356	S	S	*	.			trans	-72.3	95.1	168	-65.9	178.2	172.3	0	0	108.9
186	D	90	Very high	91.3	Very high	35 Å²	35	68 Å²	68	19%	0.187	34%	0.335	C	S	.	.			trans	-143.3	143.4	-172.7	-167.5	-49.4	0	0	0	110.8	G104 A105 R106 W184 H188 V189	G104-D186 VanDerWaalsContact C-OD2 3.24Å; G104-D186 WeakPolarHBondContact CA-OD2 3.22Å; A105-D186 PolarHBondContact N-OD2 3.18Å; R106-D186 PolarHBondContact N-OD2 3.34Å; W184-D186 PolarHBondContact O-N 2.88Å; D186-H188 PolarHBondContact O-N 3.29Å; D186-H188 IonicContact OD1-CD2 2.98Å; D186-H188 IonicContact OD1-CG 2.78Å; D186-H188 PolarHBondContact OD1-N 2.85Å; D186-V189 HydrophobicContact CB-CG2 4.11Å; D186-V189 VanDerWaalsContact O-CG2 3.32Å; D186-V189 WeakPolarHBondContact O-CG2 3.3Å; D186-V189 PolarHBondContact O-N 3.35Å
187	R	90.3	Very high	91.1	Very high	199 Å²	199	66 Å²	66	75%	0.751	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.7	178.3	70.3	-176.2	-61.6	155.5	5.9	113.4
188	H	92.4	Very high	90.9	Very high	26 Å²	26	68 Å²	68	12%	0.12	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	3.7	-175.2	-69.6	-60	0	0	0	114.4	C100 D186 L190 D191 L192	C100-H188 HydrophobicContact CB-CB 4.02Å; D186-H188 PolarHBondContact O-N 3.29Å; D186-H188 IonicContact OD1-CD2 2.98Å; D186-H188 IonicContact OD1-CG 2.78Å; D186-H188 PolarHBondContact OD1-N 2.85Å; H188-L190 VanDerWaalsContact C-N 3.27Å; H188-L190 PolarHBondContact O-N 3.05Å; H188-D191 IonicContact CE1-OD2 2.87Å; H188-D191 IonicContact CG-OD2 3.32Å; H188-D191 IonicContact ND1-OD2 2.68Å; H188-D191 PolarHBondContact ND1-OD2 2.88Å; H188-D191 PolarHBondContact O-N 3.45Å; H188-L192 WeakPolarHBondContact O-CB 3.49Å; H188-L192 WeakPolarHBondContact O-CG 2.98Å; H188-L192 PolarHBondContact O-N 2.98Å
189	V	92.9	Very high	90.9	Very high	24 Å²	24	63.5 Å²	63.5	15%	0.145	31%	0.312	C	S	.	.	H	α-helix	trans	-52.4	-44.2	178.4	165.9	0	0	0	0	112.1	V181 W184 D186 L193	V181-V189 HydrophobicContact CG1-CB 4.22Å; V181-V189 HydrophobicContact CG1-CG1 4.11Å; V181-V189 HydrophobicContact CG1-CG2 3.98Å; W184-V189 VanDerWaalsContact O-CG2 3.23Å; W184-V189 WeakPolarHBondContact O-CG2 3.41Å; D186-V189 HydrophobicContact CB-CG2 4.11Å; D186-V189 VanDerWaalsContact O-CG2 3.32Å; D186-V189 WeakPolarHBondContact O-CG2 3.3Å; D186-V189 PolarHBondContact O-N 3.35Å; V189-L193 HydrophobicContact CG1-CD1 3.89Å; V189-L193 VanDerWaalsContact O-CG 3.22Å; V189-L193 WeakPolarHBondContact O-CG 3.29Å; V189-L193 PolarHBondContact O-N 2.74Å; V189-L193 VanDerWaalsContact O-N 3.07Å
190	L	91.6	Very high	90.9	Very high	128 Å²	128	60.1 Å²	60.1	67%	0.67	29%	0.29	S	S	*	.	H	α-helix	trans	-68.1	-43.5	-178.2	-60.9	-179.1	0	0	0	112	H188 L193 V194	H188-L190 VanDerWaalsContact C-N 3.27Å; H188-L190 PolarHBondContact O-N 3.05Å; L190-L193 PolarHBondContact O-N 3.48Å; L190-V194 WeakPolarHBondContact O-CG2 3.46Å; L190-V194 PolarHBondContact O-N 2.83Å
191	D	92.5	Very high	90.9	Very high	80 Å²	80	61.5 Å²	61.5	43%	0.428	30%	0.296	S	S	.	.	H	α-helix	trans	-59.4	-48.6	177.3	-53.7	-31.8	0	0	0	110.7	C100 H188 L193 V194 L195	C100-D191 HydrophobicContact CB-CB 3.37Å; H188-D191 IonicContact CE1-OD2 2.87Å; H188-D191 IonicContact CG-OD2 3.32Å; H188-D191 IonicContact ND1-OD2 2.68Å; H188-D191 PolarHBondContact ND1-OD2 2.88Å; H188-D191 PolarHBondContact O-N 3.45Å; D191-L193 VanDerWaalsContact C-N 3.33Å; D191-L193 PolarHBondContact O-N 2.63Å; D191-V194 PolarHBondContact O-N 3.34Å; D191-V194 VanDerWaalsContact O-N 3.07Å; D191-L195 PolarHBondContact O-N 3.34Å
192	L	93.7	Very high	91	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-57.2	-43.5	176.9	-74.4	168.3	0	0	0	111.8	C100 I101 A105 F109 F177 V181 H188 V194 L195	C100-L192 HydrophobicContact CB-CD2 4.34Å; C100-L192 HydrophobicContact CB-CG 4.19Å; C100-L192 WeakPolarHBondContact O-CD2 3.43Å; I101-L192 HydrophobicContact CG1-CD2 4.29Å; A105-L192 HydrophobicContact CB-CD1 4.19Å; F109-L192 HydrophobicContact CD2-CD2 4.28Å; F109-L192 HydrophobicContact CE2-CD1 4.15Å; F109-L192 HydrophobicContact CE2-CD2 3.8Å; F177-L192 HydrophobicContact CE1-CB 4.17Å; F177-L192 VanDerWaalsContact CE1-O 3.27Å; F177-L192 WeakPolarHBondContact CE1-O 3.39Å; F177-L192 HydrophobicContact CZ-CB 4.23Å; F177-L192 HydrophobicContact CZ-CD2 4.29Å; V181-L192 HydrophobicContact CG1-CB 4.04Å; V181-L192 HydrophobicContact CG1-CD1 3.75Å; V181-L192 HydrophobicContact CG2-CB 4.39Å; V181-L192 HydrophobicContact CG2-CD1 4.23Å; H188-L192 WeakPolarHBondContact O-CB 3.49Å; H188-L192 WeakPolarHBondContact O-CG 2.98Å; H188-L192 PolarHBondContact O-N 2.98Å; L192-V194 PolarHBondContact O-N 3.42Å; L192-L195 HydrophobicContact CD2-CD1 3.94Å; L192-L195 WeakPolarHBondContact O-CB 3.39Å; L192-L195 WeakPolarHBondContact O-CG 3.49Å; L192-L195 PolarHBondContact O-N 3.35Å
193	L	91.9	Very high	91.2	Very high	48 Å²	48	58.8 Å²	58.8	25%	0.251	29%	0.285	S	S	.	.	H	α-helix	trans	-67	-22.3	178.9	-71.3	171.9	0	0	0	113.2	K178 V189 L190 D191 K200	K178-L193 HydrophobicContact CB-CD2 3.98Å; K178-L193 HydrophobicContact CG-CD2 3.92Å; V189-L193 HydrophobicContact CG1-CD1 3.89Å; V189-L193 VanDerWaalsContact O-CG 3.22Å; V189-L193 WeakPolarHBondContact O-CG 3.29Å; V189-L193 PolarHBondContact O-N 2.74Å; V189-L193 VanDerWaalsContact O-N 3.07Å; L190-L193 PolarHBondContact O-N 3.48Å; D191-L193 VanDerWaalsContact C-N 3.33Å; D191-L193 PolarHBondContact O-N 2.63Å; L193-K200 WeakPolarHBondContact O-CE 3.21Å; L193-K200 PolarHBondContact O-NZ 3.38Å
194	V	92.3	Very high	91.4	Very high	114 Å²	114	52.9 Å²	52.9	69%	0.691	26%	0.26	S	S	*	.	H	α-helix	trans	-86.9	-13.5	178.5	173.3	0	0	0	0	113.2	L190 D191 L192	L190-V194 WeakPolarHBondContact O-CG2 3.46Å; L190-V194 PolarHBondContact O-N 2.83Å; D191-V194 PolarHBondContact O-N 3.34Å; D191-V194 VanDerWaalsContact O-N 3.07Å; L192-V194 PolarHBondContact O-N 3.42Å
195	L	91.8	Very high	91.7	Very high	6 Å²	6	52.4 Å²	52.4	3%	0.031	26%	0.264	C	S	.	.	S	Bend	trans	-54.9	151.6	177.7	-68.7	174.7	0	0	0	113.6	L98 I101 F177 D191 L192 V199 K200 L203	L98-L195 HydrophobicContact CD2-CD2 3.91Å; I101-L195 HydrophobicContact CD1-CD1 3.91Å; I101-L195 HydrophobicContact CD1-CD2 4.5Å; I101-L195 HydrophobicContact CG1-CD1 3.67Å; F177-L195 HydrophobicContact CZ-CD1 4.46Å; D191-L195 PolarHBondContact O-N 3.34Å; L192-L195 HydrophobicContact CD2-CD1 3.94Å; L192-L195 WeakPolarHBondContact O-CB 3.39Å; L192-L195 WeakPolarHBondContact O-CG 3.49Å; L192-L195 PolarHBondContact O-N 3.35Å; L195-V199 HydrophobicContact CD1-CG1 4.32Å; L195-K200 HydrophobicContact CB-CG 4.22Å; L195-K200 WeakPolarHBondContact O-CE 3.5Å; L195-K200 PolarHBondContact O-NZ 3.32Å; L195-L203 HydrophobicContact CD1-CD1 4.09Å
196	P	91.3	Very high	92.2	Very high	18 Å²	18	45.1 Å²	45.1	12%	0.117	23%	0.23	C	C	.	.			trans	-61.6	144.2	174.2	-20.2	32.1	0	0	0	112.9	Y152 T155 T198 V199 K200	Y152-P196 HydrophobicContact CD2-CG 3.83Å; Y152-P196 HydrophobicContact CE2-CG 4.22Å; T155-P196 HydrophobicContact CG2-CB 4.13Å; T155-P196 WeakPolarHBondContact OG1-CB 3.36Å; T155-P196 WeakPolarHBondContact OG1-CG 3.47Å; P196-T198 VanDerWaalsContact C-N 3.29Å; P196-T198 PolarHBondContact O-N 2.78Å; P196-V199 HydrophobicContact CB-CG2 4.19Å; P196-V199 HydrophobicContact CG-CG2 4.19Å; P196-V199 WeakPolarHBondContact O-CA 3.31Å; P196-V199 WeakPolarHBondContact O-CB 3.48Å; P196-V199 PolarHBondContact O-N 3.11Å; P196-K200 PolarHBondContact O-N 3.03Å
197	G	88.3	Confident	92.4	Very high	5 Å²	5	43.8 Å²	43.8	5%	0.052	22%	0.223	C	C	.	.	H	α-helix	trans	-54.8	-37.5	179.2	0	0	0	0	0	115.3	E169 V199 K200 E201	E169-G197 VanDerWaalsContact CD-CA 3.42Å; E169-G197 WeakPolarHBondContact OE1-CA 3.46Å; E169-G197 PolarHBondContact OE1-N 2.98Å; G197-V199 VanDerWaalsContact C-N 3.29Å; G197-V199 PolarHBondContact O-N 3.38Å; G197-K200 CarbonylContact O-C 3.51Å; G197-K200 WeakPolarHBondContact O-CB 3.38Å; G197-K200 PolarHBondContact O-N 3.43Å; G197-K200 VanDerWaalsContact O-N 3.16Å; G197-E201 WeakPolarHBondContact O-CB 3.4Å; G197-E201 WeakPolarHBondContact O-CG 3.41Å; G197-E201 PolarHBondContact O-N 3.01Å
198	T	89.8	Confident	92.5	Very high	43 Å²	43	40.7 Å²	40.7	26%	0.264	22%	0.215	S	C	.	.	H	α-helix	trans	-60.7	-38.5	174.9	49.7	0	0	0	0	112.4	T155 P196 I202	T155-T198 HydrophobicContact CG2-CG2 4.43Å; T155-T198 WeakPolarHBondContact CG2-OG1 3.28Å; P196-T198 VanDerWaalsContact C-N 3.29Å; P196-T198 PolarHBondContact O-N 2.78Å; T198-I202 WeakPolarHBondContact O-CD1 3.45Å; T198-I202 WeakPolarHBondContact O-CG1 3.36Å; T198-I202 PolarHBondContact O-N 2.89Å
199	V	92.8	Very high	92.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-69.7	-43.9	174.5	179.6	0	0	0	0	109.8	L98 I101 L148 L195 P196 G197 E201 I202 L203	L98-V199 HydrophobicContact CD2-CG1 4.37Å; I101-V199 HydrophobicContact CD1-CG1 3.82Å; L148-V199 HydrophobicContact CD1-CG1 3.81Å; L148-V199 HydrophobicContact CG-CG1 4.43Å; L195-V199 HydrophobicContact CD1-CG1 4.32Å; P196-V199 HydrophobicContact CB-CG2 4.19Å; P196-V199 HydrophobicContact CG-CG2 4.19Å; P196-V199 WeakPolarHBondContact O-CA 3.31Å; P196-V199 WeakPolarHBondContact O-CB 3.48Å; P196-V199 PolarHBondContact O-N 3.11Å; G197-V199 VanDerWaalsContact C-N 3.29Å; G197-V199 PolarHBondContact O-N 3.38Å; V199-E201 VanDerWaalsContact C-N 3.29Å; V199-E201 PolarHBondContact O-N 2.67Å; V199-I202 PolarHBondContact O-N 3.36Å; V199-L203 HydrophobicContact CG1-CD1 4.2Å; V199-L203 VanDerWaalsContact O-CG 3.26Å; V199-L203 WeakPolarHBondContact O-CG 3.28Å; V199-L203 PolarHBondContact O-N 2.78Å
200	K	92.7	Very high	92.3	Very high	13 Å²	13	45.3 Å²	45.3	6%	0.057	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-35.5	175.7	-67.7	171.8	171.8	142.2	0	113	F177 L193 L195 P196 G197 L204	F177-K200 HydrophobicContact CB-CB 4.19Å; F177-K200 HydrophobicContact CB-CD 4.47Å; F177-K200 HydrophobicContact CB-CG 4.48Å; F177-K200 HydrophobicContact CD1-CB 4.33Å; F177-K200 HydrophobicContact CD1-CD 3.84Å; F177-K200 HydrophobicContact CD1-CG 3.76Å; F177-K200 HydrophobicContact CD2-CB 3.71Å; F177-K200 HydrophobicContact CD2-CG 3.9Å; F177-K200 HydrophobicContact CE1-CD 4.25Å; F177-K200 HydrophobicContact CE1-CG 3.89Å; F177-K200 HydrophobicContact CE2-CB 4.16Å; F177-K200 HydrophobicContact CE2-CG 4.02Å; F177-K200 HydrophobicContact CG-CB 3.81Å; F177-K200 HydrophobicContact CG-CD 4.08Å; F177-K200 HydrophobicContact CG-CG 3.77Å; F177-K200 HydrophobicContact CZ-CG 4.01Å; L193-K200 WeakPolarHBondContact O-CE 3.21Å; L193-K200 PolarHBondContact O-NZ 3.38Å; L195-K200 HydrophobicContact CB-CG 4.22Å; L195-K200 WeakPolarHBondContact O-CE 3.5Å; L195-K200 PolarHBondContact O-NZ 3.32Å; P196-K200 PolarHBondContact O-N 3.03Å; G197-K200 CarbonylContact O-C 3.51Å; G197-K200 WeakPolarHBondContact O-CB 3.38Å; G197-K200 PolarHBondContact O-N 3.43Å; G197-K200 VanDerWaalsContact O-N 3.16Å; K200-L204 WeakPolarHBondContact O-CB 3.41Å; K200-L204 WeakPolarHBondContact O-CG 3.45Å; K200-L204 PolarHBondContact O-N 3.04Å
201	E	92.1	Very high	92.1	Very high	48 Å²	48	40.3 Å²	40.3	22%	0.224	21%	0.214	C	C	.	.	H	α-helix	trans	-69.3	-47.8	178	-77.7	171.3	168.1	0	0	111.1	S170 S173 G197 V199 L203 L204 D205	S170-E201 WeakPolarHBondContact CB-OE1 3.19Å; S170-E201 PolarHBondContact N-OE1 3.31Å; S173-E201 VanDerWaalsContact CB-CG 3.45Å; S173-E201 WeakPolarHBondContact CB-OE1 3.34Å; S173-E201 WeakPolarHBondContact OG-CG 3.46Å; S173-E201 PolarHBondContact OG-OE1 2.95Å; G197-E201 WeakPolarHBondContact O-CB 3.4Å; G197-E201 WeakPolarHBondContact O-CG 3.41Å; G197-E201 PolarHBondContact O-N 3.01Å; V199-E201 VanDerWaalsContact C-N 3.29Å; V199-E201 PolarHBondContact O-N 2.67Å; E201-L203 VanDerWaalsContact C-N 3.29Å; E201-L203 PolarHBondContact O-N 2.98Å; E201-L204 WeakPolarHBondContact O-CB 3.15Å; E201-L204 PolarHBondContact O-N 3.21Å; E201-L204 VanDerWaalsContact O-N 3.11Å; E201-D205 PolarHBondContact O-N 3.14Å
202	I	93.5	Very high	91.7	Very high	48 Å²	48	37.7 Å²	37.7	25%	0.246	20%	0.201	C	C	.	.	H	α-helix	trans	-56.7	-43	172.4	-67	163.5	0	0	0	111.2	L148 R151 T198 V199 D205 L206	L148-I202 HydrophobicContact CD1-CB 4.36Å; L148-I202 HydrophobicContact CD1-CG2 3.91Å; R151-I202 HydrophobicContact CB-CD1 4.14Å; R151-I202 HydrophobicContact CG-CD1 3.7Å; T198-I202 WeakPolarHBondContact O-CD1 3.45Å; T198-I202 WeakPolarHBondContact O-CG1 3.36Å; T198-I202 PolarHBondContact O-N 2.89Å; V199-I202 PolarHBondContact O-N 3.36Å; I202-D205 PolarHBondContact O-N 3.42Å; I202-L206 WeakPolarHBondContact O-CB 3.49Å; I202-L206 PolarHBondContact O-N 3.03Å
203	L	94.6	Very high	90.5	Very high	3 Å²	3	39 Å²	39	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-67.7	-34.9	177.4	-68.5	175.6	0	0	0	113.3	I101 F109 L148 F177 L195 V199 E201 V207	I101-L203 HydrophobicContact CD1-CD1 3.89Å; I101-L203 HydrophobicContact CD1-CD2 4.49Å; I101-L203 HydrophobicContact CG1-CD1 3.95Å; I101-L203 HydrophobicContact CG2-CD1 4.17Å; I101-L203 HydrophobicContact CG2-CD2 3.56Å; F109-L203 HydrophobicContact CB-CD2 4.33Å; F109-L203 HydrophobicContact CD1-CB 4.01Å; F109-L203 HydrophobicContact CD1-CD2 3.93Å; F109-L203 HydrophobicContact CD1-CG 4.37Å; F109-L203 HydrophobicContact CE1-CB 3.82Å; F109-L203 HydrophobicContact CE1-CD1 4.43Å; F109-L203 HydrophobicContact CE1-CG 4.49Å; F109-L203 HydrophobicContact CG-CD2 4.19Å; L148-L203 HydrophobicContact CD1-CD2 4.29Å; L148-L203 HydrophobicContact CD1-CG 4.43Å; F177-L203 HydrophobicContact CE2-CB 4Å; F177-L203 HydrophobicContact CE2-CD1 3.81Å; F177-L203 HydrophobicContact CZ-CD1 4.23Å; L195-L203 HydrophobicContact CD1-CD1 4.09Å; V199-L203 HydrophobicContact CG1-CD1 4.2Å; V199-L203 VanDerWaalsContact O-CG 3.26Å; V199-L203 WeakPolarHBondContact O-CG 3.28Å; V199-L203 PolarHBondContact O-N 2.78Å; E201-L203 VanDerWaalsContact C-N 3.29Å; E201-L203 PolarHBondContact O-N 2.98Å; L203-V207 WeakPolarHBondContact O-CB 3.29Å; L203-V207 VanDerWaalsContact O-CG2 3.23Å; L203-V207 WeakPolarHBondContact O-CG2 3.36Å; L203-V207 PolarHBondContact O-N 3.46Å
204	L	94.1	Very high	89.2	Confident	15 Å²	15	40.6 Å²	40.6	8%	0.079	23%	0.229	C	C	.	.	H	α-helix	trans	-66.4	-42.7	172.8	-81	173.2	0	0	0	111.4	S173 A176 F177 L180 K200 E201 V207 K208	S173-L204 WeakPolarHBondContact O-CD1 3.49Å; A176-L204 HydrophobicContact CB-CD1 3.96Å; A176-L204 HydrophobicContact CB-CD2 4.21Å; F177-L204 HydrophobicContact CB-CD1 4.07Å; F177-L204 HydrophobicContact CB-CD2 4.37Å; F177-L204 HydrophobicContact CB-CG 4.19Å; F177-L204 HydrophobicContact CD2-CG 4.25Å; L180-L204 HydrophobicContact CD2-CD2 4Å; K200-L204 WeakPolarHBondContact O-CB 3.41Å; K200-L204 WeakPolarHBondContact O-CG 3.45Å; K200-L204 PolarHBondContact O-N 3.04Å; E201-L204 WeakPolarHBondContact O-CB 3.15Å; E201-L204 PolarHBondContact O-N 3.21Å; E201-L204 VanDerWaalsContact O-N 3.11Å; L204-V207 PolarHBondContact O-N 3.04Å; L204-K208 VanDerWaalsContact O-CG 3.27Å; L204-K208 WeakPolarHBondContact O-CG 3.34Å; L204-K208 PolarHBondContact O-N 2.98Å
205	D	93.3	Very high	86.7	Confident	76 Å²	76	39.8 Å²	39.8	41%	0.406	23%	0.228	S	C	.	.	H	α-helix	trans	-69.5	-42.4	-179.1	-68.8	-25.4	0	0	0	111.5	E201 I202 V207 K208 E209	E201-D205 PolarHBondContact O-N 3.14Å; I202-D205 PolarHBondContact O-N 3.42Å; D205-V207 VanDerWaalsContact C-N 3.29Å; D205-V207 PolarHBondContact O-N 3.32Å; D205-K208 WeakPolarHBondContact O-CB 3.25Å; D205-K208 PolarHBondContact O-N 3.47Å; D205-K208 VanDerWaalsContact O-N 3.1Å; D205-K208 WeakPolarHBondContact OD1-CE 3.4Å; D205-K208 IonicContact OD1-NZ 3.8Å; D205-K208 PolarHBondContact OD1-NZ 2.9Å; D205-E209 WeakPolarHBondContact O-CG 3.33Å; D205-E209 PolarHBondContact O-N 2.86Å
206	L	94.7	Very high	84	Confident	18 Å²	18	44.2 Å²	44.2	9%	0.094	26%	0.257	C	S	.	.	H	α-helix	trans	-54	-43.3	171.3	-170.9	80.5	0	0	0	112.4	L113 N116 L144 I202 S210	L113-L206 HydrophobicContact CB-CD2 4.12Å; L113-L206 HydrophobicContact CD1-CD1 4.13Å; L113-L206 HydrophobicContact CD1-CD2 4.31Å; N116-L206 HydrophobicContact CB-CD1 4.33Å; N116-L206 PolarHBondContact ND2-O 3.32Å; N116-L206 VanDerWaalsContact ND2-O 3.08Å; L144-L206 HydrophobicContact CD1-CD1 4.33Å; I202-L206 WeakPolarHBondContact O-CB 3.49Å; I202-L206 PolarHBondContact O-N 3.03Å; L206-S210 WeakPolarHBondContact O-CB 3.29Å; L206-S210 PolarHBondContact O-N 2.93Å; L206-S210 PolarHBondContact O-OG 3.19Å
207	V	94.2	Very high	80.8	Confident	7 Å²	7	47.7 Å²	47.7	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-73.1	-29.7	179	169.9	0	0	0	0	112.7	L108 F109 L180 L203 L204 D205 S210 G211 G213	L108-V207 HydrophobicContact CD2-CG1 4.47Å; L108-V207 HydrophobicContact CD2-CG2 4.48Å; L108-V207 HydrophobicContact CG-CG2 4.25Å; F109-V207 HydrophobicContact CD1-CG2 3.71Å; F109-V207 HydrophobicContact CE1-CG2 3.85Å; L180-V207 HydrophobicContact CD2-CB 4.45Å; L180-V207 HydrophobicContact CD2-CG1 4.04Å; L180-V207 HydrophobicContact CD2-CG2 4.43Å; L203-V207 WeakPolarHBondContact O-CB 3.29Å; L203-V207 VanDerWaalsContact O-CG2 3.23Å; L203-V207 WeakPolarHBondContact O-CG2 3.36Å; L203-V207 PolarHBondContact O-N 3.46Å; L204-V207 PolarHBondContact O-N 3.04Å; D205-V207 VanDerWaalsContact C-N 3.29Å; D205-V207 PolarHBondContact O-N 3.32Å; V207-S210 PolarHBondContact O-OG 3.43Å; V207-G211 PolarHBondContact O-N 2.82Å; V207-G213 VanDerWaalsContact CG1-CA 3.49Å
208	K	92.8	Very high	78.1	Confident	134 Å²	134	53 Å²	53	58%	0.583	32%	0.315	S	S	*	.	H	α-helix	trans	-68.6	-50.2	171.1	-69.3	164.7	-156.2	165.6	0	110.4	L204 D205 S210 G211	L204-K208 VanDerWaalsContact O-CG 3.27Å; L204-K208 WeakPolarHBondContact O-CG 3.34Å; L204-K208 PolarHBondContact O-N 2.98Å; D205-K208 WeakPolarHBondContact O-CB 3.25Å; D205-K208 PolarHBondContact O-N 3.47Å; D205-K208 VanDerWaalsContact O-N 3.1Å; D205-K208 WeakPolarHBondContact OD1-CE 3.4Å; D205-K208 IonicContact OD1-NZ 3.8Å; D205-K208 PolarHBondContact OD1-NZ 2.9Å; K208-S210 VanDerWaalsContact C-N 3.31Å; K208-S210 PolarHBondContact O-N 3.25Å; K208-G211 PolarHBondContact O-N 2.99Å; K208-G211 VanDerWaalsContact O-N 3.08Å
209	E	91.6	Very high	75	Confident	146 Å²	146	59.5 Å²	59.5	68%	0.682	34%	0.343	S	S	*	.	H	α-helix	trans	-59.4	-39.4	-179.8	-74.6	-179.6	168.3	0	0	112.5	N116 D205 G211	N116-E209 VanDerWaalsContact ND2-CB 3.32Å; N116-E209 WeakPolarHBondContact ND2-CB 3.45Å; N116-E209 PolarHBondContact ND2-OE2 3.2Å; D205-E209 WeakPolarHBondContact O-CG 3.33Å; D205-E209 PolarHBondContact O-N 2.86Å; E209-G211 PolarHBondContact O-N 3.27Å
210	S	89.2	Confident	72.1	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.014	37%	0.373	C	S	.	.	H	α-helix	trans	-71.4	-20.5	177.7	74.7	0	0	0	0	113.4	S112 K115 N116 L206 V207 K208 L212	S112-S210 WeakPolarHBondContact CB-OG 3.5Å; S112-S210 PolarHBondContact OG-OG 2.84Å; K115-S210 VanDerWaalsContact CD-O 3.23Å; K115-S210 WeakPolarHBondContact CD-O 3.25Å; K115-S210 PolarHBondContact NZ-O 3.39Å; N116-S210 WeakPolarHBondContact OD1-CA 3.44Å; N116-S210 WeakPolarHBondContact OD1-CB 3.36Å; N116-S210 PolarHBondContact OD1-N 2.99Å; L206-S210 WeakPolarHBondContact O-CB 3.29Å; L206-S210 PolarHBondContact O-N 2.93Å; L206-S210 PolarHBondContact O-OG 3.19Å; V207-S210 PolarHBondContact O-OG 3.43Å; K208-S210 VanDerWaalsContact C-N 3.31Å; K208-S210 PolarHBondContact O-N 3.25Å; S210-L212 PolarHBondContact O-N 2.92Å; S210-L212 WeakPolarHBondContact OG-CB 3.4Å; S210-L212 PolarHBondContact OG-N 3.2Å; S210-L212 VanDerWaalsContact OG-N 3.14Å
211	G	86.9	Confident	69.1	Low	22 Å²	22	72.8 Å²	72.8	23%	0.227	42%	0.416	C	S	.	.	S	Bend	trans	68.2	0.5	-170	0	0	0	0	0	114.5	R44 V207 K208 E209 G213 S214	R44-G211 PolarHBondContact NH2-O 2.86Å; V207-G211 PolarHBondContact O-N 2.82Å; K208-G211 PolarHBondContact O-N 2.99Å; K208-G211 VanDerWaalsContact O-N 3.08Å; E209-G211 PolarHBondContact O-N 3.27Å; G211-G213 PolarHBondContact O-N 3.46Å; G211-S214 WeakPolarHBondContact O-CB 3.41Å; G211-S214 PolarHBondContact O-N 3.39Å
212	L	83.6	Confident	66	Low	26 Å²	26	81.2 Å²	81.2	14%	0.136	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-29.2	-172.4	-65.3	-177.8	0	0	0	113.4	R44 L108 D111 K115 S210 S214	R44-L212 HydrophobicContact CG-CD2 4.41Å; R44-L212 PolarHBondContact NH2-O 2.83Å; L108-L212 HydrophobicContact CD1-CB 4.02Å; D111-L212 HydrophobicContact CB-CD1 3.63Å; K115-L212 HydrophobicContact CD-CG 4.45Å; S210-L212 PolarHBondContact O-N 2.92Å; S210-L212 WeakPolarHBondContact OG-CB 3.4Å; S210-L212 PolarHBondContact OG-N 3.2Å; S210-L212 VanDerWaalsContact OG-N 3.14Å; L212-S214 PolarHBondContact O-N 2.83Å
213	G	68.9	Low	62.9	Low	27 Å²	27	86.5 Å²	86.5	28%	0.278	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-14.9	173.9	0	0	0	0	0	114.3	V207 G211 S215	V207-G213 VanDerWaalsContact CG1-CA 3.49Å; G211-G213 PolarHBondContact O-N 3.46Å; G213-S215 PolarHBondContact O-N 2.92Å
214	S	65.3	Low	59.6	Low	81 Å²	81	93.5 Å²	93.5	57%	0.566	51%	0.512	S	S	*	.	S	Bend	trans	-87.9	102.4	174.8	-63.7	0	0	0	0	109.7	R44 G211 L212 P216	R44-S214 PolarHBondContact NH1-O 3.18Å; R44-S214 PolarHBondContact NH2-O 3.46Å; G211-S214 WeakPolarHBondContact O-CB 3.41Å; G211-S214 PolarHBondContact O-N 3.39Å; L212-S214 PolarHBondContact O-N 2.83Å; S214-P216 WeakPolarHBondContact O-CD 3.42Å
215	S	39.7	Very low	56.6	Low	97 Å²	97	99 Å²	99	68%	0.678	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-70.7	120.3	176.5	52.9	0	0	0	0	111.2	G213 S217	G213-S215 PolarHBondContact O-N 2.92Å; S215-S217 PolarHBondContact O-N 2.9Å
216	P	34.9	Very low	53.4	Low	99 Å²	99	98.8 Å²	98.8	64%	0.643	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-66.2	120.4	155.8	29.5	-30.4	0	0	0	107.5	S214	S214-P216 WeakPolarHBondContact O-CD 3.42Å
217	S	24.4	Very low	50.3	Low	91 Å²	91	102.2 Å²	102.2	64%	0.636	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-68.5	137.9	164.6	-173.8	0	0	0	0	107.7	S215 E219	S215-S217 PolarHBondContact O-N 2.9Å; S217-E219 PolarHBondContact O-N 3.3Å; S217-E219 VanDerWaalsContact O-N 3.13Å
218	P	32.1	Very low	47.1	Very low	116 Å²	116	111 Å²	111	75%	0.753	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-62.1	117	159.3	27.6	-31.3	0	0	0	107	P220	P218-P220 WeakPolarHBondContact O-CD 3.18Å
219	E	23.8	Very low	43.9	Very low	180 Å²	180	109.4 Å²	109.4	84%	0.841	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-74.2	123.8	173.4	-70.1	-150.7	141.1	0	0	109.3	S217 M221	S217-E219 PolarHBondContact O-N 3.3Å; S217-E219 VanDerWaalsContact O-N 3.13Å; E219-M221 PolarHBondContact O-N 2.87Å
220	P	31.9	Very low	40.8	Very low	97 Å²	97	110.5 Å²	110.5	63%	0.63	64%	0.641	S	S	*	*			trans	-72.5	115.4	167.8	29.9	-30.6	0	0	0	108.1	P218 R222	P218-P220 WeakPolarHBondContact O-CD 3.18Å; P220-R222 PolarHBondContact O-N 2.81Å
221	M	29.2	Very low	37.8	Very low	195 Å²	195	116.3 Å²	116.3	96%	0.961	67%	0.672	S	S	*	*			trans	-44.8	118.1	167	-78.2	-76.5	-173.3	0	0	109.6	E219	E219-M221 PolarHBondContact O-N 2.87Å
222	R	26.5	Very low	35	Very low	225 Å²	225	122 Å²	122	85%	0.849	70%	0.697	S	S	*	*			trans	-123.3	112.3	172.1	-77.4	-171.2	171.5	-149.9	-2.6	108.5	P220 D224	P220-R222 PolarHBondContact O-N 2.81Å; R222-D224 PolarHBondContact O-N 3.35Å
223	D	28.5	Very low	32.3	Very low	160 Å²	160	125.4 Å²	125.4	86%	0.856	72%	0.723	S	S	*	*			trans	-55	134.7	164.2	-76.8	-57.8	0	0	0	110
224	D	27	Very low	30.2	Very low	150 Å²	150	134.2 Å²	134.2	80%	0.802	75%	0.748	S	S	*	*			trans	-79.7	120	164.9	-178	11.6	0	0	0	109.2	R222 G226	R222-D224 PolarHBondContact O-N 3.35Å; D224-G226 PolarHBondContact OD1-N 3.35Å
225	T	29.9	Very low	28.4	Very low	131 Å²	131	137.2 Å²	137.2	80%	0.804	76%	0.758	S	S	*	*			trans	-148.6	67.2	165.7	-42.8	0	0	0	0	110.3	A227	T225-A227 PolarHBondContact O-N 3.02Å
226	G	25.8	Very low	27.7	Very low	71 Å²	71	139.5 Å²	139.5	73%	0.732	76%	0.762	S	S	*	*			trans	-68.2	122.5	176.9	0	0	0	0	0	114.4	D224	D224-G226 PolarHBondContact OD1-N 3.35Å
227	A	29.1	Very low	27.3	Very low	89 Å²	89	145.5 Å²	145.5	74%	0.736	77%	0.773	S	S	*	*			trans	-172.3	132.8	137	0	0	0	0	0	115.2	T225	T225-A227 PolarHBondContact O-N 3.02Å
228	K	27	Very low	27.4	Very low	192 Å²	192	146.9 Å²	146.9	84%	0.835	77%	0.773	S	S	*	*			trans	67.6	100.8	145	-71.3	178.2	177.2	175.1	0	121.8
229	S	26.7	Very low	27.1	Very low	101 Å²	101	149.1 Å²	149.1	71%	0.706	77%	0.77	S	S	*	*				86.2	135.7	109	72.4	0	0	0	0	123.5
230	H	26.5	Very low	27.1	Very low	169 Å²	169	144.8 Å²	144.8	78%	0.782	77%	0.766	S	S	*	*			trans	86.4	126.5	144.3	-102.6	-67	0	0	0	122
231	N	27	Very low	26.8	Very low	124 Å²	124	146 Å²	146	66%	0.663	78%	0.777	S	S	*	*			trans	55.2	117	148.7	-80.1	35.7	0	0	0	122.9
232	D	26.1	Very low	26.6	Very low	140 Å²	140	141.5 Å²	141.5	75%	0.749	76%	0.764	S	S	*	*				47.2	135.9	112.6	-84.8	-43.3	0	0	0	123.1
233	S	27.4	Very low	26.7	Very low	99 Å²	99	136 Å²	136	69%	0.692	76%	0.76	S	S	*	*			trans	78.2	108.9	145.3	-68.4	0	0	0	0	120.9
234	R	25.7	Very low	26.6	Very low	212 Å²	212	137.9 Å²	137.9	80%	0.8	76%	0.761	S	S	*	*				61.5	133.5	120.2	-77.5	-169.5	-176.4	-179.8	0.9	121.7
235	D	27.1	Very low	26.6	Very low	143 Å²	143	140.6 Å²	140.6	77%	0.765	77%	0.765	S	S	*	*			trans	62.8	154.4	147.5	-43	-24.5	0	0	0	115.5
236	D	24.8	Very low	26.3	Very low	145 Å²	145	140.2 Å²	140.2	78%	0.775	76%	0.763	S	S	*	*			cis	-144.4	-176.4	-6.3	-165	6.6	0	0	0	109
237	W	26.1	Very low	26.3	Very low	226 Å²	226	143.8 Å²	143.8	86%	0.856	77%	0.765	S	S	*	*			trans	-69.5	151.5	177	-64.2	45.6	0	0	0	112.6
238	D	26.2	Very low	26.3	Very low	120 Å²	120	145.2 Å²	145.2	64%	0.642	77%	0.766	S	S	*	*				172.6	164.9	99.4	-142.6	-11.5	0	0	0	116.2
239	K	26.4	Very low	26.2	Very low	162 Å²	162	142.4 Å²	142.4	70%	0.704	76%	0.761	S	S	*	*			trans	52.9	86.4	152.1	-77.6	172	-173.4	81.4	0	123
240	A	23.5	Very low	27	Very low	90 Å²	90	142 Å²	142	74%	0.744	76%	0.755	S	S	*	*				54.3	142.8	102.9	0	0	0	0	0	124.8
241	S	27	Very low	27.1	Very low	123 Å²	123	143.6 Å²	143.6	86%	0.86	76%	0.76	S	S	*	*			trans	75.5	144.1	161.3	82	0	0	0	0	117
242	S	25.4	Very low	26.9	Very low	99 Å²	99	142.8 Å²	142.8	69%	0.692	76%	0.764	S	S	*	*			cis	-150.9	143.4	1.3	174.9	0	0	0	0	107.8
243	S	27.8	Very low	26.8	Very low	110 Å²	110	144.3 Å²	144.3	77%	0.769	77%	0.773	S	S	*	*				-175.9	136.3	79.9	-66.4	0	0	0	0	115.5
244	K	25.9	Very low	26.6	Very low	200 Å²	200	143.3 Å²	143.3	87%	0.87	77%	0.771	S	S	*	*			trans	-18.1	124.6	165	-55.4	168.2	-176.2	176	0	118.5
245	K	27.8	Very low	26.6	Very low	206 Å²	206	140.4 Å²	140.4	90%	0.896	77%	0.771	S	S	*	*				-164.4	110.6	109	-108.6	179.5	179.3	-176.8	0	113.2
246	T	23.2	Very low	26.4	Very low	123 Å²	123	143.5 Å²	143.5	76%	0.755	77%	0.772	S	S	*	*			trans	-88.9	165.8	165.9	53.2	0	0	0	0	109
247	L	25.4	Very low	26.3	Very low	146 Å²	146	147.3 Å²	147.3	76%	0.764	78%	0.775	S	S	*	*			cis	-161.8	-176	-3.1	-133.8	34.9	0	0	0	105.5
248	P	29.3	Very low	26.2	Very low	119 Å²	119	141.5 Å²	141.5	77%	0.773	78%	0.775	S	S	*	*			cis	-135.1	145.2	-4.4	37	-17.7	0	0	0	117.3
249	D	25.9	Very low	26.2	Very low	134 Å²	134	145.6 Å²	145.6	72%	0.717	79%	0.791	S	S	*	*				-102.2	-180	120.6	-160.3	32.7	0	0	0	105
250	P	42.1	Very low	26	Very low	91 Å²	91	141.3 Å²	141.3	59%	0.591	79%	0.792	S	S	*	*			cis	-129.8	-162.3	-12.4	13.5	15.1	0	0	0	113.5
251	F	28.6	Very low	25.9	Very low	203 Å²	203	147.4 Å²	147.4	89%	0.89	80%	0.802	S	S	*	*			trans	10.3	150.9	145.6	-73	-78.9	0	0	0	122.3
252	S	23.2	Very low	26	Very low	107 Å²	107	146.2 Å²	146.2	75%	0.748	80%	0.8	S	S	*	*			trans	99.7	136	148.2	-161	0	0	0	0	118.7
253	N	23.5	Very low	26	Very low	173 Å²	173	147.3 Å²	147.3	93%	0.925	80%	0.802	S	S	*	*			trans	-144.5	141.5	147.1	-116.1	-35.3	0	0	0	107.5
254	A	24.7	Very low	26	Very low	78 Å²	78	148.1 Å²	148.1	65%	0.645	80%	0.803	S	S	*	*			trans	-116.4	164.4	-161.7	0	0	0	0	0	114.9
255	D	26.1	Very low	26.1	Very low	150 Å²	150	148.8 Å²	148.8	80%	0.802	80%	0.802	S	S	*	*			trans	-5.8	134.1	164.9	-52.8	-53	0	0	0	119.8
256	R	22.6	Very low	26.1	Very low	209 Å²	209	147 Å²	147	79%	0.789	80%	0.801	S	S	*	*				-163.3	113.5	114.8	-118.7	175.8	165.1	163.9	-2.1	117.8
257	W	22.4	Very low	26.2	Very low	224 Å²	224	147 Å²	147	85%	0.848	81%	0.807	S	S	*	*			trans	57.7	115.8	133.7	-69.4	25.5	0	0	0	121.4
258	A	23.9	Very low	26.3	Very low	104 Å²	104	143.2 Å²	143.2	86%	0.86	80%	0.797	S	S	*	*			trans	-152.6	147.8	132	0	0	0	0	0	109.8
259	E	24.8	Very low	26.5	Very low	206 Å²	206	142.9 Å²	142.9	96%	0.963	80%	0.804	S	S	*	*			trans	-85.7	147.3	176.7	-59.8	173.6	110.6	0	0	111.4
260	G	22.8	Very low	26.8	Very low	72 Å²	72	145.5 Å²	145.5	74%	0.742	81%	0.809	S	S	*	*			trans	173.2	63.4	174.4	0	0	0	0	0	121.5
261	K	22.6	Very low	26.7	Very low	219 Å²	219	147.5 Å²	147.5	95%	0.952	81%	0.814	S	S	*	*			trans	62.4	164	161.6	-69.4	-178.3	174.9	179	0	117.8
262	A	27.8	Very low	27	Very low	97 Å²	97	141.9 Å²	141.9	80%	0.802	80%	0.799	S	S	*	*			trans	-110	147	-175.7	0	0	0	0	0	112.9
263	T	25.4	Very low	27.9	Very low	122 Å²	122	143 Å²	143	75%	0.748	79%	0.79	S	S	*	*			trans	-141.5	137.9	151.8	39.2	0	0	0	0	109.4
264	T	28.1	Very low	28.8	Very low	128 Å²	128	137.8 Å²	137.8	79%	0.785	76%	0.762	S	S	*	*			trans	-87.1	130.3	-178.6	46.8	0	0	0	0	111.9
265	Y	28.2	Very low	29.6	Very low	214 Å²	214	141.1 Å²	141.1	84%	0.839	76%	0.764	S	S	*	*			trans	-145.9	143	160.7	-68.9	-67.3	0	0	0	111.9
266	D	27.4	Very low	30	Very low	167 Å²	167	140 Å²	140	89%	0.893	76%	0.758	S	S	*	*			trans	-70.8	151.1	180	-73.3	-68.8	0	0	0	113.6
267	S	25.8	Very low	31	Very low	125 Å²	125	133.3 Å²	133.3	87%	0.874	74%	0.737	S	S	*	*			trans	-149	73.8	161.7	-167.1	0	0	0	0	111.3
268	A	27.6	Very low	31.7	Very low	66 Å²	66	126.1 Å²	126.1	55%	0.545	71%	0.712	S	S	.	*			trans	-80.7	133.5	164.4	0	0	0	0	0	109.2	K270	A268-K270 PolarHBondContact O-N 2.93Å
269	A	33	Very low	31.9	Very low	111 Å²	111	125.2 Å²	125.2	92%	0.917	70%	0.7	S	S	*	*			trans	-62.3	110.3	-176.7	0	0	0	0	0	111.7
270	K	32.2	Very low	32.2	Very low	190 Å²	190	122.1 Å²	122.1	83%	0.826	70%	0.697	S	S	*	*			trans	-97.5	127.2	160.3	-64.6	179.2	178.6	-178.4	0	107.1	A268 P272	A268-K270 PolarHBondContact O-N 2.93Å; K270-P272 WeakPolarHBondContact O-CD 3.2Å
271	D	40.7	Very low	32.3	Very low	132 Å²	132	123 Å²	123	71%	0.706	70%	0.698	S	S	*	*			trans	-80.8	114.9	168.5	-164.2	-28.3	0	0	0	108.8	F273	D271-F273 VanDerWaalsContact C-N 3.31Å; D271-F273 PolarHBondContact O-N 3.33Å; D271-F273 PolarHBondContact OD1-N 2.88Å
272	P	33.9	Very low	32.5	Very low	86 Å²	86	116.4 Å²	116.4	56%	0.558	69%	0.691	S	S	*	*			trans	-75.2	-18.3	-174.1	-16.1	32.3	0	0	0	113.9	K270 L274 Q275	K270-P272 WeakPolarHBondContact O-CD 3.2Å; P272-L274 PolarHBondContact O-N 3.41Å; P272-Q275 PolarHBondContact O-N 3.42Å
273	F	43.2	Very low	32.5	Very low	129 Å²	129	118.9 Å²	118.9	57%	0.566	70%	0.697	S	S	*	*	H	α-helix	trans	-69.7	-33.7	-156	-92.2	-85.9	0	0	0	115.9	D271 Q275 D276	D271-F273 VanDerWaalsContact C-N 3.31Å; D271-F273 PolarHBondContact O-N 3.33Å; D271-F273 PolarHBondContact OD1-N 2.88Å; F273-Q275 PolarHBondContact O-N 3.44Å; F273-D276 PolarHBondContact O-N 3.04Å
274	L	42.4	Very low	32.6	Very low	64 Å²	64	123.7 Å²	123.7	34%	0.335	70%	0.701	S	S	.	*	H	α-helix	trans	-71.1	-13.6	178.9	-66.8	179.5	0	0	0	113.3	V122 P272	V122-L274 HydrophobicContact CG1-CB 4.3Å; P272-L274 PolarHBondContact O-N 3.41Å
275	Q	40.9	Very low	32.5	Very low	148 Å²	148	121.4 Å²	121.4	69%	0.692	70%	0.703	S	S	*	*	H	α-helix	trans	-90.3	-30.6	179.1	-164.7	155.4	67.1	0	0	112.3	P272 F273 I277 F278	P272-Q275 PolarHBondContact O-N 3.42Å; F273-Q275 PolarHBondContact O-N 3.44Å; Q275-I277 VanDerWaalsContact C-N 3.25Å; Q275-I277 PolarHBondContact O-N 2.88Å; Q275-F278 PolarHBondContact O-N 3.32Å; Q275-F278 VanDerWaalsContact O-N 3.09Å
276	D	34.3	Very low	32.7	Very low	126 Å²	126	118 Å²	118	67%	0.674	69%	0.693	S	S	*	*	H	α-helix	trans	-68.7	-22	-179.8	-118.9	10.2	0	0	0	113.2	F273 F278	F273-D276 PolarHBondContact O-N 3.04Å; D276-F278 PolarHBondContact O-N 3.31Å
277	I	43.6	Very low	32.5	Very low	69 Å²	69	115 Å²	115	35%	0.354	69%	0.691	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.2	-20.8	173.4	-60.8	176.2	0	0	0	111.7	Q275	Q275-I277 VanDerWaalsContact C-N 3.25Å; Q275-I277 PolarHBondContact O-N 2.88Å
278	F	37.6	Very low	32.8	Very low	74 Å²	74	116.3 Å²	116.3	33%	0.325	68%	0.683	S	S	.	*	T	Hydrogen-bonded Turn	trans	-127.2	47.8	-169.9	-68.5	-78.1	0	0	0	114.2	L120 Q275 D276	L120-F278 HydrophobicContact CD2-CE2 4.34Å; L120-F278 HydrophobicContact CD2-CZ 4.49Å; Q275-F278 PolarHBondContact O-N 3.32Å; Q275-F278 VanDerWaalsContact O-N 3.09Å; D276-F278 PolarHBondContact O-N 3.31Å
279	S	27.3	Very low	32.6	Very low	85 Å²	85	116.8 Å²	116.8	59%	0.594	70%	0.695	S	S	*	*			trans	-84.8	120.6	167.8	-82.2	0	0	0	0	112.4	A281	S279-A281 VanDerWaalsContact C-N 3.3Å; S279-A281 PolarHBondContact O-N 3.41Å
280	P	31.4	Very low	32.3	Very low	140 Å²	140	115.3 Å²	115.3	91%	0.909	68%	0.683	S	S	*	*			trans	-83.2	63.7	-175.7	34.5	-36.7	0	0	0	113.2
281	A	24.1	Very low	32.1	Very low	92 Å²	92	114.6 Å²	114.6	76%	0.76	68%	0.682	S	S	*	*			trans	-138.7	114.9	172.1	0	0	0	0	0	110.1	S279	S279-A281 VanDerWaalsContact C-N 3.3Å; S279-A281 PolarHBondContact O-N 3.41Å
282	G	27.5	Very low	31.4	Very low	79 Å²	79	116.9 Å²	116.9	81%	0.814	69%	0.689	S	S	*	*			trans	-97.7	150.5	-166.1	0	0	0	0	0	115.9
283	T	28.2	Very low	31	Very low	149 Å²	149	121.7 Å²	121.7	91%	0.914	70%	0.696	S	S	*	*			trans	-148.1	116.9	154.9	1.1	0	0	0	0	111	G285	T283-G285 PolarHBondContact O-N 3.12Å
284	R	28	Very low	30	Very low	223 Å²	223	124 Å²	124	84%	0.842	71%	0.713	S	S	*	*			trans	-85	85.1	-176.7	-171.5	-176.9	-171.6	-175.3	5	111
285	G	25.9	Very low	29.3	Very low	80 Å²	80	127.8 Å²	127.8	83%	0.825	73%	0.733	S	S	*	*			trans	-76.4	117.7	171.7	0	0	0	0	0	111.8	T283	T283-G285 PolarHBondContact O-N 3.12Å
286	K	31.2	Very low	28.5	Very low	143 Å²	143	129.8 Å²	129.8	62%	0.622	74%	0.742	S	S	*	*			trans	-113.5	134.9	-179.8	-168.9	-165.4	-176.2	-154.6	0	109.9	E288	K286-E288 HydrophobicContact CD-CG 4.43Å; K286-E288 VanDerWaalsContact CE-CD 3.42Å; K286-E288 VanDerWaalsContact CE-OE1 3.26Å; K286-E288 WeakPolarHBondContact CE-OE1 3.49Å; K286-E288 IonicContact NZ-OE1 2.81Å; K286-E288 PolarHBondContact NZ-OE1 2.72Å; K286-E288 IonicContact NZ-OE2 3.09Å; K286-E288 PolarHBondContact NZ-OE2 2.91Å
287	A	24.8	Very low	28.1	Very low	103 Å²	103	128.9 Å²	128.9	85%	0.851	75%	0.745	S	S	*	*			trans	-122.7	135.1	165.7	0	0	0	0	0	109.2
288	E	30.2	Very low	27.7	Very low	153 Å²	153	131.1 Å²	131.1	72%	0.715	76%	0.764	S	S	*	*			trans	-119	142.1	173.9	-72.9	179.5	135.4	0	0	109	K286	K286-E288 HydrophobicContact CD-CG 4.43Å; K286-E288 VanDerWaalsContact CE-CD 3.42Å; K286-E288 VanDerWaalsContact CE-OE1 3.26Å; K286-E288 WeakPolarHBondContact CE-OE1 3.49Å; K286-E288 IonicContact NZ-OE1 2.81Å; K286-E288 PolarHBondContact NZ-OE1 2.72Å; K286-E288 IonicContact NZ-OE2 3.09Å; K286-E288 PolarHBondContact NZ-OE2 2.91Å
289	G	24.8	Very low	27	Very low	77 Å²	77	135.7 Å²	135.7	79%	0.794	79%	0.786	S	S	*	*			trans	-153.8	146.6	175.6	0	0	0	0	0	108.9
290	A	27.1	Very low	27.2	Very low	80 Å²	80	140.9 Å²	140.9	66%	0.661	80%	0.801	S	S	*	*			trans	-127.3	-165.5	-173.4	0	0	0	0	0	111.1
291	E	27.7	Very low	26.9	Very low	174 Å²	174	139.8 Å²	139.8	81%	0.813	79%	0.792	S	S	*	*			trans	71.3	141.2	171.3	-65.9	173.9	-169.4	0	0	115.5
292	E	25.5	Very low	27.3	Very low	181 Å²	181	138.8 Å²	138.8	85%	0.846	79%	0.791	S	S	*	*			cis	-150.7	166	-15.2	-179.1	164.9	-147.6	0	0	109.3
293	R	25.2	Very low	27.2	Very low	187 Å²	187	144.1 Å²	144.1	71%	0.706	79%	0.794	S	S	*	*			trans	-72.2	131.5	170	-79.1	-174.9	171.5	116.8	-7.9	111.7
294	L	22.1	Very low	27.2	Very low	177 Å²	177	146.1 Å²	146.1	93%	0.927	79%	0.794	S	S	*	*			trans	-126.3	151.3	138.3	-76.7	178.3	0	0	0	110.2
295	L	27.8	Very low	27.5	Very low	144 Å²	144	144.6 Å²	144.6	75%	0.754	80%	0.796	S	S	*	*			trans	-101.7	137.4	-174.1	-65.7	163.5	0	0	0	109.7
296	H	23.3	Very low	27.4	Very low	190 Å²	190	150 Å²	150	88%	0.88	80%	0.8	S	S	*	*				-171.9	136.7	123.6	-103.4	-71.9	0	0	0	110.9
297	S	25.9	Very low	27.5	Very low	106 Å²	106	150.3 Å²	150.3	74%	0.741	81%	0.807	S	S	*	*			trans	-104.4	169.4	163.1	-48	0	0	0	0	108.4
298	P	35.9	Very low	27.5	Very low	116 Å²	116	154.2 Å²	154.2	75%	0.753	81%	0.808	S	S	*	*				-149.4	168.9	84.8	42.5	-26.6	0	0	0	116.8
299	Q	22.6	Very low	27.4	Very low	170 Å²	170	154.9 Å²	154.9	79%	0.794	81%	0.809	S	S	*	*			trans	82.5	93.9	143.3	-148.7	145.3	-6.4	0	0	119.9	V301	Q299-V301 HydrophobicContact CG-CG2 4.31Å
300	E	32.9	Very low	27.4	Very low	194 Å²	194	160.1 Å²	160.1	91%	0.907	81%	0.812	S	S	*	*			trans	-74.6	149.6	148.2	-63.4	173.3	143.3	0	0	110
301	V	24.8	Very low	27.2	Very low	117 Å²	117	160.4 Å²	160.4	71%	0.709	82%	0.815	S	S	*	*			trans	-136.5	124.6	155.1	179.9	0	0	0	0	106.4	Q299	Q299-V301 HydrophobicContact CG-CG2 4.31Å
302	G	31.4	Very low	27.1	Very low	72 Å²	72	160.4 Å²	160.4	74%	0.742	82%	0.819	S	S	*	*			trans	-118.3	153.6	167.9	0	0	0	0	0	109.3
303	E	26.5	Very low	27	Very low	190 Å²	190	158.2 Å²	158.2	89%	0.888	82%	0.818	S	S	*	*			trans	-142.5	152.4	176.2	-105.6	163.5	-155.7	0	0	109.9
304	E	27.9	Very low	27.1	Very low	192 Å²	192	155.6 Å²	155.6	90%	0.897	82%	0.822	S	S	*	*			trans	-99.2	167.8	-165.9	-59.1	-179.5	131.1	0	0	112.8
305	E	34.5	Very low	27.3	Very low	190 Å²	190	157.2 Å²	157.2	89%	0.888	82%	0.822	S	S	*	*			trans	-66.6	137.9	172.3	-71	-173.3	99.7	0	0	112.6
306	Q	24.5	Very low	27.3	Very low	195 Å²	195	155.3 Å²	155.3	91%	0.911	83%	0.827	S	S	*	*			trans	-148.7	139.5	153.6	-122.4	166.4	70.3	0	0	112.2
307	L	32.2	Very low	27.3	Very low	148 Å²	148	149.9 Å²	149.9	78%	0.775	82%	0.822	S	S	*	*			trans	-74.1	151	176.4	-78.1	79.9	0	0	0	111.3
308	E	25.6	Very low	27.3	Very low	185 Å²	185	154.7 Å²	154.7	86%	0.864	83%	0.833	S	S	*	*			trans	-143.1	174.7	132.1	-129.6	-169.9	166	0	0	113.9
309	K	27.3	Very low	26.9	Very low	168 Å²	168	152.7 Å²	152.7	73%	0.73	83%	0.833	S	S	*	*			trans	-128.3	142.7	-164.5	-55.5	168.1	-176.6	170	0	111.2
310	Q	24.9	Very low	27.1	Very low	187 Å²	187	154.2 Å²	154.2	87%	0.874	84%	0.84	S	S	*	*			trans	-175.5	153	144.1	-101.8	147.4	94.8	0	0	108.5
311	A	23.9	Very low	26.9	Very low	86 Å²	86	148.3 Å²	148.3	71%	0.711	83%	0.831	S	S	*	*			cis	163.9	112.8	-22.7	0	0	0	0	0	104.1
312	I	25	Very low	26.9	Very low	174 Å²	174	151 Å²	151	89%	0.892	84%	0.841	S	S	*	*			trans	-128.6	145.4	175	-64.6	-175.9	0	0	0	109.5
313	T	22.7	Very low	27.3	Very low	135 Å²	135	153 Å²	153	83%	0.828	84%	0.844	S	S	*	*			trans	-83.4	140.7	-157.9	-44.4	0	0	0	0	114.3
314	V	27.5	Very low	27.5	Very low	132 Å²	132	153.1 Å²	153.1	80%	0.8	85%	0.845	S	S	*	*			trans	-81.6	139.8	168.4	176.7	0	0	0	0	110.8
315	K	25.3	Very low	27.5	Very low	210 Å²	210	153.3 Å²	153.3	91%	0.913	85%	0.846	S	S	*	*			trans	-131.8	132.9	157.7	-120.8	-171.7	179	-171.9	0	109.6
316	A	27.7	Very low	27.4	Very low	104 Å²	104	148.8 Å²	148.8	86%	0.86	83%	0.832	S	S	*	*			trans	-95.4	154.1	-179.1	0	0	0	0	0	112.2
317	G	25.1	Very low	27.7	Very low	76 Å²	76	148.9 Å²	148.9	78%	0.784	83%	0.833	S	S	*	*			trans	-158	144.2	169.8	0	0	0	0	0	108
318	E	25.4	Very low	27.6	Very low	208 Å²	208	152.6 Å²	152.6	97%	0.972	84%	0.837	S	S	*	*			trans	-96.3	158.1	-162.4	-58.6	163.3	117.2	0	0	113.1
319	G	26.2	Very low	28	Very low	73 Å²	73	152.8 Å²	152.8	75%	0.753	84%	0.838	S	S	*	*			trans	134.1	82.6	153.6	0	0	0	0	0	118.9
320	Q	26.7	Very low	28.3	Very low	203 Å²	203	151.5 Å²	151.5	95%	0.949	84%	0.838	S	S	*	*				49.6	117.5	125.7	-175.1	176.8	-4.7	0	0	120.8
321	G	29.1	Very low	29.4	Very low	69 Å²	69	147.9 Å²	147.9	71%	0.711	83%	0.833	S	S	*	*			trans	154.4	111.9	151.8	0	0	0	0	0	117.1
322	D	26.3	Very low	29.9	Very low	173 Å²	173	152.2 Å²	152.2	93%	0.925	84%	0.841	S	S	*	*			trans	55.2	171.8	159.3	-67.2	-17.1	0	0	0	120.9
323	S	38.8	Very low	30.9	Very low	114 Å²	114	145.2 Å²	145.2	80%	0.797	81%	0.812	S	S	*	*			trans	-115.2	130.2	-157.3	-53.6	0	0	0	0	113
324	E	31.4	Very low	32.8	Very low	194 Å²	194	143 Å²	143	91%	0.907	80%	0.795	S	S	*	*			trans	-159.5	134.5	153.3	-110.6	159.5	-145.3	0	0	108.2
325	E	27	Very low	35	Very low	196 Å²	196	145.6 Å²	145.6	92%	0.916	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-83.5	127.4	178.5	-73.1	-153	154.2	0	0	111
326	P	33.6	Very low	37.6	Very low	94 Å²	94	139.7 Å²	139.7	61%	0.61	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-83.1	123.8	176.4	31.5	-32.5	0	0	0	111.8	W328	P326-W328 PolarHBondContact O-N 3.42Å
327	E	29.9	Very low	40.4	Very low	197 Å²	197	136.8 Å²	136.8	92%	0.921	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-63.3	121.1	167.1	-70.1	-169.6	114.7	0	0	110.8
328	W	29.9	Very low	43.2	Very low	227 Å²	227	139.9 Å²	139.9	86%	0.86	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-89.6	125.6	172.1	-78.1	90.8	0	0	0	111.4	P326 L330	P326-W328 PolarHBondContact O-N 3.42Å; W328-L330 PolarHBondContact O-N 3Å
329	Q	34.9	Very low	46.1	Very low	188 Å²	188	136.1 Å²	136.1	88%	0.879	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-65.8	128.2	179.1	-62.8	173.3	-18.4	0	0	111.6
330	L	32	Very low	49	Very low	142 Å²	142	133.3 Å²	133.3	74%	0.743	68%	0.681	S	S	*	*			trans	-133.6	133.3	159.7	-79.8	176.1	0	0	0	110.6	W328 N334	W328-L330 PolarHBondContact O-N 3Å; L330-N334 PolarHBondContact O-ND2 3.49Å
331	S	48.6	Very low	52	Low	110 Å²	110	123.8 Å²	123.8	77%	0.769	64%	0.637	S	S	*	*			trans	-96.2	168.2	175.1	-168.3	0	0	0	0	111.1	G333	S331-G333 PolarHBondContact O-N 3.35Å
332	M	34.5	Very low	54.8	Low	178 Å²	178	127.6 Å²	127.6	88%	0.877	63%	0.633	S	S	*	*	S	Bend	trans	59.9	-44	-176.9	-73.3	170.3	57.8	0	0	117	N334	M332-N334 VanDerWaalsContact C-N 3.28Å; M332-N334 PolarHBondContact O-N 3.45Å
333	G	46.1	Very low	57.9	Low	27 Å²	27	123.9 Å²	123.9	28%	0.278	61%	0.609	S	S	.	*	H	α-helix	trans	-64.6	-24.8	-177.3	0	0	0	0	0	115.4	S331 K335 E336 F337	S331-G333 PolarHBondContact O-N 3.35Å; G333-K335 PolarHBondContact O-N 2.85Å; G333-E336 PolarHBondContact O-N 2.85Å; G333-F337 WeakPolarHBondContact O-CB 3.33Å; G333-F337 PolarHBondContact O-N 3.26Å; G333-F337 VanDerWaalsContact O-N 3.09Å
334	N	62.8	Low	60.3	Low	89 Å²	89	118.5 Å²	118.5	48%	0.476	57%	0.571	S	S	.	*	H	α-helix	trans	-64.8	-36	-170.7	-63.7	-25.1	0	0	0	113.9	L330 M332 W338	L330-N334 PolarHBondContact O-ND2 3.49Å; M332-N334 VanDerWaalsContact C-N 3.28Å; M332-N334 PolarHBondContact O-N 3.45Å; N334-W338 WeakPolarHBondContact O-CB 3.49Å; N334-W338 PolarHBondContact O-N 3.07Å
335	K	73.8	Confident	63	Low	185 Å²	185	111.9 Å²	111.9	80%	0.804	54%	0.544	S	S	*	.	H	α-helix	trans	-66.1	-44.6	-177.4	-72.6	-172.5	178.6	-177.8	0	111.5	G333 L339	G333-K335 PolarHBondContact O-N 2.85Å; K335-L339 WeakPolarHBondContact O-CB 3.22Å; K335-L339 PolarHBondContact O-N 2.89Å
336	E	79.3	Confident	66	Low	86 Å²	86	106.8 Å²	106.8	40%	0.402	54%	0.536	S	S	.	.	H	α-helix	trans	-69.2	-42.7	178.1	-165.2	-176.4	148.8	0	0	111.3	G333 W338 L339 L340 P363 K364	G333-E336 PolarHBondContact O-N 2.85Å; E336-W338 PolarHBondContact O-N 2.86Å; E336-L339 PolarHBondContact O-N 3.36Å; E336-L339 VanDerWaalsContact O-N 3.09Å; E336-L340 HydrophobicContact CG-CD1 3.95Å; E336-L340 HydrophobicContact CG-CG 4.41Å; E336-L340 WeakPolarHBondContact O-CB 3.45Å; E336-L340 WeakPolarHBondContact O-CG 3.17Å; E336-L340 PolarHBondContact O-N 3.02Å; E336-P363 HydrophobicContact CB-CB 4.3Å; E336-P363 VanDerWaalsContact CD-CB 3.5Å; E336-P363 HydrophobicContact CG-CB 4.18Å; E336-P363 WeakPolarHBondContact OE1-CB 3.43Å; E336-K364 PolarHBondContact OE1-N 3.06Å
337	F	87	Confident	68.3	Low	44 Å²	44	106.9 Å²	106.9	19%	0.193	53%	0.529	C	S	.	.	H	α-helix	trans	-53.8	-49	173	-179.8	-83.6	0	0	0	112.1	G333 L339 L341 L358 K359	G333-F337 WeakPolarHBondContact O-CB 3.33Å; G333-F337 PolarHBondContact O-N 3.26Å; G333-F337 VanDerWaalsContact O-N 3.09Å; F337-L339 VanDerWaalsContact C-N 3.32Å; F337-L339 PolarHBondContact O-N 3.4Å; F337-L341 HydrophobicContact CE1-CD2 4.13Å; F337-L341 VanDerWaalsContact O-CB 3.22Å; F337-L341 WeakPolarHBondContact O-CB 3.43Å; F337-L341 PolarHBondContact O-N 3.36Å; F337-L358 HydrophobicContact CD2-CB 3.72Å; F337-L358 HydrophobicContact CD2-CD1 4.15Å; F337-L358 HydrophobicContact CD2-CG 4.49Å; F337-L358 HydrophobicContact CE2-CB 3.39Å; F337-L358 HydrophobicContact CE2-CD1 4.1Å; F337-L358 HydrophobicContact CE2-CG 4.39Å; F337-L358 HydrophobicContact CG-CD1 4.49Å; F337-L358 HydrophobicContact CZ-CB 4.24Å; F337-L358 HydrophobicContact CZ-CD1 4.39Å; F337-K359 HydrophobicContact CE2-CG 4.31Å
338	W	85	Confident	70.9	Confident	141 Å²	141	100.5 Å²	100.5	53%	0.534	52%	0.517	S	S	.	.	H	α-helix	trans	-68.1	-29.2	177.7	-80.4	114.5	0	0	0	113.4	N334 E336 L341 K342	N334-W338 WeakPolarHBondContact O-CB 3.49Å; N334-W338 PolarHBondContact O-N 3.07Å; E336-W338 PolarHBondContact O-N 2.86Å; W338-L341 HydrophobicContact CE3-CD2 3.83Å; W338-L341 HydrophobicContact CZ3-CD2 3.72Å; W338-K342 WeakPolarHBondContact O-CB 3.21Å; W338-K342 WeakPolarHBondContact O-CG 3.47Å; W338-K342 PolarHBondContact O-N 3.24Å; W338-K342 VanDerWaalsContact O-N 3.12Å
339	L	86.1	Confident	73.7	Confident	129 Å²	129	91.4 Å²	91.4	68%	0.675	48%	0.482	S	S	*	.	H	α-helix	trans	-74.4	-45.6	177.8	-154.8	73.3	0	0	0	111.2	K335 E336 F337 K342 F343	K335-L339 WeakPolarHBondContact O-CB 3.22Å; K335-L339 PolarHBondContact O-N 2.89Å; E336-L339 PolarHBondContact O-N 3.36Å; E336-L339 VanDerWaalsContact O-N 3.09Å; F337-L339 VanDerWaalsContact C-N 3.32Å; F337-L339 PolarHBondContact O-N 3.4Å; L339-K342 PolarHBondContact O-N 2.85Å; L339-F343 WeakPolarHBondContact O-CB 3.34Å; L339-F343 PolarHBondContact O-N 3.03Å
340	L	86.3	Confident	76.2	Confident	13 Å²	13	85.2 Å²	85.2	7%	0.068	46%	0.458	C	S	.	.	H	α-helix	trans	-61.4	-43.9	173	-70.1	163.9	0	0	0	111.3	E336 K342 F343 F344 L358 K364 A366 I369	E336-L340 HydrophobicContact CG-CD1 3.95Å; E336-L340 HydrophobicContact CG-CG 4.41Å; E336-L340 WeakPolarHBondContact O-CB 3.45Å; E336-L340 WeakPolarHBondContact O-CG 3.17Å; E336-L340 PolarHBondContact O-N 3.02Å; L340-K342 PolarHBondContact O-N 3.2Å; L340-F343 WeakPolarHBondContact O-CB 3.18Å; L340-F343 PolarHBondContact O-N 3.01Å; L340-F344 HydrophobicContact CB-CE2 4.35Å; L340-F344 HydrophobicContact CD2-CE2 4.15Å; L340-F344 WeakPolarHBondContact O-CD2 3.39Å; L340-F344 PolarHBondContact O-N 2.94Å; L340-L358 HydrophobicContact CB-CD1 4.13Å; L340-L358 HydrophobicContact CB-CD2 3.79Å; L340-L358 HydrophobicContact CD1-CD2 3.83Å; L340-L358 HydrophobicContact CG-CD2 4.41Å; L340-K364 WeakPolarHBondContact CD1-O 3.41Å; L340-A366 HydrophobicContact CD2-CB 3.84Å; L340-I369 HydrophobicContact CD1-CD1 4.01Å
341	L	89	Confident	78.9	Confident	4 Å²	4	82.6 Å²	82.6	2%	0.021	44%	0.442	C	S	.	.	H	α-helix	trans	-58.6	-49.6	177.1	-178.6	56	0	0	0	111.4	F337 W338 F343 T345 E351 V354 K355 L358	F337-L341 HydrophobicContact CE1-CD2 4.13Å; F337-L341 VanDerWaalsContact O-CB 3.22Å; F337-L341 WeakPolarHBondContact O-CB 3.43Å; F337-L341 PolarHBondContact O-N 3.36Å; W338-L341 HydrophobicContact CE3-CD2 3.83Å; W338-L341 HydrophobicContact CZ3-CD2 3.72Å; L341-F343 VanDerWaalsContact C-N 3.33Å; L341-F343 PolarHBondContact O-N 2.99Å; L341-T345 WeakPolarHBondContact O-CB 3.38Å; L341-T345 PolarHBondContact O-N 2.92Å; L341-T345 PolarHBondContact O-OG1 2.84Å; L341-E351 HydrophobicContact CD1-CG 3.79Å; L341-E351 HydrophobicContact CD2-CG 4.42Å; L341-E351 HydrophobicContact CG-CG 4.34Å; L341-V354 HydrophobicContact CD1-CB 3.71Å; L341-V354 HydrophobicContact CD1-CG1 3.51Å; L341-K355 HydrophobicContact CD1-CG 4.04Å; L341-K355 HydrophobicContact CD2-CG 4.07Å; L341-L358 HydrophobicContact CB-CD1 3.93Å
342	K	88.9	Confident	80.7	Confident	149 Å²	149	82.4 Å²	82.4	65%	0.648	43%	0.432	S	S	*	.	H	α-helix	trans	-62.4	-38.4	175.4	-75.7	178.1	177.4	-176.9	0	112.6	W338 L339 L340 A346	W338-K342 WeakPolarHBondContact O-CB 3.21Å; W338-K342 WeakPolarHBondContact O-CG 3.47Å; W338-K342 PolarHBondContact O-N 3.24Å; W338-K342 VanDerWaalsContact O-N 3.12Å; L339-K342 PolarHBondContact O-N 2.85Å; L340-K342 PolarHBondContact O-N 3.2Å; K342-A346 WeakPolarHBondContact O-CB 3.1Å; K342-A346 PolarHBondContact O-N 3.38Å
343	F	90.9	Very high	83.2	Confident	95 Å²	95	73.9 Å²	73.9	42%	0.417	39%	0.39	S	S	.	.	H	α-helix	trans	-61.5	-55.4	178.1	175.4	-98.4	0	0	0	111.8	L339 L340 L341 T345 A346 M347 A366	L339-F343 WeakPolarHBondContact O-CB 3.34Å; L339-F343 PolarHBondContact O-N 3.03Å; L340-F343 WeakPolarHBondContact O-CB 3.18Å; L340-F343 PolarHBondContact O-N 3.01Å; L341-F343 VanDerWaalsContact C-N 3.33Å; L341-F343 PolarHBondContact O-N 2.99Å; F343-T345 PolarHBondContact O-N 3.37Å; F343-A346 PolarHBondContact O-N 3.34Å; F343-M347 HydrophobicContact CD1-CE 4.28Å; F343-M347 HydrophobicContact CE1-CE 3.49Å; F343-M347 VanDerWaalsContact CE1-CE 3.49Å; F343-M347 HydrophobicContact CE1-SD 4.01Å; F343-M347 HydrophobicContact CE2-SD 4.28Å; F343-M347 HydrophobicContact CZ-CE 3.79Å; F343-M347 HydrophobicContact CZ-SD 3.7Å; F343-M347 WeakPolarHBondContact O-CG 3.4Å; F343-M347 PolarHBondContact O-N 2.81Å; F343-M347 VanDerWaalsContact O-N 3.1Å; F343-A366 HydrophobicContact CD1-CB 3.91Å; F343-A366 HydrophobicContact CE1-CB 3.7Å; F343-A366 HydrophobicContact CZ-CB 4.4Å
344	F	89.3	Confident	85.2	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-68.1	-37.5	-178.6	-66.6	-65.3	0	0	0	112.8	L340 A346 M347 G348 Y349 V354 A366 I369 L370 V373	L340-F344 HydrophobicContact CB-CE2 4.35Å; L340-F344 HydrophobicContact CD2-CE2 4.15Å; L340-F344 WeakPolarHBondContact O-CD2 3.39Å; L340-F344 PolarHBondContact O-N 2.94Å; F344-A346 VanDerWaalsContact C-N 3.33Å; F344-A346 PolarHBondContact O-N 3.35Å; F344-M347 HydrophobicContact CD1-CE 4.04Å; F344-M347 HydrophobicContact CE1-CE 4.33Å; F344-M347 CarbonylContact O-C 3.56Å; F344-M347 PolarHBondContact O-N 2.9Å; F344-M347 VanDerWaalsContact O-N 3.11Å; F344-G348 PolarHBondContact O-N 3.44Å; F344-Y349 HydrophobicContact CB-CD2 4.03Å; F344-Y349 HydrophobicContact CD1-CD2 4.11Å; F344-Y349 HydrophobicContact CD1-CE2 4.31Å; F344-Y349 WeakPolarHBondContact O-CD2 3.4Å; F344-Y349 PolarHBondContact O-N 2.97Å; F344-Y349 VanDerWaalsContact O-N 3.12Å; F344-V354 HydrophobicContact CB-CB 4.41Å; F344-V354 HydrophobicContact CB-CG1 3.83Å; F344-V354 HydrophobicContact CB-CG2 3.59Å; F344-V354 HydrophobicContact CD2-CG1 3.91Å; F344-V354 HydrophobicContact CG-CG1 4.28Å; F344-A366 HydrophobicContact CZ-CB 3.93Å; F344-A366 WeakPolarHBondContact CZ-O 3.21Å; F344-I369 HydrophobicContact CD2-CG2 4.41Å; F344-I369 HydrophobicContact CE2-CB 3.96Å; F344-I369 HydrophobicContact CE2-CG2 3.52Å; F344-I369 HydrophobicContact CZ-CB 3.79Å; F344-I369 HydrophobicContact CZ-CG2 3.72Å; F344-L370 HydrophobicContact CD1-CD1 4.23Å; F344-L370 HydrophobicContact CE1-CB 3.99Å; F344-L370 HydrophobicContact CE1-CD1 3.91Å; F344-V373 HydrophobicContact CB-CG1 4.43Å; F344-V373 HydrophobicContact CD1-CG1 4.36Å; F344-V373 HydrophobicContact CD2-CG2 4.3Å; F344-V373 HydrophobicContact CE2-CG2 4.47Å; F344-V373 HydrophobicContact CG-CG1 4.41Å; F344-V373 HydrophobicContact CG-CG2 4.34Å
345	T	89.2	Confident	86.4	Confident	55 Å²	55	71.2 Å²	71.2	34%	0.337	37%	0.367	S	S	.	.	H	α-helix	trans	-68	-31.5	174.9	-64.3	0	0	0	0	112.3	L341 F343 M347 G348 Y349	L341-T345 WeakPolarHBondContact O-CB 3.38Å; L341-T345 PolarHBondContact O-N 2.92Å; L341-T345 PolarHBondContact O-OG1 2.84Å; F343-T345 PolarHBondContact O-N 3.37Å; T345-M347 VanDerWaalsContact C-N 3.3Å; T345-M347 PolarHBondContact O-N 3.2Å; T345-G348 PolarHBondContact O-N 2.93Å; T345-G348 VanDerWaalsContact O-N 3.12Å; T345-Y349 WeakPolarHBondContact CA-O 3.36Å; T345-Y349 PolarHBondContact OG1-O 3.12Å
346	A	88.8	Confident	86.9	Confident	90 Å²	90	67.1 Å²	67.1	74%	0.744	35%	0.346	S	S	*	.	H	α-helix	trans	-69	-25.6	169.9	0	0	0	0	0	113.4	K342 F343 F344 G348	K342-A346 WeakPolarHBondContact O-CB 3.1Å; K342-A346 PolarHBondContact O-N 3.38Å; F343-A346 PolarHBondContact O-N 3.34Å; F344-A346 VanDerWaalsContact C-N 3.33Å; F344-A346 PolarHBondContact O-N 3.35Å; A346-G348 VanDerWaalsContact C-N 3.26Å
347	M	83	Confident	87.2	Confident	95 Å²	95	63.2 Å²	63.2	47%	0.468	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	2.7	170	-59.7	-154.4	-53	0	0	113.7	F343 F344 T345 Y349 L370	F343-M347 HydrophobicContact CD1-CE 4.28Å; F343-M347 HydrophobicContact CE1-CE 3.49Å; F343-M347 VanDerWaalsContact CE1-CE 3.49Å; F343-M347 HydrophobicContact CE1-SD 4.01Å; F343-M347 HydrophobicContact CE2-SD 4.28Å; F343-M347 HydrophobicContact CZ-CE 3.79Å; F343-M347 HydrophobicContact CZ-SD 3.7Å; F343-M347 WeakPolarHBondContact O-CG 3.4Å; F343-M347 PolarHBondContact O-N 2.81Å; F343-M347 VanDerWaalsContact O-N 3.1Å; F344-M347 HydrophobicContact CD1-CE 4.04Å; F344-M347 HydrophobicContact CE1-CE 4.33Å; F344-M347 CarbonylContact O-C 3.56Å; F344-M347 PolarHBondContact O-N 2.9Å; F344-M347 VanDerWaalsContact O-N 3.11Å; T345-M347 VanDerWaalsContact C-N 3.3Å; T345-M347 PolarHBondContact O-N 3.2Å; M347-Y349 HydrophobicContact CB-CD2 4.32Å; M347-Y349 HydrophobicContact CB-CE2 4.35Å; M347-Y349 HydrophobicContact CE-CE2 4.19Å; M347-L370 HydrophobicContact CE-CD1 3.78Å
348	G	83.1	Confident	87.2	Confident	64 Å²	64	61.2 Å²	61.2	66%	0.66	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.8	0.7	173	0	0	0	0	0	116.1	F344 T345 A346	F344-G348 PolarHBondContact O-N 3.44Å; T345-G348 PolarHBondContact O-N 2.93Å; T345-G348 VanDerWaalsContact O-N 3.12Å; A346-G348 VanDerWaalsContact C-N 3.26Å
349	Y	89.7	Confident	87.1	Confident	35 Å²	35	62.8 Å²	62.8	14%	0.137	33%	0.33	C	S	.	.			trans	-74.7	141.8	176.3	-63	-71.7	0	0	0	112.2	F344 T345 M347 E351 L370 V373 Q374 Q377	F344-Y349 HydrophobicContact CB-CD2 4.03Å; F344-Y349 HydrophobicContact CD1-CD2 4.11Å; F344-Y349 HydrophobicContact CD1-CE2 4.31Å; F344-Y349 WeakPolarHBondContact O-CD2 3.4Å; F344-Y349 PolarHBondContact O-N 2.97Å; F344-Y349 VanDerWaalsContact O-N 3.12Å; T345-Y349 WeakPolarHBondContact CA-O 3.36Å; T345-Y349 PolarHBondContact OG1-O 3.12Å; M347-Y349 HydrophobicContact CB-CD2 4.32Å; M347-Y349 HydrophobicContact CB-CE2 4.35Å; M347-Y349 HydrophobicContact CE-CE2 4.19Å; Y349-E351 PolarHBondContact O-N 3.26Å; Y349-L370 HydrophobicContact CE2-CD1 3.72Å; Y349-V373 HydrophobicContact CD1-CG1 3.61Å; Y349-V373 HydrophobicContact CD2-CG1 3.69Å; Y349-V373 HydrophobicContact CE1-CG1 4.12Å; Y349-V373 HydrophobicContact CE2-CG1 4.18Å; Y349-V373 HydrophobicContact CG-CG1 3.37Å; Y349-Q374 HydrophobicContact CE1-CB 4.4Å; Y349-Q374 VanDerWaalsContact CE1-OE1 3.3Å; Y349-Q374 PolarHBondContact OH-OE1 3.48Å; Y349-Q377 HydrophobicContact CD1-CB 4.22Å; Y349-Q377 HydrophobicContact CD1-CG 4.3Å
350	T	87.8	Confident	86.8	Confident	59 Å²	59	64.2 Å²	64.2	36%	0.362	33%	0.331	S	S	.	.			trans	-66.8	134.7	-177.2	61	0	0	0	0	111.6	D352 V353 V354 Q377	T350-D352 PolarHBondContact O-N 3.35Å; T350-D352 VanDerWaalsContact O-N 3.13Å; T350-V353 PolarHBondContact O-N 3.12Å; T350-V353 WeakPolarHBondContact OG1-CB 3.3Å; T350-V353 WeakPolarHBondContact OG1-CG2 3.44Å; T350-V354 WeakPolarHBondContact O-CG2 3.48Å; T350-V354 PolarHBondContact O-N 3.26Å; T350-V354 VanDerWaalsContact O-N 3.08Å; T350-Q377 PolarHBondContact OG1-NE2 3.48Å; T350-Q377 PolarHBondContact OG1-OE1 3.11Å
351	E	88.8	Confident	86.3	Confident	86 Å²	86	65.3 Å²	65.3	40%	0.402	34%	0.338	S	S	.	.	H	α-helix	trans	-57.5	-34.8	-171.5	-159.1	-168.6	158.2	0	0	112.3	L341 Y349 K355	L341-E351 HydrophobicContact CD1-CG 3.79Å; L341-E351 HydrophobicContact CD2-CG 4.42Å; L341-E351 HydrophobicContact CG-CG 4.34Å; Y349-E351 PolarHBondContact O-N 3.26Å; E351-K355 HydrophobicContact CG-CD 4.35Å; E351-K355 WeakPolarHBondContact O-CB 3.33Å; E351-K355 WeakPolarHBondContact O-CD 3.49Å; E351-K355 WeakPolarHBondContact O-CG 3.47Å; E351-K355 PolarHBondContact O-N 3.1Å; E351-K355 WeakPolarHBondContact OE1-CE 3.39Å; E351-K355 IonicContact OE1-NZ 3Å; E351-K355 PolarHBondContact OE1-NZ 3.28Å; E351-K355 IonicContact OE2-NZ 3.72Å
352	D	85.6	Confident	85.5	Confident	106 Å²	106	66.3 Å²	66.3	57%	0.567	35%	0.35	S	S	*	.	H	α-helix	trans	-73.1	-34.3	178.5	-63.6	-44	0	0	0	113.6	T350 R356	T350-D352 PolarHBondContact O-N 3.35Å; T350-D352 VanDerWaalsContact O-N 3.13Å; D352-R356 VanDerWaalsContact O-CG 3.32Å; D352-R356 WeakPolarHBondContact O-CG 3.47Å; D352-R356 PolarHBondContact O-N 3.36Å; D352-R356 PolarHBondContact O-NH1 3.06Å
353	V	88.1	Confident	84.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-49.7	171.2	162.9	0	0	0	0	109.5	T350 K355 R356 V357 V373 E376 Q377	T350-V353 PolarHBondContact O-N 3.12Å; T350-V353 WeakPolarHBondContact OG1-CB 3.3Å; T350-V353 WeakPolarHBondContact OG1-CG2 3.44Å; V353-K355 PolarHBondContact O-N 3.49Å; V353-R356 PolarHBondContact O-N 3.09Å; V353-R356 VanDerWaalsContact O-N 3.09Å; V353-V357 PolarHBondContact O-N 3.45Å; V353-V373 HydrophobicContact CG1-CG1 4.44Å; V353-E376 HydrophobicContact CG1-CB 3.92Å; V353-E376 HydrophobicContact CG1-CG 3.87Å; V353-Q377 HydrophobicContact CG1-CB 4.08Å
354	V	87.1	Confident	83.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.2	-44.1	-179.5	-177.4	0	0	0	0	110.8	L341 F344 T350 R356 V357 L358 V373	L341-V354 HydrophobicContact CD1-CB 3.71Å; L341-V354 HydrophobicContact CD1-CG1 3.51Å; F344-V354 HydrophobicContact CB-CB 4.41Å; F344-V354 HydrophobicContact CB-CG1 3.83Å; F344-V354 HydrophobicContact CB-CG2 3.59Å; F344-V354 HydrophobicContact CD2-CG1 3.91Å; F344-V354 HydrophobicContact CG-CG1 4.28Å; T350-V354 WeakPolarHBondContact O-CG2 3.48Å; T350-V354 PolarHBondContact O-N 3.26Å; T350-V354 VanDerWaalsContact O-N 3.08Å; V354-R356 PolarHBondContact O-N 2.99Å; V354-V357 PolarHBondContact O-N 3.39Å; V354-L358 HydrophobicContact CG1-CD1 3.75Å; V354-L358 HydrophobicContact CG1-CG 4.17Å; V354-L358 WeakPolarHBondContact O-CB 3.15Å; V354-L358 VanDerWaalsContact O-CG 3.28Å; V354-L358 WeakPolarHBondContact O-CG 3.18Å; V354-L358 PolarHBondContact O-N 3.12Å; V354-V373 HydrophobicContact CG2-CG1 3.92Å
355	K	87.4	Confident	82.8	Confident	60 Å²	60	68.1 Å²	68.1	26%	0.261	37%	0.366	S	S	.	.	H	α-helix	trans	-58.1	-41.7	172.8	-77.8	166	-177.3	161	0	112.7	L341 E351 V353 K359	L341-K355 HydrophobicContact CD1-CG 4.04Å; L341-K355 HydrophobicContact CD2-CG 4.07Å; E351-K355 HydrophobicContact CG-CD 4.35Å; E351-K355 WeakPolarHBondContact O-CB 3.33Å; E351-K355 WeakPolarHBondContact O-CD 3.49Å; E351-K355 WeakPolarHBondContact O-CG 3.47Å; E351-K355 PolarHBondContact O-N 3.1Å; E351-K355 WeakPolarHBondContact OE1-CE 3.39Å; E351-K355 IonicContact OE1-NZ 3Å; E351-K355 PolarHBondContact OE1-NZ 3.28Å; E351-K355 IonicContact OE2-NZ 3.72Å; V353-K355 PolarHBondContact O-N 3.49Å; K355-K359 WeakPolarHBondContact O-CB 3.38Å; K355-K359 VanDerWaalsContact O-CG 3.27Å; K355-K359 WeakPolarHBondContact O-CG 3.29Å; K355-K359 PolarHBondContact O-N 3.36Å; K355-K359 VanDerWaalsContact O-N 3.08Å
356	R	84.7	Confident	82.2	Confident	99 Å²	99	66.9 Å²	66.9	37%	0.374	36%	0.361	S	S	.	.	H	α-helix	trans	-64.4	-46.2	177.3	-75.1	-166.9	-45	-91.2	17.2	111.8	D352 V353 V354 K360 E376	D352-R356 VanDerWaalsContact O-CG 3.32Å; D352-R356 WeakPolarHBondContact O-CG 3.47Å; D352-R356 PolarHBondContact O-N 3.36Å; D352-R356 PolarHBondContact O-NH1 3.06Å; V353-R356 PolarHBondContact O-N 3.09Å; V353-R356 VanDerWaalsContact O-N 3.09Å; V354-R356 PolarHBondContact O-N 2.99Å; R356-K360 VanDerWaalsContact O-CB 3.28Å; R356-K360 WeakPolarHBondContact O-CB 3.37Å; R356-K360 PolarHBondContact O-N 3.04Å; R356-E376 IonicContact CZ-OE1 3.58Å; R356-E376 VanDerWaalsContact CZ-OE1 3.32Å; R356-E376 IonicContact NE-OE1 3.58Å; R356-E376 PolarHBondContact NE-OE1 3.06Å; R356-E376 IonicContact NH2-OE1 2.67Å; R356-E376 PolarHBondContact NH2-OE1 3.48Å
357	V	85	Confident	81.7	Confident	4 Å²	4	66.4 Å²	66.4	2%	0.024	35%	0.353	C	S	.	.	H	α-helix	trans	-65.7	-48.5	179.5	-179	0	0	0	0	111.1	V353 V354 K359 K360 T361 I369 L372 V373 E376	V353-V357 PolarHBondContact O-N 3.45Å; V354-V357 PolarHBondContact O-N 3.39Å; V357-K359 VanDerWaalsContact C-N 3.32Å; V357-K359 PolarHBondContact O-N 2.91Å; V357-K360 CarbonylContact O-C 3.56Å; V357-K360 WeakPolarHBondContact O-CA 3.47Å; V357-K360 WeakPolarHBondContact O-CB 3.43Å; V357-K360 PolarHBondContact O-N 3.13Å; V357-T361 HydrophobicContact CG1-CG2 4.41Å; V357-T361 PolarHBondContact O-N 2.88Å; V357-T361 PolarHBondContact O-OG1 3.48Å; V357-T361 VanDerWaalsContact O-OG1 3.11Å; V357-I369 HydrophobicContact CG1-CG2 4Å; V357-L372 HydrophobicContact CG1-CB 3.68Å; V357-V373 HydrophobicContact CB-CG2 3.96Å; V357-V373 HydrophobicContact CG1-CG2 4.02Å; V357-V373 HydrophobicContact CG2-CG2 4.14Å; V357-E376 HydrophobicContact CG2-CB 3.55Å; V357-E376 HydrophobicContact CG2-CG 3.73Å
358	L	86.9	Confident	81.4	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-59.5	-39.8	179.1	-68.6	174.5	0	0	0	112.6	F337 L340 L341 V354 K360 G362 I369	F337-L358 HydrophobicContact CD2-CB 3.72Å; F337-L358 HydrophobicContact CD2-CD1 4.15Å; F337-L358 HydrophobicContact CD2-CG 4.49Å; F337-L358 HydrophobicContact CE2-CB 3.39Å; F337-L358 HydrophobicContact CE2-CD1 4.1Å; F337-L358 HydrophobicContact CE2-CG 4.39Å; F337-L358 HydrophobicContact CG-CD1 4.49Å; F337-L358 HydrophobicContact CZ-CB 4.24Å; F337-L358 HydrophobicContact CZ-CD1 4.39Å; L340-L358 HydrophobicContact CB-CD1 4.13Å; L340-L358 HydrophobicContact CB-CD2 3.79Å; L340-L358 HydrophobicContact CD1-CD2 3.83Å; L340-L358 HydrophobicContact CG-CD2 4.41Å; L341-L358 HydrophobicContact CB-CD1 3.93Å; V354-L358 HydrophobicContact CG1-CD1 3.75Å; V354-L358 HydrophobicContact CG1-CG 4.17Å; V354-L358 WeakPolarHBondContact O-CB 3.15Å; V354-L358 VanDerWaalsContact O-CG 3.28Å; V354-L358 WeakPolarHBondContact O-CG 3.18Å; V354-L358 PolarHBondContact O-N 3.12Å; L358-K360 PolarHBondContact O-N 2.72Å; L358-G362 WeakPolarHBondContact O-CA 3.25Å; L358-G362 PolarHBondContact O-N 3.31Å; L358-I369 HydrophobicContact CD2-CD1 3.77Å; L358-I369 HydrophobicContact CD2-CG2 4.21Å
359	K	83.6	Confident	81.5	Confident	174 Å²	174	63.5 Å²	63.5	76%	0.757	32%	0.321	S	S	*	.	H	α-helix	trans	-65.7	-23.5	173.2	-76.2	-179.1	175.7	-169.8	0	113.6	F337 K355 V357	F337-K359 HydrophobicContact CE2-CG 4.31Å; K355-K359 WeakPolarHBondContact O-CB 3.38Å; K355-K359 VanDerWaalsContact O-CG 3.27Å; K355-K359 WeakPolarHBondContact O-CG 3.29Å; K355-K359 PolarHBondContact O-N 3.36Å; K355-K359 VanDerWaalsContact O-N 3.08Å; V357-K359 VanDerWaalsContact C-N 3.32Å; V357-K359 PolarHBondContact O-N 2.91Å
360	K	78.8	Confident	81.3	Confident	160 Å²	160	64.6 Å²	64.6	70%	0.696	33%	0.328	S	S	*	.	H	α-helix	trans	-94.2	-28.3	-175.6	-175.3	-179.2	179.4	-175.2	0	113.1	R356 V357 L358 E376	R356-K360 VanDerWaalsContact O-CB 3.28Å; R356-K360 WeakPolarHBondContact O-CB 3.37Å; R356-K360 PolarHBondContact O-N 3.04Å; V357-K360 CarbonylContact O-C 3.56Å; V357-K360 WeakPolarHBondContact O-CA 3.47Å; V357-K360 WeakPolarHBondContact O-CB 3.43Å; V357-K360 PolarHBondContact O-N 3.13Å; L358-K360 PolarHBondContact O-N 2.72Å; K360-E376 IonicContact NZ-OE2 3.6Å; K360-E376 PolarHBondContact NZ-OE2 3.08Å
361	T	77	Confident	81.1	Confident	35 Å²	35	67.5 Å²	67.5	22%	0.215	34%	0.342	C	S	.	.	H	α-helix	trans	-105.5	-20.2	178.5	54	0	0	0	0	115.1	V357 K364 L372	V357-T361 HydrophobicContact CG1-CG2 4.41Å; V357-T361 PolarHBondContact O-N 2.88Å; V357-T361 PolarHBondContact O-OG1 3.48Å; V357-T361 VanDerWaalsContact O-OG1 3.11Å; T361-K364 WeakPolarHBondContact O-CE 3.49Å; T361-L372 HydrophobicContact CG2-CD1 3.59Å
362	G	71	Confident	81	Confident	26 Å²	26	66.6 Å²	66.6	27%	0.268	34%	0.34	S	S	.	.			trans	74	179.9	-166.3	0	0	0	0	0	113	L358 K364	L358-G362 WeakPolarHBondContact O-CA 3.25Å; L358-G362 PolarHBondContact O-N 3.31Å; G362-K364 PolarHBondContact O-N 3.08Å
363	P	64.7	Low	81.1	Confident	69 Å²	69	61.6 Å²	61.6	45%	0.448	31%	0.313	S	S	.	.	S	Bend	trans	-63.1	127.6	173.2	26.2	-32.7	0	0	0	111	E336	E336-P363 HydrophobicContact CB-CB 4.3Å; E336-P363 VanDerWaalsContact CD-CB 3.5Å; E336-P363 HydrophobicContact CG-CB 4.18Å; E336-P363 WeakPolarHBondContact OE1-CB 3.43Å
364	K	72.6	Confident	81	Confident	91 Å²	91	65.1 Å²	65.1	40%	0.396	33%	0.329	S	S	.	.			trans	-154.9	165.6	174.2	-54.2	-176.2	177.9	-175.9	0	108.8	E336 L340 T361 G362 A366 I369	E336-K364 PolarHBondContact OE1-N 3.06Å; L340-K364 WeakPolarHBondContact CD1-O 3.41Å; T361-K364 WeakPolarHBondContact O-CE 3.49Å; G362-K364 PolarHBondContact O-N 3.08Å; K364-A366 PolarHBondContact O-N 3.18Å; K364-I369 HydrophobicContact CB-CD1 3.91Å; K364-I369 HydrophobicContact CB-CG1 4.08Å; K364-I369 WeakPolarHBondContact O-CD1 2.99Å
365	E	76.8	Confident	80.9	Confident	122 Å²	122	70.8 Å²	70.8	57%	0.57	36%	0.356	S	S	*	.			trans	-51.2	138.6	173	-57	178.4	149.8	0	0	112.4	S367 Q368 I369	E365-S367 WeakPolarHBondContact CB-OG 3.3Å; E365-S367 PolarHBondContact O-N 2.67Å; E365-S367 VanDerWaalsContact O-N 3.14Å; E365-Q368 HydrophobicContact CB-CG 4.18Å; E365-Q368 WeakPolarHBondContact O-CB 3.28Å; E365-Q368 PolarHBondContact O-N 2.98Å; E365-Q368 PolarHBondContact OE2-NE2 2.95Å; E365-I369 PolarHBondContact O-N 3.17Å
366	A	76.6	Confident	80.9	Confident	28 Å²	28	69.6 Å²	69.6	23%	0.231	35%	0.351	C	S	.	.	H	α-helix	trans	-58.1	-31.9	-177.3	0	0	0	0	0	113.4	L340 F343 F344 K364 Q368 I369 L370	L340-A366 HydrophobicContact CD2-CB 3.84Å; F343-A366 HydrophobicContact CD1-CB 3.91Å; F343-A366 HydrophobicContact CE1-CB 3.7Å; F343-A366 HydrophobicContact CZ-CB 4.4Å; F344-A366 HydrophobicContact CZ-CB 3.93Å; F344-A366 WeakPolarHBondContact CZ-O 3.21Å; K364-A366 PolarHBondContact O-N 3.18Å; A366-Q368 VanDerWaalsContact C-N 3.25Å; A366-Q368 PolarHBondContact O-N 3.23Å; A366-I369 PolarHBondContact O-N 3.34Å; A366-L370 WeakPolarHBondContact O-CB 3.38Å; A366-L370 PolarHBondContact O-N 2.94Å
367	S	78.2	Confident	81	Confident	81 Å²	81	65.6 Å²	65.6	57%	0.566	34%	0.336	S	S	*	.	H	α-helix	trans	-55.7	-36.3	172	46.2	0	0	0	0	113.4	E365	E365-S367 WeakPolarHBondContact CB-OG 3.3Å; E365-S367 PolarHBondContact O-N 2.67Å; E365-S367 VanDerWaalsContact O-N 3.14Å
368	Q	76.6	Confident	81	Confident	98 Å²	98	69.6 Å²	69.6	46%	0.458	36%	0.358	S	S	.	.	H	α-helix	trans	-85.7	-13.1	-177.5	-55.1	178.2	27.3	0	0	113	E365 A366	E365-Q368 HydrophobicContact CB-CG 4.18Å; E365-Q368 WeakPolarHBondContact O-CB 3.28Å; E365-Q368 PolarHBondContact O-N 2.98Å; E365-Q368 PolarHBondContact OE2-NE2 2.95Å; A366-Q368 VanDerWaalsContact C-N 3.25Å; A366-Q368 PolarHBondContact O-N 3.23Å
369	I	83.8	Confident	80.9	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-104.8	-26.6	-176.3	-62.9	-176.9	0	0	0	111.3	L340 F344 V357 L358 K364 E365 A366 D371 L372 V373	L340-I369 HydrophobicContact CD1-CD1 4.01Å; F344-I369 HydrophobicContact CD2-CG2 4.41Å; F344-I369 HydrophobicContact CE2-CB 3.96Å; F344-I369 HydrophobicContact CE2-CG2 3.52Å; F344-I369 HydrophobicContact CZ-CB 3.79Å; F344-I369 HydrophobicContact CZ-CG2 3.72Å; V357-I369 HydrophobicContact CG1-CG2 4Å; L358-I369 HydrophobicContact CD2-CD1 3.77Å; L358-I369 HydrophobicContact CD2-CG2 4.21Å; K364-I369 HydrophobicContact CB-CD1 3.91Å; K364-I369 HydrophobicContact CB-CG1 4.08Å; K364-I369 WeakPolarHBondContact O-CD1 2.99Å; E365-I369 PolarHBondContact O-N 3.17Å; A366-I369 PolarHBondContact O-N 3.34Å; I369-D371 PolarHBondContact O-N 3.28Å; I369-L372 PolarHBondContact O-N 3.46Å; I369-L372 VanDerWaalsContact O-N 3.11Å; I369-V373 HydrophobicContact CG2-CG2 3.73Å; I369-V373 PolarHBondContact O-N 2.63Å
370	L	85.6	Confident	80.9	Confident	57 Å²	57	65.3 Å²	65.3	30%	0.298	34%	0.344	S	S	.	.	H	α-helix	trans	-52.2	-52.3	-178.6	-178.8	60.8	0	0	0	113.3	F344 M347 Y349 A366 L372 V373 Q374	F344-L370 HydrophobicContact CD1-CD1 4.23Å; F344-L370 HydrophobicContact CE1-CB 3.99Å; F344-L370 HydrophobicContact CE1-CD1 3.91Å; M347-L370 HydrophobicContact CE-CD1 3.78Å; Y349-L370 HydrophobicContact CE2-CD1 3.72Å; A366-L370 WeakPolarHBondContact O-CB 3.38Å; A366-L370 PolarHBondContact O-N 2.94Å; L370-L372 PolarHBondContact O-N 3.49Å; L370-V373 PolarHBondContact O-N 3.17Å; L370-V373 VanDerWaalsContact O-N 3.15Å; L370-Q374 PolarHBondContact O-N 3.24Å
371	D	85.3	Confident	81	Confident	120 Å²	120	60.8 Å²	60.8	64%	0.642	33%	0.327	S	S	*	.	H	α-helix	trans	-59.3	-34.4	-179.1	-63.8	-13.5	0	0	0	112.4	I369 Q375	I369-D371 PolarHBondContact O-N 3.28Å; D371-Q375 VanDerWaalsContact O-CB 3.29Å; D371-Q375 WeakPolarHBondContact O-CB 3.42Å; D371-Q375 PolarHBondContact O-N 3.46Å
372	L	85.4	Confident	81	Confident	68 Å²	68	66.7 Å²	66.7	36%	0.356	35%	0.346	S	S	.	.	H	α-helix	trans	-79	-35.3	179.6	-63.3	172.9	0	0	0	111.8	V357 T361 I369 L370 E376	V357-L372 HydrophobicContact CG1-CB 3.68Å; T361-L372 HydrophobicContact CG2-CD1 3.59Å; I369-L372 PolarHBondContact O-N 3.46Å; I369-L372 VanDerWaalsContact O-N 3.11Å; L370-L372 PolarHBondContact O-N 3.49Å; L372-E376 WeakPolarHBondContact O-CB 3.42Å; L372-E376 PolarHBondContact O-N 3.48Å
373	V	87.7	Confident	81	Confident	0 Å²	0	71 Å²	71	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-66.3	-43	171.8	168	0	0	0	0	110.9	F344 Y349 V353 V354 V357 I369 L370 Q377	F344-V373 HydrophobicContact CB-CG1 4.43Å; F344-V373 HydrophobicContact CD1-CG1 4.36Å; F344-V373 HydrophobicContact CD2-CG2 4.3Å; F344-V373 HydrophobicContact CE2-CG2 4.47Å; F344-V373 HydrophobicContact CG-CG1 4.41Å; F344-V373 HydrophobicContact CG-CG2 4.34Å; Y349-V373 HydrophobicContact CD1-CG1 3.61Å; Y349-V373 HydrophobicContact CD2-CG1 3.69Å; Y349-V373 HydrophobicContact CE1-CG1 4.12Å; Y349-V373 HydrophobicContact CE2-CG1 4.18Å; Y349-V373 HydrophobicContact CG-CG1 3.37Å; V353-V373 HydrophobicContact CG1-CG1 4.44Å; V354-V373 HydrophobicContact CG2-CG1 3.92Å; V357-V373 HydrophobicContact CB-CG2 3.96Å; V357-V373 HydrophobicContact CG1-CG2 4.02Å; V357-V373 HydrophobicContact CG2-CG2 4.14Å; I369-V373 HydrophobicContact CG2-CG2 3.73Å; I369-V373 PolarHBondContact O-N 2.63Å; L370-V373 PolarHBondContact O-N 3.17Å; L370-V373 VanDerWaalsContact O-N 3.15Å; V373-Q377 WeakPolarHBondContact O-CB 3.46Å; V373-Q377 PolarHBondContact O-N 3.29Å
374	Q	86.6	Confident	81	Confident	75 Å²	75	73.4 Å²	73.4	35%	0.35	36%	0.364	S	S	.	.	H	α-helix	trans	-60.8	-51.8	173.3	-173.4	66.3	61.5	0	0	111	Y349 L370 E376 Q377 D378	Y349-Q374 HydrophobicContact CE1-CB 4.4Å; Y349-Q374 VanDerWaalsContact CE1-OE1 3.3Å; Y349-Q374 PolarHBondContact OH-OE1 3.48Å; L370-Q374 PolarHBondContact O-N 3.24Å; Q374-E376 PolarHBondContact O-N 3.33Å; Q374-Q377 WeakPolarHBondContact O-CB 3.37Å; Q374-Q377 PolarHBondContact O-N 3.38Å; Q374-Q377 VanDerWaalsContact O-N 3.14Å; Q374-D378 PolarHBondContact NE2-OD1 3.17Å; Q374-D378 PolarHBondContact O-N 3Å
375	Q	85.6	Confident	80.3	Confident	119 Å²	119	75.1 Å²	75.1	56%	0.556	38%	0.377	S	S	*	.	H	α-helix	trans	-59.9	-42	179.7	177.7	173.2	90.2	0	0	112.9	D371 L379	D371-Q375 VanDerWaalsContact O-CB 3.29Å; D371-Q375 WeakPolarHBondContact O-CB 3.42Å; D371-Q375 PolarHBondContact O-N 3.46Å; Q375-L379 HydrophobicContact CG-CD1 4.14Å; Q375-L379 WeakPolarHBondContact O-CB 3.35Å; Q375-L379 WeakPolarHBondContact O-CD1 3.47Å; Q375-L379 WeakPolarHBondContact O-CG 3.48Å; Q375-L379 PolarHBondContact O-N 2.92Å
376	E	86.1	Confident	79.2	Confident	34 Å²	34	75.4 Å²	75.4	16%	0.159	38%	0.377	C	S	.	.	H	α-helix	trans	-71.9	-29.1	177.9	-175.9	83	-150.5	0	0	111.6	V353 R356 V357 K360 L372 Q374 S380	V353-E376 HydrophobicContact CG1-CB 3.92Å; V353-E376 HydrophobicContact CG1-CG 3.87Å; R356-E376 IonicContact CZ-OE1 3.58Å; R356-E376 VanDerWaalsContact CZ-OE1 3.32Å; R356-E376 IonicContact NE-OE1 3.58Å; R356-E376 PolarHBondContact NE-OE1 3.06Å; R356-E376 IonicContact NH2-OE1 2.67Å; R356-E376 PolarHBondContact NH2-OE1 3.48Å; V357-E376 HydrophobicContact CG2-CB 3.55Å; V357-E376 HydrophobicContact CG2-CG 3.73Å; K360-E376 IonicContact NZ-OE2 3.6Å; K360-E376 PolarHBondContact NZ-OE2 3.08Å; L372-E376 WeakPolarHBondContact O-CB 3.42Å; L372-E376 PolarHBondContact O-N 3.48Å; Q374-E376 PolarHBondContact O-N 3.33Å; E376-S380 WeakPolarHBondContact O-CB 3.28Å; E376-S380 PolarHBondContact O-N 3.08Å
377	Q	87.5	Confident	77.7	Confident	15 Å²	15	79.3 Å²	79.3	7%	0.07	40%	0.401	C	S	.	.	H	α-helix	trans	-68.2	-51.7	170.8	-170.7	68	63.1	0	0	110.9	Y349 T350 V353 V373 Q374 L379 S380 D381	Y349-Q377 HydrophobicContact CD1-CB 4.22Å; Y349-Q377 HydrophobicContact CD1-CG 4.3Å; T350-Q377 PolarHBondContact OG1-NE2 3.48Å; T350-Q377 PolarHBondContact OG1-OE1 3.11Å; V353-Q377 HydrophobicContact CG1-CB 4.08Å; V373-Q377 WeakPolarHBondContact O-CB 3.46Å; V373-Q377 PolarHBondContact O-N 3.29Å; Q374-Q377 WeakPolarHBondContact O-CB 3.37Å; Q374-Q377 PolarHBondContact O-N 3.38Å; Q374-Q377 VanDerWaalsContact O-N 3.14Å; Q377-L379 PolarHBondContact O-N 3.39Å; Q377-S380 WeakPolarHBondContact O-CA 3.45Å; Q377-S380 WeakPolarHBondContact O-CB 3.13Å; Q377-S380 PolarHBondContact O-N 3.37Å; Q377-D381 PolarHBondContact NE2-OD1 3.49Å; Q377-D381 VanDerWaalsContact O-CG 3.29Å; Q377-D381 PolarHBondContact O-N 3.05Å
378	D	84	Confident	76.1	Confident	88 Å²	88	80 Å²	80	47%	0.471	41%	0.406	S	S	.	.	H	α-helix	trans	-57.2	-37.5	178.6	-60.6	-14.7	0	0	0	111.6	Q374 R382	Q374-D378 PolarHBondContact NE2-OD1 3.17Å; Q374-D378 PolarHBondContact O-N 3Å; D378-R382 WeakPolarHBondContact O-CB 3.4Å; D378-R382 PolarHBondContact O-N 3.27Å; D378-R382 VanDerWaalsContact O-N 3.13Å
379	L	84.6	Confident	74.3	Confident	71 Å²	71	78.8 Å²	78.8	37%	0.372	42%	0.42	S	S	.	.	H	α-helix	trans	-68.5	-46.6	172.8	-73.8	170.3	0	0	0	112.1	Q375 Q377 D381 R382 E383	Q375-L379 HydrophobicContact CG-CD1 4.14Å; Q375-L379 WeakPolarHBondContact O-CB 3.35Å; Q375-L379 WeakPolarHBondContact O-CD1 3.47Å; Q375-L379 WeakPolarHBondContact O-CG 3.48Å; Q375-L379 PolarHBondContact O-N 2.92Å; Q377-L379 PolarHBondContact O-N 3.39Å; L379-D381 PolarHBondContact O-N 3.05Å; L379-R382 CarbonylContact O-C 3.53Å; L379-R382 PolarHBondContact O-N 3.43Å; L379-E383 WeakPolarHBondContact O-CG 3.45Å; L379-E383 PolarHBondContact O-N 3.02Å
380	S	84.3	Confident	72.1	Confident	14 Å²	14	89.9 Å²	89.9	10%	0.098	46%	0.462	C	S	.	.	H	α-helix	trans	-59.4	-44.4	178.8	-169.2	0	0	0	0	111.7	E376 Q377 E383 Q384	E376-S380 WeakPolarHBondContact O-CB 3.28Å; E376-S380 PolarHBondContact O-N 3.08Å; Q377-S380 WeakPolarHBondContact O-CA 3.45Å; Q377-S380 WeakPolarHBondContact O-CB 3.13Å; Q377-S380 PolarHBondContact O-N 3.37Å; S380-E383 PolarHBondContact O-N 3.43Å; S380-E383 VanDerWaalsContact O-N 3.14Å; S380-Q384 WeakPolarHBondContact O-CG 3.34Å; S380-Q384 PolarHBondContact O-N 2.91Å
381	D	81.8	Confident	69.5	Low	65 Å²	65	92.3 Å²	92.3	35%	0.348	48%	0.484	S	S	.	.	H	α-helix	trans	-68.7	-38.5	179	-62.5	-9.4	0	0	0	110.9	Q377 L379 E383 N385	Q377-D381 PolarHBondContact NE2-OD1 3.49Å; Q377-D381 VanDerWaalsContact O-CG 3.29Å; Q377-D381 PolarHBondContact O-N 3.05Å; L379-D381 PolarHBondContact O-N 3.05Å; D381-E383 PolarHBondContact O-N 3.35Å; D381-N385 WeakPolarHBondContact O-CB 3.41Å; D381-N385 PolarHBondContact O-N 2.89Å; D381-N385 PolarHBondContact O-ND2 3.37Å
382	R	76.5	Confident	67	Low	160 Å²	160	93.1 Å²	93.1	60%	0.604	49%	0.493	S	S	*	.	H	α-helix	trans	-68.1	-18.6	172.7	-175.7	178.6	177.7	-146.7	4.2	113.4	D378 L379 K386	D378-R382 WeakPolarHBondContact O-CB 3.4Å; D378-R382 PolarHBondContact O-N 3.27Å; D378-R382 VanDerWaalsContact O-N 3.13Å; L379-R382 CarbonylContact O-C 3.53Å; L379-R382 PolarHBondContact O-N 3.43Å; R382-K386 WeakPolarHBondContact O-CD 3.48Å; R382-K386 WeakPolarHBondContact O-CE 3.32Å; R382-K386 VanDerWaalsContact O-CG 3.29Å; R382-K386 WeakPolarHBondContact O-CG 3.48Å
383	E	70.7	Confident	64.4	Low	116 Å²	116	98.1 Å²	98.1	54%	0.542	51%	0.512	S	S	.	.	H	α-helix	trans	-93.2	-37.5	173.9	-73.6	-172	166.2	0	0	112.8	L379 S380 D381 N385 K386 C387	L379-E383 WeakPolarHBondContact O-CG 3.45Å; L379-E383 PolarHBondContact O-N 3.02Å; S380-E383 PolarHBondContact O-N 3.43Å; S380-E383 VanDerWaalsContact O-N 3.14Å; D381-E383 PolarHBondContact O-N 3.35Å; E383-N385 VanDerWaalsContact C-N 3.3Å; E383-N385 PolarHBondContact O-N 3.17Å; E383-K386 WeakPolarHBondContact O-CA 3.27Å; E383-K386 WeakPolarHBondContact O-CB 3.32Å; E383-K386 PolarHBondContact O-N 2.87Å; E383-C387 PolarHBondContact O-N 2.86Å
384	Q	63.8	Low	61.8	Low	119 Å²	119	108.2 Å²	108.2	56%	0.556	56%	0.556	S	S	*	*	H	α-helix	trans	-59.6	-42.3	169.5	-70.2	-178.3	17.2	0	0	111.2	S380 K386 C387 S388	S380-Q384 WeakPolarHBondContact O-CG 3.34Å; S380-Q384 PolarHBondContact O-N 2.91Å; Q384-K386 PolarHBondContact O-N 2.84Å; Q384-C387 PolarHBondContact O-N 3.03Å; Q384-S388 PolarHBondContact O-N 2.9Å; Q384-S388 PolarHBondContact O-OG 3.03Å
385	N	57.8	Low	59.2	Low	127 Å²	127	112.2 Å²	112.2	68%	0.679	57%	0.574	S	S	*	*	H	α-helix	trans	-66.5	-10	172.7	-77.1	-51.8	0	0	0	114.9	D381 E383	D381-N385 WeakPolarHBondContact O-CB 3.41Å; D381-N385 PolarHBondContact O-N 2.89Å; D381-N385 PolarHBondContact O-ND2 3.37Å; E383-N385 VanDerWaalsContact C-N 3.3Å; E383-N385 PolarHBondContact O-N 3.17Å
386	K	55.6	Low	56.4	Low	129 Å²	129	109.8 Å²	109.8	56%	0.561	58%	0.581	S	S	*	*	H	α-helix	trans	-95.9	-35.1	168.7	-67.1	165.6	-166.8	159.8	0	112.4	R382 E383 Q384	R382-K386 WeakPolarHBondContact O-CD 3.48Å; R382-K386 WeakPolarHBondContact O-CE 3.32Å; R382-K386 VanDerWaalsContact O-CG 3.29Å; R382-K386 WeakPolarHBondContact O-CG 3.48Å; E383-K386 WeakPolarHBondContact O-CA 3.27Å; E383-K386 WeakPolarHBondContact O-CB 3.32Å; E383-K386 PolarHBondContact O-N 2.87Å; Q384-K386 PolarHBondContact O-N 2.84Å
387	C	44.2	Very low	53.7	Low	109 Å²	109	114.4 Å²	114.4	74%	0.736	61%	0.612	S	S	*	*	H	α-helix	trans	-77.8	-28.5	-177.6	-95.5	0	0	0	0	114	E383 Q384 G389	E383-C387 PolarHBondContact O-N 2.86Å; Q384-C387 PolarHBondContact O-N 3.03Å; C387-G389 PolarHBondContact O-N 3.43Å; C387-G389 VanDerWaalsContact O-N 3.08Å
388	S	43.8	Very low	50.9	Low	95 Å²	95	120.7 Å²	120.7	66%	0.664	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-10	177.5	55.9	0	0	0	0	114.5	Q384 R390	Q384-S388 PolarHBondContact O-N 2.9Å; Q384-S388 PolarHBondContact O-OG 3.03Å; S388-R390 PolarHBondContact O-N 2.82Å
389	G	39.9	Very low	48.1	Very low	73 Å²	73	122.8 Å²	122.8	75%	0.753	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	16.1	-174.7	0	0	0	0	0	117.6	C387	C387-G389 PolarHBondContact O-N 3.43Å; C387-G389 VanDerWaalsContact O-N 3.08Å
390	R	36.6	Very low	45.3	Very low	233 Å²	233	126.8 Å²	126.8	88%	0.879	67%	0.671	S	S	*	*			trans	-143.3	125.9	-173.7	-156.7	169.6	-176.2	171.5	-0.1	115.6	S388	S388-R390 PolarHBondContact O-N 2.82Å
391	S	31.3	Very low	42.6	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	70%	0.702	S	S	*	*			trans	80.5	128.3	-180	-139.7	0	0	0	0	114.6
392	T	33.3	Very low	40.1	Very low	137 Å²	137	134 Å²	134	84%	0.84	72%	0.719	S	S	*	*			cis	-145.2	165	2.2	-20.7	0	0	0	0	111.7
393	K	31.6	Very low	37.7	Very low	172 Å²	172	136.5 Å²	136.5	75%	0.748	73%	0.734	S	S	*	*			trans	-89.8	135.3	-160.9	-69	163.3	160.9	-172.9	0	116.5
394	K	32.2	Very low	35.7	Very low	212 Å²	212	139.6 Å²	139.6	92%	0.922	75%	0.749	S	S	*	*				-132	164.7	129.1	-78	-168	176.4	178.3	0	108.6
395	H	32.2	Very low	34.1	Very low	159 Å²	159	142.7 Å²	142.7	74%	0.736	76%	0.763	S	S	*	*			trans	-117	151.2	-157.6	-77.6	23.8	0	0	0	115.7
396	G	26.2	Very low	33.2	Very low	68 Å²	68	142.4 Å²	142.4	70%	0.701	77%	0.768	S	S	*	*			trans	150.2	81.3	170.9	0	0	0	0	0	111.4
397	V	29.3	Very low	31.9	Very low	132 Å²	132	141.6 Å²	141.6	80%	0.8	78%	0.777	S	S	*	*				67.4	113.8	76.5	178.5	0	0	0	0	110.4
398	I	28.3	Very low	31.2	Very low	147 Å²	147	145.7 Å²	145.7	75%	0.754	79%	0.786	S	S	*	*			cis	-162.4	170.6	9.8	-144.8	170.9	0	0	0	113.6
399	L	25.6	Very low	30.5	Very low	132 Å²	132	147.2 Å²	147.2	69%	0.691	79%	0.791	S	S	*	*			trans	79.7	114.4	160.1	-111.2	58.4	0	0	0	123.1
400	H	27.1	Very low	30	Very low	154 Å²	154	152.3 Å²	152.3	71%	0.713	80%	0.795	S	S	*	*				34.8	151.7	127.4	-64.3	-42.2	0	0	0	124
401	Q	27.3	Very low	29.7	Very low	163 Å²	163	149.8 Å²	149.8	76%	0.762	79%	0.793	S	S	*	*			cis	-174.3	140.9	-19.3	-174.7	164.7	33.1	0	0	108.5
402	G	28.5	Very low	29.6	Very low	67 Å²	67	153.4 Å²	153.4	69%	0.691	80%	0.795	S	S	*	*			trans	-82.4	162.3	174.6	0	0	0	0	0	114
403	K	26.3	Very low	29.5	Very low	213 Å²	213	154.1 Å²	154.1	93%	0.926	79%	0.789	S	S	*	*			trans	-144	144.4	163.7	-86.9	-165.2	173	-174.9	0	111.5
404	E	29.2	Very low	29.4	Very low	182 Å²	182	153.3 Å²	153.3	85%	0.85	79%	0.793	S	S	*	*			trans	-104.4	140	179.2	-56.8	155.8	126.8	0	0	110
405	Q	30.1	Very low	29.4	Very low	183 Å²	183	151.8 Å²	151.8	86%	0.855	79%	0.789	S	S	*	*			trans	60.2	176.5	150.4	-85.6	176.2	-10.3	0	0	117.7
406	P	38.5	Very low	29.2	Very low	122 Å²	122	151.1 Å²	151.1	79%	0.792	79%	0.791	S	S	*	*			cis	-122.1	-167.6	6.1	43.9	-28.7	0	0	0	115.4
407	C	27.9	Very low	29.4	Very low	111 Å²	111	154 Å²	154	75%	0.75	80%	0.795	S	S	*	*			trans	-81.2	163.3	-177.4	-35.9	0	0	0	0	113.7
408	E	29.1	Very low	29.3	Very low	195 Å²	195	156 Å²	156	91%	0.911	80%	0.796	S	S	*	*			trans	-154.3	163.8	142.5	-124.2	162.7	-141.5	0	0	112.1
409	T	30.8	Very low	29.3	Very low	127 Å²	127	157.5 Å²	157.5	78%	0.779	80%	0.8	S	S	*	*			trans	-92.2	165.1	-173.8	44.6	0	0	0	0	111.8
410	E	29.4	Very low	29.4	Very low	180 Å²	180	155.4 Å²	155.4	84%	0.841	80%	0.801	S	S	*	*				-168	-175.1	66.7	-76.2	-165.7	136.3	0	0	112.9
411	H	28.7	Very low	29.5	Very low	181 Å²	181	151.4 Å²	151.4	84%	0.838	80%	0.801	S	S	*	*			trans	-60.7	169.5	171.8	-60.2	-87.1	0	0	0	112.6
412	K	30.8	Very low	29.7	Very low	185 Å²	185	154.5 Å²	154.5	80%	0.804	81%	0.806	S	S	*	*			cis	-168.1	172.5	38.7	-154.8	174.6	177.8	-165.3	0	113.5
413	E	29.5	Very low	29.8	Very low	152 Å²	152	159.5 Å²	159.5	71%	0.71	81%	0.809	S	S	*	*			trans	-74.7	155.3	178.8	-57	131.1	149	0	0	114.7
414	D	31.2	Very low	30.1	Very low	155 Å²	155	156 Å²	156	83%	0.829	80%	0.799	S	S	*	*			trans	46.5	146.8	150.6	-44.4	-23.8	0	0	0	119.9
415	E	31.1	Very low	30.2	Very low	180 Å²	180	155.3 Å²	155.3	84%	0.841	79%	0.793	S	S	*	*			cis	-149.5	155.9	35.1	-92.9	178.4	150.7	0	0	113.1
416	D	28.9	Very low	30.3	Very low	145 Å²	145	154.8 Å²	154.8	78%	0.775	79%	0.79	S	S	*	*			trans	20.6	151.7	144	-68.8	-12.1	0	0	0	125.1
417	T	29.5	Very low	29.9	Very low	127 Å²	127	153.7 Å²	153.7	78%	0.779	79%	0.786	S	S	*	*			trans	120.7	139.1	141.7	-38.9	0	0	0	0	116.9
418	E	28.6	Very low	30	Very low	175 Å²	175	156.1 Å²	156.1	82%	0.818	79%	0.791	S	S	*	*			trans	-39	166.8	172.8	-50.1	172.8	141	0	0	116
419	E	27.3	Very low	30	Very low	179 Å²	179	149.7 Å²	149.7	84%	0.836	78%	0.777	S	S	*	*			cis	-158	-163.9	27.9	-149.1	-154.7	133.4	0	0	112.6
420	A	28.6	Very low	30	Very low	88 Å²	88	150.9 Å²	150.9	73%	0.727	78%	0.779	S	S	*	*			trans	-39.5	153.4	176.7	0	0	0	0	0	117.1
421	G	28.5	Very low	29.8	Very low	69 Å²	69	150.6 Å²	150.6	71%	0.711	78%	0.775	S	S	*	*			cis	145.9	171.8	10.2	0	0	0	0	0	111.5
422	R	31.3	Very low	29.9	Very low	228 Å²	228	149.5 Å²	149.5	86%	0.86	77%	0.77	S	S	*	*			trans	69.7	122.9	178.1	-73.5	-173.7	170.8	-161.5	1.5	117.5
423	K	30.7	Very low	29.8	Very low	172 Å²	172	144 Å²	144	75%	0.748	77%	0.766	S	S	*	*				82	120.4	73.6	-148.8	-175.2	-167.6	173.2	0	111.4
424	I	33.2	Very low	29.7	Very low	141 Å²	141	145.4 Å²	145.4	72%	0.723	78%	0.778	S	S	*	*				-176.5	135.5	90.9	-93.4	174.8	0	0	0	112.9
425	K	30.2	Very low	29.4	Very low	166 Å²	166	146.6 Å²	146.6	72%	0.722	78%	0.778	S	S	*	*			trans	44.1	124.1	145.4	-60.2	-168.8	164.3	-168.3	0	122.1
426	H	31.8	Very low	29.2	Very low	172 Å²	172	144.8 Å²	144.8	80%	0.796	78%	0.779	S	S	*	*				68.4	135.5	93.9	-51.7	-49.7	0	0	0	115.8
427	S	31	Very low	29.1	Very low	100 Å²	100	141.3 Å²	141.3	70%	0.699	78%	0.778	S	S	*	*				-166.3	155.8	82.1	50.1	0	0	0	0	116.7
428	N	29.9	Very low	28.9	Very low	162 Å²	162	138.5 Å²	138.5	87%	0.866	77%	0.773	S	S	*	*			trans	59.8	156	151.7	-58.1	8.8	0	0	0	120.4
429	G	29.5	Very low	28.8	Very low	59 Å²	59	139.5 Å²	139.5	61%	0.608	78%	0.778	S	S	*	*			cis	161.7	166.4	-6.7	0	0	0	0	0	113.5
430	D	29.5	Very low	28.8	Very low	153 Å²	153	138.3 Å²	138.3	82%	0.818	77%	0.773	S	S	*	*			trans	70.6	150.4	170	-45.4	-27.4	0	0	0	116.5
431	F	26.6	Very low	28.7	Very low	173 Å²	173	140.9 Å²	140.9	76%	0.759	77%	0.773	S	S	*	*			cis	-166.3	161.6	-3.5	-130.8	-136.7	0	0	0	107.3
432	E	31.3	Very low	28.5	Very low	158 Å²	158	143.3 Å²	143.3	74%	0.738	77%	0.774	S	S	*	*			cis	-164.3	152.3	-11.6	-162.3	-176.1	-160.6	0	0	110.4
433	G	28.6	Very low	28.4	Very low	70 Å²	70	138.4 Å²	138.4	72%	0.722	76%	0.764	S	S	*	*			trans	79.9	154.9	150.3	0	0	0	0	0	120
434	L	26.1	Very low	28.2	Very low	182 Å²	182	140.3 Å²	140.3	95%	0.953	77%	0.767	S	S	*	*			cis	-153.2	175.2	-9.7	-166.5	56.3	0	0	0	110.3
435	Q	25.4	Very low	28	Very low	179 Å²	179	140.7 Å²	140.7	84%	0.836	77%	0.77	S	S	*	*			trans	-126	-179.9	-159	-161.7	178	21.3	0	0	114.4
436	V	27.4	Very low	28	Very low	143 Å²	143	140.9 Å²	140.9	87%	0.867	77%	0.773	S	S	*	*			trans	113.1	137.8	166.1	177.4	0	0	0	0	114
437	G	25.5	Very low	28	Very low	72 Å²	72	141.1 Å²	141.1	74%	0.742	77%	0.772	S	S	*	*			cis	149.1	135	-10.3	0	0	0	0	0	114.9
438	G	26.1	Very low	28.1	Very low	67 Å²	67	145 Å²	145	69%	0.691	78%	0.779	S	S	*	*			trans	96.9	119	178.7	0	0	0	0	0	114
439	E	26.9	Very low	27.9	Very low	197 Å²	197	140.6 Å²	140.6	92%	0.921	77%	0.772	S	S	*	*				78.7	137.7	69.8	-70.3	177.1	168	0	0	113
440	E	25.8	Very low	27.8	Very low	154 Å²	154	149.9 Å²	149.9	72%	0.72	79%	0.789	S	S	*	*			cis	-152.1	163	18.6	-149.3	-159.2	132.6	0	0	113.3
441	L	27	Very low	27.6	Very low	141 Å²	141	146.5 Å²	146.5	74%	0.738	79%	0.79	S	S	*	*			trans	29.2	137.7	152.4	-103	69.1	0	0	0	121.7
442	T	25.5	Very low	27.7	Very low	120 Å²	120	143.8 Å²	143.8	74%	0.736	79%	0.793	S	S	*	*			cis	-158.6	-164.7	24.9	60.4	0	0	0	0	109.4
443	I	28.3	Very low	27.6	Very low	125 Å²	125	145.2 Å²	145.2	64%	0.641	80%	0.799	S	S	*	*			cis	-160.1	152.2	-9.7	-131	-77.4	0	0	0	108.9
444	R	26.5	Very low	27.6	Very low	212 Å²	212	149.5 Å²	149.5	80%	0.8	81%	0.806	S	S	*	*			trans	61.5	136.4	169.2	-74.5	168.4	-158.6	174.3	6.7	116.7
445	N	29	Very low	27.9	Very low	150 Å²	150	147.6 Å²	147.6	80%	0.802	80%	0.801	S	S	*	*			cis	-130.7	170	10	-81.6	-40	0	0	0	112.7
446	H	29.7	Very low	28.1	Very low	170 Å²	170	147.5 Å²	147.5	79%	0.787	80%	0.801	S	S	*	*			trans	-100.4	164.9	173.1	-87.7	-3.3	0	0	0	111.1
447	K	31.8	Very low	28.2	Very low	176 Å²	176	150.1 Å²	150.1	77%	0.765	80%	0.803	S	S	*	*			cis	-153.3	164.1	7.3	-136.5	172.6	-176.8	-179.5	0	111.6
448	Q	32.6	Very low	28.4	Very low	182 Å²	182	150 Å²	150	85%	0.85	80%	0.796	S	S	*	*			trans	-71.2	162.7	174.6	-61.8	128	-54.8	0	0	113.3
449	G	27.1	Very low	28.8	Very low	70 Å²	70	156.2 Å²	156.2	72%	0.722	81%	0.807	S	S	*	*			cis	127	163	-1.6	0	0	0	0	0	113.9
450	R	26.7	Very low	29.4	Very low	254 Å²	254	154.9 Å²	154.9	96%	0.958	80%	0.8	S	S	*	*			trans	-168.7	137.2	164.5	-120.9	-178.5	-171.4	-91.2	0.1	112.2
451	G	25.4	Very low	30.3	Very low	81 Å²	81	156.6 Å²	156.6	84%	0.835	81%	0.808	S	S	*	*			trans	68.8	98.9	156.1	0	0	0	0	0	117.9
452	S	29	Very low	31.6	Very low	117 Å²	117	155.4 Å²	155.4	82%	0.818	80%	0.799	S	S	*	*			trans	-118.1	128.7	155.9	-58.7	0	0	0	0	107.9
453	E	29.9	Very low	33.7	Very low	187 Å²	187	153.1 Å²	153.1	87%	0.874	78%	0.782	S	S	*	*			trans	-139.3	130.6	158.6	-70.1	-170.1	147.7	0	0	107.2	V455	E453-V455 PolarHBondContact O-N 3.37Å
454	D	28	Very low	35.6	Very low	161 Å²	161	155.2 Å²	155.2	86%	0.861	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-77.2	121.8	-174.7	-58.6	-73.5	0	0	0	110.6	Q456	D454-Q456 PolarHBondContact O-N 2.87Å
455	V	32.6	Very low	37.7	Very low	141 Å²	141	148.2 Å²	148.2	86%	0.855	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-78.8	117.1	176.9	178.2	0	0	0	0	109.1	E453	E453-V455 PolarHBondContact O-N 3.37Å
456	Q	28.6	Very low	39.8	Very low	178 Å²	178	142 Å²	142	83%	0.832	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-64.7	130.8	170.7	-64.9	170.1	-6.3	0	0	109.6	D454 A458	D454-Q456 PolarHBondContact O-N 2.87Å; Q456-A458 PolarHBondContact O-N 3.43Å
457	E	30.1	Very low	41.9	Very low	197 Å²	197	135 Å²	135	92%	0.921	71%	0.708	S	S	*	*			trans	-67.8	102.4	168.7	-70.4	-176.2	128.8	0	0	108.8	E459	E457-E459 PolarHBondContact O-N 3Å
458	A	30.4	Very low	44	Very low	71 Å²	71	130.3 Å²	130.3	59%	0.587	69%	0.694	S	S	*	*			trans	-75.7	117.4	172.5	0	0	0	0	0	109.3	Q456 H460	Q456-A458 PolarHBondContact O-N 3.43Å; A458-H460 VanDerWaalsContact C-N 3.31Å; A458-H460 PolarHBondContact O-N 3.28Å
459	E	34.6	Very low	45.9	Very low	196 Å²	196	123 Å²	123	92%	0.916	66%	0.661	S	S	*	*			trans	-63.9	91.4	168.7	-67	-174.1	143.3	0	0	109.3	E457 Q461	E457-E459 PolarHBondContact O-N 3Å; E459-Q461 PolarHBondContact O-N 2.69Å
460	H	39.6	Very low	48.3	Very low	170 Å²	170	121 Å²	121	79%	0.787	63%	0.632	S	S	*	*			trans	-69.3	95.3	172.3	-82.5	-55.9	0	0	0	109.6	A458 E462	A458-H460 VanDerWaalsContact C-N 3.31Å; A458-H460 PolarHBondContact O-N 3.28Å; H460-E462 PolarHBondContact O-N 2.68Å
461	Q	42.9	Very low	50.8	Low	189 Å²	189	116.4 Å²	116.4	88%	0.883	62%	0.619	S	S	*	*			trans	-44	106.8	161.3	-175.8	88.3	57.9	0	0	108.9	E459 D463	E459-Q461 PolarHBondContact O-N 2.69Å; Q461-D463 PolarHBondContact O-N 2.9Å
462	E	55.2	Low	52.9	Low	116 Å²	116	115.2 Å²	115.2	54%	0.542	60%	0.601	S	S	.	*			trans	-64.4	123.9	-177.9	-65.3	-158	126.3	0	0	110.2	H460 F464 K470	H460-E462 PolarHBondContact O-N 2.68Å; E462-F464 PolarHBondContact O-N 2.92Å; E462-K470 IonicContact OE1-NZ 2.78Å; E462-K470 PolarHBondContact OE1-NZ 2.78Å
463	D	68.9	Low	55.2	Low	72 Å²	72	110.2 Å²	110.2	39%	0.385	57%	0.567	S	S	.	*			trans	-58	130.3	169.6	176.1	3.2	0	0	0	109.3	Q461 V465 L466 G467 Y487	Q461-D463 PolarHBondContact O-N 2.9Å; D463-V465 PolarHBondContact O-N 2.68Å; D463-V465 PolarHBondContact OD1-N 3.19Å; D463-L466 HydrophobicContact CB-CB 4.07Å; D463-L466 WeakPolarHBondContact O-CA 3.18Å; D463-L466 WeakPolarHBondContact O-CB 3.22Å; D463-L466 PolarHBondContact O-N 3.23Å; D463-G467 PolarHBondContact O-N 3.49Å; D463-Y487 PolarHBondContact OD2-OH 3.1Å
464	F	68.6	Low	57.3	Low	169 Å²	169	103.6 Å²	103.6	74%	0.741	54%	0.544	S	S	*	.	H	α-helix	trans	-54.2	-36.3	176.7	176	-96.2	0	0	0	111.7	E462 G467 V468	E462-F464 PolarHBondContact O-N 2.92Å; F464-G467 PolarHBondContact O-N 3.12Å; F464-V468 HydrophobicContact CD1-CG2 4.31Å; F464-V468 HydrophobicContact CE1-CG2 3.88Å; F464-V468 HydrophobicContact CE2-CG2 4.33Å; F464-V468 HydrophobicContact CZ-CG2 3.89Å; F464-V468 WeakPolarHBondContact O-CG2 3.34Å; F464-V468 PolarHBondContact O-N 3.09Å
465	V	70	Confident	59.4	Low	65 Å²	65	101.8 Å²	101.8	39%	0.394	54%	0.539	S	S	.	.	H	α-helix	trans	-64.3	-46.5	176	-177.9	0	0	0	0	110.4	D463 G467 V468 M469 Y487	D463-V465 PolarHBondContact O-N 2.68Å; D463-V465 PolarHBondContact OD1-N 3.19Å; V465-G467 VanDerWaalsContact C-N 3.34Å; V465-G467 PolarHBondContact O-N 2.92Å; V465-V468 PolarHBondContact O-N 3.39Å; V465-M469 HydrophobicContact CG1-CG 4.33Å; V465-M469 HydrophobicContact CG1-SD 4.01Å; V465-M469 WeakPolarHBondContact O-CB 3.29Å; V465-M469 VanDerWaalsContact O-CG 3.25Å; V465-M469 WeakPolarHBondContact O-CG 3.32Å; V465-M469 PolarHBondContact O-N 3.46Å; V465-Y487 HydrophobicContact CG1-CE2 4.39Å
466	L	74.9	Confident	61	Low	19 Å²	19	99.5 Å²	99.5	10%	0.099	53%	0.528	C	S	.	.	H	α-helix	trans	-59.9	-42.7	175.2	176.5	59	0	0	0	111.8	D463 V468 M469 K470 T484 Y487	D463-L466 HydrophobicContact CB-CB 4.07Å; D463-L466 WeakPolarHBondContact O-CA 3.18Å; D463-L466 WeakPolarHBondContact O-CB 3.22Å; D463-L466 PolarHBondContact O-N 3.23Å; L466-V468 PolarHBondContact O-N 3.42Å; L466-M469 PolarHBondContact O-N 2.99Å; L466-K470 HydrophobicContact CD1-CG 4.29Å; L466-K470 WeakPolarHBondContact O-CG 3.46Å; L466-K470 PolarHBondContact O-N 3.24Å; L466-T484 HydrophobicContact CD2-CG2 4.39Å; L466-Y487 HydrophobicContact CB-CD1 4.17Å; L466-Y487 HydrophobicContact CB-CE1 3.89Å; L466-Y487 HydrophobicContact CD1-CD1 3.94Å; L466-Y487 HydrophobicContact CD1-CD2 4.43Å; L466-Y487 HydrophobicContact CD1-CG 3.89Å; L466-Y487 HydrophobicContact CD2-CD1 4.24Å; L466-Y487 HydrophobicContact CG-CD1 4.34Å
467	G	73.6	Confident	63.2	Low	24 Å²	24	94.4 Å²	94.4	25%	0.247	52%	0.523	C	S	.	.	H	α-helix	trans	-62.6	-39.6	176.7	0	0	0	0	0	113.7	D463 F464 V465 K471	D463-G467 PolarHBondContact O-N 3.49Å; F464-G467 PolarHBondContact O-N 3.12Å; V465-G467 VanDerWaalsContact C-N 3.34Å; V465-G467 PolarHBondContact O-N 2.92Å; G467-K471 PolarHBondContact O-N 3.41Å
468	V	75.4	Confident	65.3	Low	77 Å²	77	88 Å²	88	47%	0.467	49%	0.491	S	S	.	.	H	α-helix	trans	-67.3	-43.5	172.7	171	0	0	0	0	111	F464 V465 L466 K471 A472	F464-V468 HydrophobicContact CD1-CG2 4.31Å; F464-V468 HydrophobicContact CE1-CG2 3.88Å; F464-V468 HydrophobicContact CE2-CG2 4.33Å; F464-V468 HydrophobicContact CZ-CG2 3.89Å; F464-V468 WeakPolarHBondContact O-CG2 3.34Å; F464-V468 PolarHBondContact O-N 3.09Å; V465-V468 PolarHBondContact O-N 3.39Å; L466-V468 PolarHBondContact O-N 3.42Å; V468-K471 PolarHBondContact O-N 3.34Å; V468-A472 PolarHBondContact O-N 3.42Å
469	M	71.8	Confident	67.6	Low	30 Å²	30	88.3 Å²	88.3	15%	0.148	49%	0.486	C	S	.	.	H	α-helix	trans	-68.1	-36.6	-178.8	-69.8	-170.7	82.8	0	0	112.9	V465 L466 A472 A473 Y487 T495 L498	V465-M469 HydrophobicContact CG1-CG 4.33Å; V465-M469 HydrophobicContact CG1-SD 4.01Å; V465-M469 WeakPolarHBondContact O-CB 3.29Å; V465-M469 VanDerWaalsContact O-CG 3.25Å; V465-M469 WeakPolarHBondContact O-CG 3.32Å; V465-M469 PolarHBondContact O-N 3.46Å; L466-M469 PolarHBondContact O-N 2.99Å; M469-A472 PolarHBondContact O-N 2.92Å; M469-A473 WeakPolarHBondContact O-CB 3.5Å; M469-A473 PolarHBondContact O-N 3Å; M469-Y487 HydrophobicContact SD-CD2 4.23Å; M469-Y487 HydrophobicContact SD-CE2 3.9Å; M469-T495 HydrophobicContact CE-CG2 3.59Å; M469-T495 HydrophobicContact SD-CG2 4.15Å; M469-L498 HydrophobicContact CE-CB 4.15Å; M469-L498 HydrophobicContact CE-CD2 3.31Å; M469-L498 HydrophobicContact CE-CG 4.32Å; M469-L498 HydrophobicContact SD-CD2 4.38Å
470	K	79.2	Confident	69.6	Low	28 Å²	28	83.4 Å²	83.4	12%	0.122	46%	0.463	C	S	.	.	H	α-helix	trans	-54.1	-53.6	170	-80.2	178	169.8	-168.2	0	111.4	E462 L466 A472 A473 A474 E480 T484	E462-K470 IonicContact OE1-NZ 2.78Å; E462-K470 PolarHBondContact OE1-NZ 2.78Å; L466-K470 HydrophobicContact CD1-CG 4.29Å; L466-K470 WeakPolarHBondContact O-CG 3.46Å; L466-K470 PolarHBondContact O-N 3.24Å; K470-A472 PolarHBondContact O-N 2.86Å; K470-A473 PolarHBondContact O-N 2.91Å; K470-A474 WeakPolarHBondContact O-CB 3.49Å; K470-A474 PolarHBondContact O-N 3.23Å; K470-E480 HydrophobicContact CB-CG 4.14Å; K470-E480 HydrophobicContact CD-CB 4.31Å; K470-E480 HydrophobicContact CD-CG 4.48Å; K470-E480 HydrophobicContact CG-CB 4.14Å; K470-E480 HydrophobicContact CG-CG 4.23Å; K470-T484 WeakPolarHBondContact CE-OG1 3.49Å
471	K	77.3	Confident	71.3	Confident	157 Å²	157	83 Å²	83	68%	0.683	46%	0.461	S	S	*	.	H	α-helix	trans	-61.8	-44.1	178.9	-79	179.4	174.8	173.7	0	113	G467 V468 T475	G467-K471 PolarHBondContact O-N 3.41Å; V468-K471 PolarHBondContact O-N 3.34Å; K471-T475 PolarHBondContact O-N 2.85Å; K471-T475 PolarHBondContact O-OG1 3.08Å
472	A	71.1	Confident	72.6	Confident	56 Å²	56	76.2 Å²	76.2	46%	0.463	43%	0.431	S	S	.	.	H	α-helix	trans	-62.7	-44.1	178.5	0	0	0	0	0	111.5	V468 M469 K470 T475 C476	V468-A472 PolarHBondContact O-N 3.42Å; M469-A472 PolarHBondContact O-N 2.92Å; K470-A472 PolarHBondContact O-N 2.86Å; A472-T475 WeakPolarHBondContact O-CB 3.37Å; A472-T475 PolarHBondContact O-N 3Å; A472-C476 PolarHBondContact O-N 3.04Å; A472-C476 PolarHBondContact O-SG 2.78Å
473	A	75.7	Confident	73.5	Confident	12 Å²	12	70.7 Å²	70.7	10%	0.099	41%	0.406	C	S	.	.	H	α-helix	trans	-70.8	-37.7	179.9	0	0	0	0	0	113.1	M469 K470 T475 C476 G477 Y478 V483	M469-A473 WeakPolarHBondContact O-CB 3.5Å; M469-A473 PolarHBondContact O-N 3Å; K470-A473 PolarHBondContact O-N 2.91Å; A473-T475 VanDerWaalsContact C-N 3.3Å; A473-T475 PolarHBondContact O-N 3.09Å; A473-C476 CarbonylContact O-C 3.6Å; A473-C476 WeakPolarHBondContact O-CA 3.39Å; A473-C476 PolarHBondContact O-N 3.37Å; A473-G477 PolarHBondContact O-N 3.46Å; A473-Y478 PolarHBondContact O-N 2.78Å; A473-V483 HydrophobicContact CB-CG1 4.41Å; A473-V483 HydrophobicContact CB-CG2 3.38Å
474	A	74.8	Confident	73.8	Confident	47 Å²	47	69.5 Å²	69.5	39%	0.388	40%	0.401	S	S	.	.	H	α-helix	trans	-61.6	-37.7	171.6	0	0	0	0	0	112.1	K470 C476 G477 Y478	K470-A474 WeakPolarHBondContact O-CB 3.49Å; K470-A474 PolarHBondContact O-N 3.23Å; A474-C476 PolarHBondContact O-N 2.98Å; A474-G477 PolarHBondContact O-N 2.87Å; A474-Y478 WeakPolarHBondContact CA-O 3.44Å
475	T	72.9	Confident	74	Confident	124 Å²	124	67.9 Å²	67.9	76%	0.761	39%	0.393	S	S	*	.	H	α-helix	trans	-62.3	-23.2	172	-48.8	0	0	0	0	112.3	K471 A472 A473	K471-T475 PolarHBondContact O-N 2.85Å; K471-T475 PolarHBondContact O-OG1 3.08Å; A472-T475 WeakPolarHBondContact O-CB 3.37Å; A472-T475 PolarHBondContact O-N 3Å; A473-T475 VanDerWaalsContact C-N 3.3Å; A473-T475 PolarHBondContact O-N 3.09Å
476	C	66.5	Low	73.9	Confident	93 Å²	93	65.6 Å²	65.6	63%	0.628	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	11.9	175	-60.1	0	0	0	0	113.6	A472 A473 A474 Y478	A472-C476 PolarHBondContact O-N 3.04Å; A472-C476 PolarHBondContact O-SG 2.78Å; A473-C476 CarbonylContact O-C 3.6Å; A473-C476 WeakPolarHBondContact O-CA 3.39Å; A473-C476 PolarHBondContact O-N 3.37Å; A474-C476 PolarHBondContact O-N 2.98Å; C476-Y478 HydrophobicContact CB-CD2 3.95Å; C476-Y478 HydrophobicContact CB-CE2 4.12Å; C476-Y478 WeakPolarHBondContact O-CD2 3.17Å
477	G	73	Confident	73.6	Confident	71 Å²	71	67.3 Å²	67.3	73%	0.732	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	5.5	175.7	0	0	0	0	0	116.7	A473 A474	A473-G477 PolarHBondContact O-N 3.46Å; A474-G477 PolarHBondContact O-N 2.87Å
478	Y	74.1	Confident	73.3	Confident	62 Å²	62	70.6 Å²	70.6	24%	0.243	40%	0.403	C	S	.	.			trans	-87.6	142.3	178.9	-66.4	-95.9	0	0	0	112.1	A473 A474 C476 L502	A473-Y478 PolarHBondContact O-N 2.78Å; A474-Y478 WeakPolarHBondContact CA-O 3.44Å; C476-Y478 HydrophobicContact CB-CD2 3.95Å; C476-Y478 HydrophobicContact CB-CE2 4.12Å; C476-Y478 WeakPolarHBondContact O-CD2 3.17Å; Y478-L502 HydrophobicContact CD1-CD2 3.73Å; Y478-L502 HydrophobicContact CE1-CB 4.15Å; Y478-L502 HydrophobicContact CE1-CD2 3.89Å; Y478-L502 HydrophobicContact CG-CD2 4.5Å
479	T	79.8	Confident	72.8	Confident	77 Å²	77	74 Å²	74	47%	0.472	42%	0.416	S	S	.	.			trans	-75.5	137.7	175.4	57.5	0	0	0	0	112	E481 N482 V483	T479-E481 PolarHBondContact O-N 3.36Å; T479-N482 WeakPolarHBondContact O-CB 3.34Å; T479-N482 PolarHBondContact O-N 3.13Å; T479-N482 PolarHBondContact OG1-ND2 2.89Å; T479-V483 WeakPolarHBondContact O-CG2 3.48Å; T479-V483 PolarHBondContact O-N 3.14Å
480	E	76.3	Confident	72.4	Confident	93 Å²	93	74.9 Å²	74.9	44%	0.435	42%	0.421	S	S	.	.	H	α-helix	trans	-59.4	-31.1	-177.4	-61.6	-168.2	174.4	0	0	113.3	K470 V483 T484	K470-E480 HydrophobicContact CB-CG 4.14Å; K470-E480 HydrophobicContact CD-CB 4.31Å; K470-E480 HydrophobicContact CD-CG 4.48Å; K470-E480 HydrophobicContact CG-CB 4.14Å; K470-E480 HydrophobicContact CG-CG 4.23Å; E480-V483 PolarHBondContact O-N 2.94Å; E480-T484 WeakPolarHBondContact O-CB 3.42Å; E480-T484 PolarHBondContact O-N 2.99Å; E480-T484 PolarHBondContact O-OG1 3.44Å
481	E	74.9	Confident	71.2	Confident	162 Å²	162	79.4 Å²	79.4	76%	0.757	46%	0.457	S	S	*	.	H	α-helix	trans	-61.9	-42.7	174	-61.3	175.2	173.2	0	0	112	T479 K485	T479-E481 PolarHBondContact O-N 3.36Å; E481-K485 WeakPolarHBondContact O-CB 3.46Å; E481-K485 PolarHBondContact O-N 2.93Å
482	N	71.2	Confident	69.9	Low	47 Å²	47	79.6 Å²	79.6	25%	0.251	46%	0.46	S	S	.	.	H	α-helix	trans	-66.8	-40.8	177	-91.4	-40.9	0	0	0	111.3	T479 I486 K505	T479-N482 WeakPolarHBondContact O-CB 3.34Å; T479-N482 PolarHBondContact O-N 3.13Å; T479-N482 PolarHBondContact OG1-ND2 2.89Å; N482-I486 VanDerWaalsContact O-CG1 3.28Å; N482-I486 WeakPolarHBondContact O-CG1 3.38Å; N482-I486 PolarHBondContact O-N 3.27Å; N482-K505 PolarHBondContact OD1-NZ 2.78Å
483	V	73.6	Confident	69.2	Low	0 Å²	0	80.7 Å²	80.7	0%	0	48%	0.476	C	S	.	.	H	α-helix	trans	-62.6	-51.6	176.6	179.4	0	0	0	0	110.2	A473 T479 E480 K485 I486 Y487 L498	A473-V483 HydrophobicContact CB-CG1 4.41Å; A473-V483 HydrophobicContact CB-CG2 3.38Å; T479-V483 WeakPolarHBondContact O-CG2 3.48Å; T479-V483 PolarHBondContact O-N 3.14Å; E480-V483 PolarHBondContact O-N 2.94Å; V483-K485 VanDerWaalsContact C-N 3.33Å; V483-K485 PolarHBondContact O-N 2.98Å; V483-I486 PolarHBondContact O-N 2.79Å; V483-Y487 WeakPolarHBondContact O-CB 3.42Å; V483-Y487 PolarHBondContact O-N 2.63Å; V483-L498 HydrophobicContact CG1-CD2 4.36Å
484	T	75.3	Confident	68.2	Low	46 Å²	46	82.8 Å²	82.8	28%	0.282	49%	0.491	S	S	.	.	H	α-helix	trans	-58.2	-45	179.5	-53.3	0	0	0	0	111.2	L466 K470 E480 I486 Y487 S488	L466-T484 HydrophobicContact CD2-CG2 4.39Å; K470-T484 WeakPolarHBondContact CE-OG1 3.49Å; E480-T484 WeakPolarHBondContact O-CB 3.42Å; E480-T484 PolarHBondContact O-N 2.99Å; E480-T484 PolarHBondContact O-OG1 3.44Å; T484-I486 PolarHBondContact O-N 3.21Å; T484-Y487 PolarHBondContact O-N 2.9Å; T484-S488 PolarHBondContact O-N 3.18Å; T484-S488 PolarHBondContact O-OG 2.83Å
485	K	73.1	Confident	67.4	Low	135 Å²	135	84.9 Å²	84.9	59%	0.587	50%	0.498	S	S	*	.	H	α-helix	trans	-63.6	-36.9	-179.4	-176.2	168.9	-176.1	168.8	0	113.6	E481 V483 S488 M489	E481-K485 WeakPolarHBondContact O-CB 3.46Å; E481-K485 PolarHBondContact O-N 2.93Å; V483-K485 VanDerWaalsContact C-N 3.33Å; V483-K485 PolarHBondContact O-N 2.98Å; K485-S488 WeakPolarHBondContact CA-OG 3.4Å; K485-S488 PolarHBondContact O-OG 3.48Å; K485-M489 WeakPolarHBondContact O-CG 3.38Å
486	I	68.4	Low	66.4	Low	18 Å²	18	85.1 Å²	85.1	9%	0.092	49%	0.491	C	S	.	.	H	α-helix	trans	-78.5	-38.3	177	-56.4	164.7	0	0	0	109.8	N482 V483 T484 S488 M489 L490 L498 E501 L502 K505	N482-I486 VanDerWaalsContact O-CG1 3.28Å; N482-I486 WeakPolarHBondContact O-CG1 3.38Å; N482-I486 PolarHBondContact O-N 3.27Å; V483-I486 PolarHBondContact O-N 2.79Å; T484-I486 PolarHBondContact O-N 3.21Å; I486-S488 VanDerWaalsContact C-N 3.35Å; I486-S488 PolarHBondContact O-N 2.96Å; I486-M489 PolarHBondContact O-N 3.43Å; I486-L490 PolarHBondContact O-N 3.36Å; I486-L498 HydrophobicContact CB-CD1 3.83Å; I486-L498 HydrophobicContact CG2-CD1 3.53Å; I486-L498 HydrophobicContact CG2-CG 4.4Å; I486-E501 HydrophobicContact CG2-CB 3.98Å; I486-E501 HydrophobicContact CG2-CG 4.32Å; I486-L502 HydrophobicContact CD1-CD2 3.62Å; I486-L502 HydrophobicContact CD1-CG 4.18Å; I486-K505 HydrophobicContact CD1-CD 4.02Å
487	Y	67.8	Low	66.3	Low	54 Å²	54	84.2 Å²	84.2	21%	0.212	48%	0.477	C	S	.	.	H	α-helix	trans	-57.9	-45.6	174.3	-163.5	-99.2	0	0	0	111.4	D463 V465 L466 M469 V483 T484 M489 L490	D463-Y487 PolarHBondContact OD2-OH 3.1Å; V465-Y487 HydrophobicContact CG1-CE2 4.39Å; L466-Y487 HydrophobicContact CB-CD1 4.17Å; L466-Y487 HydrophobicContact CB-CE1 3.89Å; L466-Y487 HydrophobicContact CD1-CD1 3.94Å; L466-Y487 HydrophobicContact CD1-CD2 4.43Å; L466-Y487 HydrophobicContact CD1-CG 3.89Å; L466-Y487 HydrophobicContact CD2-CD1 4.24Å; L466-Y487 HydrophobicContact CG-CD1 4.34Å; M469-Y487 HydrophobicContact SD-CD2 4.23Å; M469-Y487 HydrophobicContact SD-CE2 3.9Å; V483-Y487 WeakPolarHBondContact O-CB 3.42Å; V483-Y487 PolarHBondContact O-N 2.63Å; T484-Y487 PolarHBondContact O-N 2.9Å; Y487-M489 PolarHBondContact O-N 3.36Å; Y487-M489 VanDerWaalsContact O-N 3.08Å; Y487-L490 PolarHBondContact O-N 2.93Å
488	S	66.7	Low	65.9	Low	93 Å²	93	81 Å²	81	65%	0.65	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-9.4	175.5	61.3	0	0	0	0	115.1	T484 K485 I486	T484-S488 PolarHBondContact O-N 3.18Å; T484-S488 PolarHBondContact O-OG 2.83Å; K485-S488 WeakPolarHBondContact CA-OG 3.4Å; K485-S488 PolarHBondContact O-OG 3.48Å; I486-S488 VanDerWaalsContact C-N 3.35Å; I486-S488 PolarHBondContact O-N 2.96Å
489	M	64.9	Low	65.5	Low	149 Å²	149	83.3 Å²	83.3	73%	0.734	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-4.6	174.9	-70.1	-176.5	68.1	0	0	113.3	K485 I486 Y487	K485-M489 WeakPolarHBondContact O-CG 3.38Å; I486-M489 PolarHBondContact O-N 3.43Å; Y487-M489 PolarHBondContact O-N 3.36Å; Y487-M489 VanDerWaalsContact O-N 3.08Å
490	L	63.6	Low	64.9	Low	48 Å²	48	83.2 Å²	83.2	25%	0.251	46%	0.456	S	S	.	.			trans	-101.4	101.2	176.2	-66.3	178.8	0	0	0	109.7	I486 Y487 E492 Q497 L498	I486-L490 PolarHBondContact O-N 3.36Å; Y487-L490 PolarHBondContact O-N 2.93Å; L490-E492 PolarHBondContact O-N 2.97Å; L490-Q497 HydrophobicContact CD1-CB 4.28Å; L490-Q497 HydrophobicContact CD1-CG 4.41Å; L490-Q497 HydrophobicContact CD2-CB 4.37Å; L490-Q497 HydrophobicContact CD2-CG 3.7Å; L490-L498 HydrophobicContact CD1-CB 3.88Å; L490-L498 HydrophobicContact CD1-CD1 3.64Å; L490-L498 HydrophobicContact CD1-CG 4.4Å
491	S	53.5	Low	64.4	Low	124 Å²	124	81.1 Å²	81.1	87%	0.867	45%	0.446	S	S	*	.	S	Bend	trans	-71.5	-8.1	-179.9	53.6	0	0	0	0	114.6
492	E	51.7	Low	64	Low	160 Å²	160	74 Å²	74	75%	0.748	41%	0.413	S	S	*	.	S	Bend	trans	-135.7	130.4	177.7	-65.5	-179.4	-176.1	0	0	109.6	L490 S494	L490-E492 PolarHBondContact O-N 2.97Å; E492-S494 VanDerWaalsContact C-N 3.26Å; E492-S494 PolarHBondContact O-N 2.86Å
493	G	55.4	Low	63.7	Low	79 Å²	79	76.8 Å²	76.8	81%	0.814	42%	0.424	S	S	*	.			trans	-73.6	54.6	-163.9	0	0	0	0	0	116.6	T495	G493-T495 PolarHBondContact O-N 2.89Å
494	S	55.6	Low	63.4	Low	57 Å²	57	82.4 Å²	82.4	40%	0.399	45%	0.449	S	S	.	.			trans	-87.4	100.6	174.8	-178.8	0	0	0	0	111.6	E492 H496 Q497 L498	E492-S494 VanDerWaalsContact C-N 3.26Å; E492-S494 PolarHBondContact O-N 2.86Å; S494-H496 PolarHBondContact O-N 3.25Å; S494-H496 VanDerWaalsContact O-N 3.14Å; S494-Q497 WeakPolarHBondContact O-CB 3.41Å; S494-Q497 PolarHBondContact O-N 3.14Å; S494-Q497 PolarHBondContact OG-N 3.44Å; S494-L498 PolarHBondContact O-N 2.8Å
495	T	57.2	Low	62.7	Low	90 Å²	90	83 Å²	83	55%	0.552	45%	0.447	S	S	*	.	H	α-helix	trans	-52.8	-34.1	173.7	-34.6	0	0	0	0	112.4	M469 G493 L499	M469-T495 HydrophobicContact CE-CG2 3.59Å; M469-T495 HydrophobicContact SD-CG2 4.15Å; G493-T495 PolarHBondContact O-N 2.89Å; T495-L499 PolarHBondContact O-N 3.25Å
496	H	52.6	Low	61.7	Low	129 Å²	129	81.7 Å²	81.7	60%	0.597	44%	0.443	S	S	*	.	H	α-helix	trans	-68.2	-35	176.9	-175.7	-91.4	0	0	0	112.5	S494 L500	S494-H496 PolarHBondContact O-N 3.25Å; S494-H496 VanDerWaalsContact O-N 3.14Å; H496-L500 WeakPolarHBondContact O-CG 3.41Å; H496-L500 PolarHBondContact O-N 2.93Å
497	Q	62.8	Low	60.9	Low	74 Å²	74	84.4 Å²	84.4	35%	0.346	46%	0.464	S	S	.	.	H	α-helix	trans	-67.6	-42.5	177	-166.7	64.4	38.9	0	0	111.3	L490 S494 L499 L500 E501	L490-Q497 HydrophobicContact CD1-CB 4.28Å; L490-Q497 HydrophobicContact CD1-CG 4.41Å; L490-Q497 HydrophobicContact CD2-CB 4.37Å; L490-Q497 HydrophobicContact CD2-CG 3.7Å; S494-Q497 WeakPolarHBondContact O-CB 3.41Å; S494-Q497 PolarHBondContact O-N 3.14Å; S494-Q497 PolarHBondContact OG-N 3.44Å; Q497-L499 VanDerWaalsContact C-N 3.31Å; Q497-L499 PolarHBondContact O-N 2.82Å; Q497-L500 PolarHBondContact O-N 2.62Å; Q497-E501 PolarHBondContact NE2-OE2 3.21Å; Q497-E501 PolarHBondContact O-N 2.59Å
498	L	64.7	Low	59.8	Low	5 Å²	5	89.1 Å²	89.1	3%	0.026	49%	0.486	C	S	.	.	H	α-helix	trans	-59.4	-42.9	177.4	-162.8	90	0	0	0	111.7	M469 V483 I486 L490 S494 L500 E501 L502	M469-L498 HydrophobicContact CE-CB 4.15Å; M469-L498 HydrophobicContact CE-CD2 3.31Å; M469-L498 HydrophobicContact CE-CG 4.32Å; M469-L498 HydrophobicContact SD-CD2 4.38Å; V483-L498 HydrophobicContact CG1-CD2 4.36Å; I486-L498 HydrophobicContact CB-CD1 3.83Å; I486-L498 HydrophobicContact CG2-CD1 3.53Å; I486-L498 HydrophobicContact CG2-CG 4.4Å; L490-L498 HydrophobicContact CD1-CB 3.88Å; L490-L498 HydrophobicContact CD1-CD1 3.64Å; L490-L498 HydrophobicContact CD1-CG 4.4Å; S494-L498 PolarHBondContact O-N 2.8Å; L498-L500 PolarHBondContact O-N 3.2Å; L498-E501 PolarHBondContact O-N 3.49Å; L498-L502 HydrophobicContact CD2-CD1 3.99Å; L498-L502 HydrophobicContact CG-CD1 4.11Å; L498-L502 WeakPolarHBondContact O-CB 3.43Å; L498-L502 VanDerWaalsContact O-CG 3.31Å; L498-L502 WeakPolarHBondContact O-CG 3.21Å; L498-L502 PolarHBondContact O-N 2.97Å
499	L	66.7	Low	58.8	Low	109 Å²	109	90.1 Å²	90.1	57%	0.571	48%	0.48	S	S	*	.	H	α-helix	trans	-62.8	-42.4	-179.1	-167.3	69.2	0	0	0	112	T495 Q497 L502 Q503	T495-L499 PolarHBondContact O-N 3.25Å; Q497-L499 VanDerWaalsContact C-N 3.31Å; Q497-L499 PolarHBondContact O-N 2.82Å; L499-L502 PolarHBondContact O-N 3.33Å; L499-Q503 PolarHBondContact O-N 2.68Å
500	L	67.1	Low	57.6	Low	76 Å²	76	87.4 Å²	87.4	40%	0.398	47%	0.472	S	S	.	.	H	α-helix	trans	-64.9	-43.1	174.5	-70.4	173.3	0	0	0	112.1	H496 Q497 L498 L502 K504	H496-L500 WeakPolarHBondContact O-CG 3.41Å; H496-L500 PolarHBondContact O-N 2.93Å; Q497-L500 PolarHBondContact O-N 2.62Å; L498-L500 PolarHBondContact O-N 3.2Å; L500-L502 VanDerWaalsContact C-N 3.31Å; L500-L502 PolarHBondContact O-N 2.78Å; L500-K504 WeakPolarHBondContact O-CB 3.48Å; L500-K504 PolarHBondContact O-N 3.39Å
501	E	66	Low	56.2	Low	49 Å²	49	90.8 Å²	90.8	23%	0.229	49%	0.487	C	S	.	.	H	α-helix	trans	-66.9	-32	179.2	-126.2	64.2	-124.2	0	0	112.2	I486 Q497 L498 K504 K505	I486-E501 HydrophobicContact CG2-CB 3.98Å; I486-E501 HydrophobicContact CG2-CG 4.32Å; Q497-E501 PolarHBondContact NE2-OE2 3.21Å; Q497-E501 PolarHBondContact O-N 2.59Å; L498-E501 PolarHBondContact O-N 3.49Å; E501-K504 WeakPolarHBondContact OE1-CD 3.2Å; E501-K504 WeakPolarHBondContact OE1-CE 3.39Å; E501-K504 IonicContact OE1-NZ 3.08Å; E501-K504 PolarHBondContact OE1-NZ 2.92Å; E501-K505 WeakPolarHBondContact O-CB 3.41Å; E501-K505 PolarHBondContact O-N 2.86Å; E501-K505 VanDerWaalsContact O-N 3.14Å
502	L	65.4	Low	55.3	Low	13 Å²	13	88.1 Å²	88.1	7%	0.068	48%	0.478	C	S	.	.	H	α-helix	trans	-65.5	-54.1	173.3	-76	164.1	0	0	0	112	Y478 I486 L498 L499 L500 K504 K505 E506	Y478-L502 HydrophobicContact CD1-CD2 3.73Å; Y478-L502 HydrophobicContact CE1-CB 4.15Å; Y478-L502 HydrophobicContact CE1-CD2 3.89Å; Y478-L502 HydrophobicContact CG-CD2 4.5Å; I486-L502 HydrophobicContact CD1-CD2 3.62Å; I486-L502 HydrophobicContact CD1-CG 4.18Å; L498-L502 HydrophobicContact CD2-CD1 3.99Å; L498-L502 HydrophobicContact CG-CD1 4.11Å; L498-L502 WeakPolarHBondContact O-CB 3.43Å; L498-L502 VanDerWaalsContact O-CG 3.31Å; L498-L502 WeakPolarHBondContact O-CG 3.21Å; L498-L502 PolarHBondContact O-N 2.97Å; L499-L502 PolarHBondContact O-N 3.33Å; L500-L502 VanDerWaalsContact C-N 3.31Å; L500-L502 PolarHBondContact O-N 2.78Å; L502-K504 VanDerWaalsContact C-N 3.27Å; L502-K504 PolarHBondContact O-N 3.11Å; L502-K505 WeakPolarHBondContact O-CA 3.28Å; L502-K505 WeakPolarHBondContact O-CB 3.12Å; L502-K505 PolarHBondContact O-N 3.23Å; L502-E506 PolarHBondContact O-N 2.97Å
503	Q	66.1	Low	54.3	Low	105 Å²	105	85 Å²	85	49%	0.491	48%	0.475	S	S	.	.	H	α-helix	trans	-59.6	-37.9	177.2	-68.2	-171.9	-62.7	0	0	112.4	L499 K505 E506 S507	L499-Q503 PolarHBondContact O-N 2.68Å; Q503-K505 PolarHBondContact O-N 3.34Å; Q503-E506 PolarHBondContact O-N 3.46Å; Q503-S507 PolarHBondContact O-N 2.91Å; Q503-S507 PolarHBondContact O-OG 3.32Å
504	K	67.8	Low	53	Low	117 Å²	117	88.4 Å²	88.4	51%	0.509	47%	0.467	S	S	.	.	H	α-helix	trans	-69.5	-16.9	176.9	-176.8	175.8	168.4	-164	0	113.2	L500 E501 L502	L500-K504 WeakPolarHBondContact O-CB 3.48Å; L500-K504 PolarHBondContact O-N 3.39Å; E501-K504 WeakPolarHBondContact OE1-CD 3.2Å; E501-K504 WeakPolarHBondContact OE1-CE 3.39Å; E501-K504 IonicContact OE1-NZ 3.08Å; E501-K504 PolarHBondContact OE1-NZ 2.92Å; L502-K504 VanDerWaalsContact C-N 3.27Å; L502-K504 PolarHBondContact O-N 3.11Å
505	K	59.4	Low	51.7	Low	59 Å²	59	95.7 Å²	95.7	26%	0.257	49%	0.491	S	S	.	.	H	α-helix	trans	-91.1	-39.9	174	-159.9	-176.9	-177.1	-157.5	0	112	N482 I486 E501 L502 Q503 S507 K508 E509	N482-K505 PolarHBondContact OD1-NZ 2.78Å; I486-K505 HydrophobicContact CD1-CD 4.02Å; E501-K505 WeakPolarHBondContact O-CB 3.41Å; E501-K505 PolarHBondContact O-N 2.86Å; E501-K505 VanDerWaalsContact O-N 3.14Å; L502-K505 WeakPolarHBondContact O-CA 3.28Å; L502-K505 WeakPolarHBondContact O-CB 3.12Å; L502-K505 PolarHBondContact O-N 3.23Å; Q503-K505 PolarHBondContact O-N 3.34Å; K505-S507 PolarHBondContact O-N 3.15Å; K505-K508 WeakPolarHBondContact O-CA 3.46Å; K505-K508 WeakPolarHBondContact O-CB 3.44Å; K505-K508 PolarHBondContact O-N 2.92Å; K505-E509 WeakPolarHBondContact CE-OE1 3.46Å; K505-E509 IonicContact NZ-OE1 2.59Å; K505-E509 PolarHBondContact O-N 3.14Å
506	E	53.3	Low	50.2	Low	107 Å²	107	97.3 Å²	97.3	50%	0.5	49%	0.493	S	S	.	.	H	α-helix	trans	-53.2	-41.1	167.1	-174.9	176.6	-140.5	0	0	111	L502 Q503 K508 E509 T510	L502-E506 PolarHBondContact O-N 2.97Å; Q503-E506 PolarHBondContact O-N 3.46Å; E506-K508 PolarHBondContact O-N 3.11Å; E506-E509 PolarHBondContact O-N 3.36Å; E506-T510 PolarHBondContact O-N 2.92Å; E506-T510 VanDerWaalsContact O-N 3.1Å; E506-T510 PolarHBondContact O-OG1 2.93Å
507	S	49.8	Very low	49	Very low	76 Å²	76	97.1 Å²	97.1	53%	0.531	50%	0.503	S	S	.	.	H	α-helix	trans	-62.9	-16.5	172.6	-55.6	0	0	0	0	115.3	Q503 K505	Q503-S507 PolarHBondContact O-N 2.91Å; Q503-S507 PolarHBondContact O-OG 3.32Å; K505-S507 PolarHBondContact O-N 3.15Å
508	K	45.9	Very low	47.3	Very low	152 Å²	152	102.7 Å²	102.7	66%	0.661	52%	0.521	S	S	*	.	H	α-helix	trans	-103.2	-33.9	177.6	-77.4	-175.9	172.2	-176.4	0	112.6	K505 E506 T510 E511 G512	K505-K508 WeakPolarHBondContact O-CA 3.46Å; K505-K508 WeakPolarHBondContact O-CB 3.44Å; K505-K508 PolarHBondContact O-N 2.92Å; E506-K508 PolarHBondContact O-N 3.11Å; K508-T510 VanDerWaalsContact C-N 3.35Å; K508-E511 PolarHBondContact O-N 3.37Å; K508-G512 PolarHBondContact O-N 3Å
509	E	46	Very low	45.6	Very low	115 Å²	115	109.8 Å²	109.8	54%	0.537	55%	0.554	S	S	.	*	H	α-helix	trans	-74.8	-28.1	178.6	-68.6	176.9	-165.8	0	0	111	K505 E506 G512	K505-E509 WeakPolarHBondContact CE-OE1 3.46Å; K505-E509 IonicContact NZ-OE1 2.59Å; K505-E509 PolarHBondContact O-N 3.14Å; E506-E509 PolarHBondContact O-N 3.36Å; E509-G512 PolarHBondContact O-N 2.88Å
510	T	38.8	Very low	43.7	Very low	92 Å²	92	113.1 Å²	113.1	56%	0.564	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-20	169	46.5	0	0	0	0	115.1	E506 K508	E506-T510 PolarHBondContact O-N 2.92Å; E506-T510 VanDerWaalsContact O-N 3.1Å; E506-T510 PolarHBondContact O-OG1 2.93Å; K508-T510 VanDerWaalsContact C-N 3.35Å
511	E	34.6	Very low	41.7	Very low	119 Å²	119	117.2 Å²	117.2	56%	0.556	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-11.5	168.8	-82	-75	107.1	0	0	112.7	K508 S513 K514	K508-E511 PolarHBondContact O-N 3.37Å; E511-S513 VanDerWaalsContact C-N 3.28Å; E511-S513 PolarHBondContact O-N 3.05Å; E511-K514 WeakPolarHBondContact OE1-CE 3.37Å; E511-K514 IonicContact OE1-NZ 2.74Å; E511-K514 PolarHBondContact OE1-NZ 3.19Å
512	G	33.5	Very low	39.8	Very low	67 Å²	67	120.8 Å²	120.8	69%	0.691	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-11.4	-179.1	0	0	0	0	0	115.5	K508 E509	K508-G512 PolarHBondContact O-N 3Å; E509-G512 PolarHBondContact O-N 2.88Å
513	S	31.6	Very low	38	Very low	96 Å²	96	126.1 Å²	126.1	67%	0.671	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	6.4	-171	56.9	0	0	0	0	115.1	E511 K515	E511-S513 VanDerWaalsContact C-N 3.28Å; E511-S513 PolarHBondContact O-N 3.05Å; S513-K515 PolarHBondContact O-N 3.49Å
514	K	28.5	Very low	36.1	Very low	150 Å²	150	129 Å²	129	65%	0.652	66%	0.658	S	S	*	*			trans	-86.3	81.6	172	-72.8	175.7	-176.1	161.6	0	112.2	E511 E516	E511-K514 WeakPolarHBondContact OE1-CE 3.37Å; E511-K514 IonicContact OE1-NZ 2.74Å; E511-K514 PolarHBondContact OE1-NZ 3.19Å; K514-E516 VanDerWaalsContact C-N 3.31Å; K514-E516 PolarHBondContact O-N 3.41Å; K514-E516 VanDerWaalsContact O-N 3.09Å
515	K	27.3	Very low	34.3	Very low	209 Å²	209	129 Å²	129	91%	0.909	67%	0.668	S	S	*	*			trans	-78.1	82.2	161.1	-96.3	-170.6	174.3	-179	0	110.6	S513 P517	S513-K515 PolarHBondContact O-N 3.49Å; K515-P517 WeakPolarHBondContact O-CD 3.29Å
516	E	25.8	Very low	32.7	Very low	125 Å²	125	135.4 Å²	135.4	58%	0.584	70%	0.699	S	S	*	*			trans	-71.1	118.4	160.3	177.4	177.5	-100.6	0	0	109.3	K514 R518	K514-E516 VanDerWaalsContact C-N 3.31Å; K514-E516 PolarHBondContact O-N 3.41Å; K514-E516 VanDerWaalsContact O-N 3.09Å; E516-R518 HydrophobicContact CG-CG 4.1Å; E516-R518 PolarHBondContact O-N 3.46Å; E516-R518 IonicContact OE2-CZ 3.71Å; E516-R518 IonicContact OE2-NE 2.71Å; E516-R518 PolarHBondContact OE2-NE 3.12Å; E516-R518 IonicContact OE2-NH2 3.8Å; E516-R518 PolarHBondContact OE2-NH2 2.91Å
517	P	27.8	Very low	31.5	Very low	125 Å²	125	139.6 Å²	139.6	81%	0.812	72%	0.715	S	S	*	*			trans	-83.1	106.9	168.5	3.2	16	0	0	0	108.3	K515 E519	K515-P517 WeakPolarHBondContact O-CD 3.29Å; P517-E519 PolarHBondContact O-N 3.14Å
518	R	26.8	Very low	30.3	Very low	191 Å²	191	144.7 Å²	144.7	72%	0.721	73%	0.731	S	S	*	*			trans	-78.7	118.6	177.9	-71.9	-167.2	-179.4	-174.4	-4.1	112.7	E516	E516-R518 HydrophobicContact CG-CG 4.1Å; E516-R518 PolarHBondContact O-N 3.46Å; E516-R518 IonicContact OE2-CZ 3.71Å; E516-R518 IonicContact OE2-NE 2.71Å; E516-R518 PolarHBondContact OE2-NE 3.12Å; E516-R518 IonicContact OE2-NH2 3.8Å; E516-R518 PolarHBondContact OE2-NH2 2.91Å
519	E	28.6	Very low	29.4	Very low	154 Å²	154	145.5 Å²	145.5	72%	0.72	74%	0.737	S	S	*	*				47	105.2	129	-58.6	175.8	132.6	0	0	118.2	P517	P517-E519 PolarHBondContact O-N 3.14Å
520	I	26.9	Very low	28.4	Very low	179 Å²	179	146.5 Å²	146.5	92%	0.918	75%	0.745	S	S	*	*				-124.1	152.3	127.2	41.1	174.8	0	0	0	108.2
521	H	26.5	Very low	27.8	Very low	161 Å²	161	148.4 Å²	148.4	75%	0.745	75%	0.751	S	S	*	*			trans	-84.3	163.6	-153.6	-118.3	-89.6	0	0	0	116.3
522	D	24.9	Very low	27.4	Very low	125 Å²	125	150.5 Å²	150.5	67%	0.668	77%	0.766	S	S	*	*			trans	64.9	107.8	153.4	-66.4	-13	0	0	0	122.1
523	V	28.3	Very low	27.1	Very low	125 Å²	125	151.3 Å²	151.3	76%	0.758	77%	0.774	S	S	*	*				21.8	110.1	114.2	-168.8	0	0	0	0	117.2
524	L	26.6	Very low	26.8	Very low	164 Å²	164	155.1 Å²	155.1	86%	0.859	79%	0.786	S	S	*	*				-154.2	160.1	107.3	-138.3	99.8	0	0	0	114.1
525	V	29.2	Very low	26.7	Very low	119 Å²	119	152 Å²	152	72%	0.721	79%	0.788	S	S	*	*			trans	-65	137.9	175.5	169.5	0	0	0	0	111.6	K527	V525-K527 PolarHBondContact O-N 2.77Å
526	E	25.5	Very low	26.6	Very low	193 Å²	193	150.5 Å²	150.5	90%	0.902	78%	0.784	S	S	*	*			trans	-66.1	118.4	162.2	-72.7	-171.7	143	0	0	110.8
527	K	27.9	Very low	26.7	Very low	194 Å²	194	150.3 Å²	150.3	84%	0.843	79%	0.791	S	S	*	*			trans	-149.6	146.1	144.2	-116.8	-179.8	-178.5	-173.8	0	110.3	V525	V525-K527 PolarHBondContact O-N 2.77Å
528	E	25.8	Very low	26.6	Very low	183 Å²	183	152.4 Å²	152.4	86%	0.855	79%	0.79	S	S	*	*			trans	-68	136	-175.8	-59.3	150.5	115.9	0	0	110.9
529	E	25.8	Very low	26.6	Very low	169 Å²	169	148.7 Å²	148.7	79%	0.79	79%	0.789	S	S	*	*				175.7	121	103.7	-92.2	-162.8	136.8	0	0	114.7
530	I	26.3	Very low	26.4	Very low	136 Å²	136	151.5 Å²	151.5	70%	0.697	80%	0.799	S	S	*	*			trans	30.2	124.8	145.8	-0.1	178.6	0	0	0	123.6
531	N	25.5	Very low	26.2	Very low	132 Å²	132	146.1 Å²	146.1	71%	0.706	79%	0.787	S	S	*	*			trans	80.6	120.5	137.5	-87.1	-18.3	0	0	0	124.6
532	L	27.3	Very low	26	Very low	164 Å²	164	146.8 Å²	146.8	86%	0.859	79%	0.791	S	S	*	*			trans	65.7	124.1	132.9	-60.6	167.4	0	0	0	121.5
533	G	25.3	Very low	25.8	Very low	83 Å²	83	148.9 Å²	148.9	86%	0.856	79%	0.794	S	S	*	*			trans	168.1	104.4	158.4	0	0	0	0	0	117.3
534	L	26.2	Very low	25.7	Very low	176 Å²	176	150.6 Å²	150.6	92%	0.921	79%	0.792	S	S	*	*			trans	-56.1	160.3	178.4	-86.9	153.2	0	0	0	118.9
535	A	26.4	Very low	25.7	Very low	84 Å²	84	149.9 Å²	149.9	69%	0.694	79%	0.787	S	S	*	*			trans	80.2	108.1	141.7	0	0	0	0	0	122.5
536	E	25.9	Very low	25.6	Very low	178 Å²	178	153.4 Å²	153.4	83%	0.832	80%	0.795	S	S	*	*				53.4	148.1	120.1	-64.4	-171.3	164.6	0	0	124.6
537	T	26.3	Very low	25.9	Very low	121 Å²	121	153.8 Å²	153.8	74%	0.742	79%	0.794	S	S	*	*			trans	78.3	118.4	156.4	49	0	0	0	0	123
538	E	27.2	Very low	26	Very low	169 Å²	169	150.5 Å²	150.5	79%	0.79	79%	0.786	S	S	*	*				74.3	124.4	128.9	-64.7	-163.4	153.6	0	0	125.2
539	T	26.6	Very low	26.4	Very low	114 Å²	114	149 Å²	149	70%	0.699	78%	0.777	S	S	*	*			trans	67.5	118.1	138.1	57.3	0	0	0	0	123.6
540	K	24	Very low	26.4	Very low	213 Å²	213	151.9 Å²	151.9	93%	0.926	78%	0.78	S	S	*	*				36.7	115.7	127	-63.6	-179.7	176.2	177.7	0	120.2
541	G	23.6	Very low	26.5	Very low	65 Å²	65	152.5 Å²	152.5	67%	0.67	79%	0.785	S	S	*	*			trans	153	124.2	164.4	0	0	0	0	0	107.8
542	E	21.6	Very low	27.5	Very low	176 Å²	176	151.5 Å²	151.5	82%	0.822	79%	0.786	S	S	*	*				56.6	124.4	59.5	-55.1	-155.8	138.7	0	0	113
543	F	21	Very low	27.6	Very low	168 Å²	168	151 Å²	151	74%	0.737	78%	0.784	S	S	*	*			cis	-156.9	155.5	-4.9	-139.1	-107.4	0	0	0	110
544	F	24.7	Very low	27.8	Very low	162 Å²	162	156 Å²	156	71%	0.711	79%	0.785	S	S	*	*			trans	8.3	136.5	163.8	-76.9	-110.5	0	0	0	123.7
545	I	27.9	Very low	27.9	Very low	148 Å²	148	151.2 Å²	151.2	76%	0.759	78%	0.778	S	S	*	*			trans	21.3	121.4	138	-59.4	178.1	0	0	0	118.8
546	H	26.2	Very low	28	Very low	193 Å²	193	156.1 Å²	156.1	89%	0.894	79%	0.786	S	S	*	*			trans	-62.4	135.8	161.6	-86.5	14.9	0	0	0	113.5
547	K	31.8	Very low	28.1	Very low	202 Å²	202	153.2 Å²	153.2	88%	0.878	78%	0.781	S	S	*	*			trans	-151.8	124.7	150.5	-153.8	172.1	-174.1	178.5	0	113.1
548	D	30.1	Very low	28.1	Very low	125 Å²	125	156.9 Å²	156.9	67%	0.668	79%	0.786	S	S	*	*			trans	-104.5	150.9	172.8	-125.8	23.6	0	0	0	108.3
549	K	33.8	Very low	28.1	Very low	151 Å²	151	156.3 Å²	156.3	66%	0.657	78%	0.784	S	S	*	*			cis	-163.5	131.9	-4.5	-152.9	178.6	-148.4	74.1	0	111.1
550	R	26.7	Very low	29	Very low	229 Å²	229	155.4 Å²	155.4	86%	0.864	78%	0.78	S	S	*	*			trans	143	123.5	136.3	-80.6	179.3	-76.7	-165.6	-2.4	116
551	D	28.9	Very low	29.1	Very low	150 Å²	150	153.3 Å²	153.3	80%	0.802	77%	0.771	S	S	*	*			trans	-72.5	178.5	172.1	-62.9	-71.7	0	0	0	112.9
552	P	46.6	Very low	29.3	Very low	111 Å²	111	162 Å²	162	72%	0.721	78%	0.783	S	S	*	*			cis	-148.7	174.5	25.2	45	-24.6	0	0	0	122.4
553	D	27.8	Very low	29.5	Very low	152 Å²	152	159.1 Å²	159.1	81%	0.813	78%	0.783	S	S	*	*			trans	107.9	149.4	141	-89.9	-1.7	0	0	0	122.4
554	E	30.5	Very low	29.7	Very low	190 Å²	190	158.5 Å²	158.5	89%	0.888	78%	0.784	S	S	*	*			trans	-54.8	156	-153.9	-51	-175.9	124.9	0	0	118.8
555	G	27.8	Very low	29.8	Very low	74 Å²	74	158.7 Å²	158.7	76%	0.763	79%	0.787	S	S	*	*			trans	-162.3	-10.7	-177	0	0	0	0	0	123.2
556	Q	29.1	Very low	29.7	Very low	188 Å²	188	158.7 Å²	158.7	88%	0.879	79%	0.788	S	S	*	*			trans	65.5	142.1	164.7	-76.6	-172.6	28.8	0	0	123.2
557	T	27.1	Very low	29.7	Very low	117 Å²	117	153.9 Å²	153.9	72%	0.718	78%	0.781	S	S	*	*			trans	28.5	128.5	149.7	6.9	0	0	0	0	121.4
558	K	26.4	Very low	29.4	Very low	197 Å²	197	153.7 Å²	153.7	86%	0.857	78%	0.784	S	S	*	*				55.5	102.8	55.6	-80.3	-172.6	179.8	178.9	0	116.7
559	E	28	Very low	29.3	Very low	157 Å²	157	153.1 Å²	153.1	73%	0.734	79%	0.79	S	S	*	*			trans	-172.6	149.1	140.1	-111.9	-92.5	123.5	0	0	110.5	K561	E559-K561 IonicContact OE1-NZ 2.65Å; E559-K561 PolarHBondContact OE1-NZ 3.47Å; E559-K561 IonicContact OE2-NZ 2.9Å; E559-K561 PolarHBondContact OE2-NZ 3.41Å
560	P	46.1	Very low	29	Very low	96 Å²	96	153.8 Å²	153.8	62%	0.623	80%	0.8	S	S	*	*			trans	-114.6	148.4	173.3	37.8	-28.5	0	0	0	112.9
561	K	26.2	Very low	29	Very low	169 Å²	169	149.3 Å²	149.3	74%	0.735	79%	0.793	S	S	*	*			trans	-175.9	123.9	146.3	-94	130.8	-135.3	152.4	0	114.8	E559	E559-K561 IonicContact OE1-NZ 2.65Å; E559-K561 PolarHBondContact OE1-NZ 3.47Å; E559-K561 IonicContact OE2-NZ 2.9Å; E559-K561 PolarHBondContact OE2-NZ 3.41Å
562	R	28	Very low	28.8	Very low	247 Å²	247	154.1 Å²	154.1	93%	0.932	80%	0.8	S	S	*	*			trans	-27.9	125	144.5	174.4	-160.6	-157.7	171.8	7.7	116.6
563	S	24.2	Very low	27.8	Very low	115 Å²	115	153.8 Å²	153.8	80%	0.804	80%	0.796	S	S	*	*			trans	-164.5	170.2	143.4	59.3	0	0	0	0	111.8
564	M	25.2	Very low	27.5	Very low	156 Å²	156	157.1 Å²	157.1	77%	0.768	80%	0.797	S	S	*	*			trans	-109.2	168	179.7	-67.3	168	53.8	0	0	111.7
565	Q	26.7	Very low	27.2	Very low	165 Å²	165	152 Å²	152	77%	0.771	78%	0.783	S	S	*	*			trans	88.9	152.8	137.4	-115.8	177.9	-17.6	0	0	120.7
566	L	25.8	Very low	27	Very low	149 Å²	149	155.8 Å²	155.8	78%	0.78	79%	0.785	S	S	*	*			trans	61.5	121.6	-176.6	-74.2	71.3	0	0	0	114
567	A	26.4	Very low	26.7	Very low	91 Å²	91	156.1 Å²	156.1	75%	0.752	78%	0.784	S	S	*	*			cis	79.9	117.8	34.3	0	0	0	0	0	114.7
568	E	25.7	Very low	27.1	Very low	199 Å²	199	156 Å²	156	93%	0.93	79%	0.785	S	S	*	*				-154.2	172.8	126.8	-123.6	176.4	172.3	0	0	111.4
569	S	29	Very low	27	Very low	113 Å²	113	155.6 Å²	155.6	79%	0.79	78%	0.783	S	S	*	*			trans	-94.1	163	-173.1	-50.5	0	0	0	0	111.9
570	D	26.7	Very low	26.8	Very low	165 Å²	165	156.1 Å²	156.1	88%	0.882	79%	0.786	S	S	*	*				-155.5	159.7	117.4	-138.8	-15.5	0	0	0	114.1
571	L	26.2	Very low	25.8	Very low	135 Å²	135	158.8 Å²	158.8	71%	0.707	79%	0.794	S	S	*	*			trans	-120.5	130.3	-175.2	-116.6	147.5	0	0	0	109.7	T573	L571-T573 HydrophobicContact CD2-CG2 4.34Å
572	R	25.9	Very low	25.7	Very low	251 Å²	251	154.7 Å²	154.7	95%	0.947	79%	0.792	S	S	*	*			trans	-141.1	133.1	147.4	-78	-151.4	173.6	-147.1	-4.3	113.8
573	T	25.3	Very low	26.4	Very low	104 Å²	104	147.8 Å²	147.8	64%	0.638	78%	0.779	S	S	*	*			trans	-102.5	162.6	171.5	50.9	0	0	0	0	109.9	L571	L571-T573 HydrophobicContact CD2-CG2 4.34Å
574	W	22.4	Very low	26.5	Very low	221 Å²	221	149.7 Å²	149.7	84%	0.837	78%	0.78	S	S	*	*				-169	161.6	112	-147.7	-98.5	0	0	0	113.4
575	S	23.7	Very low	26.6	Very low	84 Å²	84	150.1 Å²	150.1	59%	0.587	78%	0.78	S	S	*	*			trans	-68.7	168.4	-171.9	-44.8	0	0	0	0	117
576	N	23.7	Very low	27.2	Very low	153 Å²	153	148 Å²	148	82%	0.818	78%	0.781	S	S	*	*				-172.3	153	107.9	-93.1	-26.8	0	0	0	117.3
577	K	22.5	Very low	27.2	Very low	194 Å²	194	146.5 Å²	146.5	84%	0.843	78%	0.777	S	S	*	*			trans	-101.1	170.4	153.4	-73.2	-178.2	178	177.2	0	107.1
578	P	35	Very low	27.4	Very low	115 Å²	115	146 Å²	146	75%	0.747	77%	0.768	S	S	*	*			cis	-145.1	-157.8	21.3	44.6	-22.8	0	0	0	115.7
579	K	24.3	Very low	27.7	Very low	188 Å²	188	144.7 Å²	144.7	82%	0.817	76%	0.762	S	S	*	*			trans	-5.2	144.5	154	-58.7	174.1	175.8	179.7	0	116.4
580	Q	23.3	Very low	27.7	Very low	168 Å²	168	146.3 Å²	146.3	79%	0.785	76%	0.761	S	S	*	*				174.1	176.3	64.3	-146.6	176.3	16.2	0	0	111.1
581	L	25.6	Very low	27.8	Very low	152 Å²	152	145 Å²	145	80%	0.796	75%	0.754	S	S	*	*			trans	81.3	135.2	159	-103.8	67.4	0	0	0	121.8
582	A	24.9	Very low	27.8	Very low	84 Å²	84	146.5 Å²	146.5	69%	0.694	76%	0.758	S	S	*	*			trans	-102.2	-157.2	158.3	0	0	0	0	0	107.4
583	P	41.2	Very low	28.7	Very low	102 Å²	102	139.7 Å²	139.7	66%	0.662	75%	0.746	S	S	*	*			cis	-138.7	177.8	1.2	40.2	-20	0	0	0	116.2
584	N	27.4	Very low	28.7	Very low	154 Å²	154	141.5 Å²	141.5	82%	0.824	75%	0.751	S	S	*	*				175.3	147.8	114.4	-91.2	-36	0	0	0	114.3
585	Q	27.4	Very low	28.9	Very low	165 Å²	165	137.2 Å²	137.2	77%	0.771	75%	0.745	S	S	*	*			trans	-99.1	174.6	164.5	-63.2	-176.7	-16.3	0	0	109.7
586	P	38.5	Very low	29.1	Very low	122 Å²	122	138.9 Å²	138.9	79%	0.792	75%	0.751	S	S	*	*				-116.7	141.2	90.1	-7.5	28.4	0	0	0	113.6
587	V	26.6	Very low	29.2	Very low	116 Å²	116	139.1 Å²	139.1	70%	0.703	75%	0.752	S	S	*	*				69.9	122.7	86	171.4	0	0	0	0	111.8
588	S	29.5	Very low	29.4	Very low	80 Å²	80	138.5 Å²	138.5	56%	0.559	74%	0.744	S	S	*	*			cis	-171.2	164	6	46.4	0	0	0	0	114.7
589	Q	33.7	Very low	29.8	Very low	172 Å²	172	139 Å²	139	80%	0.804	75%	0.747	S	S	*	*			trans	68.1	143.6	153.8	-73.5	162.2	11.5	0	0	116.8
590	L	28.8	Very low	29.9	Very low	147 Å²	147	136.2 Å²	136.2	77%	0.77	74%	0.737	S	S	*	*			cis	-160.8	178.1	-14.4	-143.8	50.9	0	0	0	105.9
591	N	28.2	Very low	30.1	Very low	137 Å²	137	137.2 Å²	137.2	73%	0.733	74%	0.742	S	S	*	*			cis	-155.5	-175.8	9.6	-161.8	9.5	0	0	0	111.1
592	Q	26.6	Very low	30.3	Very low	167 Å²	167	136.1 Å²	136.1	78%	0.78	74%	0.736	S	S	*	*			trans	-122.1	-165.5	162.5	-69.3	-166.3	-4.8	0	0	108.2
593	P	43.6	Very low	30.5	Very low	108 Å²	108	137.6 Å²	137.6	70%	0.701	74%	0.737	S	S	*	*			cis	-128.2	-158	-1	38.8	-14.7	0	0	0	112.2
594	L	25.8	Very low	29.8	Very low	142 Å²	142	140 Å²	140	74%	0.743	74%	0.743	S	S	*	*			cis	-153.5	-175.7	13	-165.8	45.6	0	0	0	112.7
595	N	26.9	Very low	30	Very low	132 Å²	132	140.8 Å²	140.8	71%	0.706	74%	0.742	S	S	*	*			trans	-81.2	-165.4	-177.6	-45.6	-32.9	0	0	0	112.6
596	T	27.3	Very low	30.2	Very low	118 Å²	118	140.4 Å²	140.4	72%	0.724	75%	0.745	S	S	*	*			cis	-160.6	-176.9	23.6	-9.2	0	0	0	0	107.5
597	L	26.7	Very low	29.8	Very low	159 Å²	159	141.9 Å²	141.9	83%	0.832	75%	0.752	S	S	*	*			cis	-155.5	-175.2	16.9	-134.5	163.4	0	0	0	109.4
598	R	25.4	Very low	29.9	Very low	180 Å²	180	145.9 Å²	145.9	68%	0.679	76%	0.759	S	S	*	*			trans	-150	161.4	172.6	-141.7	-165.5	-159.8	-164.2	4.7	109.3	H600	R598-H600 PolarHBondContact NH1-CE1 3.07Å; R598-H600 PolarHBondContact NH1-NE2 3.15Å
599	P	43.8	Very low	29.9	Very low	126 Å²	126	144.8 Å²	144.8	82%	0.818	76%	0.761	S	S	*	*			trans	-123	178.7	137.2	-2.4	23.9	0	0	0	113.7
600	H	26.7	Very low	29.9	Very low	130 Å²	130	142.8 Å²	142.8	60%	0.602	76%	0.763	S	S	*	*			trans	-129.8	162.7	-172.2	-89.2	-126.4	0	0	0	112.2	R598	R598-H600 PolarHBondContact NH1-CE1 3.07Å; R598-H600 PolarHBondContact NH1-NE2 3.15Å
601	Q	28.6	Very low	30.1	Very low	189 Å²	189	141.9 Å²	141.9	88%	0.883	77%	0.766	S	S	*	*			trans	-153.2	169.8	143	-116	173.1	-3	0	0	110.5
602	D	27.8	Very low	30	Very low	128 Å²	128	143.6 Å²	143.6	68%	0.684	77%	0.772	S	S	*	*			trans	-115.9	136.5	-141.3	-63.4	-75.5	0	0	0	117.8
603	V	29.3	Very low	30.4	Very low	116 Å²	116	141.4 Å²	141.4	70%	0.703	77%	0.772	S	S	*	*				56.3	125.2	121.3	-177.7	0	0	0	0	122.1
604	L	27.5	Very low	29.8	Very low	151 Å²	151	142.9 Å²	142.9	79%	0.791	78%	0.779	S	S	*	*				-165.8	98.1	128	-108.8	171.1	0	0	0	115.7
605	Q	30.6	Very low	29.8	Very low	171 Å²	171	147 Å²	147	80%	0.799	79%	0.787	S	S	*	*			trans	49.4	139	144.7	-66.2	177.1	16.2	0	0	125.3
606	D	32	Very low	29.8	Very low	158 Å²	158	145.5 Å²	145.5	85%	0.845	79%	0.792	S	S	*	*			trans	-84.8	160.6	173	-49.8	-102.1	0	0	0	115.8
607	V	30.5	Very low	29.8	Very low	152 Å²	152	145.1 Å²	145.1	92%	0.921	79%	0.794	S	S	*	*			trans	-144.2	144	131.6	-172.9	0	0	0	0	109.6
608	K	29	Very low	30	Very low	200 Å²	200	142.9 Å²	142.9	87%	0.87	79%	0.792	S	S	*	*			trans	-125.1	140.7	-177.8	-179.1	175.4	179.4	175.8	0	112.8
609	G	29.4	Very low	30.3	Very low	58 Å²	58	143.2 Å²	143.2	60%	0.598	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-100.1	170.7	176.5	0	0	0	0	0	115.4
610	P	32.7	Very low	29.6	Very low	130 Å²	130	140.2 Å²	140.2	84%	0.844	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-85	165.1	-164	-12.4	31.3	0	0	0	116.4
611	P	33.7	Very low	30.7	Very low	128 Å²	128	139.9 Å²	139.9	83%	0.831	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-92.1	173.1	-174.2	38	-37	0	0	0	115.2
612	M	26.9	Very low	31.3	Very low	172 Å²	172	136.3 Å²	136.3	85%	0.847	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-69.8	154.1	177.3	-57.9	-157	-49.7	0	0	114
613	P	34.5	Very low	31.3	Very low	121 Å²	121	138.2 Å²	138.2	79%	0.786	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-81.8	146.3	168	33.9	-34	0	0	0	112.7
614	T	30.6	Very low	31.4	Very low	139 Å²	139	140.7 Å²	140.7	85%	0.853	82%	0.816	S	S	*	*			trans	-116.9	140.3	168.8	-53.1	0	0	0	0	108.8
615	Y	26.5	Very low	31.8	Very low	230 Å²	230	138.5 Å²	138.5	90%	0.902	81%	0.811	S	S	*	*			trans	-78.9	144.4	-176.3	-79.5	-84.6	0	0	0	114.3
616	A	26.3	Very low	31.5	Very low	100 Å²	100	139.9 Å²	139.9	83%	0.826	81%	0.814	S	S	*	*			trans	-149.8	152.3	155.2	0	0	0	0	0	108.5
617	S	28	Very low	31.4	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	81%	0.813	S	S	*	*			trans	-115	154.6	-160.2	-65.5	0	0	0	0	116.1
618	S	31.1	Very low	31.9	Very low	113 Å²	113	139.4 Å²	139.4	79%	0.79	81%	0.808	S	S	*	*			trans	61.4	120.3	157.3	62.9	0	0	0	0	120.7
619	L	31.5	Very low	32	Very low	186 Å²	186	136.8 Å²	136.8	97%	0.974	80%	0.803	S	S	*	*				-162.6	162.9	118.6	-104.1	166.7	0	0	0	110.9
620	G	29.3	Very low	31.9	Very low	63 Å²	63	142.5 Å²	142.5	65%	0.649	81%	0.811	S	S	*	*			trans	-94.8	176.8	-169.5	0	0	0	0	0	116.6
621	P	48.7	Very low	32	Very low	124 Å²	124	142.6 Å²	142.6	81%	0.805	80%	0.801	S	S	*	*			trans	-95.1	173.5	-164.8	40.7	-39.2	0	0	0	114.2
622	P	40.4	Very low	32	Very low	114 Å²	114	145.1 Å²	145.1	74%	0.74	80%	0.801	S	S	*	*				-151.2	150.3	97.4	38	-20.4	0	0	0	118.5
623	L	27.7	Very low	32.1	Very low	168 Å²	168	140.3 Å²	140.3	88%	0.88	80%	0.795	S	S	*	*			trans	60.2	142.3	139.6	-62	171	0	0	0	124.1
624	M	31.8	Very low	31.9	Very low	168 Å²	168	143.5 Å²	143.5	83%	0.828	80%	0.8	S	S	*	*			trans	-82.3	169.4	167.1	-50.4	-88.7	85.9	0	0	111
625	P	36.6	Very low	31.8	Very low	104 Å²	104	142.7 Å²	142.7	68%	0.675	80%	0.795	S	S	*	*				-157.9	174.2	88.6	35.3	-12.3	0	0	0	119.5
626	F	23.8	Very low	32	Very low	200 Å²	200	136.9 Å²	136.9	88%	0.877	78%	0.783	S	S	*	*			trans	99.2	115.7	154	-68.7	-63.1	0	0	0	124.1
627	H	30.6	Very low	32	Very low	177 Å²	177	143.1 Å²	143.1	82%	0.819	79%	0.787	S	S	*	*			trans	-82.5	162.6	157.5	-88	-79.3	0	0	0	112
628	P	41.3	Very low	32	Very low	124 Å²	124	141.2 Å²	141.2	81%	0.805	79%	0.785	S	S	*	*				-148.3	178.9	95.8	36.9	-19.7	0	0	0	114.6
629	N	29.8	Very low	32.8	Very low	144 Å²	144	142 Å²	142	77%	0.77	79%	0.787	S	S	*	*			cis	-179.9	144.2	-37.9	-178.2	12	0	0	0	108.6
630	K	28.8	Very low	32.9	Very low	178 Å²	178	140.3 Å²	140.3	77%	0.774	78%	0.779	S	S	*	*			trans	151.4	143.3	156.8	-90.4	173.2	179.1	-176.9	0	111.5
631	Q	34.3	Very low	33.7	Very low	133 Å²	133	143 Å²	143	62%	0.621	79%	0.786	S	S	*	*			cis	-166.2	144.5	-14.3	-128.9	171.7	-6.2	0	0	111.1
632	Q	32.9	Very low	32.6	Very low	181 Å²	181	141.2 Å²	141.2	85%	0.846	78%	0.781	S	S	*	*			trans	63.6	144.8	157.5	-65.3	158.9	-16.3	0	0	120
633	G	29.1	Very low	32	Very low	70 Å²	70	142.2 Å²	142.2	72%	0.722	79%	0.785	S	S	*	*			cis	171.9	156.7	-11.5	0	0	0	0	0	115.2
634	Q	30.4	Very low	32	Very low	189 Å²	189	139.7 Å²	139.7	88%	0.883	78%	0.781	S	S	*	*			trans	64.1	116.4	166.9	-67.2	177.5	-37.9	0	0	118.7
635	T	29.9	Very low	31.8	Very low	122 Å²	122	139.8 Å²	139.8	75%	0.748	78%	0.777	S	S	*	*				67.7	131.9	69.2	65.3	0	0	0	0	114.9
636	T	29.1	Very low	31.4	Very low	107 Å²	107	142.9 Å²	142.9	66%	0.656	78%	0.783	S	S	*	*				178.4	146.6	75.7	-72.9	0	0	0	0	114.5
637	Y	28	Very low	31.5	Very low	232 Å²	232	138.2 Å²	138.2	91%	0.91	77%	0.771	S	S	*	*			trans	60.1	149.2	162.3	-68.3	-46.1	0	0	0	124.8
638	G	26.4	Very low	31.5	Very low	69 Å²	69	137.1 Å²	137.1	71%	0.711	77%	0.766	S	S	*	*			trans	-103.2	-145.1	164.9	0	0	0	0	0	112.2
639	P	48.3	Very low	31	Very low	129 Å²	129	139.1 Å²	139.1	84%	0.838	76%	0.764	S	S	*	*			cis	-136.6	-170.3	17.5	43.7	-25.5	0	0	0	116
640	D	34.6	Very low	30.8	Very low	150 Å²	150	138.1 Å²	138.1	80%	0.802	76%	0.764	S	S	*	*			trans	-68.2	164.4	166.1	-47.2	-84.1	0	0	0	113
641	P	44.3	Very low	31.3	Very low	121 Å²	121	138.1 Å²	138.1	79%	0.786	77%	0.766	S	S	*	*				-156.2	160.6	88.3	41.3	-22.3	0	0	0	119
642	A	27.3	Very low	31.1	Very low	85 Å²	85	139.2 Å²	139.2	70%	0.702	77%	0.774	S	S	*	*			trans	61.3	125.7	136.9	0	0	0	0	0	124.1
643	T	26.8	Very low	30.8	Very low	135 Å²	135	137.5 Å²	137.5	83%	0.828	77%	0.771	S	S	*	*			trans	49.3	125.9	136.2	62.1	0	0	0	0	121.7
644	S	28.7	Very low	31.1	Very low	115 Å²	115	140.5 Å²	140.5	80%	0.804	78%	0.775	S	S	*	*				-178.9	160.3	99.3	-166	0	0	0	0	114
645	K	27.6	Very low	31.7	Very low	171 Å²	171	137.4 Å²	137.4	74%	0.743	77%	0.771	S	S	*	*			trans	-62	170.9	-175.4	-53.4	164.2	175.7	178	0	116.2
646	Q	28.5	Very low	31.8	Very low	168 Å²	168	137.2 Å²	137.2	79%	0.785	77%	0.766	S	S	*	*			trans	70.6	155.1	147.7	-79.7	170.6	-44.2	0	0	117.9
647	T	24.4	Very low	31.7	Very low	103 Å²	103	137.3 Å²	137.3	63%	0.632	77%	0.771	S	S	*	*			cis	-176.1	155.2	-43.4	26.1	0	0	0	0	107.6
648	H	30.7	Very low	31.7	Very low	153 Å²	153	134.4 Å²	134.4	71%	0.708	76%	0.763	S	S	*	*			trans	65.4	120.7	159.8	-63.8	-58	0	0	0	120.9
649	Q	31.2	Very low	32	Very low	166 Å²	166	140.4 Å²	140.4	78%	0.776	76%	0.764	S	S	*	*			trans	68.9	159.5	135	-59.9	172.9	3.9	0	0	116.8
650	T	26	Very low	31.2	Very low	124 Å²	124	141 Å²	141	76%	0.761	76%	0.755	S	S	*	*			cis	-144.1	169	12.2	-28.9	0	0	0	0	111
651	H	39.8	Very low	31	Very low	178 Å²	178	138.9 Å²	138.9	82%	0.824	75%	0.752	S	S	*	*			trans	-60	155.6	168.7	-67.7	-103.6	0	0	0	113.3
652	I	29.9	Very low	30.4	Very low	155 Å²	155	137 Å²	137	80%	0.795	75%	0.747	S	S	*	*			trans	-162.5	134.8	140.5	-107.2	153.7	0	0	0	113.4
653	N	25.1	Very low	30.5	Very low	146 Å²	146	141 Å²	141	78%	0.781	76%	0.755	S	S	*	*			trans	41.2	138	155.8	-58.6	-16.5	0	0	0	125.2
654	V	36.8	Very low	30.7	Very low	133 Å²	133	139 Å²	139	81%	0.806	75%	0.746	S	S	*	*			trans	-90.9	149.8	158.9	178.7	0	0	0	0	110.1
655	P	42.6	Very low	31	Very low	123 Å²	123	138 Å²	138	80%	0.799	74%	0.739	S	S	*	*			trans	-146.9	96.3	136.4	33.7	-15	0	0	0	116.9
656	N	32.5	Very low	31.2	Very low	119 Å²	119	138.1 Å²	138.1	64%	0.636	74%	0.74	S	S	*	*				31.1	124.5	126.9	-164.7	-3.1	0	0	0	122.5
657	S	26.3	Very low	31.4	Very low	109 Å²	109	135.7 Å²	135.7	76%	0.762	73%	0.728	S	S	*	*			trans	-153.1	131.1	138.1	-79.6	0	0	0	0	108.5
658	K	28.7	Very low	31.5	Very low	171 Å²	171	137.3 Å²	137.3	74%	0.743	73%	0.729	S	S	*	*				62.3	135.7	67.4	-68.3	-178.3	179.2	172.8	0	111.9
659	R	31.5	Very low	31.5	Very low	195 Å²	195	136.1 Å²	136.1	74%	0.736	72%	0.723	S	S	*	*			cis	-169.9	164.3	35.9	-147.5	168.1	179.5	-132.8	19.1	113.2
660	H	31.1	Very low	31.3	Very low	141 Å²	141	136.1 Å²	136.1	65%	0.653	72%	0.723	S	S	*	*			trans	73.8	148.6	165.9	-55.8	-60.7	0	0	0	117.5
661	S	30.8	Very low	31.4	Very low	106 Å²	106	134.6 Å²	134.6	74%	0.741	72%	0.723	S	S	*	*			cis	-176.1	168.7	-13.9	-91.8	0	0	0	0	108
662	A	31.2	Very low	31	Very low	80 Å²	80	134.4 Å²	134.4	66%	0.661	72%	0.723	S	S	*	*			cis	-177.1	-178.3	-26.9	0	0	0	0	0	109.2
663	I	30.2	Very low	31.7	Very low	171 Å²	171	132.6 Å²	132.6	88%	0.877	72%	0.721	S	S	*	*			trans	76.8	133.8	163.5	-58.3	171.9	0	0	0	117.2
664	S	30.4	Very low	31.8	Very low	91 Å²	91	131.9 Å²	131.9	64%	0.636	72%	0.717	S	S	*	*			cis	-172.7	152.3	-17.6	176.6	0	0	0	0	113.1
665	S	34.5	Very low	31.3	Very low	96 Å²	96	133.1 Å²	133.1	67%	0.671	72%	0.718	S	S	*	*			trans	63.4	151.3	149	43.5	0	0	0	0	120.1
666	K	32.7	Very low	30.5	Very low	172 Å²	172	134.8 Å²	134.8	75%	0.748	71%	0.713	S	S	*	*			cis	-173	175.9	-4	-99.2	175.4	154.6	-128.7	0	104.7
667	Q	32.3	Very low	30.3	Very low	117 Å²	117	138.1 Å²	138.1	55%	0.547	72%	0.722	S	S	.	*			cis	-176.4	172.6	-11	-100.5	-179.7	-52.7	0	0	105.6
668	E	26.3	Very low	30.2	Very low	138 Å²	138	137 Å²	137	65%	0.645	72%	0.719	S	S	*	*			cis	-168.9	-171.2	-20.5	-106.4	166.3	-156.3	0	0	105.9
669	H	30.7	Very low	30.2	Very low	128 Å²	128	134 Å²	134	59%	0.593	72%	0.72	S	S	*	*			cis	-162	165.8	9.5	-138.2	45.6	0	0	0	110.4
670	Q	28.3	Very low	30.3	Very low	165 Å²	165	132.1 Å²	132.1	77%	0.771	72%	0.724	S	S	*	*			trans	35.1	150.5	143	-70.9	178.9	4.3	0	0	123.9
671	A	26.6	Very low	31	Very low	92 Å²	92	130.7 Å²	130.7	76%	0.76	73%	0.728	S	S	*	*			cis	-165.5	174.8	-6.6	0	0	0	0	0	112.3
672	Q	32.9	Very low	31.1	Very low	174 Å²	174	131.7 Å²	131.7	81%	0.813	73%	0.732	S	S	*	*			trans	-107	179.7	172.6	-62.2	-175	-40.1	0	0	112.5
673	P	44.5	Very low	31	Very low	117 Å²	117	132.8 Å²	132.8	76%	0.76	73%	0.734	S	S	*	*				-151.9	143.9	92.2	38.1	-19.4	0	0	0	119.2
674	N	27.1	Very low	30.9	Very low	131 Å²	131	130.8 Å²	130.8	70%	0.701	73%	0.73	S	S	*	*			trans	43	140.3	137.8	-61.5	-5.1	0	0	0	125
675	I	26.2	Very low	30.8	Very low	160 Å²	160	137.2 Å²	137.2	82%	0.821	74%	0.74	S	S	*	*				-152.5	150.5	111.2	-100.4	158.1	0	0	0	111
676	F	25.7	Very low	31	Very low	157 Å²	157	138.9 Å²	138.9	69%	0.689	75%	0.747	S	S	*	*			trans	-44	166.2	-176.5	-61.6	-101.5	0	0	0	118.4
677	F	27.6	Very low	30.9	Very low	190 Å²	190	142.2 Å²	142.2	83%	0.833	76%	0.755	S	S	*	*			cis	-143.5	168.1	22.5	-96.8	-74	0	0	0	114.7
678	A	25.5	Very low	31.1	Very low	85 Å²	85	143.8 Å²	143.8	70%	0.702	77%	0.767	S	S	*	*			trans	-25.3	160.3	163.7	0	0	0	0	0	119.7
679	S	28.2	Very low	31.5	Very low	109 Å²	109	147.3 Å²	147.3	76%	0.762	78%	0.78	S	S	*	*			cis	159.2	131.1	-24	56.2	0	0	0	0	108.7
680	D	33	Very low	31.4	Very low	154 Å²	154	151.8 Å²	151.8	82%	0.824	79%	0.792	S	S	*	*			trans	-68.7	-176.9	170.9	-48	-82.2	0	0	0	112.5
681	P	46	Very low	31.7	Very low	112 Å²	112	148.8 Å²	148.8	73%	0.727	79%	0.789	S	S	*	*			cis	-136.9	-168.2	-2.8	44.1	-27.2	0	0	0	114.1
682	P	33.3	Very low	31.9	Very low	127 Å²	127	153.9 Å²	153.9	83%	0.825	79%	0.794	S	S	*	*			trans	-113.4	158.7	151.6	37.3	-29	0	0	0	112.7
683	S	28.9	Very low	32.1	Very low	102 Å²	102	152.9 Å²	152.9	71%	0.713	79%	0.793	S	S	*	*			trans	-148	160.4	174.9	66.9	0	0	0	0	113.7
684	T	28.4	Very low	31.3	Very low	129 Å²	129	152.9 Å²	152.9	79%	0.791	80%	0.796	S	S	*	*			trans	84.5	143	168.6	76.8	0	0	0	0	120.3
685	R	28.6	Very low	32.1	Very low	226 Å²	226	151.7 Å²	151.7	85%	0.853	80%	0.795	S	S	*	*			trans	72.5	86.6	156.1	-76.2	-178.5	165.4	175.8	-4.4	121.2
686	T	38	Very low	32.7	Very low	131 Å²	131	149.8 Å²	149.8	80%	0.804	80%	0.796	S	S	*	*				42.3	107.7	114.8	58	0	0	0	0	118.8
687	R	30.8	Very low	33.1	Very low	243 Å²	243	147.1 Å²	147.1	92%	0.917	80%	0.797	S	S	*	*			trans	-154	144	141.6	-155.9	166.6	-175.8	167.4	0.1	111
688	D	37.5	Very low	33.9	Very low	150 Å²	150	143.7 Å²	143.7	80%	0.802	80%	0.797	S	S	*	*			trans	-64.7	152.7	-179.2	-44.7	-99.6	0	0	0	112.7
689	K	32.9	Very low	35.1	Very low	211 Å²	211	144.5 Å²	144.5	92%	0.917	79%	0.793	S	S	*	*			trans	-146.9	128.7	149.4	-113.7	166.2	-175.8	179.8	0	110.3
690	R	30.5	Very low	36	Very low	222 Å²	222	145.3 Å²	145.3	84%	0.838	79%	0.793	S	S	*	*			trans	-71.5	154.2	-176.6	-72.2	175.7	172.2	153.3	-4.6	111.4
691	S	34.1	Very low	37.2	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	77%	0.77	S	S	*	*			trans	-55.7	144.2	160.9	42	0	0	0	0	111.4
692	F	29.2	Very low	38.8	Very low	199 Å²	199	139.1 Å²	139.1	87%	0.873	76%	0.758	S	S	*	*			trans	-127	127.9	156.6	-80.5	-82.7	0	0	0	107.7
693	I	37.4	Very low	41	Very low	153 Å²	153	134.8 Å²	134.8	79%	0.785	74%	0.736	S	S	*	*			trans	-99.2	134	178	-63.5	168.3	0	0	0	106.9
694	S	28.4	Very low	43.8	Very low	117 Å²	117	133.9 Å²	133.9	82%	0.818	72%	0.721	S	S	*	*			trans	-99.3	122.6	166.9	-62	0	0	0	0	108.8
695	P	44.2	Very low	46.5	Very low	107 Å²	107	132.2 Å²	132.2	70%	0.695	70%	0.704	S	S	*	*			trans	-83.6	176.2	-178.5	34.4	-35.9	0	0	0	112.9
696	S	38.3	Very low	49.3	Very low	120 Å²	120	129 Å²	129	84%	0.839	69%	0.692	S	S	*	*			trans	57	83.9	169.9	55.9	0	0	0	0	117.1
697	S	34.6	Very low	51.9	Low	101 Å²	101	123.7 Å²	123.7	71%	0.706	66%	0.658	S	S	*	*			trans	-106	127.6	132.2	176.6	0	0	0	0	107.2	V699	S697-V699 PolarHBondContact O-N 3.18Å
698	S	43.4	Very low	54.7	Low	118 Å²	118	114.6 Å²	114.6	83%	0.825	63%	0.627	S	S	*	*			trans	-78.8	70.9	175.1	53	0	0	0	0	110	V700	S698-V700 PolarHBondContact O-N 3.01Å
699	V	50.6	Low	57.3	Low	102 Å²	102	112.4 Å²	112.4	62%	0.618	61%	0.612	S	S	*	*			trans	-61.6	118.6	-179.4	179.9	0	0	0	0	109.6	S697 V701	S697-V699 PolarHBondContact O-N 3.18Å; V699-V701 WeakPolarHBondContact O-CG2 3.33Å; V699-V701 PolarHBondContact O-N 2.91Å
700	V	47.4	Very low	59.9	Low	126 Å²	126	103.8 Å²	103.8	76%	0.764	58%	0.583	S	S	*	*			trans	-64.1	107.3	174.3	178.6	0	0	0	0	108.7	S698 T702	S698-V700 PolarHBondContact O-N 3.01Å; V700-T702 PolarHBondContact O-N 2.96Å
701	V	58.1	Low	62.8	Low	58 Å²	58	94.8 Å²	94.8	35%	0.352	55%	0.551	S	S	.	*			trans	-75.8	99.4	-170	-162.7	0	0	0	0	110.6	V699 Q705 R706	V699-V701 WeakPolarHBondContact O-CG2 3.33Å; V699-V701 PolarHBondContact O-N 2.91Å; V701-Q705 HydrophobicContact CG1-CB 3.8Å; V701-Q705 HydrophobicContact CG1-CG 3.66Å; V701-R706 HydrophobicContact CB-CG 4.5Å; V701-R706 HydrophobicContact CG1-CB 4.39Å; V701-R706 HydrophobicContact CG1-CG 3.78Å; V701-R706 PolarHBondContact O-NE 3.5Å; V701-R706 VanDerWaalsContact O-NE 3.15Å; V701-R706 PolarHBondContact O-NH2 3.37Å
702	T	80.4	Confident	65.5	Low	78 Å²	78	97.2 Å²	97.2	48%	0.479	55%	0.551	S	S	.	*			trans	-57.6	161.5	177	67.6	0	0	0	0	111.7	V700 E704 Q705 R706	V700-T702 PolarHBondContact O-N 2.96Å; T702-E704 VanDerWaalsContact C-N 3.26Å; T702-E704 PolarHBondContact O-N 3.2Å; T702-Q705 PolarHBondContact O-N 3.18Å; T702-Q705 WeakPolarHBondContact OG1-CB 3.47Å; T702-Q705 PolarHBondContact OG1-N 3.33Å; T702-R706 PolarHBondContact O-N 3.35Å
703	G	80	Confident	68.4	Low	35 Å²	35	91.5 Å²	91.5	36%	0.361	53%	0.533	S	S	.	.	H	α-helix	trans	-58	-41	174.4	0	0	0	0	0	112.2	R706 F707 L744	G703-R706 PolarHBondContact O-N 3.43Å; G703-F707 WeakPolarHBondContact O-CB 3.28Å; G703-F707 PolarHBondContact O-N 3.41Å; G703-L744 VanDerWaalsContact C-CD1 3.43Å; G703-L744 VanDerWaalsContact O-CD1 3.26Å; G703-L744 WeakPolarHBondContact O-CD1 3.35Å
704	E	86.1	Confident	70.9	Confident	83 Å²	83	90.5 Å²	90.5	39%	0.388	54%	0.536	S	S	.	.	H	α-helix	trans	-57.6	-48.6	172.3	162.4	163.1	-147.4	0	0	112.4	T702 F707 L708 F747	T702-E704 VanDerWaalsContact C-N 3.26Å; T702-E704 PolarHBondContact O-N 3.2Å; E704-F707 PolarHBondContact O-N 3.48Å; E704-L708 HydrophobicContact CG-CD1 4.21Å; E704-L708 WeakPolarHBondContact O-CG 3.44Å; E704-L708 PolarHBondContact O-N 2.7Å; E704-F747 HydrophobicContact CB-CE2 4.39Å; E704-F747 HydrophobicContact CG-CE2 3.83Å; E704-F747 HydrophobicContact CG-CZ 3.9Å; E704-F747 WeakPolarHBondContact OE1-CZ 2.99Å
705	Q	85.9	Confident	74	Confident	95 Å²	95	86.9 Å²	86.9	44%	0.444	51%	0.506	S	S	.	.	H	α-helix	trans	-65.4	-42.2	179.7	-175	63.9	18.2	0	0	111.6	V701 T702 F707 L708 E709	V701-Q705 HydrophobicContact CG1-CB 3.8Å; V701-Q705 HydrophobicContact CG1-CG 3.66Å; T702-Q705 PolarHBondContact O-N 3.18Å; T702-Q705 WeakPolarHBondContact OG1-CB 3.47Å; T702-Q705 PolarHBondContact OG1-N 3.33Å; Q705-F707 VanDerWaalsContact C-N 3.33Å; Q705-F707 PolarHBondContact O-N 2.83Å; Q705-L708 PolarHBondContact O-N 3.49Å; Q705-E709 WeakPolarHBondContact O-CB 3.4Å; Q705-E709 PolarHBondContact O-N 3.44Å
706	R	87.2	Confident	76.3	Confident	157 Å²	157	88.2 Å²	88.2	59%	0.592	50%	0.503	S	S	*	.	H	α-helix	trans	-63.2	-35.6	173.9	-103.1	176.4	-71.3	160.9	-5.5	112.9	V701 T702 G703 G710	V701-R706 HydrophobicContact CB-CG 4.5Å; V701-R706 HydrophobicContact CG1-CB 4.39Å; V701-R706 HydrophobicContact CG1-CG 3.78Å; V701-R706 PolarHBondContact O-NE 3.5Å; V701-R706 VanDerWaalsContact O-NE 3.15Å; V701-R706 PolarHBondContact O-NH2 3.37Å; T702-R706 PolarHBondContact O-N 3.35Å; G703-R706 PolarHBondContact O-N 3.43Å; R706-G710 PolarHBondContact O-N 3.24Å
707	F	91.9	Very high	78.9	Confident	21 Å²	21	83.9 Å²	83.9	9%	0.092	47%	0.47	C	S	.	.	H	α-helix	trans	-66.2	-48	173.7	169	-93.6	0	0	0	111.1	G703 E704 Q705 E709 G710 L711 H742 L744 F747 K784	G703-F707 WeakPolarHBondContact O-CB 3.28Å; G703-F707 PolarHBondContact O-N 3.41Å; E704-F707 PolarHBondContact O-N 3.48Å; Q705-F707 VanDerWaalsContact C-N 3.33Å; Q705-F707 PolarHBondContact O-N 2.83Å; F707-E709 VanDerWaalsContact C-N 3.33Å; F707-E709 PolarHBondContact O-N 2.85Å; F707-G710 CarbonylContact O-C 3.57Å; F707-G710 WeakPolarHBondContact O-CA 3.41Å; F707-G710 PolarHBondContact O-N 3.27Å; F707-G710 VanDerWaalsContact O-N 3.12Å; F707-L711 HydrophobicContact CD1-CD1 4.5Å; F707-L711 HydrophobicContact CD1-CG 4.43Å; F707-L711 HydrophobicContact CD2-CD2 4.42Å; F707-L711 HydrophobicContact CE1-CD1 3.74Å; F707-L711 HydrophobicContact CE1-CD2 4.27Å; F707-L711 HydrophobicContact CE1-CG 4.05Å; F707-L711 HydrophobicContact CE2-CD2 3.89Å; F707-L711 HydrophobicContact CZ-CD1 3.87Å; F707-L711 HydrophobicContact CZ-CD2 3.81Å; F707-L711 HydrophobicContact CZ-CG 4.09Å; F707-L711 WeakPolarHBondContact O-CG 3.36Å; F707-L711 PolarHBondContact O-N 2.78Å; F707-H742 WeakPolarHBondContact CD2-O 3.03Å; F707-H742 WeakPolarHBondContact CE2-O 3.46Å; F707-L744 HydrophobicContact CB-CD1 4Å; F707-F747 AromaticContact CD1-CD2 3.28Å; F707-F747 HydrophobicContact CD1-CD2 3.28Å; F707-F747 AromaticContact CD1-CE2 3.59Å; F707-F747 HydrophobicContact CD1-CE2 3.59Å; F707-F747 HydrophobicContact CD1-CG 4.21Å; F707-F747 HydrophobicContact CE1-CB 3.87Å; F707-F747 AromaticContact CE1-CD2 3.24Å; F707-F747 HydrophobicContact CE1-CD2 3.24Å; F707-F747 AromaticContact CE1-CE2 3.92Å; F707-F747 HydrophobicContact CE1-CE2 3.92Å; F707-F747 AromaticContact CE1-CG 3.71Å; F707-F747 HydrophobicContact CE1-CG 3.71Å; F707-F747 HydrophobicContact CG-CD2 4.29Å; F707-F747 HydrophobicContact CZ-CB 4.2Å; F707-F747 HydrophobicContact CZ-CD2 4.23Å; F707-K784 HydrophobicContact CE1-CG 4.19Å
708	L	90.9	Very high	81.7	Confident	52 Å²	52	85.2 Å²	85.2	27%	0.272	46%	0.463	S	S	.	.	H	α-helix	trans	-64.4	-35.4	178.3	-67.7	174.5	0	0	0	112.8	E704 Q705 L711 F747	E704-L708 HydrophobicContact CG-CD1 4.21Å; E704-L708 WeakPolarHBondContact O-CG 3.44Å; E704-L708 PolarHBondContact O-N 2.7Å; Q705-L708 PolarHBondContact O-N 3.49Å; L708-L711 PolarHBondContact O-N 3.31Å; L708-F747 HydrophobicContact CD1-CZ 4.07Å; L708-F747 HydrophobicContact CD2-CE1 4.4Å; L708-F747 HydrophobicContact CD2-CE2 4.05Å; L708-F747 HydrophobicContact CD2-CZ 3.85Å; L708-F747 HydrophobicContact CG-CE2 4.11Å; L708-F747 HydrophobicContact CG-CZ 4.07Å
709	E	90.9	Very high	84	Confident	104 Å²	104	81.8 Å²	81.8	49%	0.486	44%	0.435	S	S	.	.	H	α-helix	trans	-64.8	-45.2	168.7	-177.7	174.3	-152.5	0	0	111.5	Q705 F707 L711 Q712	Q705-E709 WeakPolarHBondContact O-CB 3.4Å; Q705-E709 PolarHBondContact O-N 3.44Å; F707-E709 VanDerWaalsContact C-N 3.33Å; F707-E709 PolarHBondContact O-N 2.85Å; E709-L711 PolarHBondContact O-N 3.05Å; E709-Q712 VanDerWaalsContact O-CB 3.25Å; E709-Q712 WeakPolarHBondContact O-CB 3.45Å; E709-Q712 PolarHBondContact O-N 3.13Å
710	G	88.6	Confident	85.9	Confident	29 Å²	29	80 Å²	80	30%	0.299	43%	0.425	S	S	.	.	H	α-helix	trans	-55.9	-33.7	173	0	0	0	0	0	113.4	R706 F707 Q712 T713 R751	R706-G710 PolarHBondContact O-N 3.24Å; F707-G710 CarbonylContact O-C 3.57Å; F707-G710 WeakPolarHBondContact O-CA 3.41Å; F707-G710 PolarHBondContact O-N 3.27Å; F707-G710 VanDerWaalsContact O-N 3.12Å; G710-Q712 VanDerWaalsContact C-N 3.26Å; G710-Q712 PolarHBondContact O-N 3.2Å; G710-T713 WeakPolarHBondContact O-CB 3.49Å; G710-T713 PolarHBondContact O-N 3.19Å; G710-T713 PolarHBondContact O-OG1 2.83Å; G710-R751 PolarHBondContact O-NH2 2.98Å
711	L	90.9	Very high	87.8	Confident	34 Å²	34	82 Å²	82	18%	0.178	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-19	174.7	-57	-159.3	0	0	0	113.7	F707 L708 E709 T713 K784 E785	F707-L711 HydrophobicContact CD1-CD1 4.5Å; F707-L711 HydrophobicContact CD1-CG 4.43Å; F707-L711 HydrophobicContact CD2-CD2 4.42Å; F707-L711 HydrophobicContact CE1-CD1 3.74Å; F707-L711 HydrophobicContact CE1-CD2 4.27Å; F707-L711 HydrophobicContact CE1-CG 4.05Å; F707-L711 HydrophobicContact CE2-CD2 3.89Å; F707-L711 HydrophobicContact CZ-CD1 3.87Å; F707-L711 HydrophobicContact CZ-CD2 3.81Å; F707-L711 HydrophobicContact CZ-CG 4.09Å; F707-L711 WeakPolarHBondContact O-CG 3.36Å; F707-L711 PolarHBondContact O-N 2.78Å; L708-L711 PolarHBondContact O-N 3.31Å; E709-L711 PolarHBondContact O-N 3.05Å; L711-T713 VanDerWaalsContact C-N 3.26Å; L711-K784 HydrophobicContact CD1-CB 3.55Å; L711-K784 HydrophobicContact CD1-CD 4.44Å; L711-K784 HydrophobicContact CD1-CG 3.84Å; L711-E785 WeakPolarHBondContact CD2-OE2 3.35Å
712	Q	91	Very high	89.2	Confident	152 Å²	152	85.3 Å²	85.3	71%	0.71	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-22.3	173	-54.8	180	42.3	0	0	111.8	E709 G710 P714	E709-Q712 VanDerWaalsContact O-CB 3.25Å; E709-Q712 WeakPolarHBondContact O-CB 3.45Å; E709-Q712 PolarHBondContact O-N 3.13Å; G710-Q712 VanDerWaalsContact C-N 3.26Å; G710-Q712 PolarHBondContact O-N 3.2Å; Q712-P714 WeakPolarHBondContact O-CD 3.26Å
713	T	91	Very high	89.5	Confident	79 Å²	79	87.1 Å²	87.1	49%	0.485	46%	0.456	S	S	.	.	S	Bend	trans	-67.8	122.8	170	70	0	0	0	0	108.9	G710 L711 F715 R751	G710-T713 WeakPolarHBondContact O-CB 3.49Å; G710-T713 PolarHBondContact O-N 3.19Å; G710-T713 PolarHBondContact O-OG1 2.83Å; L711-T713 VanDerWaalsContact C-N 3.26Å; T713-F715 PolarHBondContact O-N 3.15Å; T713-R751 PolarHBondContact O-NH1 3.45Å; T713-R751 PolarHBondContact O-NH2 3.4Å; T713-R751 PolarHBondContact OG1-NH2 3.48Å
714	P	89	Confident	89.9	Confident	132 Å²	132	86.7 Å²	86.7	86%	0.857	45%	0.452	S	S	*	.			trans	-71.3	107.3	-175.6	27.6	-33.9	0	0	0	110.3	Q712	Q712-P714 WeakPolarHBondContact O-CD 3.26Å
715	F	93.4	Very high	90.2	Very high	42 Å²	42	86.5 Å²	86.5	18%	0.184	45%	0.453	C	S	.	.			trans	-83.7	155.3	160.4	178.7	-119.1	0	0	0	109.5	T713 L717 R751 A754 L755 Y788	T713-F715 PolarHBondContact O-N 3.15Å; F715-L717 HydrophobicContact CE1-CB 4.42Å; F715-R751 HydrophobicContact CD1-CG 3.81Å; F715-R751 HydrophobicContact CE1-CG 4.43Å; F715-R751 HydrophobicContact CG-CG 4.35Å; F715-A754 HydrophobicContact CE1-CB 3.83Å; F715-L755 HydrophobicContact CD2-CD2 4.03Å; F715-L755 HydrophobicContact CE1-CD2 4.34Å; F715-L755 HydrophobicContact CE1-CG 4.28Å; F715-L755 HydrophobicContact CE2-CD2 3.54Å; F715-L755 HydrophobicContact CE2-CG 4.34Å; F715-L755 HydrophobicContact CZ-CD2 3.73Å; F715-L755 HydrophobicContact CZ-CG 4.08Å; F715-Y788 VanDerWaalsContact C-OH 3.28Å; F715-Y788 AromaticContact CD1-CE1 3.97Å; F715-Y788 HydrophobicContact CD1-CE1 3.97Å; F715-Y788 AromaticContact CD1-CE2 3.9Å; F715-Y788 HydrophobicContact CD1-CE2 3.9Å; F715-Y788 AromaticContact CD1-CZ 3.46Å; F715-Y788 VanDerWaalsContact CD1-CZ 3.46Å; F715-Y788 VanDerWaalsContact CD1-OH 3.28Å; F715-Y788 WeakPolarHBondContact CD1-OH 3.33Å; F715-Y788 HydrophobicContact CE1-CE1 4.02Å; F715-Y788 HydrophobicContact CE1-CE2 4.5Å; F715-Y788 AromaticContact CE1-CZ 3.98Å; F715-Y788 PolarHBondContact O-OH 3.07Å
716	Q	92.3	Very high	90.3	Very high	135 Å²	135	87.7 Å²	87.7	63%	0.631	47%	0.469	S	S	*	.			trans	-147.9	123.9	168.9	-176.7	177.3	48.7	0	0	106.5	K718	Q716-K718 PolarHBondContact O-N 3.01Å
717	L	93.1	Very high	90.6	Very high	29 Å²	29	87.2 Å²	87.2	15%	0.152	48%	0.478	C	S	.	.			trans	-60.6	116.5	177.1	175.8	59	0	0	0	109.4	F715 L719 A754 Q758 Y788 L792 L795	F715-L717 HydrophobicContact CE1-CB 4.42Å; L717-L719 HydrophobicContact CD1-CD1 4.5Å; L717-L719 HydrophobicContact CD1-CD2 3.86Å; L717-L719 HydrophobicContact CD1-CG 4.02Å; L717-L719 HydrophobicContact CD2-CD1 4.42Å; L717-L719 HydrophobicContact CG-CD1 4.43Å; L717-L719 HydrophobicContact CG-CG 4.15Å; L717-A754 HydrophobicContact CD1-CB 4.29Å; L717-Q758 HydrophobicContact CD1-CB 4Å; L717-Y788 HydrophobicContact CB-CD1 4.13Å; L717-Y788 HydrophobicContact CB-CE1 3.9Å; L717-L792 HydrophobicContact CD2-CD2 3.63Å; L717-L792 HydrophobicContact CD2-CG 4.12Å; L717-L795 HydrophobicContact CD2-CD1 4.29Å
718	K	93	Very high	90.7	Very high	129 Å²	129	89.2 Å²	89.2	56%	0.561	49%	0.49	S	S	*	.			trans	-116.2	112.6	178.5	-72.2	174.8	-174.4	177.9	0	109	Q716 Q758	Q716-K718 PolarHBondContact O-N 3.01Å; K718-Q758 WeakPolarHBondContact O-CG 3.09Å; K718-Q758 PolarHBondContact O-NE2 3.43Å; K718-Q758 PolarHBondContact O-OE1 3.39Å
719	L	92.8	Very high	90.9	Very high	45 Å²	45	96.9 Å²	96.9	24%	0.236	52%	0.515	C	S	.	.			trans	-115.8	116.7	174.7	-57.5	177.9	0	0	0	107.3	L717 V757 Q758 W761 L795 L797	L717-L719 HydrophobicContact CD1-CD1 4.5Å; L717-L719 HydrophobicContact CD1-CD2 3.86Å; L717-L719 HydrophobicContact CD1-CG 4.02Å; L717-L719 HydrophobicContact CD2-CD1 4.42Å; L717-L719 HydrophobicContact CG-CD1 4.43Å; L717-L719 HydrophobicContact CG-CG 4.15Å; L719-V757 HydrophobicContact CD2-CG1 4.49Å; L719-Q758 HydrophobicContact CD2-CB 4.34Å; L719-W761 HydrophobicContact CB-CD2 4.13Å; L719-W761 HydrophobicContact CB-CG 4.29Å; L719-W761 HydrophobicContact CB-CZ2 4.23Å; L719-W761 HydrophobicContact CD2-CB 3.71Å; L719-W761 HydrophobicContact CD2-CD2 3.85Å; L719-W761 HydrophobicContact CD2-CE3 4.35Å; L719-W761 HydrophobicContact CD2-CG 3.54Å; L719-W761 HydrophobicContact CG-CD2 4.4Å; L719-W761 HydrophobicContact CG-CG 4.45Å; L719-L795 HydrophobicContact CD1-CD1 3.81Å; L719-L797 HydrophobicContact CD1-CD1 3.43Å; L719-L797 VanDerWaalsContact CD1-CD1 3.43Å
720	T	90.6	Very high	91	Very high	66 Å²	66	94.4 Å²	94.4	41%	0.405	51%	0.513	S	S	.	.			trans	-78.9	139.3	-179.7	53.8	0	0	0	0	111.2	E722 W761	T720-E722 PolarHBondContact O-N 3.21Å; T720-W761 VanDerWaalsContact N-NE1 3.14Å; T720-W761 PolarHBondContact O-NE1 3.03Å
721	D	87.4	Confident	91.5	Very high	168 Å²	168	94.6 Å²	94.6	90%	0.898	51%	0.506	S	S	*	.			trans	-76.9	20.9	178.1	-157.5	30.4	0	0	0	113.1
722	E	87.4	Confident	91.7	Very high	126 Å²	126	97.8 Å²	97.8	59%	0.589	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-67.3	142	176.6	-65.1	-59.6	152	0	0	110.5	T720 G724 R766	T720-E722 PolarHBondContact O-N 3.21Å; E722-G724 PolarHBondContact O-N 2.99Å; E722-R766 VanDerWaalsContact O-CZ 3.27Å; E722-R766 PolarHBondContact O-NE 3.19Å; E722-R766 PolarHBondContact O-NH2 3.09Å
723	P	85.8	Confident	92	Very high	117 Å²	117	91 Å²	91	76%	0.76	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-63.5	127.1	176.8	26.6	-33.8	0	0	0	110.8
724	G	89.3	Confident	92.2	Very high	26 Å²	26	90.2 Å²	90.2	27%	0.268	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-69.9	161.4	175.3	0	0	0	0	0	113.3	E722 P726 G764	E722-G724 PolarHBondContact O-N 2.99Å; G724-P726 WeakPolarHBondContact O-CD 3.27Å; G724-G764 CarbonylContact C-O 3.34Å; G724-G764 WeakPolarHBondContact CA-O 3.45Å
725	N	91.1	Very high	92.5	Very high	78 Å²	78	83.9 Å²	83.9	42%	0.417	45%	0.448	S	S	.	.			trans	-81.5	112.3	172.4	176.5	-3.6	0	0	0	109.5	N727 L728 G764	N725-N727 PolarHBondContact O-N 2.77Å; N725-N727 WeakPolarHBondContact OD1-CB 3.23Å; N725-N727 PolarHBondContact OD1-N 3.13Å; N725-N727 VanDerWaalsContact OD1-N 3.07Å; N725-N727 PolarHBondContact OD1-ND2 2.78Å; N725-L728 HydrophobicContact CB-CD1 3.83Å; N725-L728 HydrophobicContact CB-CG 3.87Å; N725-L728 WeakPolarHBondContact O-CB 3.17Å; N725-L728 PolarHBondContact O-N 2.94Å; N725-L728 VanDerWaalsContact O-N 3.15Å; N725-G764 PolarHBondContact N-O 3.31Å
726	P	89	Confident	92.5	Very high	120 Å²	120	82.4 Å²	82.4	78%	0.779	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.9	-173.9	30.9	-37.1	0	0	0	113.7	G724 L728	G724-P726 WeakPolarHBondContact O-CD 3.27Å; P726-L728 VanDerWaalsContact C-N 3.31Å
727	N	92.6	Very high	92.6	Very high	147 Å²	147	80.8 Å²	80.8	79%	0.786	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-6.3	176.3	-56.5	-55.5	0	0	0	112.7	N725	N725-N727 PolarHBondContact O-N 2.77Å; N725-N727 WeakPolarHBondContact OD1-CB 3.23Å; N725-N727 PolarHBondContact OD1-N 3.13Å; N725-N727 VanDerWaalsContact OD1-N 3.07Å; N725-N727 PolarHBondContact OD1-ND2 2.78Å
728	L	93.8	Very high	92.8	Very high	64 Å²	64	81.6 Å²	81.6	34%	0.335	44%	0.444	S	S	.	.	S	Bend	trans	-78.2	138	176.8	-66.4	177.8	0	0	0	111.2	N725 P726 R763	N725-L728 HydrophobicContact CB-CD1 3.83Å; N725-L728 HydrophobicContact CB-CG 3.87Å; N725-L728 WeakPolarHBondContact O-CB 3.17Å; N725-L728 PolarHBondContact O-N 2.94Å; N725-L728 VanDerWaalsContact O-N 3.15Å; P726-L728 VanDerWaalsContact C-N 3.31Å; L728-R763 WeakPolarHBondContact CD1-O 3.36Å
729	R	95.2	Very high	92.9	Very high	212 Å²	212	75.5 Å²	75.5	80%	0.8	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-60.3	150.7	175.3	-80.4	170.2	48	-179.4	-7.2	111.9	H765	R729-H765 PolarHBondContact O-ND1 2.98Å
730	A	94.7	Very high	93	Very high	53 Å²	53	75.5 Å²	75.5	44%	0.438	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-54	139.1	162.5	0	0	0	0	0	111.1	H767	A730-H767 WeakPolarHBondContact CA-O 3.19Å; A730-H767 VanDerWaalsContact CB-ND1 3.28Å; A730-H767 WeakPolarHBondContact CB-ND1 3.26Å
731	I	97.4	Very high	93.2	Very high	32 Å²	32	76.9 Å²	76.9	16%	0.164	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124.2	172.2	-57.5	-61.6	0	0	0	108.1	I733 F760 H765 H767 I768 S769	I731-I733 HydrophobicContact CG2-CD1 4.44Å; I731-I733 HydrophobicContact CG2-CG1 3.81Å; I731-F760 HydrophobicContact CD1-CD1 4.18Å; I731-F760 HydrophobicContact CD1-CE1 4.2Å; I731-F760 HydrophobicContact CG1-CD1 4.05Å; I731-F760 HydrophobicContact CG1-CE1 4.49Å; I731-F760 HydrophobicContact CG1-CG 4.18Å; I731-F760 HydrophobicContact CG2-CD1 4.47Å; I731-F760 HydrophobicContact CG2-CD2 3.84Å; I731-F760 HydrophobicContact CG2-CE2 3.92Å; I731-F760 HydrophobicContact CG2-CG 4.14Å; I731-F760 HydrophobicContact CG2-CZ 4.29Å; I731-H765 HydrophobicContact CG1-CB 4.48Å; I731-H765 WeakPolarHBondContact CG1-ND1 3.45Å; I731-H767 PolarHBondContact N-O 3.05Å; I731-I768 HydrophobicContact CB-CG1 4.37Å; I731-I768 HydrophobicContact CB-CG2 4.47Å; I731-I768 CarbonylContact O-C 3.53Å; I731-I768 WeakPolarHBondContact O-CA 3.14Å; I731-S769 PolarHBondContact O-N 2.81Å
732	V	96.3	Very high	93.6	Very high	102 Å²	102	72.1 Å²	72.1	62%	0.618	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.4	166.7	-177	0	0	0	0	107	S769 L771	V732-S769 CarbonylContact C-O 3.58Å; V732-S769 WeakPolarHBondContact CA-O 3.38Å; V732-L771 HydrophobicContact CG1-CD1 3.79Å; V732-L771 HydrophobicContact CG1-CG 3.96Å
733	I	96.3	Very high	94	Very high	10 Å²	10	66.1 Å²	66.1	5%	0.051	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.9	-179.4	-53.4	179.3	0	0	0	108.1	I731 G735 V738 A756 V757 F760 I768 S769 A770 L771	I731-I733 HydrophobicContact CG2-CD1 4.44Å; I731-I733 HydrophobicContact CG2-CG1 3.81Å; I733-G735 PolarHBondContact O-N 2.65Å; I733-V738 HydrophobicContact CG2-CB 4.47Å; I733-V738 HydrophobicContact CG2-CG2 3.89Å; I733-A756 HydrophobicContact CD1-CB 4.16Å; I733-A756 HydrophobicContact CG2-CB 4.45Å; I733-V757 HydrophobicContact CD1-CG2 3.79Å; I733-F760 HydrophobicContact CD1-CD2 4.12Å; I733-F760 HydrophobicContact CD1-CE2 4.41Å; I733-I768 HydrophobicContact CD1-CG2 3.77Å; I733-I768 HydrophobicContact CG1-CG2 4.28Å; I733-S769 PolarHBondContact N-O 3.04Å; I733-A770 HydrophobicContact CB-CB 4.13Å; I733-A770 CarbonylContact O-C 3.56Å; I733-A770 WeakPolarHBondContact O-CA 3.17Å; I733-L771 PolarHBondContact O-N 2.92Å
734	D	95.6	Very high	94.2	Very high	61 Å²	61	64.9 Å²	64.9	33%	0.326	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	95.4	163.1	176.3	-10.9	0	0	0	108.6	S736 N737 V738	D734-S736 PolarHBondContact O-N 2.85Å; D734-S736 WeakPolarHBondContact OD1-CA 3.48Å; D734-S736 VanDerWaalsContact OD1-CB 3.25Å; D734-S736 WeakPolarHBondContact OD1-CB 3.34Å; D734-S736 PolarHBondContact OD1-N 2.86Å; D734-N737 PolarHBondContact OD1-N 3.36Å; D734-N737 WeakPolarHBondContact OD2-CB 3.36Å; D734-N737 PolarHBondContact OD2-ND2 3.45Å; D734-V738 VanDerWaalsContact O-CB 3.31Å; D734-V738 WeakPolarHBondContact O-CB 3.45Å; D734-V738 VanDerWaalsContact O-CG2 3.23Å; D734-V738 WeakPolarHBondContact O-CG2 3.31Å; D734-V738 PolarHBondContact O-N 2.9Å; D734-V738 VanDerWaalsContact O-N 3.11Å
735	G	95.4	Very high	94.3	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-72.6	-18.6	178.6	0	0	0	0	0	112.8	I733 A739 L771	I733-G735 PolarHBondContact O-N 2.65Å; G735-A739 WeakPolarHBondContact O-CB 3.49Å; G735-A739 PolarHBondContact O-N 2.81Å; G735-L771 WeakPolarHBondContact CA-O 3.44Å; G735-L771 PolarHBondContact N-O 2.92Å
736	S	93.1	Very high	94.2	Very high	11 Å²	11	67.9 Å²	67.9	8%	0.077	38%	0.378	C	S	.	.	H	α-helix	trans	-65.9	-58	173.7	-88.3	0	0	0	0	110.4	D734 M740 P773 D815	D734-S736 PolarHBondContact O-N 2.85Å; D734-S736 WeakPolarHBondContact OD1-CA 3.48Å; D734-S736 VanDerWaalsContact OD1-CB 3.25Å; D734-S736 WeakPolarHBondContact OD1-CB 3.34Å; D734-S736 PolarHBondContact OD1-N 2.86Å; S736-M740 VanDerWaalsContact O-CG 3.3Å; S736-M740 WeakPolarHBondContact O-CG 3.37Å; S736-M740 PolarHBondContact O-N 3.44Å; S736-P773 WeakPolarHBondContact OG-CD 3.35Å; S736-D815 WeakPolarHBondContact CB-OD2 3.42Å; S736-D815 PolarHBondContact OG-OD2 2.99Å
737	N	94.1	Very high	94.4	Very high	101 Å²	101	62.7 Å²	62.7	54%	0.54	34%	0.343	S	S	.	.	H	α-helix	trans	-77	-34.3	-176	-73.9	-45.6	0	0	0	113.1	D734 A739 M740 S741	D734-N737 PolarHBondContact OD1-N 3.36Å; D734-N737 WeakPolarHBondContact OD2-CB 3.36Å; D734-N737 PolarHBondContact OD2-ND2 3.45Å; N737-A739 PolarHBondContact O-N 2.89Å; N737-M740 PolarHBondContact O-N 2.92Å; N737-S741 WeakPolarHBondContact O-CB 3.44Å; N737-S741 PolarHBondContact O-N 3.5Å
738	V	97.3	Very high	94.6	Very high	46 Å²	46	55.8 Å²	55.8	28%	0.279	31%	0.306	S	S	.	.	H	α-helix	trans	-61.2	-45.2	174	167.7	0	0	0	0	111.6	I733 D734 H742 G752 A756	I733-V738 HydrophobicContact CG2-CB 4.47Å; I733-V738 HydrophobicContact CG2-CG2 3.89Å; D734-V738 VanDerWaalsContact O-CB 3.31Å; D734-V738 WeakPolarHBondContact O-CB 3.45Å; D734-V738 VanDerWaalsContact O-CG2 3.23Å; D734-V738 WeakPolarHBondContact O-CG2 3.31Å; D734-V738 PolarHBondContact O-N 2.9Å; D734-V738 VanDerWaalsContact O-N 3.11Å; V738-H742 WeakPolarHBondContact O-CB 3.37Å; V738-H742 PolarHBondContact O-N 2.91Å; V738-G752 WeakPolarHBondContact CG1-O 3.48Å; V738-A756 HydrophobicContact CG1-CB 4.02Å
739	A	96.1	Very high	94.7	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-69.9	-35.8	-179.8	0	0	0	0	0	113.3	G735 N737 G743 F748 S749 I753	G735-A739 WeakPolarHBondContact O-CB 3.49Å; G735-A739 PolarHBondContact O-N 2.81Å; N737-A739 PolarHBondContact O-N 2.89Å; A739-G743 PolarHBondContact O-N 3.29Å; A739-G743 VanDerWaalsContact O-N 3.08Å; A739-F748 HydrophobicContact CB-CD1 4.11Å; A739-F748 HydrophobicContact CB-CD2 3.48Å; A739-F748 VanDerWaalsContact CB-CD2 3.48Å; A739-F748 HydrophobicContact CB-CE1 3.93Å; A739-F748 HydrophobicContact CB-CE2 3.32Å; A739-F748 HydrophobicContact CB-CG 3.91Å; A739-F748 HydrophobicContact CB-CZ 3.56Å; A739-S749 WeakPolarHBondContact CA-O 3.38Å; A739-S749 WeakPolarHBondContact CB-O 3.46Å; A739-S749 PolarHBondContact O-N 3.34Å; A739-I753 HydrophobicContact CB-CD1 4.02Å; A739-I753 HydrophobicContact CB-CG1 3.84Å
740	M	95	Very high	94.8	Very high	45 Å²	45	42.6 Å²	42.6	22%	0.222	25%	0.252	C	S	.	.	H	α-helix	trans	-70.4	-42.7	174.6	-69.2	-58.1	-46.6	0	0	111.7	S736 N737 G743 L744 G745 F748 R776	S736-M740 VanDerWaalsContact O-CG 3.3Å; S736-M740 WeakPolarHBondContact O-CG 3.37Å; S736-M740 PolarHBondContact O-N 3.44Å; N737-M740 PolarHBondContact O-N 2.92Å; M740-G743 CarbonylContact O-C 3.54Å; M740-G743 PolarHBondContact O-N 2.94Å; M740-L744 PolarHBondContact O-N 2.85Å; M740-G745 WeakPolarHBondContact CE-O 3.26Å; M740-G745 PolarHBondContact O-N 3.03Å; M740-F748 HydrophobicContact CG-CD2 4.22Å; M740-F748 HydrophobicContact SD-CB 4.17Å; M740-F748 HydrophobicContact SD-CD2 3.9Å; M740-R776 PolarHBondContact SD-NH2 3.38Å
741	S	95.3	Very high	94.9	Very high	95 Å²	95	41.3 Å²	41.3	66%	0.664	24%	0.236	S	C	*	.	H	α-helix	trans	-63.3	-47.9	177.9	-179.6	0	0	0	0	111.7	N737 G743 L744	N737-S741 WeakPolarHBondContact O-CB 3.44Å; N737-S741 PolarHBondContact O-N 3.5Å; S741-G743 PolarHBondContact O-N 3.45Å; S741-L744 PolarHBondContact O-N 3.11Å
742	H	95.6	Very high	94.9	Very high	68 Å²	68	40 Å²	40	32%	0.315	23%	0.23	S	C	.	.	H	α-helix	trans	-63.7	-29.3	174.7	-171.3	-99.6	0	0	0	112.5	F707 V738 L744 S749	F707-H742 WeakPolarHBondContact CD2-O 3.03Å; F707-H742 WeakPolarHBondContact CE2-O 3.46Å; V738-H742 WeakPolarHBondContact O-CB 3.37Å; V738-H742 PolarHBondContact O-N 2.91Å; H742-L744 VanDerWaalsContact C-N 3.28Å; H742-L744 PolarHBondContact O-N 3.21Å; H742-S749 WeakPolarHBondContact ND1-CB 3.17Å; H742-S749 PolarHBondContact ND1-OG 3.08Å
743	G	94.4	Very high	94.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	15.9	172.6	0	0	0	0	0	115.4	A739 M740 S741 G745 H746 F747	A739-G743 PolarHBondContact O-N 3.29Å; A739-G743 VanDerWaalsContact O-N 3.08Å; M740-G743 CarbonylContact O-C 3.54Å; M740-G743 PolarHBondContact O-N 2.94Å; S741-G743 PolarHBondContact O-N 3.45Å; G743-G745 PolarHBondContact O-N 2.6Å; G743-G745 VanDerWaalsContact O-N 3.13Å; G743-H746 PolarHBondContact O-N 3.1Å; G743-H746 VanDerWaalsContact O-N 3.09Å; G743-F747 PolarHBondContact O-N 3.32Å
744	L	91.1	Very high	95	Very high	92 Å²	92	34.6 Å²	34.6	48%	0.482	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	22.2	179.9	-53.1	178.9	0	0	0	114.8	G703 F707 M740 S741 H742 H746	G703-L744 VanDerWaalsContact C-CD1 3.43Å; G703-L744 VanDerWaalsContact O-CD1 3.26Å; G703-L744 WeakPolarHBondContact O-CD1 3.35Å; F707-L744 HydrophobicContact CB-CD1 4Å; M740-L744 PolarHBondContact O-N 2.85Å; S741-L744 PolarHBondContact O-N 3.11Å; H742-L744 VanDerWaalsContact C-N 3.28Å; H742-L744 PolarHBondContact O-N 3.21Å; L744-H746 PolarHBondContact O-CD2 2.84Å; L744-H746 PolarHBondContact O-N 3.48Å
745	G	90.4	Very high	95.1	Very high	52 Å²	52	34.8 Å²	34.8	54%	0.536	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	-17.3	-172.9	0	0	0	0	0	114.9	M740 G743	M740-G745 WeakPolarHBondContact CE-O 3.26Å; M740-G745 PolarHBondContact O-N 3.03Å; G743-G745 PolarHBondContact O-N 2.6Å; G743-G745 VanDerWaalsContact O-N 3.13Å
746	H	89.1	Confident	95.2	Very high	114 Å²	114	35.8 Å²	35.8	53%	0.528	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-36.1	178.8	-64.5	-91.2	0	0	0	112.7	G743 L744	G743-H746 PolarHBondContact O-N 3.1Å; G743-H746 VanDerWaalsContact O-N 3.09Å; L744-H746 PolarHBondContact O-CD2 2.84Å; L744-H746 PolarHBondContact O-N 3.48Å
747	F	94.3	Very high	95.4	Very high	11 Å²	11	35.3 Å²	35.3	5%	0.048	20%	0.203	C	C	.	.	S	Bend	trans	-117.9	160.7	-176.4	-58.7	-65.5	0	0	0	112.6	E704 F707 L708 G743 R782 K784	E704-F747 HydrophobicContact CB-CE2 4.39Å; E704-F747 HydrophobicContact CG-CE2 3.83Å; E704-F747 HydrophobicContact CG-CZ 3.9Å; E704-F747 WeakPolarHBondContact OE1-CZ 2.99Å; F707-F747 AromaticContact CD1-CD2 3.28Å; F707-F747 HydrophobicContact CD1-CD2 3.28Å; F707-F747 AromaticContact CD1-CE2 3.59Å; F707-F747 HydrophobicContact CD1-CE2 3.59Å; F707-F747 HydrophobicContact CD1-CG 4.21Å; F707-F747 HydrophobicContact CE1-CB 3.87Å; F707-F747 AromaticContact CE1-CD2 3.24Å; F707-F747 HydrophobicContact CE1-CD2 3.24Å; F707-F747 AromaticContact CE1-CE2 3.92Å; F707-F747 HydrophobicContact CE1-CE2 3.92Å; F707-F747 AromaticContact CE1-CG 3.71Å; F707-F747 HydrophobicContact CE1-CG 3.71Å; F707-F747 HydrophobicContact CG-CD2 4.29Å; F707-F747 HydrophobicContact CZ-CB 4.2Å; F707-F747 HydrophobicContact CZ-CD2 4.23Å; L708-F747 HydrophobicContact CD1-CZ 4.07Å; L708-F747 HydrophobicContact CD2-CE1 4.4Å; L708-F747 HydrophobicContact CD2-CE2 4.05Å; L708-F747 HydrophobicContact CD2-CZ 3.85Å; L708-F747 HydrophobicContact CG-CE2 4.11Å; L708-F747 HydrophobicContact CG-CZ 4.07Å; G743-F747 PolarHBondContact O-N 3.32Å; F747-R782 WeakPolarHBondContact CA-O 3.26Å; F747-R782 WeakPolarHBondContact CB-O 3.12Å; F747-R782 HydrophobicContact CD1-CB 4.22Å; F747-K784 HydrophobicContact CB-CG 4.26Å; F747-K784 HydrophobicContact CD1-CD 4.46Å; F747-K784 VanDerWaalsContact CD1-CE 3.41Å; F747-K784 HydrophobicContact CD1-CG 4.25Å; F747-K784 VanDerWaalsContact CE1-CE 3.46Å; F747-K784 HydrophobicContact CG-CG 4.31Å
748	F	95.6	Very high	95.6	Very high	2 Å²	2	32 Å²	32	1%	0.009	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	100.9	165	-173.4	-95.2	0	0	0	108.5	A739 M740 I753 V772 R776 R782 I783 K784 M789	A739-F748 HydrophobicContact CB-CD1 4.11Å; A739-F748 HydrophobicContact CB-CD2 3.48Å; A739-F748 VanDerWaalsContact CB-CD2 3.48Å; A739-F748 HydrophobicContact CB-CE1 3.93Å; A739-F748 HydrophobicContact CB-CE2 3.32Å; A739-F748 HydrophobicContact CB-CG 3.91Å; A739-F748 HydrophobicContact CB-CZ 3.56Å; M740-F748 HydrophobicContact CG-CD2 4.22Å; M740-F748 HydrophobicContact SD-CB 4.17Å; M740-F748 HydrophobicContact SD-CD2 3.9Å; F748-I753 HydrophobicContact CE1-CD1 4.32Å; F748-I753 HydrophobicContact CZ-CD1 4.11Å; F748-V772 HydrophobicContact CZ-CG1 4.02Å; F748-R776 HydrophobicContact CE1-CB 4.36Å; F748-R776 HydrophobicContact CE1-CG 4.43Å; F748-R776 HydrophobicContact CE2-CG 4.12Å; F748-R776 VanDerWaalsContact CE2-CZ 3.46Å; F748-R776 HydrophobicContact CZ-CB 4.28Å; F748-R776 HydrophobicContact CZ-CG 3.96Å; F748-R782 PolarHBondContact N-O 2.7Å; F748-I783 HydrophobicContact CB-CG1 3.96Å; F748-I783 HydrophobicContact CD1-CG1 4.04Å; F748-I783 HydrophobicContact CD1-CG2 4.25Å; F748-I783 HydrophobicContact CG-CG1 4.32Å; F748-I783 WeakPolarHBondContact O-CA 3.45Å; F748-K784 PolarHBondContact O-N 2.83Å; F748-M789 HydrophobicContact CD1-SD 4.48Å; F748-M789 HydrophobicContact CE1-CE 4.39Å; F748-M789 HydrophobicContact CE1-SD 3.72Å
749	S	96.8	Very high	95.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	104.1	-175.1	-173.3	0	0	0	0	111.7	A739 H742 R751 G752	A739-S749 WeakPolarHBondContact CA-O 3.38Å; A739-S749 WeakPolarHBondContact CB-O 3.46Å; A739-S749 PolarHBondContact O-N 3.34Å; H742-S749 WeakPolarHBondContact ND1-CB 3.17Å; H742-S749 PolarHBondContact ND1-OG 3.08Å; S749-R751 PolarHBondContact O-N 3.21Å; S749-G752 PolarHBondContact O-N 3.01Å; S749-G752 PolarHBondContact OG-N 3.3Å
750	C	96.4	Very high	95.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.9	-31	177.8	-54.5	0	0	0	0	111.9	G752 I753 A754 K784 E785 M789	C750-G752 VanDerWaalsContact C-N 3.27Å; C750-G752 PolarHBondContact O-N 2.83Å; C750-I753 WeakPolarHBondContact O-CB 3.33Å; C750-I753 PolarHBondContact O-N 3.23Å; C750-I753 VanDerWaalsContact O-N 3.14Å; C750-A754 PolarHBondContact O-N 2.92Å; C750-A754 VanDerWaalsContact O-N 3.12Å; C750-K784 VanDerWaalsContact CB-O 3.29Å; C750-K784 WeakPolarHBondContact CB-O 3.3Å; C750-K784 PolarHBondContact N-O 2.95Å; C750-K784 PolarHBondContact SG-O 3.31Å; C750-E785 VanDerWaalsContact CB-O 3.29Å; C750-E785 WeakPolarHBondContact CB-O 3.25Å; C750-M789 HydrophobicContact CB-CG 3.93Å; C750-M789 HydrophobicContact CB-SD 4.36Å; C750-M789 PolarHBondContact SG-SD 2.94Å
751	R	96.9	Very high	95.7	Very high	25 Å²	25	36.7 Å²	36.7	9%	0.094	20%	0.201	C	C	.	.	H	α-helix	trans	-58.3	-34.2	168.7	170.1	167.3	173.3	167.7	-3.4	113.1	G710 T713 F715 S749 I753 A754 L755 E785 Y788	G710-R751 PolarHBondContact O-NH2 2.98Å; T713-R751 PolarHBondContact O-NH1 3.45Å; T713-R751 PolarHBondContact O-NH2 3.4Å; T713-R751 PolarHBondContact OG1-NH2 3.48Å; F715-R751 HydrophobicContact CD1-CG 3.81Å; F715-R751 HydrophobicContact CE1-CG 4.43Å; F715-R751 HydrophobicContact CG-CG 4.35Å; S749-R751 PolarHBondContact O-N 3.21Å; R751-I753 VanDerWaalsContact C-N 3.32Å; R751-I753 PolarHBondContact O-N 3.21Å; R751-A754 PolarHBondContact O-N 3.08Å; R751-L755 HydrophobicContact CG-CD1 3.85Å; R751-L755 HydrophobicContact CG-CG 4.26Å; R751-L755 WeakPolarHBondContact O-CB 3.35Å; R751-L755 VanDerWaalsContact O-CG 3.26Å; R751-L755 WeakPolarHBondContact O-CG 3.16Å; R751-L755 PolarHBondContact O-N 2.85Å; R751-E785 WeakPolarHBondContact CB-OE2 3.37Å; R751-E785 WeakPolarHBondContact CD-OE1 3.14Å; R751-E785 WeakPolarHBondContact CD-OE2 3.37Å; R751-E785 IonicContact CZ-OE1 2.63Å; R751-E785 IonicContact NH1-OE1 2.69Å; R751-E785 PolarHBondContact NH1-OE1 3.14Å; R751-E785 VanDerWaalsContact NH1-OE1 3.09Å; R751-Y788 HydrophobicContact CB-CD2 4.01Å; R751-Y788 HydrophobicContact CB-CE2 4.02Å
752	G	97.1	Very high	95.7	Very high	4 Å²	4	36.3 Å²	36.3	4%	0.041	19%	0.191	C	C	.	.	H	α-helix	trans	-60.2	-41.2	173.1	0	0	0	0	0	112.6	V738 S749 C750 A756	V738-G752 WeakPolarHBondContact CG1-O 3.48Å; S749-G752 PolarHBondContact O-N 3.01Å; S749-G752 PolarHBondContact OG-N 3.3Å; C750-G752 VanDerWaalsContact C-N 3.27Å; C750-G752 PolarHBondContact O-N 2.83Å; G752-A756 PolarHBondContact O-N 2.94Å; G752-A756 VanDerWaalsContact O-N 3.08Å
753	I	97.6	Very high	95.6	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.5	-46.2	174.9	-46.6	178.9	0	0	0	110.3	A739 F748 C750 R751 L755 A756 V757 A770 V772 L792	A739-I753 HydrophobicContact CB-CD1 4.02Å; A739-I753 HydrophobicContact CB-CG1 3.84Å; F748-I753 HydrophobicContact CE1-CD1 4.32Å; F748-I753 HydrophobicContact CZ-CD1 4.11Å; C750-I753 WeakPolarHBondContact O-CB 3.33Å; C750-I753 PolarHBondContact O-N 3.23Å; C750-I753 VanDerWaalsContact O-N 3.14Å; R751-I753 VanDerWaalsContact C-N 3.32Å; R751-I753 PolarHBondContact O-N 3.21Å; I753-L755 PolarHBondContact O-N 3.45Å; I753-A756 PolarHBondContact O-N 3.09Å; I753-V757 WeakPolarHBondContact O-CG2 3.39Å; I753-V757 PolarHBondContact O-N 2.87Å; I753-A770 HydrophobicContact CG2-CB 3.7Å; I753-V772 HydrophobicContact CD1-CG2 3.85Å; I753-L792 HydrophobicContact CB-CD1 4.32Å; I753-L792 HydrophobicContact CG2-CD1 3.92Å
754	A	97.7	Very high	95.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-39.7	-180	0	0	0	0	0	113	F715 L717 C750 R751 V757 Q758 Y788 L792	F715-A754 HydrophobicContact CE1-CB 3.83Å; L717-A754 HydrophobicContact CD1-CB 4.29Å; C750-A754 PolarHBondContact O-N 2.92Å; C750-A754 VanDerWaalsContact O-N 3.12Å; R751-A754 PolarHBondContact O-N 3.08Å; A754-V757 PolarHBondContact O-N 3.46Å; A754-Q758 WeakPolarHBondContact O-CB 3.43Å; A754-Q758 PolarHBondContact O-N 3.25Å; A754-Y788 HydrophobicContact CB-CD1 3.84Å; A754-Y788 HydrophobicContact CB-CG 3.89Å; A754-L792 HydrophobicContact CB-CD1 4.23Å
755	L	97.8	Very high	95.9	Very high	65 Å²	65	37.5 Å²	37.5	34%	0.34	19%	0.192	S	C	.	.	H	α-helix	trans	-61.8	-42.7	172.1	-74.4	166.4	0	0	0	111.7	F715 R751 I753 Q758 H759	F715-L755 HydrophobicContact CD2-CD2 4.03Å; F715-L755 HydrophobicContact CE1-CD2 4.34Å; F715-L755 HydrophobicContact CE1-CG 4.28Å; F715-L755 HydrophobicContact CE2-CD2 3.54Å; F715-L755 HydrophobicContact CE2-CG 4.34Å; F715-L755 HydrophobicContact CZ-CD2 3.73Å; F715-L755 HydrophobicContact CZ-CG 4.08Å; R751-L755 HydrophobicContact CG-CD1 3.85Å; R751-L755 HydrophobicContact CG-CG 4.26Å; R751-L755 WeakPolarHBondContact O-CB 3.35Å; R751-L755 VanDerWaalsContact O-CG 3.26Å; R751-L755 WeakPolarHBondContact O-CG 3.16Å; R751-L755 PolarHBondContact O-N 2.85Å; I753-L755 PolarHBondContact O-N 3.45Å; L755-Q758 PolarHBondContact O-N 2.86Å; L755-H759 VanDerWaalsContact O-CB 3.27Å; L755-H759 WeakPolarHBondContact O-CB 3.44Å; L755-H759 PolarHBondContact O-N 2.95Å
756	A	98	Very high	96.1	Very high	21 Å²	21	38.3 Å²	38.3	17%	0.174	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-44.1	176.7	0	0	0	0	0	112.3	I733 V738 G752 I753 H759 F760	I733-A756 HydrophobicContact CD1-CB 4.16Å; I733-A756 HydrophobicContact CG2-CB 4.45Å; V738-A756 HydrophobicContact CG1-CB 4.02Å; G752-A756 PolarHBondContact O-N 2.94Å; G752-A756 VanDerWaalsContact O-N 3.08Å; I753-A756 PolarHBondContact O-N 3.09Å; A756-H759 PolarHBondContact O-N 3.06Å; A756-F760 WeakPolarHBondContact O-CD2 3.37Å; A756-F760 PolarHBondContact O-N 2.95Å
757	V	97.9	Very high	96.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-48.5	175.1	171.6	0	0	0	0	110.8	L719 I733 I753 A754 H759 F760 W761 I768 A770 L792 L797	L719-V757 HydrophobicContact CD2-CG1 4.49Å; I733-V757 HydrophobicContact CD1-CG2 3.79Å; I753-V757 WeakPolarHBondContact O-CG2 3.39Å; I753-V757 PolarHBondContact O-N 2.87Å; A754-V757 PolarHBondContact O-N 3.46Å; V757-H759 VanDerWaalsContact C-N 3.35Å; V757-H759 PolarHBondContact O-N 3.2Å; V757-F760 PolarHBondContact O-N 2.99Å; V757-W761 WeakPolarHBondContact O-CB 3.44Å; V757-W761 PolarHBondContact O-N 3.05Å; V757-I768 HydrophobicContact CG1-CG2 4.41Å; V757-I768 HydrophobicContact CG2-CG2 4.27Å; V757-A770 HydrophobicContact CG2-CB 4.48Å; V757-L792 HydrophobicContact CB-CD2 4.03Å; V757-L792 HydrophobicContact CG1-CD2 3.82Å; V757-L792 HydrophobicContact CG2-CD1 4.34Å; V757-L792 HydrophobicContact CG2-CD2 4.03Å; V757-L797 HydrophobicContact CG1-CB 4.32Å; V757-L797 HydrophobicContact CG1-CD1 3.89Å
758	Q	97.2	Very high	96.5	Very high	32 Å²	32	39.2 Å²	39.2	15%	0.15	18%	0.183	C	C	.	.	H	α-helix	trans	-62.1	-40.9	178.4	-176.2	172.8	-22.5	0	0	112	L717 K718 L719 A754 L755 F760 W761 D762	L717-Q758 HydrophobicContact CD1-CB 4Å; K718-Q758 WeakPolarHBondContact O-CG 3.09Å; K718-Q758 PolarHBondContact O-NE2 3.43Å; K718-Q758 PolarHBondContact O-OE1 3.39Å; L719-Q758 HydrophobicContact CD2-CB 4.34Å; A754-Q758 WeakPolarHBondContact O-CB 3.43Å; A754-Q758 PolarHBondContact O-N 3.25Å; L755-Q758 PolarHBondContact O-N 2.86Å; Q758-F760 VanDerWaalsContact C-N 3.28Å; Q758-F760 PolarHBondContact O-N 2.77Å; Q758-W761 WeakPolarHBondContact O-CB 3.35Å; Q758-W761 PolarHBondContact O-N 3.44Å; Q758-D762 WeakPolarHBondContact CG-OD2 3.42Å; Q758-D762 PolarHBondContact NE2-OD2 3.17Å; Q758-D762 WeakPolarHBondContact O-CB 3.33Å; Q758-D762 PolarHBondContact O-N 3.42Å
759	H	96.9	Very high	96.5	Very high	92 Å²	92	40.3 Å²	40.3	43%	0.426	19%	0.192	S	C	.	.	H	α-helix	trans	-56.1	-38.7	178.3	-179.8	109.6	0	0	0	113.3	L755 A756 V757 R763	L755-H759 VanDerWaalsContact O-CB 3.27Å; L755-H759 WeakPolarHBondContact O-CB 3.44Å; L755-H759 PolarHBondContact O-N 2.95Å; A756-H759 PolarHBondContact O-N 3.06Å; V757-H759 VanDerWaalsContact C-N 3.35Å; V757-H759 PolarHBondContact O-N 3.2Å; H759-R763 PolarHBondContact CD2-NH1 2.96Å; H759-R763 VanDerWaalsContact CE1-CZ 3.45Å; H759-R763 PolarHBondContact CE1-NH1 3.26Å; H759-R763 PolarHBondContact CE1-NH2 3.12Å; H759-R763 PolarHBondContact NE2-NE 2.91Å; H759-R763 PolarHBondContact NE2-NH1 3.34Å; H759-R763 WeakPolarHBondContact O-CD 3.36Å; H759-R763 WeakPolarHBondContact O-CG 3.29Å; H759-R763 PolarHBondContact O-NH1 3.18Å
760	F	96.9	Very high	96.6	Very high	62 Å²	62	40.3 Å²	40.3	27%	0.272	19%	0.192	S	C	.	.	H	α-helix	trans	-81.1	-32.7	174.5	-68.6	-68	0	0	0	112.6	I731 I733 A756 V757 Q758 R763 G764 H765 I768	I731-F760 HydrophobicContact CD1-CD1 4.18Å; I731-F760 HydrophobicContact CD1-CE1 4.2Å; I731-F760 HydrophobicContact CG1-CD1 4.05Å; I731-F760 HydrophobicContact CG1-CE1 4.49Å; I731-F760 HydrophobicContact CG1-CG 4.18Å; I731-F760 HydrophobicContact CG2-CD1 4.47Å; I731-F760 HydrophobicContact CG2-CD2 3.84Å; I731-F760 HydrophobicContact CG2-CE2 3.92Å; I731-F760 HydrophobicContact CG2-CG 4.14Å; I731-F760 HydrophobicContact CG2-CZ 4.29Å; I733-F760 HydrophobicContact CD1-CD2 4.12Å; I733-F760 HydrophobicContact CD1-CE2 4.41Å; A756-F760 WeakPolarHBondContact O-CD2 3.37Å; A756-F760 PolarHBondContact O-N 2.95Å; V757-F760 PolarHBondContact O-N 2.99Å; Q758-F760 VanDerWaalsContact C-N 3.28Å; Q758-F760 PolarHBondContact O-N 2.77Å; F760-R763 PolarHBondContact O-N 2.84Å; F760-G764 PolarHBondContact O-N 2.98Å; F760-H765 HydrophobicContact CB-CB 4.28Å; F760-H765 WeakPolarHBondContact O-CB 3.21Å; F760-H765 PolarHBondContact O-CD2 3.38Å; F760-H765 PolarHBondContact O-N 3.06Å; F760-H765 VanDerWaalsContact O-N 3.13Å; F760-I768 HydrophobicContact CB-CD1 3.69Å; F760-I768 HydrophobicContact CB-CG1 4.24Å
761	W	96.2	Very high	96.5	Very high	36 Å²	36	42.3 Å²	42.3	14%	0.136	20%	0.202	C	C	.	.	H	α-helix	trans	-63.2	-44.5	175.8	-169.6	-82.7	0	0	0	112.3	L719 T720 V757 Q758 R763 G764 R766 I768 L797	L719-W761 HydrophobicContact CB-CD2 4.13Å; L719-W761 HydrophobicContact CB-CG 4.29Å; L719-W761 HydrophobicContact CB-CZ2 4.23Å; L719-W761 HydrophobicContact CD2-CB 3.71Å; L719-W761 HydrophobicContact CD2-CD2 3.85Å; L719-W761 HydrophobicContact CD2-CE3 4.35Å; L719-W761 HydrophobicContact CD2-CG 3.54Å; L719-W761 HydrophobicContact CG-CD2 4.4Å; L719-W761 HydrophobicContact CG-CG 4.45Å; T720-W761 VanDerWaalsContact N-NE1 3.14Å; T720-W761 PolarHBondContact O-NE1 3.03Å; V757-W761 WeakPolarHBondContact O-CB 3.44Å; V757-W761 PolarHBondContact O-N 3.05Å; Q758-W761 WeakPolarHBondContact O-CB 3.35Å; Q758-W761 PolarHBondContact O-N 3.44Å; W761-R763 PolarHBondContact O-N 2.95Å; W761-G764 PolarHBondContact O-N 3.12Å; W761-R766 VanDerWaalsContact CE2-CZ 3.41Å; W761-R766 VanDerWaalsContact CZ2-CD 3.42Å; W761-R766 PolarHBondContact O-NH1 3.44Å; W761-I768 HydrophobicContact CB-CD1 4.21Å; W761-I768 HydrophobicContact CE3-CD1 4.25Å; W761-L797 HydrophobicContact CE3-CD1 4.42Å; W761-L797 HydrophobicContact CZ3-CD1 4.26Å; W761-L797 HydrophobicContact CZ3-CD2 4.15Å
762	D	95.2	Very high	96.3	Very high	87 Å²	87	41.1 Å²	41.1	47%	0.465	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-15.4	177.3	-66.8	-15.7	0	0	0	112.3	Q758	Q758-D762 WeakPolarHBondContact CG-OD2 3.42Å; Q758-D762 PolarHBondContact NE2-OD2 3.17Å; Q758-D762 WeakPolarHBondContact O-CB 3.33Å; Q758-D762 PolarHBondContact O-N 3.42Å
763	R	94.6	Very high	96	Very high	144 Å²	144	41 Å²	41	54%	0.543	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	6.3	171	-72.5	167.1	175.4	64.1	5.4	113.6	L728 H759 F760 W761	L728-R763 WeakPolarHBondContact CD1-O 3.36Å; H759-R763 PolarHBondContact CD2-NH1 2.96Å; H759-R763 VanDerWaalsContact CE1-CZ 3.45Å; H759-R763 PolarHBondContact CE1-NH1 3.26Å; H759-R763 PolarHBondContact CE1-NH2 3.12Å; H759-R763 PolarHBondContact NE2-NE 2.91Å; H759-R763 PolarHBondContact NE2-NH1 3.34Å; H759-R763 WeakPolarHBondContact O-CD 3.36Å; H759-R763 WeakPolarHBondContact O-CG 3.29Å; H759-R763 PolarHBondContact O-NH1 3.18Å; F760-R763 PolarHBondContact O-N 2.84Å; W761-R763 PolarHBondContact O-N 2.95Å
764	G	94.8	Very high	95.5	Very high	15 Å²	15	45.1 Å²	45.1	16%	0.155	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	9.2	177.5	0	0	0	0	0	115.2	G724 N725 F760 W761	G724-G764 CarbonylContact C-O 3.34Å; G724-G764 WeakPolarHBondContact CA-O 3.45Å; N725-G764 PolarHBondContact N-O 3.31Å; F760-G764 PolarHBondContact O-N 2.98Å; W761-G764 PolarHBondContact O-N 3.12Å
765	H	96.3	Very high	94.8	Very high	26 Å²	26	46.7 Å²	46.7	12%	0.12	22%	0.221	C	C	.	.			trans	-71.9	135.8	167	-64.8	-101.8	0	0	0	109.5	R729 I731 F760 I768	R729-H765 PolarHBondContact O-ND1 2.98Å; I731-H765 HydrophobicContact CG1-CB 4.48Å; I731-H765 WeakPolarHBondContact CG1-ND1 3.45Å; F760-H765 HydrophobicContact CB-CB 4.28Å; F760-H765 WeakPolarHBondContact O-CB 3.21Å; F760-H765 PolarHBondContact O-CD2 3.38Å; F760-H765 PolarHBondContact O-N 3.06Å; F760-H765 VanDerWaalsContact O-N 3.13Å; H765-I768 HydrophobicContact CB-CD1 4.02Å; H765-I768 HydrophobicContact CB-CG1 3.9Å
766	R	94.4	Very high	94.4	Very high	68 Å²	68	45.2 Å²	45.2	26%	0.257	21%	0.211	S	C	.	.			trans	-120.3	-17.8	172.9	-61.8	-72.1	172.6	-94.9	9.2	113.1	E722 W761 I768	E722-R766 VanDerWaalsContact O-CZ 3.27Å; E722-R766 PolarHBondContact O-NE 3.19Å; E722-R766 PolarHBondContact O-NH2 3.09Å; W761-R766 VanDerWaalsContact CE2-CZ 3.41Å; W761-R766 VanDerWaalsContact CZ2-CD 3.42Å; W761-R766 PolarHBondContact O-NH1 3.44Å; R766-I768 PolarHBondContact O-N 2.87Å
767	H	95.2	Very high	93.7	Very high	137 Å²	137	48.2 Å²	48.2	63%	0.634	22%	0.221	S	C	*	.			trans	-94.2	74.1	172.9	-168.6	-61.9	0	0	0	110.3	A730 I731	A730-H767 WeakPolarHBondContact CA-O 3.19Å; A730-H767 VanDerWaalsContact CB-ND1 3.28Å; A730-H767 WeakPolarHBondContact CB-ND1 3.26Å; I731-H767 PolarHBondContact N-O 3.05Å
768	I	97.1	Very high	93	Very high	7 Å²	7	53.6 Å²	53.6	4%	0.036	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.5	179	-54.5	165	0	0	0	108.3	I731 I733 V757 F760 W761 H765 R766 L797	I731-I768 HydrophobicContact CB-CG1 4.37Å; I731-I768 HydrophobicContact CB-CG2 4.47Å; I731-I768 CarbonylContact O-C 3.53Å; I731-I768 WeakPolarHBondContact O-CA 3.14Å; I733-I768 HydrophobicContact CD1-CG2 3.77Å; I733-I768 HydrophobicContact CG1-CG2 4.28Å; V757-I768 HydrophobicContact CG1-CG2 4.41Å; V757-I768 HydrophobicContact CG2-CG2 4.27Å; F760-I768 HydrophobicContact CB-CD1 3.69Å; F760-I768 HydrophobicContact CB-CG1 4.24Å; W761-I768 HydrophobicContact CB-CD1 4.21Å; W761-I768 HydrophobicContact CE3-CD1 4.25Å; H765-I768 HydrophobicContact CB-CD1 4.02Å; H765-I768 HydrophobicContact CB-CG1 3.9Å; R766-I768 PolarHBondContact O-N 2.87Å; I768-L797 HydrophobicContact CB-CD2 4.37Å
769	S	96.5	Very high	91.9	Very high	26 Å²	26	59.1 Å²	59.1	18%	0.182	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	121.2	172.1	-161.8	0	0	0	0	111.4	I731 V732 I733	I731-S769 PolarHBondContact O-N 2.81Å; V732-S769 CarbonylContact C-O 3.58Å; V732-S769 WeakPolarHBondContact CA-O 3.38Å; I733-S769 PolarHBondContact N-O 3.04Å
770	A	97.1	Very high	91.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.3	172.2	0	0	0	0	0	110.6	I733 I753 V757 L797 L798 S799	I733-A770 HydrophobicContact CB-CB 4.13Å; I733-A770 CarbonylContact O-C 3.56Å; I733-A770 WeakPolarHBondContact O-CA 3.17Å; I753-A770 HydrophobicContact CG2-CB 3.7Å; V757-A770 HydrophobicContact CG2-CB 4.48Å; A770-L797 PolarHBondContact N-O 2.89Å; A770-L798 HydrophobicContact CB-CB 4.38Å; A770-L798 HydrophobicContact CB-CG 4.42Å; A770-L798 CarbonylContact O-C 3.56Å; A770-L798 WeakPolarHBondContact O-CA 3.28Å; A770-S799 PolarHBondContact O-N 3.32Å
771	L	95.8	Very high	90.8	Very high	42 Å²	42	59.4 Å²	59.4	22%	0.22	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.8	176.6	-59.4	-176.2	0	0	0	109.9	V732 I733 G735 T801	V732-L771 HydrophobicContact CG1-CD1 3.79Å; V732-L771 HydrophobicContact CG1-CG 3.96Å; I733-L771 PolarHBondContact O-N 2.92Å; G735-L771 WeakPolarHBondContact CA-O 3.44Å; G735-L771 PolarHBondContact N-O 2.92Å; L771-T801 HydrophobicContact CB-CG2 4.11Å; L771-T801 HydrophobicContact CD2-CG2 4.24Å
772	V	93.1	Very high	90.5	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	135.8	178.1	-178.5	0	0	0	0	110.1	F748 I753 R776 M789 L798 S799 Y800 T801	F748-V772 HydrophobicContact CZ-CG1 4.02Å; I753-V772 HydrophobicContact CD1-CG2 3.85Å; V772-R776 HydrophobicContact CG1-CB 3.65Å; V772-R776 HydrophobicContact CG1-CG 3.83Å; V772-M789 HydrophobicContact CG1-CE 3.87Å; V772-L798 HydrophobicContact CG2-CD1 3.86Å; V772-L798 HydrophobicContact CG2-CG 4.18Å; V772-S799 PolarHBondContact N-O 2.9Å; V772-Y800 HydrophobicContact CB-CD1 4.4Å; V772-Y800 HydrophobicContact CB-CE1 4.44Å; V772-Y800 HydrophobicContact CG1-CE1 4.34Å; V772-Y800 CarbonylContact O-C 3.51Å; V772-Y800 WeakPolarHBondContact O-CA 3.28Å; V772-Y800 WeakPolarHBondContact O-CD1 3.38Å; V772-T801 PolarHBondContact O-N 3.08Å
773	P	90.4	Very high	90.5	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	142.3	175.3	-29.2	38.1	0	0	0	114.4	S736 W775 R776 S813 D815	S736-P773 WeakPolarHBondContact OG-CD 3.35Å; P773-W775 HydrophobicContact CB-CD2 4.47Å; P773-W775 HydrophobicContact CB-CG 4.01Å; P773-W775 PolarHBondContact O-N 3.43Å; P773-W775 VanDerWaalsContact O-N 3.12Å; P773-R776 WeakPolarHBondContact O-CB 3.29Å; P773-R776 PolarHBondContact O-N 2.95Å; P773-S813 WeakPolarHBondContact CG-OG 3.43Å; P773-D815 VanDerWaalsContact CD-OD2 3.26Å; P773-D815 WeakPolarHBondContact CD-OD2 3.44Å; P773-D815 HydrophobicContact CG-CB 4.11Å; P773-D815 WeakPolarHBondContact CG-OD1 3.37Å; P773-D815 WeakPolarHBondContact CG-OD2 3.43Å
774	Q	86.8	Confident	90.5	Very high	87 Å²	87	56.8 Å²	56.8	41%	0.407	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-53	-33	173.3	-75.1	169.9	-4	0	0	113.4	R776 Q777 T801	Q774-R776 PolarHBondContact O-N 3.19Å; Q774-Q777 VanDerWaalsContact O-CB 3.28Å; Q774-Q777 WeakPolarHBondContact O-CB 3.29Å; Q774-Q777 WeakPolarHBondContact O-CG 3.11Å; Q774-Q777 PolarHBondContact O-N 3.22Å; Q774-T801 WeakPolarHBondContact CG-O 3.43Å; Q774-T801 PolarHBondContact N-O 3.11Å
775	W	83.3	Confident	90.4	Very high	34 Å²	34	57.9 Å²	57.9	13%	0.129	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-61.7	-24	177.5	70.8	-101.9	0	0	0	114	P773 Q777 K778 S803 R810	P773-W775 HydrophobicContact CB-CD2 4.47Å; P773-W775 HydrophobicContact CB-CG 4.01Å; P773-W775 PolarHBondContact O-N 3.43Å; P773-W775 VanDerWaalsContact O-N 3.12Å; W775-Q777 PolarHBondContact O-N 2.9Å; W775-K778 PolarHBondContact O-N 2.63Å; W775-S803 PolarHBondContact N-OG 3.29Å; W775-R810 VanDerWaalsContact CD2-CZ 3.47Å; W775-R810 VanDerWaalsContact CD2-NE 3.33Å; W775-R810 VanDerWaalsContact CE2-CZ 3.47Å; W775-R810 VanDerWaalsContact CE2-NE 3.33Å; W775-R810 VanDerWaalsContact CH2-CZ 3.48Å; W775-R810 VanDerWaalsContact CH2-NH1 3.3Å
776	R	88.1	Confident	90.3	Very high	33 Å²	33	59.5 Å²	59.5	13%	0.125	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-72.2	-6.2	174.3	-65.6	-75.7	-168.7	179.5	5.5	113.4	M740 F748 V772 P773 Q774 K778 I783 M789	M740-R776 PolarHBondContact SD-NH2 3.38Å; F748-R776 HydrophobicContact CE1-CB 4.36Å; F748-R776 HydrophobicContact CE1-CG 4.43Å; F748-R776 HydrophobicContact CE2-CG 4.12Å; F748-R776 VanDerWaalsContact CE2-CZ 3.46Å; F748-R776 HydrophobicContact CZ-CB 4.28Å; F748-R776 HydrophobicContact CZ-CG 3.96Å; V772-R776 HydrophobicContact CG1-CB 3.65Å; V772-R776 HydrophobicContact CG1-CG 3.83Å; P773-R776 WeakPolarHBondContact O-CB 3.29Å; P773-R776 PolarHBondContact O-N 2.95Å; Q774-R776 PolarHBondContact O-N 3.19Å; R776-K778 VanDerWaalsContact C-N 3.28Å; R776-I783 WeakPolarHBondContact O-CD1 3.44Å; R776-M789 HydrophobicContact CB-CE 4.06Å
777	Q	84.8	Confident	90.3	Very high	84 Å²	84	60.7 Å²	60.7	39%	0.393	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-75.4	-16.7	171.6	-62.5	178.3	8.8	0	0	113	Q774 W775 Q786 Y800	Q774-Q777 VanDerWaalsContact O-CB 3.28Å; Q774-Q777 WeakPolarHBondContact O-CB 3.29Å; Q774-Q777 WeakPolarHBondContact O-CG 3.11Å; Q774-Q777 PolarHBondContact O-N 3.22Å; W775-Q777 PolarHBondContact O-N 2.9Å; Q777-Q786 PolarHBondContact O-NE2 3.49Å; Q777-Y800 HydrophobicContact CG-CD1 3.88Å; Q777-Y800 HydrophobicContact CG-CE1 3.32Å; Q777-Y800 HydrophobicContact CG-CE2 4.36Å
778	K	82	Confident	90.3	Very high	113 Å²	113	54.6 Å²	54.6	49%	0.491	26%	0.264	S	S	.	.	S	Bend	trans	-71.1	145.6	-178.9	-66.5	-178	172.1	-173.7	0	111.5	W775 R776 D780 I783 E805	W775-K778 PolarHBondContact O-N 2.63Å; R776-K778 VanDerWaalsContact C-N 3.28Å; K778-D780 PolarHBondContact O-N 3.44Å; K778-I783 WeakPolarHBondContact O-CD1 3.44Å; K778-E805 WeakPolarHBondContact CE-OE1 3.28Å; K778-E805 IonicContact NZ-OE1 3.48Å; K778-E805 PolarHBondContact NZ-OE1 2.72Å; K778-E805 IonicContact NZ-OE2 2.68Å; K778-E805 PolarHBondContact NZ-OE2 2.88Å
779	N	75.3	Confident	90.2	Very high	149 Å²	149	54.3 Å²	54.3	80%	0.797	26%	0.262	S	S	*	.			trans	-69.9	88.3	176.7	-60.5	5.2	0	0	0	111.1
780	D	84.5	Confident	90.1	Very high	50 Å²	50	56.2 Å²	56.2	27%	0.267	27%	0.273	S	S	.	.			trans	-100.5	129.7	166.2	-174.7	-45.5	0	0	0	108.7	K778 R782 I783	K778-D780 PolarHBondContact O-N 3.44Å; D780-R782 PolarHBondContact O-N 2.95Å; D780-R782 VanDerWaalsContact OD1-CB 3.27Å; D780-R782 WeakPolarHBondContact OD1-CB 3.16Å; D780-R782 IonicContact OD1-CZ 3.71Å; D780-R782 PolarHBondContact OD1-N 3.31Å; D780-R782 IonicContact OD1-NE 3.72Å; D780-R782 PolarHBondContact OD1-NE 2.95Å; D780-R782 IonicContact OD1-NH2 2.99Å; D780-R782 IonicContact OD2-CZ 2.72Å; D780-R782 IonicContact OD2-NE 3.8Å; D780-R782 PolarHBondContact OD2-NE 3.12Å; D780-R782 IonicContact OD2-NH2 3.4Å; D780-R782 PolarHBondContact OD2-NH2 2.93Å; D780-I783 HydrophobicContact CB-CD1 3.87Å; D780-I783 HydrophobicContact CB-CG1 4.17Å; D780-I783 WeakPolarHBondContact O-CB 3.47Å; D780-I783 PolarHBondContact O-N 3.31Å
781	P	86.3	Confident	90	Very high	109 Å²	109	59.3 Å²	59.3	71%	0.708	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-11.8	-179.4	26.1	-35.8	0	0	0	114.6	K784	P781-K784 PolarHBondContact O-NZ 3.28Å
782	R	90	Very high	90	Very high	142 Å²	142	57.3 Å²	57.3	54%	0.536	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-10.8	173.1	-61.9	168.2	-68.6	-170	0.8	113.7	F747 F748 D780	F747-R782 WeakPolarHBondContact CA-O 3.26Å; F747-R782 WeakPolarHBondContact CB-O 3.12Å; F747-R782 HydrophobicContact CD1-CB 4.22Å; F748-R782 PolarHBondContact N-O 2.7Å; D780-R782 PolarHBondContact O-N 2.95Å; D780-R782 VanDerWaalsContact OD1-CB 3.27Å; D780-R782 WeakPolarHBondContact OD1-CB 3.16Å; D780-R782 IonicContact OD1-CZ 3.71Å; D780-R782 PolarHBondContact OD1-N 3.31Å; D780-R782 IonicContact OD1-NE 3.72Å; D780-R782 PolarHBondContact OD1-NE 2.95Å; D780-R782 IonicContact OD1-NH2 2.99Å; D780-R782 IonicContact OD2-CZ 2.72Å; D780-R782 IonicContact OD2-NE 3.8Å; D780-R782 PolarHBondContact OD2-NE 3.12Å; D780-R782 IonicContact OD2-NH2 3.4Å; D780-R782 PolarHBondContact OD2-NH2 2.93Å
783	I	93.9	Very high	90.1	Very high	19 Å²	19	61.6 Å²	61.6	10%	0.097	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	128.4	168	-67	164.2	0	0	0	108.1	F748 R776 K778 D780 Q786	F748-I783 HydrophobicContact CB-CG1 3.96Å; F748-I783 HydrophobicContact CD1-CG1 4.04Å; F748-I783 HydrophobicContact CD1-CG2 4.25Å; F748-I783 HydrophobicContact CG-CG1 4.32Å; F748-I783 WeakPolarHBondContact O-CA 3.45Å; R776-I783 WeakPolarHBondContact O-CD1 3.44Å; K778-I783 WeakPolarHBondContact O-CD1 3.44Å; D780-I783 HydrophobicContact CB-CD1 3.87Å; D780-I783 HydrophobicContact CB-CG1 4.17Å; D780-I783 WeakPolarHBondContact O-CB 3.47Å; D780-I783 PolarHBondContact O-N 3.31Å; I783-Q786 HydrophobicContact CG2-CB 3.94Å; I783-Q786 HydrophobicContact CG2-CG 4.07Å
784	K	94.6	Very high	90.3	Very high	51 Å²	51	67.5 Å²	67.5	22%	0.222	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137	-177	-55.1	-58.6	-174.1	-168.2	0	111.3	F707 L711 F747 F748 C750 P781 Q786	F707-K784 HydrophobicContact CE1-CG 4.19Å; L711-K784 HydrophobicContact CD1-CB 3.55Å; L711-K784 HydrophobicContact CD1-CD 4.44Å; L711-K784 HydrophobicContact CD1-CG 3.84Å; F747-K784 HydrophobicContact CB-CG 4.26Å; F747-K784 HydrophobicContact CD1-CD 4.46Å; F747-K784 VanDerWaalsContact CD1-CE 3.41Å; F747-K784 HydrophobicContact CD1-CG 4.25Å; F747-K784 VanDerWaalsContact CE1-CE 3.46Å; F747-K784 HydrophobicContact CG-CG 4.31Å; F748-K784 PolarHBondContact O-N 2.83Å; C750-K784 VanDerWaalsContact CB-O 3.29Å; C750-K784 WeakPolarHBondContact CB-O 3.3Å; C750-K784 PolarHBondContact N-O 2.95Å; C750-K784 PolarHBondContact SG-O 3.31Å; P781-K784 PolarHBondContact O-NZ 3.28Å; K784-Q786 PolarHBondContact O-N 3.31Å
785	E	93.7	Very high	90.7	Very high	38 Å²	38	68.2 Å²	68.2	18%	0.178	34%	0.337	C	S	.	.			trans	56.9	42.9	-179.5	-61.6	161.4	110	0	0	113.7	L711 C750 R751 H787 Y788	L711-E785 WeakPolarHBondContact CD2-OE2 3.35Å; C750-E785 VanDerWaalsContact CB-O 3.29Å; C750-E785 WeakPolarHBondContact CB-O 3.25Å; R751-E785 WeakPolarHBondContact CB-OE2 3.37Å; R751-E785 WeakPolarHBondContact CD-OE1 3.14Å; R751-E785 WeakPolarHBondContact CD-OE2 3.37Å; R751-E785 IonicContact CZ-OE1 2.63Å; R751-E785 IonicContact NH1-OE1 2.69Å; R751-E785 PolarHBondContact NH1-OE1 3.14Å; R751-E785 VanDerWaalsContact NH1-OE1 3.09Å; E785-H787 PolarHBondContact O-N 3.05Å; E785-Y788 HydrophobicContact CB-CD2 3.67Å; E785-Y788 HydrophobicContact CB-CE2 3.81Å; E785-Y788 HydrophobicContact CG-CE2 4.35Å; E785-Y788 WeakPolarHBondContact O-CD2 3.27Å; E785-Y788 PolarHBondContact O-N 3.29Å; E785-Y788 VanDerWaalsContact O-N 3.09Å
786	Q	93.6	Very high	91.2	Very high	60 Å²	60	69 Å²	69	28%	0.28	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-23.2	-174.9	-166.5	176.2	-6.5	0	0	115.1	Q777 I783 K784 Y788 M789	Q777-Q786 PolarHBondContact O-NE2 3.49Å; I783-Q786 HydrophobicContact CG2-CB 3.94Å; I783-Q786 HydrophobicContact CG2-CG 4.07Å; K784-Q786 PolarHBondContact O-N 3.31Å; Q786-Y788 PolarHBondContact O-N 2.86Å; Q786-M789 HydrophobicContact CG-SD 4.37Å; Q786-M789 WeakPolarHBondContact O-CB 3.36Å; Q786-M789 PolarHBondContact O-N 2.98Å
787	H	93.8	Very high	91.6	Very high	93 Å²	93	68 Å²	68	43%	0.431	35%	0.352	S	S	.	.	H	α-helix	trans	-53.4	-37	175.5	58.9	-96.6	0	0	0	112.6	E785 M789 T790 D791	E785-H787 PolarHBondContact O-N 3.05Å; H787-M789 PolarHBondContact O-N 3.28Å; H787-M789 VanDerWaalsContact O-N 3.15Å; H787-T790 WeakPolarHBondContact O-CA 3.47Å; H787-T790 VanDerWaalsContact O-CB 3.32Å; H787-T790 WeakPolarHBondContact O-CB 3.49Å; H787-T790 PolarHBondContact O-N 3.15Å; H787-D791 IonicContact CD2-OD2 2.64Å; H787-D791 VanDerWaalsContact O-CG 3.3Å; H787-D791 PolarHBondContact O-N 3.41Å
788	Y	96.2	Very high	92.1	Very high	10 Å²	10	64.2 Å²	64.2	4%	0.039	34%	0.335	C	S	.	.	H	α-helix	trans	-58.9	-29.4	176.4	-71.6	-56.4	0	0	0	113.9	F715 L717 R751 A754 E785 Q786 L792	F715-Y788 VanDerWaalsContact C-OH 3.28Å; F715-Y788 AromaticContact CD1-CE1 3.97Å; F715-Y788 HydrophobicContact CD1-CE1 3.97Å; F715-Y788 AromaticContact CD1-CE2 3.9Å; F715-Y788 HydrophobicContact CD1-CE2 3.9Å; F715-Y788 AromaticContact CD1-CZ 3.46Å; F715-Y788 VanDerWaalsContact CD1-CZ 3.46Å; F715-Y788 VanDerWaalsContact CD1-OH 3.28Å; F715-Y788 WeakPolarHBondContact CD1-OH 3.33Å; F715-Y788 HydrophobicContact CE1-CE1 4.02Å; F715-Y788 HydrophobicContact CE1-CE2 4.5Å; F715-Y788 AromaticContact CE1-CZ 3.98Å; F715-Y788 PolarHBondContact O-OH 3.07Å; L717-Y788 HydrophobicContact CB-CD1 4.13Å; L717-Y788 HydrophobicContact CB-CE1 3.9Å; R751-Y788 HydrophobicContact CB-CD2 4.01Å; R751-Y788 HydrophobicContact CB-CE2 4.02Å; A754-Y788 HydrophobicContact CB-CD1 3.84Å; A754-Y788 HydrophobicContact CB-CG 3.89Å; E785-Y788 HydrophobicContact CB-CD2 3.67Å; E785-Y788 HydrophobicContact CB-CE2 3.81Å; E785-Y788 HydrophobicContact CG-CE2 4.35Å; E785-Y788 WeakPolarHBondContact O-CD2 3.27Å; E785-Y788 PolarHBondContact O-N 3.29Å; E785-Y788 VanDerWaalsContact O-N 3.09Å; Q786-Y788 PolarHBondContact O-N 2.86Å; Y788-L792 VanDerWaalsContact O-CB 3.28Å; Y788-L792 WeakPolarHBondContact O-CB 3.22Å; Y788-L792 WeakPolarHBondContact O-CD1 3.28Å; Y788-L792 WeakPolarHBondContact O-CG 3.23Å; Y788-L792 PolarHBondContact O-N 2.89Å
789	M	94.4	Very high	92.7	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-70.9	-35.7	175	-67.3	172	60.6	0	0	111.8	F748 C750 V772 R776 Q786 H787 Q793 L798 Y800	F748-M789 HydrophobicContact CD1-SD 4.48Å; F748-M789 HydrophobicContact CE1-CE 4.39Å; F748-M789 HydrophobicContact CE1-SD 3.72Å; C750-M789 HydrophobicContact CB-CG 3.93Å; C750-M789 HydrophobicContact CB-SD 4.36Å; C750-M789 PolarHBondContact SG-SD 2.94Å; V772-M789 HydrophobicContact CG1-CE 3.87Å; R776-M789 HydrophobicContact CB-CE 4.06Å; Q786-M789 HydrophobicContact CG-SD 4.37Å; Q786-M789 WeakPolarHBondContact O-CB 3.36Å; Q786-M789 PolarHBondContact O-N 2.98Å; H787-M789 PolarHBondContact O-N 3.28Å; H787-M789 VanDerWaalsContact O-N 3.15Å; M789-Q793 VanDerWaalsContact O-CB 3.23Å; M789-Q793 WeakPolarHBondContact O-CB 3.4Å; M789-Q793 PolarHBondContact O-N 2.97Å; M789-L798 HydrophobicContact CB-CD1 4.22Å; M789-L798 HydrophobicContact CG-CD1 4.17Å; M789-Y800 WeakPolarHBondContact CB-OH 3.47Å; M789-Y800 HydrophobicContact CE-CE1 3.58Å; M789-Y800 VanDerWaalsContact CE-OH 3.28Å; M789-Y800 WeakPolarHBondContact CE-OH 3.32Å
790	T	93.9	Very high	93.4	Very high	66 Å²	66	56.1 Å²	56.1	41%	0.405	30%	0.299	S	S	.	.	H	α-helix	trans	-68.9	-45.1	174	-50.1	0	0	0	0	110.8	H787 Q793 N794	H787-T790 WeakPolarHBondContact O-CA 3.47Å; H787-T790 VanDerWaalsContact O-CB 3.32Å; H787-T790 WeakPolarHBondContact O-CB 3.49Å; H787-T790 PolarHBondContact O-N 3.15Å; T790-Q793 PolarHBondContact O-N 3.19Å; T790-N794 WeakPolarHBondContact O-CB 3.27Å; T790-N794 PolarHBondContact O-N 3.33Å; T790-N794 PolarHBondContact O-ND2 3.21Å
791	D	95	Very high	93.5	Very high	65 Å²	65	54.4 Å²	54.4	35%	0.348	29%	0.29	S	S	.	.	H	α-helix	trans	-63.5	-48.7	-179.7	-60.4	-33.3	0	0	0	111.1	H787 Q793 N794 L795	H787-D791 IonicContact CD2-OD2 2.64Å; H787-D791 VanDerWaalsContact O-CG 3.3Å; H787-D791 PolarHBondContact O-N 3.41Å; D791-Q793 VanDerWaalsContact C-N 3.32Å; D791-Q793 PolarHBondContact O-N 3.01Å; D791-N794 PolarHBondContact O-N 2.98Å; D791-L795 WeakPolarHBondContact O-CD1 3.33Å; D791-L795 VanDerWaalsContact O-CG 3.27Å; D791-L795 WeakPolarHBondContact O-CG 3.25Å; D791-L795 PolarHBondContact O-N 3.29Å
792	L	96.5	Very high	93.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.7	-34.9	175.8	-68.8	170.4	0	0	0	112.7	L717 I753 A754 V757 Y788 L795 G796 L797 L798	L717-L792 HydrophobicContact CD2-CD2 3.63Å; L717-L792 HydrophobicContact CD2-CG 4.12Å; I753-L792 HydrophobicContact CB-CD1 4.32Å; I753-L792 HydrophobicContact CG2-CD1 3.92Å; A754-L792 HydrophobicContact CB-CD1 4.23Å; V757-L792 HydrophobicContact CB-CD2 4.03Å; V757-L792 HydrophobicContact CG1-CD2 3.82Å; V757-L792 HydrophobicContact CG2-CD1 4.34Å; V757-L792 HydrophobicContact CG2-CD2 4.03Å; Y788-L792 VanDerWaalsContact O-CB 3.28Å; Y788-L792 WeakPolarHBondContact O-CB 3.22Å; Y788-L792 WeakPolarHBondContact O-CD1 3.28Å; Y788-L792 WeakPolarHBondContact O-CG 3.23Å; Y788-L792 PolarHBondContact O-N 2.89Å; L792-L795 PolarHBondContact O-N 3.09Å; L792-G796 PolarHBondContact O-N 3.49Å; L792-L797 HydrophobicContact CD2-CB 4.09Å; L792-L797 HydrophobicContact CD2-CD1 4.37Å; L792-L797 PolarHBondContact O-N 2.9Å; L792-L798 HydrophobicContact CB-CB 3.62Å; L792-L798 HydrophobicContact CB-CD1 4.33Å; L792-L798 HydrophobicContact CD1-CD1 4.41Å; L792-L798 PolarHBondContact O-N 2.81Å
793	Q	95.2	Very high	92.5	Very high	90 Å²	90	47 Å²	47	42%	0.421	26%	0.261	S	S	.	.	H	α-helix	trans	-66.1	-45.9	174.2	-176.8	-171.5	8.9	0	0	111.3	M789 T790 D791 L795 G796 L798 Y800	M789-Q793 VanDerWaalsContact O-CB 3.23Å; M789-Q793 WeakPolarHBondContact O-CB 3.4Å; M789-Q793 PolarHBondContact O-N 2.97Å; T790-Q793 PolarHBondContact O-N 3.19Å; D791-Q793 VanDerWaalsContact C-N 3.32Å; D791-Q793 PolarHBondContact O-N 3.01Å; Q793-L795 PolarHBondContact O-N 3.3Å; Q793-G796 PolarHBondContact O-N 2.95Å; Q793-L798 HydrophobicContact CB-CD2 4.46Å; Q793-Y800 HydrophobicContact CB-CE2 4.22Å; Q793-Y800 HydrophobicContact CG-CD2 4.35Å; Q793-Y800 HydrophobicContact CG-CE2 4.09Å
794	N	94.8	Very high	91.1	Very high	124 Å²	124	53.5 Å²	53.5	66%	0.663	28%	0.284	S	S	*	.	H	α-helix	trans	-61.7	-31.7	178.5	-71.6	-26.5	0	0	0	112.2	T790 D791 G796	T790-N794 WeakPolarHBondContact O-CB 3.27Å; T790-N794 PolarHBondContact O-N 3.33Å; T790-N794 PolarHBondContact O-ND2 3.21Å; D791-N794 PolarHBondContact O-N 2.98Å; N794-G796 VanDerWaalsContact C-N 3.29Å
795	L	94.3	Very high	89.5	Confident	102 Å²	102	54.6 Å²	54.6	53%	0.534	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-4.1	174.3	-67.4	163.8	0	0	0	113.8	L717 L719 D791 L792 Q793 L797	L717-L795 HydrophobicContact CD2-CD1 4.29Å; L719-L795 HydrophobicContact CD1-CD1 3.81Å; D791-L795 WeakPolarHBondContact O-CD1 3.33Å; D791-L795 VanDerWaalsContact O-CG 3.27Å; D791-L795 WeakPolarHBondContact O-CG 3.25Å; D791-L795 PolarHBondContact O-N 3.29Å; L792-L795 PolarHBondContact O-N 3.09Å; Q793-L795 PolarHBondContact O-N 3.3Å; L795-L797 HydrophobicContact CB-CD1 3.94Å; L795-L797 HydrophobicContact CB-CG 4.03Å; L795-L797 HydrophobicContact CD1-CD1 4.36Å; L795-L797 PolarHBondContact O-N 2.94Å
796	G	94	Very high	87.7	Confident	51 Å²	51	55.6 Å²	55.6	53%	0.526	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	4.5	-175	0	0	0	0	0	115	L792 Q793 N794	L792-G796 PolarHBondContact O-N 3.49Å; Q793-G796 PolarHBondContact O-N 2.95Å; N794-G796 VanDerWaalsContact C-N 3.29Å
797	L	95.9	Very high	85.4	Confident	12 Å²	12	61 Å²	61	6%	0.063	32%	0.324	C	S	.	.			trans	-87.4	-10.4	-176.1	-61.2	173	0	0	0	113.2	L719 V757 W761 I768 A770 L792 L795	L719-L797 HydrophobicContact CD1-CD1 3.43Å; L719-L797 VanDerWaalsContact CD1-CD1 3.43Å; V757-L797 HydrophobicContact CG1-CB 4.32Å; V757-L797 HydrophobicContact CG1-CD1 3.89Å; W761-L797 HydrophobicContact CE3-CD1 4.42Å; W761-L797 HydrophobicContact CZ3-CD1 4.26Å; W761-L797 HydrophobicContact CZ3-CD2 4.15Å; I768-L797 HydrophobicContact CB-CD2 4.37Å; A770-L797 PolarHBondContact N-O 2.89Å; L792-L797 HydrophobicContact CD2-CB 4.09Å; L792-L797 HydrophobicContact CD2-CD1 4.37Å; L792-L797 PolarHBondContact O-N 2.9Å; L795-L797 HydrophobicContact CB-CD1 3.94Å; L795-L797 HydrophobicContact CB-CG 4.03Å; L795-L797 HydrophobicContact CD1-CD1 4.36Å; L795-L797 PolarHBondContact O-N 2.94Å
798	L	96.3	Very high	83.7	Confident	3 Å²	3	60 Å²	60	2%	0.016	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	130.9	170.7	-177.4	156	0	0	0	110.4	A770 V772 M789 L792 Q793 Y800	A770-L798 HydrophobicContact CB-CB 4.38Å; A770-L798 HydrophobicContact CB-CG 4.42Å; A770-L798 CarbonylContact O-C 3.56Å; A770-L798 WeakPolarHBondContact O-CA 3.28Å; V772-L798 HydrophobicContact CG2-CD1 3.86Å; V772-L798 HydrophobicContact CG2-CG 4.18Å; M789-L798 HydrophobicContact CB-CD1 4.22Å; M789-L798 HydrophobicContact CG-CD1 4.17Å; L792-L798 HydrophobicContact CB-CB 3.62Å; L792-L798 HydrophobicContact CB-CD1 4.33Å; L792-L798 HydrophobicContact CD1-CD1 4.41Å; L792-L798 PolarHBondContact O-N 2.81Å; Q793-L798 HydrophobicContact CB-CD2 4.46Å; L798-Y800 HydrophobicContact CD2-CD1 4.19Å; L798-Y800 HydrophobicContact CD2-CD2 3.74Å; L798-Y800 HydrophobicContact CD2-CE1 3.95Å; L798-Y800 HydrophobicContact CD2-CE2 3.45Å; L798-Y800 VanDerWaalsContact CD2-CE2 3.45Å; L798-Y800 HydrophobicContact CD2-CG 4.12Å
799	S	93.9	Very high	81.5	Confident	56 Å²	56	67.6 Å²	67.6	39%	0.392	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	133.5	177.2	-76.5	0	0	0	0	111	A770 V772	A770-S799 PolarHBondContact O-N 3.32Å; V772-S799 PolarHBondContact N-O 2.9Å
800	Y	90.9	Very high	80.1	Confident	36 Å²	36	73.9 Å²	73.9	14%	0.141	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	114.5	-177.3	-76	-77.6	0	0	0	112.6	V772 Q777 M789 Q793 L798	V772-Y800 HydrophobicContact CB-CD1 4.4Å; V772-Y800 HydrophobicContact CB-CE1 4.44Å; V772-Y800 HydrophobicContact CG1-CE1 4.34Å; V772-Y800 CarbonylContact O-C 3.51Å; V772-Y800 WeakPolarHBondContact O-CA 3.28Å; V772-Y800 WeakPolarHBondContact O-CD1 3.38Å; Q777-Y800 HydrophobicContact CG-CD1 3.88Å; Q777-Y800 HydrophobicContact CG-CE1 3.32Å; Q777-Y800 HydrophobicContact CG-CE2 4.36Å; M789-Y800 WeakPolarHBondContact CB-OH 3.47Å; M789-Y800 HydrophobicContact CE-CE1 3.58Å; M789-Y800 VanDerWaalsContact CE-OH 3.28Å; M789-Y800 WeakPolarHBondContact CE-OH 3.32Å; Q793-Y800 HydrophobicContact CB-CE2 4.22Å; Q793-Y800 HydrophobicContact CG-CD2 4.35Å; Q793-Y800 HydrophobicContact CG-CE2 4.09Å; L798-Y800 HydrophobicContact CD2-CD1 4.19Å; L798-Y800 HydrophobicContact CD2-CD2 3.74Å; L798-Y800 HydrophobicContact CD2-CE1 3.95Å; L798-Y800 HydrophobicContact CD2-CE2 3.45Å; L798-Y800 VanDerWaalsContact CD2-CE2 3.45Å; L798-Y800 HydrophobicContact CD2-CG 4.12Å
801	T	87.4	Confident	78.5	Confident	15 Å²	15	74.6 Å²	74.6	9%	0.092	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	141.3	177.4	64.7	0	0	0	0	110.8	L771 V772 Q774 Y814 D815	L771-T801 HydrophobicContact CB-CG2 4.11Å; L771-T801 HydrophobicContact CD2-CG2 4.24Å; V772-T801 PolarHBondContact O-N 3.08Å; Q774-T801 WeakPolarHBondContact CG-O 3.43Å; Q774-T801 PolarHBondContact N-O 3.11Å; T801-Y814 WeakPolarHBondContact CB-O 3.46Å; T801-D815 HydrophobicContact CG2-CB 4.45Å; T801-D815 PolarHBondContact OG1-N 3.22Å
802	P	80.4	Confident	76.9	Confident	72 Å²	72	76.3 Å²	76.3	47%	0.468	41%	0.413	S	S	.	.			trans	-55.3	142.5	178.2	-27.5	35.6	0	0	0	112.5	Y814	P802-Y814 HydrophobicContact CB-CD2 4.34Å; P802-Y814 VanDerWaalsContact O-CD2 3.29Å; P802-Y814 WeakPolarHBondContact O-CD2 3.49Å; P802-Y814 PolarHBondContact O-N 3.39Å; P802-Y814 VanDerWaalsContact O-N 3.1Å
803	S	72.8	Confident	75.2	Confident	23 Å²	23	77.2 Å²	77.2	16%	0.161	42%	0.419	C	S	.	.			trans	-142.4	133.6	172.5	62.8	0	0	0	0	111	W775	W775-S803 PolarHBondContact N-OG 3.29Å
804	R	65.9	Low	73.7	Confident	156 Å²	156	76.6 Å²	76.6	59%	0.589	41%	0.413	S	S	*	.			trans	-100.3	129.1	178.6	-65.7	178	179.9	-178.7	-0.6	109.8	I811	R804-I811 HydrophobicContact CB-CB 4.1Å; R804-I811 HydrophobicContact CB-CD1 4.12Å; R804-I811 WeakPolarHBondContact O-CB 3.45Å; R804-I811 PolarHBondContact O-N 3.01Å
805	E	61.6	Low	71.9	Confident	73 Å²	73	71.8 Å²	71.8	34%	0.341	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.7	163.9	-74.1	-178.7	-138.3	0	0	108.9	K778 K809 R810	K778-E805 WeakPolarHBondContact CE-OE1 3.28Å; K778-E805 IonicContact NZ-OE1 3.48Å; K778-E805 PolarHBondContact NZ-OE1 2.72Å; K778-E805 IonicContact NZ-OE2 2.68Å; K778-E805 PolarHBondContact NZ-OE2 2.88Å; E805-K809 WeakPolarHBondContact CA-O 3.34Å; E805-R810 HydrophobicContact CG-CB 4.5Å
806	V	55.5	Low	70.3	Confident	60 Å²	60	73.1 Å²	73.1	36%	0.364	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	116.9	-174.4	173.5	0	0	0	0	107.6	G808 K809 I811	V806-G808 VanDerWaalsContact C-N 3.26Å; V806-G808 PolarHBondContact O-N 2.99Å; V806-K809 PolarHBondContact N-O 3.4Å; V806-K809 PolarHBondContact O-N 2.85Å; V806-K809 VanDerWaalsContact O-N 3.08Å; V806-I811 HydrophobicContact CB-CD1 4.19Å; V806-I811 HydrophobicContact CG2-CD1 3.65Å
807	H	44.6	Very low	68.4	Low	173 Å²	173	80.3 Å²	80.3	80%	0.801	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	40.9	-176.8	-57.5	72.6	0	0	0	113.3	K809	H807-K809 PolarHBondContact O-N 2.93Å; H807-K809 VanDerWaalsContact O-N 3.11Å
808	G	58.9	Low	67	Low	71 Å²	71	83.8 Å²	83.8	73%	0.732	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	-11.2	-178.6	0	0	0	0	0	115.4	V806	V806-G808 VanDerWaalsContact C-N 3.26Å; V806-G808 PolarHBondContact O-N 2.99Å
809	K	49.2	Very low	65.5	Low	171 Å²	171	88 Å²	88	74%	0.743	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	133.8	171.1	-67.2	-173.8	176.9	-178.1	0	109.9	E805 V806 H807	E805-K809 WeakPolarHBondContact CA-O 3.34Å; V806-K809 PolarHBondContact N-O 3.4Å; V806-K809 PolarHBondContact O-N 2.85Å; V806-K809 VanDerWaalsContact O-N 3.08Å; H807-K809 PolarHBondContact O-N 2.93Å; H807-K809 VanDerWaalsContact O-N 3.11Å
810	R	64.4	Low	63.9	Low	132 Å²	132	89.8 Å²	89.8	50%	0.498	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	133.1	175	-175.7	179	-59.4	132.5	8.7	109.8	W775 E805	W775-R810 VanDerWaalsContact CD2-CZ 3.47Å; W775-R810 VanDerWaalsContact CD2-NE 3.33Å; W775-R810 VanDerWaalsContact CE2-CZ 3.47Å; W775-R810 VanDerWaalsContact CE2-NE 3.33Å; W775-R810 VanDerWaalsContact CH2-CZ 3.48Å; W775-R810 VanDerWaalsContact CH2-NH1 3.3Å; E805-R810 HydrophobicContact CG-CB 4.5Å
811	I	61.9	Low	62.3	Low	81 Å²	81	92.9 Å²	92.9	42%	0.415	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-94.5	144.1	163	-59	173.7	0	0	0	106.6	R804 V806 S813	R804-I811 HydrophobicContact CB-CB 4.1Å; R804-I811 HydrophobicContact CB-CD1 4.12Å; R804-I811 WeakPolarHBondContact O-CB 3.45Å; R804-I811 PolarHBondContact O-N 3.01Å; V806-I811 HydrophobicContact CB-CD1 4.19Å; V806-I811 HydrophobicContact CG2-CD1 3.65Å; I811-S813 PolarHBondContact O-N 2.78Å
812	S	59.6	Low	60.7	Low	101 Å²	101	97.8 Å²	97.8	71%	0.706	49%	0.49	S	S	*	.			trans	-43	129.8	-178.3	-46.7	0	0	0	0	112.1
813	S	62.7	Low	59.4	Low	19 Å²	19	99.5 Å²	99.5	13%	0.133	49%	0.491	C	S	.	.			trans	-73	165	176.6	34.6	0	0	0	0	111.2	P773 I811 D815	P773-S813 WeakPolarHBondContact CG-OG 3.43Å; I811-S813 PolarHBondContact O-N 2.78Å; S813-D815 VanDerWaalsContact C-N 3.31Å; S813-D815 WeakPolarHBondContact CB-OD1 3.21Å; S813-D815 PolarHBondContact OG-OD1 2.9Å
814	Y	63.3	Low	58.4	Low	78 Å²	78	105 Å²	105	31%	0.306	52%	0.515	S	S	.	.	S	Bend	trans	-97.6	28.5	-177.5	-69.8	-116.8	0	0	0	111.1	T801 P802	T801-Y814 WeakPolarHBondContact CB-O 3.46Å; P802-Y814 HydrophobicContact CB-CD2 4.34Å; P802-Y814 VanDerWaalsContact O-CD2 3.29Å; P802-Y814 WeakPolarHBondContact O-CD2 3.49Å; P802-Y814 PolarHBondContact O-N 3.39Å; P802-Y814 VanDerWaalsContact O-N 3.1Å
815	D	56.3	Low	57.9	Low	23 Å²	23	101.1 Å²	101.1	12%	0.123	51%	0.509	C	S	.	.	S	Bend	trans	-74.2	-33.1	172.5	39.9	-24.8	0	0	0	113.3	S736 P773 T801 S813 R817	S736-D815 WeakPolarHBondContact CB-OD2 3.42Å; S736-D815 PolarHBondContact OG-OD2 2.99Å; P773-D815 VanDerWaalsContact CD-OD2 3.26Å; P773-D815 WeakPolarHBondContact CD-OD2 3.44Å; P773-D815 HydrophobicContact CG-CB 4.11Å; P773-D815 WeakPolarHBondContact CG-OD1 3.37Å; P773-D815 WeakPolarHBondContact CG-OD2 3.43Å; T801-D815 HydrophobicContact CG2-CB 4.45Å; T801-D815 PolarHBondContact OG1-N 3.22Å; S813-D815 VanDerWaalsContact C-N 3.31Å; S813-D815 WeakPolarHBondContact CB-OD1 3.21Å; S813-D815 PolarHBondContact OG-OD1 2.9Å; D815-R817 VanDerWaalsContact C-N 3.31Å; D815-R817 PolarHBondContact O-N 2.64Å
816	D	61.5	Low	57.6	Low	130 Å²	130	103.4 Å²	103.4	70%	0.695	52%	0.523	S	S	*	.			trans	-84.8	19.9	-179.2	-49.1	-49.6	0	0	0	114.9
817	R	52.8	Low	57.8	Low	202 Å²	202	107.4 Å²	107.4	76%	0.762	54%	0.538	S	S	*	.			trans	-126.3	0	-162.1	-80.3	-169.1	170	-148	-0.8	117.7	D815	D815-R817 VanDerWaalsContact C-N 3.31Å; D815-R817 PolarHBondContact O-N 2.64Å

Retrieved 817 of 817 residues in 1025.6 ms (Link to these results)

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